A0A5K4F7R6_SCHMA Loading...

Nuclear pore complex protein AlphaSync Fragmented

AlphaFold DB , UniProt , Accession A0A5K4F7R6, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 2,746 aa.

>A0A5K4F7R6_SCHMA|A0A5K4F7R6
MENSLQKHKQLLLSPLSFPGKNERDYEIVKNANNSAVTLPEFPHKVVLSEDVIQESLFISEVFNFNELRAVELCLTVESQLSLFPCLGRGFVAVVLYYESHLSIIDTLVALIGARDGRMWSNPTSAEICQVIHSFTDELSANGLFPNILGVLRSFSVYKEFSRLENLQVLGDSKHRHDVFMMLKNISEGLAECVMLWSCQSVLNLSEFKLVLDCLLSSANQEPSTKNNGNQNELTFQNNGQLTREGLHLLMSLLHCLQPFSSNTLCADQVSDLTDIDWTHPLYTDRTFAASIGRLLDNQRSLFEQRSEESDSDRLKLLAFIRLSWALCLRRTSHLRAELRRRQTVDVSRSTPYTVANRKDLATLNEDFGIGGDEEDELQAALAIESGALEFARKQILNTTDFEREPLWVYRMHCIITDLIVHMAVRVKEIRLRDEDILRSTGFDPSTTGHGFANFLLLIAQLYNQPGSRLHGRLGLEFWWPVGELTNIAPVALGSSDLLSPSTADKSPRPKFHTYGSQSRNAELDNIRQAALIRFLRLAGDMVTAPCLFLPYLRMLHGLCCSRSAAGLCFSLLKANATNPGRGASLITWDHFFNSFRQYLNHMKQVVVQPEPTNFRLQASNQLYPHLYFNDGVTPRSRVSGFPRSTTESMYGHRKGSSSSDIGATTVPMNIQPRSIQPEEQAGLQAVLRLVARVCRMDPVARSTFISNPQWQLIPICMGFLTCPVSLDLKADILYLLTEFCKSQQNIPVIWQHFVSSELLPFTVQRHPNQPQSIHGLNTDMDEVEPRAEEYPLTNAFLTLITVMLPKLINYPIPIPSNVLRSGDTKEMGTFGLTSIGHNIPSQTNPFLSITSFITNTIFLRHTMRAYRNPVERWDIAASCLILFDGLVHDFLNRLNNATAIITTMMSSSHEKNVDNLDALFTTVSTSTGVVSGDNKQNPNVVSGQSVDWASYLLNVLFQIGKEQQQQQPIHGHHLHATLPSSISSLETIISQLHLPVGWPYTDPGYHLATQLLTDSSLFRMVTGLLEVGLHRHLEFPIPNGPPVSMTRATYAGLSLIRRLLASEDILVTFVRRIATNIQPRIGSVHSSSNISIPLPNVPSFGLTILPVYVSRLLMSTNIGSGRADLIPMLLKYCLLADYLPDHTSCAVSILGYLASSIQPHSDLLALLTADETTRNQLLGAFTYLIKWPMNVDINSNLIPMDNNLDNEGHFAFTDEWLYGDNDNNELCLHSVGTFSSRLPSPVINAARYDAAFPLQTNNWYFPSRIWERCASYLNTYFSEWTDMRITHNRMNNNDYYIQAFGDWFYQVTVNTYSIPISISFLQILLAVMEHPAPNLAHWLCGFCVDNCKAISRSNLQDAGIADQQRTCLHSMLDMIDSTTHWLQSITTLPFEFSCTLQWNLALIWQILYKLGSNPLTSEPLLRFLRGNHDLLAKYLHSDLCQPLLSSSLDGNVCENFTDRQKAVIEALSLNRKNWILRLYAIEIRVCAMANQRSYVTRLLKLFLGDLLFDNSLLLKSNDEWISHFILNTFKLFDLVSFKSPSVLVNFLQILNTSNELVNDCNPFESKLFNSNVLHELLKKSSINCPLLSSDSNATKVLSTMIHFKIFLMNLFMKLISTRNDLDSYSNEDLNKLITLTFDQVFDINRSAYHLSILEVFNTSYLSSSSSTTTVSALIKQISDLREWIDHRNIHNLHLYAGKQVAIEAWRQAVEISLGLMTNQGQYDSGNNNNTVQRSSNQPMISVPSYLYSELISLLRNDGDGDIGIGSNNMSQYKFKLRPVPVLCLDVLILLLSQICSVKEVPQTIRLLASGTSLTLCSFFHCQSSYVNASKSNISEMPTSGLDKCVYNKHWSPLLISVMELLVKSIVRTKTSTQRMRANYYGSLCYVIRFCRDLGQSLKDDKVSLTDFNSLMECFSIFNYSTTNTNTNLNTIHSNALNSSDLNQLHSTLITDIIHGHTMIQLAAMSLLELLISFDRCSQQLITYLDNQGTIQHILDTIIEDLQVIGKFLTSVNTELPDYSSVLNRSNYLPLESNNNNNHNYPNEDSSSIMSSYLLYQSKMSILCRIGSYPIGAKILANHGIINRLTNCDVLSLSNLANCYSYGLDCLYICEDDNNNNNQQYQDISHRSNESNQLMDLIWFRSSKFQRYLSYSSSSSSSSIVGKSDHSIYWDFIESIISSIMIEPGCEIDENELMKINWAGLLIPTLRLSKILINSLGTTHMSINQQIVNFLHTHSSSLMCNEIQLASSIVTFLSRQDWSYINHSNSSSSSSTNQPINSNWLIQWIASETNLINLFSLIMPSFNSPVSIMCSDEAFEGNSFYTSFTDFISFSFSFFCFRYSNLQREVIQSKILNHTFELLINLIHPSNIHSFTDNDLSSIYKFQNNYFAFEYSFIETQYIQLIYSLLFILTGYISIPEYRIRKFITDNINNHTTARTLFQYFNHSIIHSEQENSTFNVKIQNTLTLIVNLLQWSLKCLRSKEKICLALINVQFLNSSSNSRTKEPTKSKIIGEQRNQQQQQFGQSIVQLLNCESFSENLPINELKQASSIIFKCPLQLLNSVDRITAGKENQNAEIQMMQRLTQLGVSCLRVQLRGLIGIIEQSTFLLWKHLNSLINNPNIIIGENNKETPLHHQSLQSSHGVRNLSTTNCITSPMMKSSLKPLLTPTKRNTLMNTAFSQENNSILQMNMSWLRNHCEHLVQDEIMEMLNQLTKAAYLKQNQRLFIQVMHNRLERIIQKQLNSNLST

Structure and PAE viewers are unavailable as this is a multi-fragment structure.

 

Download 8 Fragment Structures   AlphaSync Parameters   PDBs   Table  
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
1M68.1Low77.6Confident116 Ų11694 Ų9457%0.57146%0.462SS*.  0-63.80-172.3178.374.100111.3N3 S4 L5 I128 V131M1-N3 PolarHBondContact O-N 3.47Å; M1-S4 WeakPolarHBondContact O-CA 3.23Å; M1-S4 VanDerWaalsContact O-CB 3.32Å; M1-S4 WeakPolarHBondContact O-CB 3.35Å; M1-S4 PolarHBondContact O-N 3.22Å; M1-L5 HydrophobicContact CG-CD1 4.12Å; M1-L5 HydrophobicContact CG-CG 4.47Å; M1-L5 PolarHBondContact O-N 3.22Å; M1-I128 HydrophobicContact CE-CG2 4.19Å; M1-V131 HydrophobicContact CE-CB 3.97Å; M1-V131 HydrophobicContact CE-CG1 3.64Å
2E75.5Confident77.6Confident102 Ų10286.8 Ų86.848%0.47743%0.427SS..Hα-helixtrans-46.4-52.1179.2-72.4179.7169.900114.2S4 L5 Q6 V131E2-S4 PolarHBondContact O-N 2.83Å; E2-L5 PolarHBondContact O-N 2.89Å; E2-L5 VanDerWaalsContact O-N 3.08Å; E2-Q6 WeakPolarHBondContact O-CG 3.4Å; E2-Q6 PolarHBondContact O-N 2.81Å; E2-V131 HydrophobicContact CG-CB 4.45Å; E2-V131 HydrophobicContact CG-CG1 3.45Å; E2-V131 VanDerWaalsContact CG-CG1 3.45Å; E2-V131 HydrophobicContact CG-CG2 4.13Å; E2-V131 WeakPolarHBondContact OE1-CG2 3.38Å
3N78.4Confident77.6Confident128 Ų12883.2 Ų83.268%0.68441%0.41SS*.Hα-helixtrans-57.1-34.7178.2-67.2-9.1000112.9M1 K7M1-N3 PolarHBondContact O-N 3.47Å; N3-K7 WeakPolarHBondContact O-CB 3.25Å; N3-K7 PolarHBondContact O-N 2.89Å; N3-K7 VanDerWaalsContact O-N 3.1Å
4S77.5Confident77.4Confident68 Ų6879.4 Ų79.448%0.47640%0.396SS..Hα-helixtrans-73.1-40.8177.5-166.60000111.4M1 E2 K7 H8M1-S4 WeakPolarHBondContact O-CA 3.23Å; M1-S4 VanDerWaalsContact O-CB 3.32Å; M1-S4 WeakPolarHBondContact O-CB 3.35Å; M1-S4 PolarHBondContact O-N 3.22Å; E2-S4 PolarHBondContact O-N 2.83Å; S4-K7 PolarHBondContact O-N 3.29Å; S4-H8 PolarHBondContact O-N 2.89Å; S4-H8 PolarHBondContact O-ND1 3.01Å
5L80Confident76.8Confident23 Ų2374.3 Ų74.312%0.1237%0.371CS..Hα-helixtrans-64.1-43.3176-68.2175.5000111.4M1 E2 K7 H8 K9 L111 F135M1-L5 HydrophobicContact CG-CD1 4.12Å; M1-L5 HydrophobicContact CG-CG 4.47Å; M1-L5 PolarHBondContact O-N 3.22Å; E2-L5 PolarHBondContact O-N 2.89Å; E2-L5 VanDerWaalsContact O-N 3.08Å; L5-K7 PolarHBondContact O-N 3.28Å; L5-H8 PolarHBondContact O-N 2.96Å; L5-K9 PolarHBondContact O-N 2.76Å; L5-L111 HydrophobicContact CD2-CD1 3.96Å; L5-L111 HydrophobicContact CD2-CD2 4.19Å; L5-F135 HydrophobicContact CB-CD2 4.09Å; L5-F135 HydrophobicContact CB-CE1 4.24Å; L5-F135 HydrophobicContact CB-CE2 3.8Å; L5-F135 HydrophobicContact CB-CG 4.43Å; L5-F135 HydrophobicContact CB-CZ 3.89Å; L5-F135 HydrophobicContact CD1-CD1 4.28Å; L5-F135 HydrophobicContact CD1-CG 4.31Å; L5-F135 HydrophobicContact CD2-CD1 4.46Å; L5-F135 HydrophobicContact CD2-CE1 4.07Å; L5-F135 HydrophobicContact CD2-CZ 4.4Å
6Q80Confident76.5Confident126 Ų12672.2 Ų72.259%0.58936%0.361SS*.Hα-helixtrans-63.7-40176.3-72.9177.8-4.200112.1E2 H8 K9E2-Q6 WeakPolarHBondContact O-CG 3.4Å; E2-Q6 PolarHBondContact O-N 2.81Å; Q6-H8 VanDerWaalsContact C-N 3.32Å; Q6-H8 PolarHBondContact O-N 2.63Å; Q6-K9 WeakPolarHBondContact O-CB 3.48Å; Q6-K9 PolarHBondContact O-N 3.2Å
7K78.9Confident76Confident136 Ų13671.9 Ų71.959%0.59137%0.368SS*.Hα-helixtrans-59.8-40.1176.7-173.5-175.4174.4-162.60112.2N3 S4 L5 E41N3-K7 WeakPolarHBondContact O-CB 3.25Å; N3-K7 PolarHBondContact O-N 2.89Å; N3-K7 VanDerWaalsContact O-N 3.1Å; S4-K7 PolarHBondContact O-N 3.29Å; L5-K7 PolarHBondContact O-N 3.28Å; K7-E41 IonicContact NZ-OE1 3.78Å; K7-E41 PolarHBondContact NZ-OE1 3.44Å
8H80.3Confident75.4Confident70 Ų7070.6 Ų70.632%0.32436%0.359SS..Hα-helixtrans-100.88.8-174.6-56.298.1000114.1S4 L5 Q6 Q10 L11 L12S4-H8 PolarHBondContact O-N 2.89Å; S4-H8 PolarHBondContact O-ND1 3.01Å; L5-H8 PolarHBondContact O-N 2.96Å; Q6-H8 VanDerWaalsContact C-N 3.32Å; Q6-H8 PolarHBondContact O-N 2.63Å; H8-Q10 VanDerWaalsContact C-N 3.33Å; H8-Q10 PolarHBondContact O-N 3.3Å; H8-L11 PolarHBondContact O-N 3.02Å; H8-L11 VanDerWaalsContact O-N 3.1Å; H8-L12 PolarHBondContact O-N 3.29Å; H8-L12 VanDerWaalsContact O-N 3.08Å
9K80Confident74.9Confident48 Ų4870.8 Ų70.821%0.20937%0.366CS..Hα-helixtrans-55.4-41-175.1-177.2179.5172.7-175.50114.2L5 Q6 L12 L13 F135 E138 L139L5-K9 PolarHBondContact O-N 2.76Å; Q6-K9 WeakPolarHBondContact O-CB 3.48Å; Q6-K9 PolarHBondContact O-N 3.2Å; K9-L12 PolarHBondContact O-N 2.82Å; K9-L13 PolarHBondContact O-N 3.44Å; K9-F135 HydrophobicContact CB-CE2 4.2Å; K9-F135 HydrophobicContact CB-CZ 4.38Å; K9-F135 HydrophobicContact CD-CE2 4.37Å; K9-F135 HydrophobicContact CG-CE2 4.1Å; K9-F135 HydrophobicContact CG-CZ 4.38Å; K9-E138 WeakPolarHBondContact CE-OE2 3.42Å; K9-E138 IonicContact NZ-OE1 2.78Å; K9-E138 PolarHBondContact NZ-OE1 3.2Å; K9-E138 IonicContact NZ-OE2 2.82Å; K9-E138 PolarHBondContact NZ-OE2 3.09Å; K9-L139 HydrophobicContact CG-CD2 4.01Å
10Q77.7Confident74.9Confident166 Ų16669.2 Ų69.278%0.77637%0.367SS*.Hα-helixtrans-66-39.6179.2-71-175.5-10.800112H8 L12 L13 S14H8-Q10 VanDerWaalsContact C-N 3.33Å; H8-Q10 PolarHBondContact O-N 3.3Å; Q10-L12 VanDerWaalsContact C-N 3.33Å; Q10-L13 PolarHBondContact O-N 2.77Å; Q10-S14 PolarHBondContact O-N 3.16Å; Q10-S14 PolarHBondContact O-OG 3.44Å
11L77.7Confident74.9Confident51 Ų5170.3 Ų70.327%0.26737%0.369SS..Hα-helixtrans-67-36.6177.4-63.1175.9000111.5H8 S14 P15 F18 I104H8-L11 PolarHBondContact O-N 3.02Å; H8-L11 VanDerWaalsContact O-N 3.1Å; L11-S14 CarbonylContact O-C 3.57Å; L11-S14 VanDerWaalsContact O-C 3.3Å; L11-P15 WeakPolarHBondContact O-CA 3.41Å; L11-F18 HydrophobicContact CD2-CD1 3.74Å; L11-F18 HydrophobicContact CD2-CE1 3.63Å; L11-I104 HydrophobicContact CB-CD1 4.38Å
12L77.4Confident75.4Confident8 Ų868 Ų684%0.04236%0.358CS..Hα-helixtrans-70.3-30.9176.3-69.6166.5000112.9H8 K9 Q10 S14 I104 T107 L111 F135 L139 L144H8-L12 PolarHBondContact O-N 3.29Å; H8-L12 VanDerWaalsContact O-N 3.08Å; K9-L12 PolarHBondContact O-N 2.82Å; Q10-L12 VanDerWaalsContact C-N 3.33Å; L12-S14 VanDerWaalsContact C-N 3.33Å; L12-I104 HydrophobicContact CD2-CG2 4.02Å; L12-T107 WeakPolarHBondContact CD2-OG1 3.45Å; L12-L111 HydrophobicContact CD1-CD1 4.44Å; L12-F135 HydrophobicContact CD1-CE1 3.86Å; L12-F135 HydrophobicContact CD1-CZ 3.75Å; L12-L139 HydrophobicContact CB-CD1 4.45Å; L12-L144 WeakPolarHBondContact O-CD1 3.43Å
13L77.1Confident75.4Confident39 Ų3970.5 Ų70.520%0.20437%0.37CS..Hα-helixtrans-71.4-29.8178.3-170.268.1000112.7K9 Q10 L139 N142 L144 N147K9-L13 PolarHBondContact O-N 3.44Å; Q10-L13 PolarHBondContact O-N 2.77Å; L13-L139 HydrophobicContact CB-CD2 4.39Å; L13-L139 HydrophobicContact CD1-CD2 4.27Å; L13-N142 HydrophobicContact CD1-CB 3.7Å; L13-N142 HydrophobicContact CD2-CB 4.01Å; L13-L144 HydrophobicContact CD1-CB 4.21Å; L13-N147 PolarHBondContact O-ND2 2.91Å; L13-N147 VanDerWaalsContact O-ND2 3.13Å
14S74.9Confident75.5Confident31 Ų3173.6 Ų73.622%0.21737%0.373CS..SBendtrans-138.679.5-179.454.30000110.9Q10 L11 L12 L16 S17Q10-S14 PolarHBondContact O-N 3.16Å; Q10-S14 PolarHBondContact O-OG 3.44Å; L11-S14 CarbonylContact O-C 3.57Å; L11-S14 VanDerWaalsContact O-C 3.3Å; L12-S14 VanDerWaalsContact C-N 3.33Å; S14-L16 PolarHBondContact O-N 3.03Å; S14-S17 WeakPolarHBondContact CB-OG 3.44Å; S14-S17 PolarHBondContact O-N 3.41Å; S14-S17 PolarHBondContact OG-OG 3.47Å
15P68.1Low75.5Confident3 Ų371.6 Ų71.62%0.01936%0.356CS..THydrogen-bonded Turntrans-60.6-16.7-164.819.9-32.2000115.7L11 H101 I104 I105 L190L11-P15 WeakPolarHBondContact O-CA 3.41Å; P15-H101 PolarHBondContact O-ND1 2.87Å; P15-I104 HydrophobicContact CB-CG2 4.13Å; P15-I105 HydrophobicContact CB-CG1 4.16Å; P15-L190 HydrophobicContact CB-CD2 4.25Å; P15-L190 HydrophobicContact CG-CD2 3.55Å
16L72.6Confident75.4Confident40 Ų4074.6 Ų74.621%0.20937%0.367CS..THydrogen-bonded Turntrans-116.6-3176.6-61.7-173.1000114.5S14 H101 V151 F155 I186 L190S14-L16 PolarHBondContact O-N 3.03Å; L16-H101 HydrophobicContact CD2-CB 4Å; L16-H101 WeakPolarHBondContact CD2-ND1 3.15Å; L16-V151 HydrophobicContact CB-CG1 4.41Å; L16-V151 HydrophobicContact CD1-CG1 3.34Å; L16-V151 HydrophobicContact CG-CG1 3.97Å; L16-F155 HydrophobicContact CD1-CD2 3.91Å; L16-F155 HydrophobicContact CD1-CE2 4.35Å; L16-F155 HydrophobicContact CD1-CG 4.22Å; L16-I186 HydrophobicContact CD1-CG2 4.43Å; L16-I186 HydrophobicContact CD2-CG2 4.11Å; L16-L190 HydrophobicContact CD1-CD1 4.46Å
17S67.2Low75.3Confident68 Ų6874.1 Ų74.148%0.47637%0.365SS..  trans-99.7101.5-177.884.70000110.7S14S14-S17 WeakPolarHBondContact CB-OG 3.44Å; S14-S17 PolarHBondContact O-N 3.41Å; S14-S17 PolarHBondContact OG-OG 3.47Å
18F66.5Low75.3Confident48 Ų4871.3 Ų71.321%0.21136%0.355CS..  trans-88.7161.5169.2-76.4-58.3000112.2L11 G20 F65 Y97 H101 I104L11-F18 HydrophobicContact CD2-CD1 3.74Å; L11-F18 HydrophobicContact CD2-CE1 3.63Å; F18-G20 PolarHBondContact O-N 3.09Å; F18-F65 HydrophobicContact CB-CD2 3.4Å; F18-F65 VanDerWaalsContact CB-CD2 3.4Å; F18-F65 HydrophobicContact CB-CE2 3.35Å; F18-F65 AromaticContact CD1-CE2 3.74Å; F18-F65 HydrophobicContact CD1-CE2 3.74Å; F18-F65 HydrophobicContact CD1-CZ 4.44Å; F18-F65 HydrophobicContact CD2-CD2 4.08Å; F18-F65 AromaticContact CD2-CE2 3.79Å; F18-F65 HydrophobicContact CD2-CE2 3.79Å; F18-F65 HydrophobicContact CE1-CE2 4.46Å; F18-F65 HydrophobicContact CE2-CE2 4.45Å; F18-F65 AromaticContact CG-CD2 3.83Å; F18-F65 HydrophobicContact CG-CD2 3.83Å; F18-F65 AromaticContact CG-CE2 3.36Å; F18-F65 HydrophobicContact CG-CE2 3.36Å; F18-F65 HydrophobicContact CG-CZ 4.33Å; F18-Y97 AromaticContact CD2-CE2 3.91Å; F18-Y97 HydrophobicContact CD2-CE2 3.91Å; F18-Y97 HydrophobicContact CE2-CD2 4.44Å; F18-Y97 AromaticContact CE2-CE2 3.72Å; F18-Y97 HydrophobicContact CE2-CE2 3.72Å; F18-H101 AromaticContact CD2-CE1 3.54Å; F18-H101 AromaticContact CD2-NE2 3.81Å; F18-H101 AromaticContact CE2-CE1 2.98Å; F18-H101 WeakPolarHBondContact CE2-CE1 3.42Å; F18-H101 AromaticContact CE2-ND1 3.81Å; F18-H101 AromaticContact CE2-NE2 3.23Å; F18-H101 WeakPolarHBondContact CE2-NE2 3.45Å; F18-H101 AromaticContact CZ-CE1 3.69Å; F18-I104 HydrophobicContact CZ-CD1 4.5Å
19P65.8Low75.3Confident75 Ų7568 Ų6849%0.48734%0.34SS..  trans-56.5126.817023.6-32.9000109.9N66P19-N66 HydrophobicContact CG-CB 4.43Å; P19-N66 PolarHBondContact O-N 3.05Å
20G74.4Confident75.2Confident38 Ų3871.5 Ų71.539%0.39236%0.355SS..  trans-71.5-178.7179.700000113.1F18F18-G20 PolarHBondContact O-N 3.09Å
21K74.9Confident75.3Confident93 Ų9367.7 Ų67.740%0.40434%0.34SS..  trans-57.7143.4178.5-62.6-172.5-175.1-173.30112.6S60 N64 E67K21-S60 WeakPolarHBondContact CE-O 3.33Å; K21-N64 WeakPolarHBondContact CE-OD1 3.47Å; K21-E67 WeakPolarHBondContact CB-OE1 3.47Å
22N78.3Confident75.1Confident66 Ų6665.3 Ų65.335%0.35333%0.327SS..  trans-135.6120.9179.2-175.611.1000109.7R24 D25 Y26 E67N22-R24 PolarHBondContact O-N 3.36Å; N22-R24 VanDerWaalsContact O-N 3.13Å; N22-D25 HydrophobicContact CB-CB 4.13Å; N22-D25 WeakPolarHBondContact CB-OD2 3.34Å; N22-D25 PolarHBondContact ND2-OD2 3.38Å; N22-D25 PolarHBondContact O-N 3.08Å; N22-Y26 PolarHBondContact O-N 2.99Å; N22-E67 PolarHBondContact N-OE2 2.96Å
23E76.7Confident74.9Confident156 Ų15668.5 Ų68.573%0.72934%0.344SS*.Hα-helixtrans-58.5-32.8-173.6-167173.6-161.600112.7Y26 E27E23-Y26 WeakPolarHBondContact O-CB 3.15Å; E23-E27 PolarHBondContact O-N 3Å
24R78.8Confident74.2Confident193 Ų19374 Ų7473%0.72837%0.374SS*.Hα-helixtrans-66.7-42.1175-65-177.9-176.7165.82.7112.4N22 E27 I28N22-R24 PolarHBondContact O-N 3.36Å; N22-R24 VanDerWaalsContact O-N 3.13Å; R24-E27 PolarHBondContact O-N 3.36Å; R24-I28 WeakPolarHBondContact O-CD1 3.34Å; R24-I28 VanDerWaalsContact O-CG1 3.26Å; R24-I28 WeakPolarHBondContact O-CG1 3.5Å; R24-I28 PolarHBondContact O-N 2.97Å
25D77.7Confident73.6Confident26 Ų2675.4 Ų75.414%0.13938%0.384CS..Hα-helixtrans-72.4-36.8-178.7-63-23.9000109.8N22 E27 I28 V29 N66 L68N22-D25 HydrophobicContact CB-CB 4.13Å; N22-D25 WeakPolarHBondContact CB-OD2 3.34Å; N22-D25 PolarHBondContact ND2-OD2 3.38Å; N22-D25 PolarHBondContact O-N 3.08Å; D25-E27 PolarHBondContact O-N 3.43Å; D25-I28 PolarHBondContact O-N 2.88Å; D25-V29 WeakPolarHBondContact O-CG2 3.48Å; D25-V29 PolarHBondContact O-N 3.13Å; D25-N66 PolarHBondContact OD2-ND2 2.92Å; D25-L68 HydrophobicContact CB-CD1 4.08Å; D25-L68 HydrophobicContact CB-CG 4.04Å
26Y78.2Confident73.6Confident85 Ų8577.1 Ų77.133%0.33340%0.398SS..Hα-helixtrans-56.1-47.6169.6-178.7-91.9000112.4N22 E23 I28 V29 K30 L57 E67N22-Y26 PolarHBondContact O-N 2.99Å; E23-Y26 WeakPolarHBondContact O-CB 3.15Å; Y26-I28 PolarHBondContact O-N 3.42Å; Y26-V29 PolarHBondContact O-N 3.5Å; Y26-K30 HydrophobicContact CE1-CD 4.17Å; Y26-K30 VanDerWaalsContact O-CB 3.28Å; Y26-K30 WeakPolarHBondContact O-CB 3.41Å; Y26-K30 PolarHBondContact O-N 3.12Å; Y26-L57 HydrophobicContact CD2-CD2 3.59Å; Y26-L57 HydrophobicContact CE2-CD1 4.05Å; Y26-L57 HydrophobicContact CE2-CD2 3.57Å; Y26-L57 HydrophobicContact CE2-CG 4.35Å; Y26-E67 HydrophobicContact CD2-CG 4.06Å
27E78.5Confident73.4Confident117 Ų11775.5 Ų75.555%0.54739%0.39SS..Hα-helixtrans-65-37.3176.4-73.9-172.5165.800112.8E23 R24 D25 N31E23-E27 PolarHBondContact O-N 3Å; R24-E27 PolarHBondContact O-N 3.36Å; D25-E27 PolarHBondContact O-N 3.43Å; E27-N31 VanDerWaalsContact O-CB 3.31Å; E27-N31 WeakPolarHBondContact O-CB 3.3Å; E27-N31 VanDerWaalsContact O-CG 3.3Å; E27-N31 PolarHBondContact O-N 3.44Å; E27-N31 PolarHBondContact O-ND2 2.98Å
28I79.3Confident73.4Confident76 Ų7676.5 Ų76.539%0.3939%0.394SS..Hα-helixtrans-63.3-47176.1-69.5163.9000110.4R24 D25 Y26 N31 A32 V37 L68R24-I28 WeakPolarHBondContact O-CD1 3.34Å; R24-I28 VanDerWaalsContact O-CG1 3.26Å; R24-I28 WeakPolarHBondContact O-CG1 3.5Å; R24-I28 PolarHBondContact O-N 2.97Å; D25-I28 PolarHBondContact O-N 2.88Å; Y26-I28 PolarHBondContact O-N 3.42Å; I28-N31 CarbonylContact O-C 3.58Å; I28-N31 PolarHBondContact O-N 3.41Å; I28-A32 PolarHBondContact O-N 3.1Å; I28-A32 VanDerWaalsContact O-N 3.07Å; I28-V37 HydrophobicContact CG2-CG1 4.09Å; I28-V37 HydrophobicContact CG2-CG2 4.03Å; I28-L68 HydrophobicContact CG2-CD2 4.27Å
29V78.8Confident73.4Confident0 Ų074.7 Ų74.70%039%0.386CS..Hα-helixtrans-67.6-41.6-179.9172.90000111.1D25 Y26 N31 A32 I53 L57 E67 L68 V71D25-V29 WeakPolarHBondContact O-CG2 3.48Å; D25-V29 PolarHBondContact O-N 3.13Å; Y26-V29 PolarHBondContact O-N 3.5Å; V29-N31 VanDerWaalsContact C-N 3.29Å; V29-N31 PolarHBondContact O-N 3.06Å; V29-A32 WeakPolarHBondContact O-CB 3.26Å; V29-A32 PolarHBondContact O-N 3.15Å; V29-A32 VanDerWaalsContact O-N 3.13Å; V29-I53 HydrophobicContact CG1-CG2 4.34Å; V29-L57 HydrophobicContact CG1-CD2 4.15Å; V29-E67 HydrophobicContact CB-CB 4.38Å; V29-E67 HydrophobicContact CG2-CB 3.94Å; V29-L68 HydrophobicContact CG2-CD2 3.96Å; V29-L68 HydrophobicContact CG2-CG 4.41Å; V29-V71 HydrophobicContact CB-CG2 4.44Å; V29-V71 HydrophobicContact CG1-CG2 3.69Å; V29-V71 HydrophobicContact CG2-CG2 3.83Å
30K79.5Confident73.2Confident123 Ų12375.2 Ų75.254%0.53539%0.389SS..Hα-helixtrans-63.1-35.5176.3-171.8177-179.1-179.70112.7Y26 A32Y26-K30 HydrophobicContact CE1-CD 4.17Å; Y26-K30 VanDerWaalsContact O-CB 3.28Å; Y26-K30 WeakPolarHBondContact O-CB 3.41Å; Y26-K30 PolarHBondContact O-N 3.12Å; K30-A32 VanDerWaalsContact C-N 3.32Å
31N78.3Confident72.7Confident86 Ų8678.6 Ų78.646%0.4640%0.395SS..THydrogen-bonded Turntrans-88.22.3177.8-67-37000113.5E27 I28 V29 N33 N34 S35E27-N31 VanDerWaalsContact O-CB 3.31Å; E27-N31 WeakPolarHBondContact O-CB 3.3Å; E27-N31 VanDerWaalsContact O-CG 3.3Å; E27-N31 PolarHBondContact O-N 3.44Å; E27-N31 PolarHBondContact O-ND2 2.98Å; I28-N31 CarbonylContact O-C 3.58Å; I28-N31 PolarHBondContact O-N 3.41Å; V29-N31 VanDerWaalsContact C-N 3.29Å; V29-N31 PolarHBondContact O-N 3.06Å; N31-N33 PolarHBondContact O-N 3.15Å; N31-N33 VanDerWaalsContact O-N 3.09Å; N31-N34 PolarHBondContact O-N 2.84Å; N31-S35 PolarHBondContact O-N 3.46Å; N31-S35 VanDerWaalsContact O-N 3.09Å; N31-S35 PolarHBondContact O-OG 3.29Å
32A74.6Confident72Confident0 Ų078.7 Ų78.70%040%0.396CS..THydrogen-bonded Turntrans-63.3-16.9-175.600000114.5I28 V29 K30 N34 S35 V37 L48 I53I28-A32 PolarHBondContact O-N 3.1Å; I28-A32 VanDerWaalsContact O-N 3.07Å; V29-A32 WeakPolarHBondContact O-CB 3.26Å; V29-A32 PolarHBondContact O-N 3.15Å; V29-A32 VanDerWaalsContact O-N 3.13Å; K30-A32 VanDerWaalsContact C-N 3.32Å; A32-N34 VanDerWaalsContact C-N 3.29Å; A32-S35 WeakPolarHBondContact CA-O 3.15Å; A32-V37 HydrophobicContact CB-CG2 3.37Å; A32-L48 HydrophobicContact CB-CB 4.17Å; A32-L48 HydrophobicContact CB-CD1 3.69Å; A32-L48 HydrophobicContact CB-CG 4.12Å; A32-I53 HydrophobicContact CB-CD1 4.1Å; A32-I53 HydrophobicContact CB-CG1 4.43Å
33N73Confident71Confident75 Ų7581 Ų8140%0.40142%0.415SS..THydrogen-bonded Turntrans-65.8-33.4172.9-161.8-10.6000111.3N31 E50 I53N31-N33 PolarHBondContact O-N 3.15Å; N31-N33 VanDerWaalsContact O-N 3.09Å; N33-E50 PolarHBondContact ND2-OE2 2.69Å; N33-I53 HydrophobicContact CB-CD1 3.97Å
34N62.9Low70.5Confident154 Ų15480.2 Ų80.282%0.82441%0.41SS*.THydrogen-bonded Turntrans-102.2-32.2-178.7-68.1-36.8000113.7N31 A32N31-N34 PolarHBondContact O-N 2.84Å; A32-N34 VanDerWaalsContact C-N 3.29Å
35S62.1Low69.8Low61 Ų6178.1 Ų78.143%0.42741%0.407SS..SBendtrans-122.4117.5-177.157.80000111.1N31 A32 V37N31-S35 PolarHBondContact O-N 3.46Å; N31-S35 VanDerWaalsContact O-N 3.09Å; N31-S35 PolarHBondContact O-OG 3.29Å; A32-S35 WeakPolarHBondContact CA-O 3.15Å; S35-V37 PolarHBondContact O-N 3.3Å
36A67.6Low69.5Low39 Ų3979.2 Ų79.232%0.32241%0.414SS..PPolyproline II helixtrans-59.3128.4-179.400000111.8K45 V46 V47A36-K45 HydrophobicContact CB-CB 3.66Å; A36-V46 WeakPolarHBondContact CA-O 3.44Å; A36-V47 HydrophobicContact CB-CG2 3.75Å
37V69.4Low69.3Low6 Ų679.6 Ų79.64%0.03643%0.425CS..EExtended strand (participates in β ladder)trans-88.1135.6-1741800000110.1I28 A32 S35 L39 K45 V46 L68I28-V37 HydrophobicContact CG2-CG1 4.09Å; I28-V37 HydrophobicContact CG2-CG2 4.03Å; A32-V37 HydrophobicContact CB-CG2 3.37Å; S35-V37 PolarHBondContact O-N 3.3Å; V37-L39 HydrophobicContact CG1-CD2 4.1Å; V37-K45 WeakPolarHBondContact O-CA 3.46Å; V37-V46 PolarHBondContact N-O 3.45Å; V37-V46 PolarHBondContact O-N 3.01Å; V37-V46 VanDerWaalsContact O-N 3.09Å; V37-L68 HydrophobicContact CG1-CD2 3.59Å
38T67.1Low69.2Low90 Ų9074.3 Ų74.355%0.55240%0.401SS*.EExtended strand (participates in β ladder)trans-91.1116.4167.444.40000109.4K45T38-K45 HydrophobicContact CG2-CD 4.09Å; T38-K45 HydrophobicContact CG2-CG 3.57Å
39L65.9Low69.3Low9 Ų973.7 Ų73.75%0.04740%0.403CS..PPolyproline II helixtrans-89.5146.7175.2-57.9166.7000109.7V37 E41 F42 L68 V71 E72 L75V37-L39 HydrophobicContact CG1-CD2 4.1Å; L39-E41 VanDerWaalsContact C-N 3.29Å; L39-E41 PolarHBondContact O-N 3.49Å; L39-F42 HydrophobicContact CB-CB 4.16Å; L39-F42 HydrophobicContact CB-CD2 4.12Å; L39-F42 HydrophobicContact CD1-CB 4.42Å; L39-F42 HydrophobicContact CD1-CD2 3.79Å; L39-F42 HydrophobicContact CD1-CG 4.38Å; L39-F42 PolarHBondContact O-N 3.19Å; L39-L68 HydrophobicContact CD2-CD2 4.46Å; L39-V71 HydrophobicContact CD2-CB 4.37Å; L39-V71 HydrophobicContact CD2-CG1 3.95Å; L39-E72 HydrophobicContact CB-CG 4.18Å; L39-E72 HydrophobicContact CD1-CG 4.16Å; L39-E72 HydrophobicContact CD2-CG 3.97Å; L39-E72 HydrophobicContact CG-CG 4.31Å; L39-L75 HydrophobicContact CD1-CD1 3.45Å; L39-L75 VanDerWaalsContact CD1-CD1 3.45Å
40P61.7Low69.4Low86 Ų8677.6 Ų77.656%0.55842%0.421SS*.SBendtrans-61.2-30.9-175.716.5-27.4000114.6E72P40-E72 WeakPolarHBondContact CD-OE1 3.29Å; P40-E72 VanDerWaalsContact CG-OE1 3.23Å; P40-E72 WeakPolarHBondContact CG-OE1 3.48Å
41E62.8Low69.5Low110 Ų11077.1 Ų77.151%0.51442%0.424SS..SBendtrans-101.4-15.1178.7-59.1-147.3147.200114.7K7 L39K7-E41 IonicContact NZ-OE1 3.78Å; K7-E41 PolarHBondContact NZ-OE1 3.44Å; L39-E41 VanDerWaalsContact C-N 3.29Å; L39-E41 PolarHBondContact O-N 3.49Å
42F60Low69.8Low95 Ų9573.5 Ų73.542%0.41741%0.405SS..  trans-100.4123.2177.6-67.9-87.7000111.3L39 H44L39-F42 HydrophobicContact CB-CB 4.16Å; L39-F42 HydrophobicContact CB-CD2 4.12Å; L39-F42 HydrophobicContact CD1-CB 4.42Å; L39-F42 HydrophobicContact CD1-CD2 3.79Å; L39-F42 HydrophobicContact CD1-CG 4.38Å; L39-F42 PolarHBondContact O-N 3.19Å; F42-H44 PolarHBondContact O-N 3.44Å
43P58.7Low70.1Confident115 Ų11573.5 Ų73.575%0.74741%0.405SS*.SBendtrans-69.6-16.6178.727.2-33.4000113.2
44H64.9Low70.6Confident139 Ų13975.1 Ų75.164%0.64441%0.41SS*.SBendtrans-95.2138.3-174.2-60.8-59.9000112F42F42-H44 PolarHBondContact O-N 3.44Å
45K65.2Low71.6Confident149 Ų14971 Ų7165%0.64839%0.386SS*.EExtended strand (participates in β ladder)trans-76.8120.9171.7-67-170.5178.8-172.70109.3A36 V37 T38A36-K45 HydrophobicContact CB-CB 3.66Å; V37-K45 WeakPolarHBondContact O-CA 3.46Å; T38-K45 HydrophobicContact CG2-CD 4.09Å; T38-K45 HydrophobicContact CG2-CG 3.57Å
46V70.2Confident72.7Confident48 Ų4868 Ų6829%0.29137%0.366SS..EExtended strand (participates in β ladder)trans-108.6133.6-176.8-174.70000109.6A36 V37 L48A36-V46 WeakPolarHBondContact CA-O 3.44Å; V37-V46 PolarHBondContact N-O 3.45Å; V37-V46 PolarHBondContact O-N 3.01Å; V37-V46 VanDerWaalsContact O-N 3.09Å; V46-L48 HydrophobicContact CG1-CD2 4.05Å
47V74.5Confident73.5Confident93 Ų9366.9 Ų66.956%0.56435%0.354SS*.PPolyproline II helixtrans-91.7126.3167.9179.50000107.2A36A36-V47 HydrophobicContact CB-CG2 3.75Å
48L77.6Confident74.2Confident7 Ų771 Ų714%0.03737%0.372CS..PPolyproline II helixtrans-96.8144.1-174.9-58.3173.2000110.4A32 V46 V52 I53 V71 L75A32-L48 HydrophobicContact CB-CB 4.17Å; A32-L48 HydrophobicContact CB-CD1 3.69Å; A32-L48 HydrophobicContact CB-CG 4.12Å; V46-L48 HydrophobicContact CG1-CD2 4.05Å; L48-V52 HydrophobicContact CD2-CG1 4.29Å; L48-I53 HydrophobicContact CB-CD1 4.15Å; L48-I53 HydrophobicContact CB-CG1 3.82Å; L48-I53 HydrophobicContact CD1-CG1 4.32Å; L48-V71 HydrophobicContact CD1-CB 4.43Å; L48-V71 HydrophobicContact CD1-CG1 3.56Å; L48-V71 HydrophobicContact CD1-CG2 3.91Å; L48-V71 HydrophobicContact CD2-CG1 3.94Å; L48-V71 HydrophobicContact CG-CG1 4.41Å; L48-L75 HydrophobicContact CD2-CD1 4.38Å; L48-L75 HydrophobicContact CD2-CD2 4.15Å
49S80.1Confident75Confident62 Ų6267 Ų6743%0.43435%0.347SS..PPolyproline II helixtrans-73.5155.4169.259.20000110.8D51 V52 I53S49-D51 PolarHBondContact O-N 3.44Å; S49-V52 PolarHBondContact O-N 3Å; S49-V52 VanDerWaalsContact OG-CG2 3.3Å; S49-V52 WeakPolarHBondContact OG-CG2 2.92Å; S49-I53 WeakPolarHBondContact O-CG1 3.28Å; S49-I53 PolarHBondContact O-N 3.13Å; S49-I53 VanDerWaalsContact O-N 3.12Å
50E81.3Confident75.9Confident82 Ų8266.7 Ų66.738%0.38335%0.345SS..Hα-helixtrans-58.2-38-179.8-168.761.3-147.400112N33 V52 I53 Q54N33-E50 PolarHBondContact ND2-OE2 2.69Å; E50-V52 PolarHBondContact O-N 3.4Å; E50-I53 WeakPolarHBondContact O-CB 3.17Å; E50-I53 PolarHBondContact O-N 3.36Å; E50-Q54 WeakPolarHBondContact O-CG 3.01Å; E50-Q54 PolarHBondContact O-N 3.15Å; E50-Q54 PolarHBondContact OE1-NE2 3.18Å
51D82.2Confident76.9Confident113 Ų11368.4 Ų68.460%0.60435%0.346SS*.Hα-helixtrans-62.8-43.5179.5-55.2-33.3000112.1S49 I53 Q54 E55S49-D51 PolarHBondContact O-N 3.44Å; D51-I53 VanDerWaalsContact C-N 3.32Å; D51-I53 PolarHBondContact O-N 3.46Å; D51-Q54 PolarHBondContact O-N 3.38Å; D51-E55 WeakPolarHBondContact O-CB 3.28Å; D51-E55 WeakPolarHBondContact O-CG 3.27Å; D51-E55 PolarHBondContact O-N 3.28Å
52V83Confident77.9Confident11 Ų1163.6 Ų63.67%0.06732%0.324CS..Hα-helixtrans-66.3-36.8177.4174.60000110.7L48 S49 E50 S56 C74L48-V52 HydrophobicContact CD2-CG1 4.29Å; S49-V52 PolarHBondContact O-N 3Å; S49-V52 VanDerWaalsContact OG-CG2 3.3Å; S49-V52 WeakPolarHBondContact OG-CG2 2.92Å; E50-V52 PolarHBondContact O-N 3.4Å; V52-S56 WeakPolarHBondContact O-CB 3.48Å; V52-S56 PolarHBondContact O-N 3.01Å; V52-S56 PolarHBondContact O-OG 2.88Å; V52-S56 VanDerWaalsContact O-OG 3.13Å; V52-C74 HydrophobicContact CG1-CB 4.09Å
53I82.6Confident78.8Confident0 Ų060 Ų600%031%0.308CS..Hα-helixtrans-62.5-53176-65.6167.7000109.5V29 A32 N33 L48 S49 E50 D51 E55 S56 L57V29-I53 HydrophobicContact CG1-CG2 4.34Å; A32-I53 HydrophobicContact CB-CD1 4.1Å; A32-I53 HydrophobicContact CB-CG1 4.43Å; N33-I53 HydrophobicContact CB-CD1 3.97Å; L48-I53 HydrophobicContact CB-CD1 4.15Å; L48-I53 HydrophobicContact CB-CG1 3.82Å; L48-I53 HydrophobicContact CD1-CG1 4.32Å; S49-I53 WeakPolarHBondContact O-CG1 3.28Å; S49-I53 PolarHBondContact O-N 3.13Å; S49-I53 VanDerWaalsContact O-N 3.12Å; E50-I53 WeakPolarHBondContact O-CB 3.17Å; E50-I53 PolarHBondContact O-N 3.36Å; D51-I53 VanDerWaalsContact C-N 3.32Å; D51-I53 PolarHBondContact O-N 3.46Å; I53-E55 PolarHBondContact O-N 3.19Å; I53-S56 PolarHBondContact O-N 2.99Å; I53-S56 PolarHBondContact O-OG 3.42Å; I53-L57 HydrophobicContact CG2-CD1 4.19Å; I53-L57 WeakPolarHBondContact O-CG 3.49Å; I53-L57 PolarHBondContact O-N 3.49Å
54Q83.8Confident79.9Confident108 Ų10859.6 Ų59.651%0.50530%0.3SS..Hα-helixtrans-60.8-43.8-179-64-58.6-34.600112.3E50 D51 L57 F58E50-Q54 WeakPolarHBondContact O-CG 3.01Å; E50-Q54 PolarHBondContact O-N 3.15Å; E50-Q54 PolarHBondContact OE1-NE2 3.18Å; D51-Q54 PolarHBondContact O-N 3.38Å; Q54-L57 PolarHBondContact O-N 2.8Å; Q54-F58 PolarHBondContact O-N 2.87Å
55E82.4Confident80.5Confident67 Ų6753.9 Ų53.931%0.31327%0.273SS..Hα-helixtrans-67.1-38.9177.4-72.7-179.3166.600112.5D51 I53 L57 F58 I59 R89D51-E55 WeakPolarHBondContact O-CB 3.28Å; D51-E55 WeakPolarHBondContact O-CG 3.27Å; D51-E55 PolarHBondContact O-N 3.28Å; I53-E55 PolarHBondContact O-N 3.19Å; E55-L57 VanDerWaalsContact C-N 3.32Å; E55-L57 PolarHBondContact O-N 2.95Å; E55-F58 PolarHBondContact O-N 3.22Å; E55-I59 WeakPolarHBondContact O-CB 3.44Å; E55-I59 VanDerWaalsContact O-CG1 3.26Å; E55-I59 WeakPolarHBondContact O-CG1 3.39Å; E55-I59 PolarHBondContact O-N 2.8Å; E55-R89 WeakPolarHBondContact OE2-CD 3.38Å; E55-R89 IonicContact OE2-CZ 3.32Å; E55-R89 IonicContact OE2-NE 3.05Å; E55-R89 IonicContact OE2-NH1 2.92Å; E55-R89 PolarHBondContact OE2-NH1 3.21Å
56S85Confident81.4Confident0 Ų047.6 Ų47.60%025%0.246CC..Hα-helixtrans-64.1-37.7176.370.40000112.2V52 I53 I59 S60 A70V52-S56 WeakPolarHBondContact O-CB 3.48Å; V52-S56 PolarHBondContact O-N 3.01Å; V52-S56 PolarHBondContact O-OG 2.88Å; V52-S56 VanDerWaalsContact O-OG 3.13Å; I53-S56 PolarHBondContact O-N 2.99Å; I53-S56 PolarHBondContact O-OG 3.42Å; S56-I59 PolarHBondContact O-N 2.84Å; S56-S60 WeakPolarHBondContact O-CB 3.42Å; S56-S60 PolarHBondContact O-N 3.43Å; S56-A70 VanDerWaalsContact O-CB 3.3Å; S56-A70 WeakPolarHBondContact O-CB 3.44Å
57L85.1Confident82Confident14 Ų1445.6 Ų45.67%0.07323%0.234CC..Hα-helixtrans-68.4-42.5174.3-66.9-179.7000111.2Y26 V29 I53 Q54 E55 I59 S60 E61 E67Y26-L57 HydrophobicContact CD2-CD2 3.59Å; Y26-L57 HydrophobicContact CE2-CD1 4.05Å; Y26-L57 HydrophobicContact CE2-CD2 3.57Å; Y26-L57 HydrophobicContact CE2-CG 4.35Å; V29-L57 HydrophobicContact CG1-CD2 4.15Å; I53-L57 HydrophobicContact CG2-CD1 4.19Å; I53-L57 WeakPolarHBondContact O-CG 3.49Å; I53-L57 PolarHBondContact O-N 3.49Å; Q54-L57 PolarHBondContact O-N 2.8Å; E55-L57 VanDerWaalsContact C-N 3.32Å; E55-L57 PolarHBondContact O-N 2.95Å; L57-I59 PolarHBondContact O-N 3.42Å; L57-S60 WeakPolarHBondContact O-CB 3.33Å; L57-S60 PolarHBondContact O-N 2.89Å; L57-E61 WeakPolarHBondContact O-CG 3.3Å; L57-E61 PolarHBondContact O-N 3.19Å; L57-E67 HydrophobicContact CD2-CG 4.09Å
58F85.1Confident82.3Confident93 Ų9342.3 Ų42.341%0.40821%0.213SC..Hα-helixtrans-60.6-45173.9178.8-103.2000111.8Q54 E55 S60 E61 V62 V169Q54-F58 PolarHBondContact O-N 2.87Å; E55-F58 PolarHBondContact O-N 3.22Å; F58-S60 VanDerWaalsContact C-N 3.35Å; F58-S60 PolarHBondContact O-N 3.38Å; F58-E61 CarbonylContact O-C 3.6Å; F58-E61 WeakPolarHBondContact O-CA 3.29Å; F58-E61 WeakPolarHBondContact O-CB 3.5Å; F58-E61 PolarHBondContact O-N 3.2Å; F58-E61 VanDerWaalsContact O-N 3.08Å; F58-V62 HydrophobicContact CD1-CG2 4.02Å; F58-V62 HydrophobicContact CD2-CG2 4.45Å; F58-V62 HydrophobicContact CE1-CG2 3.61Å; F58-V62 HydrophobicContact CE2-CG2 4.08Å; F58-V62 HydrophobicContact CG-CG2 4.43Å; F58-V62 HydrophobicContact CZ-CG2 3.65Å; F58-V62 VanDerWaalsContact O-CG2 3.3Å; F58-V62 WeakPolarHBondContact O-CG2 3.35Å; F58-V62 PolarHBondContact O-N 3.29Å; F58-V169 HydrophobicContact CE1-CG2 4.16Å; F58-V169 HydrophobicContact CZ-CG2 4.16Å
59I83.1Confident82.5Confident6 Ų646 Ų463%0.03123%0.227CC..Hα-helixtrans-63.5-41.3176.6-73.3164.8000111E55 S56 L57 E61 V62 F63 A70 L73 C74 A93E55-I59 WeakPolarHBondContact O-CB 3.44Å; E55-I59 VanDerWaalsContact O-CG1 3.26Å; E55-I59 WeakPolarHBondContact O-CG1 3.39Å; E55-I59 PolarHBondContact O-N 2.8Å; S56-I59 PolarHBondContact O-N 2.84Å; L57-I59 PolarHBondContact O-N 3.42Å; I59-E61 VanDerWaalsContact C-N 3.26Å; I59-E61 PolarHBondContact O-N 3.02Å; I59-V62 PolarHBondContact O-N 3.25Å; I59-F63 HydrophobicContact CG2-CD2 3.8Å; I59-F63 HydrophobicContact CG2-CE2 4.12Å; I59-F63 WeakPolarHBondContact O-CD2 3.32Å; I59-F63 PolarHBondContact O-N 3.41Å; I59-A70 HydrophobicContact CG2-CB 4.26Å; I59-L73 HydrophobicContact CG2-CD2 4.04Å; I59-C74 VanDerWaalsContact CD1-SG 3.51Å; I59-A93 HydrophobicContact CD1-CB 3.58Å; I59-A93 HydrophobicContact CG1-CB 4.36Å
60S83.8Confident82.7Confident2 Ų243.1 Ų43.11%0.01421%0.206CC..Hα-helixtrans-59.1-38.1171.9170.90000111.7K21 S56 L57 F58 N64 F65K21-S60 WeakPolarHBondContact CE-O 3.33Å; S56-S60 WeakPolarHBondContact O-CB 3.42Å; S56-S60 PolarHBondContact O-N 3.43Å; L57-S60 WeakPolarHBondContact O-CB 3.33Å; L57-S60 PolarHBondContact O-N 2.89Å; F58-S60 VanDerWaalsContact C-N 3.35Å; F58-S60 PolarHBondContact O-N 3.38Å; S60-N64 CarbonylContact O-C 2.75Å; S60-N64 WeakPolarHBondContact O-CA 3.34Å; S60-N64 PolarHBondContact O-N 2.99Å; S60-F65 WeakPolarHBondContact CB-O 3.23Å; S60-F65 PolarHBondContact O-N 2.87Å; S60-F65 VanDerWaalsContact O-N 3.11Å; S60-F65 PolarHBondContact OG-O 3.26Å
61E84Confident82.8Confident123 Ų12339.2 Ų39.258%0.57519%0.188SC*.Hα-helixtrans-67.4-45.6173.3-73180178.500113.4L57 F58 I59 F63L57-E61 WeakPolarHBondContact O-CG 3.3Å; L57-E61 PolarHBondContact O-N 3.19Å; F58-E61 CarbonylContact O-C 3.6Å; F58-E61 WeakPolarHBondContact O-CA 3.29Å; F58-E61 WeakPolarHBondContact O-CB 3.5Å; F58-E61 PolarHBondContact O-N 3.2Å; F58-E61 VanDerWaalsContact O-N 3.08Å; I59-E61 VanDerWaalsContact C-N 3.26Å; I59-E61 PolarHBondContact O-N 3.02Å; E61-F63 PolarHBondContact O-N 3.29Å
62V82.5Confident82.8Confident9 Ų934.7 Ų34.76%0.05516%0.163CC..Hα-helixtrans-63.1-43.1-178.9171.70000111.6F58 I59 R163 L164 L167 V169F58-V62 HydrophobicContact CD1-CG2 4.02Å; F58-V62 HydrophobicContact CD2-CG2 4.45Å; F58-V62 HydrophobicContact CE1-CG2 3.61Å; F58-V62 HydrophobicContact CE2-CG2 4.08Å; F58-V62 HydrophobicContact CG-CG2 4.43Å; F58-V62 HydrophobicContact CZ-CG2 3.65Å; F58-V62 VanDerWaalsContact O-CG2 3.3Å; F58-V62 WeakPolarHBondContact O-CG2 3.35Å; F58-V62 PolarHBondContact O-N 3.29Å; I59-V62 PolarHBondContact O-N 3.25Å; V62-R163 PolarHBondContact O-NH1 2.98Å; V62-R163 PolarHBondContact O-NH2 2.77Å; V62-L164 HydrophobicContact CG1-CD2 4.46Å; V62-L167 HydrophobicContact CG1-CD1 4.18Å; V62-L167 HydrophobicContact CG2-CD1 4.37Å; V62-V169 HydrophobicContact CG2-CG2 4.32Å
63F80Confident82.8Confident20 Ų2035.3 Ų35.39%0.08817%0.166CC..Hα-helixtrans-102.21-176.1-61.2-61000114.4I59 E61 F65 V94 Y97 Y98 L164I59-F63 HydrophobicContact CG2-CD2 3.8Å; I59-F63 HydrophobicContact CG2-CE2 4.12Å; I59-F63 WeakPolarHBondContact O-CD2 3.32Å; I59-F63 PolarHBondContact O-N 3.41Å; E61-F63 PolarHBondContact O-N 3.29Å; F63-F65 HydrophobicContact CB-CB 4.16Å; F63-F65 PolarHBondContact O-N 3.41Å; F63-V94 HydrophobicContact CZ-CB 4.37Å; F63-V94 HydrophobicContact CZ-CG1 4.39Å; F63-V94 HydrophobicContact CZ-CG2 4.01Å; F63-Y97 HydrophobicContact CB-CE2 4.07Å; F63-Y97 AromaticContact CD1-CD1 3.64Å; F63-Y97 HydrophobicContact CD1-CD1 3.64Å; F63-Y97 HydrophobicContact CD1-CD2 4.5Å; F63-Y97 AromaticContact CD1-CE1 3.36Å; F63-Y97 HydrophobicContact CD1-CE1 3.36Å; F63-Y97 HydrophobicContact CD1-CE2 4.28Å; F63-Y97 HydrophobicContact CD1-CG 4.19Å; F63-Y97 AromaticContact CD1-CZ 3.7Å; F63-Y97 HydrophobicContact CD2-CD1 4.48Å; F63-Y97 HydrophobicContact CD2-CD2 4.24Å; F63-Y97 HydrophobicContact CD2-CE2 4.45Å; F63-Y97 HydrophobicContact CD2-CG 4.24Å; F63-Y97 AromaticContact CE1-CD1 3.43Å; F63-Y97 HydrophobicContact CE1-CD1 3.43Å; F63-Y97 VanDerWaalsContact CE1-CD1 3.43Å; F63-Y97 AromaticContact CE1-CE1 3.61Å; F63-Y97 HydrophobicContact CE1-CE1 3.61Å; F63-Y97 HydrophobicContact CE1-CG 4.06Å; F63-Y97 HydrophobicContact CE2-CD1 4.31Å; F63-Y97 HydrophobicContact CE2-CG 4.09Å; F63-Y97 HydrophobicContact CG-CD1 4.18Å; F63-Y97 HydrophobicContact CG-CD2 4.23Å; F63-Y97 AromaticContact CG-CE1 3.97Å; F63-Y97 HydrophobicContact CG-CE1 3.97Å; F63-Y97 HydrophobicContact CG-CE2 4.03Å; F63-Y97 HydrophobicContact CG-CG 4.28Å; F63-Y97 AromaticContact CG-CZ 3.87Å; F63-Y97 AromaticContact CZ-CD1 3.79Å; F63-Y97 HydrophobicContact CZ-CD1 3.79Å; F63-Y97 HydrophobicContact CZ-CE1 4.37Å; F63-Y97 AromaticContact CZ-CG 3.99Å; F63-Y97 HydrophobicContact CZ-CG 3.99Å; F63-Y98 HydrophobicContact CE1-CE2 4.1Å; F63-L164 HydrophobicContact CE1-CD2 4.47Å
64N80.8Confident82.9Confident106 Ų10635.4 Ų35.457%0.56717%0.167SC*.THydrogen-bonded Turntrans49.645.2-172-168.237.4000112.9K21 S60K21-N64 WeakPolarHBondContact CE-OD1 3.47Å; S60-N64 CarbonylContact O-C 2.75Å; S60-N64 WeakPolarHBondContact O-CA 3.34Å; S60-N64 PolarHBondContact O-N 2.99Å
65F78.8Confident82.8Confident19 Ų1932.3 Ų32.38%0.08315%0.154CC..  trans-106.8153.6-170-171-135000111.5F18 S60 F63 E67 R69 A70F18-F65 HydrophobicContact CB-CD2 3.4Å; F18-F65 VanDerWaalsContact CB-CD2 3.4Å; F18-F65 HydrophobicContact CB-CE2 3.35Å; F18-F65 AromaticContact CD1-CE2 3.74Å; F18-F65 HydrophobicContact CD1-CE2 3.74Å; F18-F65 HydrophobicContact CD1-CZ 4.44Å; F18-F65 HydrophobicContact CD2-CD2 4.08Å; F18-F65 AromaticContact CD2-CE2 3.79Å; F18-F65 HydrophobicContact CD2-CE2 3.79Å; F18-F65 HydrophobicContact CE1-CE2 4.46Å; F18-F65 HydrophobicContact CE2-CE2 4.45Å; F18-F65 AromaticContact CG-CD2 3.83Å; F18-F65 HydrophobicContact CG-CD2 3.83Å; F18-F65 AromaticContact CG-CE2 3.36Å; F18-F65 HydrophobicContact CG-CE2 3.36Å; F18-F65 HydrophobicContact CG-CZ 4.33Å; S60-F65 WeakPolarHBondContact CB-O 3.23Å; S60-F65 PolarHBondContact O-N 2.87Å; S60-F65 VanDerWaalsContact O-N 3.11Å; S60-F65 PolarHBondContact OG-O 3.26Å; F63-F65 HydrophobicContact CB-CB 4.16Å; F63-F65 PolarHBondContact O-N 3.41Å; F65-E67 PolarHBondContact O-N 3.34Å; F65-R69 HydrophobicContact CD1-CB 3.89Å; F65-R69 VanDerWaalsContact CE1-C 3.47Å; F65-R69 HydrophobicContact CE1-CB 3.12Å; F65-R69 HydrophobicContact CE1-CG 4.32Å; F65-R69 HydrophobicContact CE2-CB 3.95Å; F65-R69 HydrophobicContact CE2-CG 4.41Å; F65-R69 HydrophobicContact CZ-CB 3.17Å; F65-R69 HydrophobicContact CZ-CG 3.92Å; F65-A70 HydrophobicContact CD1-CB 4.27Å
66N83.4Confident82.8Confident16 Ų1631.5 Ų31.59%0.08615%0.153CC..  trans-56.8134.8174.3-176-78.6000111.6P19 D25 L68 R69 A70P19-N66 HydrophobicContact CG-CB 4.43Å; P19-N66 PolarHBondContact O-N 3.05Å; D25-N66 PolarHBondContact OD2-ND2 2.92Å; N66-L68 VanDerWaalsContact C-N 3.35Å; N66-L68 PolarHBondContact O-N 3.36Å; N66-L68 WeakPolarHBondContact OD1-CB 3.31Å; N66-L68 PolarHBondContact OD1-N 3.37Å; N66-R69 HydrophobicContact CB-CG 4.44Å; N66-R69 PolarHBondContact O-N 3.3Å; N66-A70 PolarHBondContact O-N 3.44Å
67E83Confident82.6Confident6 Ų631.5 Ų31.53%0.02815%0.153CC..Hα-helixtrans-62.6-37.4-172.7-64.781176.300112.5K21 N22 Y26 V29 L57 F65 R69 A70 V71K21-E67 WeakPolarHBondContact CB-OE1 3.47Å; N22-E67 PolarHBondContact N-OE2 2.96Å; Y26-E67 HydrophobicContact CD2-CG 4.06Å; V29-E67 HydrophobicContact CB-CB 4.38Å; V29-E67 HydrophobicContact CG2-CB 3.94Å; L57-E67 HydrophobicContact CD2-CG 4.09Å; F65-E67 PolarHBondContact O-N 3.34Å; E67-R69 PolarHBondContact O-N 2.94Å; E67-A70 WeakPolarHBondContact O-CB 3.23Å; E67-A70 PolarHBondContact O-N 3.21Å; E67-V71 WeakPolarHBondContact O-CG2 3.42Å; E67-V71 PolarHBondContact O-N 2.95Å
68L81.8Confident82.4Confident25 Ų2535.1 Ų35.113%0.13117%0.17CC..Hα-helixtrans-67.1-37.8177.4-70.7168.5000112D25 I28 V29 V37 L39 N66 V71 E72D25-L68 HydrophobicContact CB-CD1 4.08Å; D25-L68 HydrophobicContact CB-CG 4.04Å; I28-L68 HydrophobicContact CG2-CD2 4.27Å; V29-L68 HydrophobicContact CG2-CD2 3.96Å; V29-L68 HydrophobicContact CG2-CG 4.41Å; V37-L68 HydrophobicContact CG1-CD2 3.59Å; L39-L68 HydrophobicContact CD2-CD2 4.46Å; N66-L68 VanDerWaalsContact C-N 3.35Å; N66-L68 PolarHBondContact O-N 3.36Å; N66-L68 WeakPolarHBondContact OD1-CB 3.31Å; N66-L68 PolarHBondContact OD1-N 3.37Å; L68-V71 WeakPolarHBondContact O-CB 3.48Å; L68-V71 PolarHBondContact O-N 3.46Å; L68-E72 PolarHBondContact O-N 3.33Å
69R80.7Confident82Confident85 Ų8534.9 Ų34.932%0.32118%0.179SC..Hα-helixtrans-73.6-31.5176.6-64.7-62.1-165.4167.92.1111.7F65 N66 E67 V71 E72 L73F65-R69 HydrophobicContact CD1-CB 3.89Å; F65-R69 VanDerWaalsContact CE1-C 3.47Å; F65-R69 HydrophobicContact CE1-CB 3.12Å; F65-R69 HydrophobicContact CE1-CG 4.32Å; F65-R69 HydrophobicContact CE2-CB 3.95Å; F65-R69 HydrophobicContact CE2-CG 4.41Å; F65-R69 HydrophobicContact CZ-CB 3.17Å; F65-R69 HydrophobicContact CZ-CG 3.92Å; N66-R69 HydrophobicContact CB-CG 4.44Å; N66-R69 PolarHBondContact O-N 3.3Å; E67-R69 PolarHBondContact O-N 2.94Å; R69-V71 VanDerWaalsContact C-N 3.29Å; R69-E72 WeakPolarHBondContact CD-OE2 3.26Å; R69-E72 IonicContact CZ-OE2 3.61Å; R69-E72 IonicContact NE-OE2 3.72Å; R69-E72 IonicContact NH1-OE1 2.73Å; R69-E72 IonicContact NH1-OE2 2.75Å; R69-E72 PolarHBondContact NH1-OE2 3.26Å; R69-E72 PolarHBondContact O-N 2.83Å; R69-L73 PolarHBondContact O-N 2.96Å
70A83.8Confident81.6Confident0 Ų037.4 Ų37.40%019%0.191CC..Hα-helixtrans-62.7-38169.900000111.3S56 I59 F65 N66 E67 L73 C74S56-A70 VanDerWaalsContact O-CB 3.3Å; S56-A70 WeakPolarHBondContact O-CB 3.44Å; I59-A70 HydrophobicContact CG2-CB 4.26Å; F65-A70 HydrophobicContact CD1-CB 4.27Å; N66-A70 PolarHBondContact O-N 3.44Å; E67-A70 WeakPolarHBondContact O-CB 3.23Å; E67-A70 PolarHBondContact O-N 3.21Å; A70-L73 PolarHBondContact O-N 2.89Å; A70-C74 PolarHBondContact O-N 3.21Å; A70-C74 PolarHBondContact O-SG 2.94Å
71V83.7Confident81.2Confident1 Ų140.2 Ų40.21%0.00621%0.206CC..Hα-helixtrans-62.5-45.2171.4171.30000111.6V29 L39 L48 E67 L68 R69 L73 C74 L75V29-V71 HydrophobicContact CB-CG2 4.44Å; V29-V71 HydrophobicContact CG1-CG2 3.69Å; V29-V71 HydrophobicContact CG2-CG2 3.83Å; L39-V71 HydrophobicContact CD2-CB 4.37Å; L39-V71 HydrophobicContact CD2-CG1 3.95Å; L48-V71 HydrophobicContact CD1-CB 4.43Å; L48-V71 HydrophobicContact CD1-CG1 3.56Å; L48-V71 HydrophobicContact CD1-CG2 3.91Å; L48-V71 HydrophobicContact CD2-CG1 3.94Å; L48-V71 HydrophobicContact CG-CG1 4.41Å; E67-V71 WeakPolarHBondContact O-CG2 3.42Å; E67-V71 PolarHBondContact O-N 2.95Å; L68-V71 WeakPolarHBondContact O-CB 3.48Å; L68-V71 PolarHBondContact O-N 3.46Å; R69-V71 VanDerWaalsContact C-N 3.29Å; V71-L73 VanDerWaalsContact C-N 3.3Å; V71-L73 PolarHBondContact O-N 3.42Å; V71-C74 PolarHBondContact O-N 3.46Å; V71-L75 HydrophobicContact CG1-CD1 4.03Å; V71-L75 HydrophobicContact CG1-CG 4.37Å; V71-L75 WeakPolarHBondContact O-CG 3.2Å; V71-L75 PolarHBondContact O-N 3.35Å
72E82.1Confident80.5Confident17 Ų1736.4 Ų36.48%0.07919%0.193CC..Hα-helixtrans-59.9-41.4176-70.1-178.6160.600112.2L39 P40 L68 R69 L75 T76L39-E72 HydrophobicContact CB-CG 4.18Å; L39-E72 HydrophobicContact CD1-CG 4.16Å; L39-E72 HydrophobicContact CD2-CG 3.97Å; L39-E72 HydrophobicContact CG-CG 4.31Å; P40-E72 WeakPolarHBondContact CD-OE1 3.29Å; P40-E72 VanDerWaalsContact CG-OE1 3.23Å; P40-E72 WeakPolarHBondContact CG-OE1 3.48Å; L68-E72 PolarHBondContact O-N 3.33Å; R69-E72 WeakPolarHBondContact CD-OE2 3.26Å; R69-E72 IonicContact CZ-OE2 3.61Å; R69-E72 IonicContact NE-OE2 3.72Å; R69-E72 IonicContact NH1-OE1 2.73Å; R69-E72 IonicContact NH1-OE2 2.75Å; R69-E72 PolarHBondContact NH1-OE2 3.26Å; R69-E72 PolarHBondContact O-N 2.83Å; E72-L75 PolarHBondContact O-N 3.39Å; E72-T76 WeakPolarHBondContact O-CB 3.27Å; E72-T76 PolarHBondContact O-N 2.87Å; E72-T76 PolarHBondContact O-OG1 3.28Å
73L83.4Confident79.8Confident25 Ų2538.9 Ų38.913%0.13121%0.205CC..Hα-helixtrans-60.8-48.7174.5-17764000110.3I59 R69 A70 V71 L75 T76 V77 A93 L96I59-L73 HydrophobicContact CG2-CD2 4.04Å; R69-L73 PolarHBondContact O-N 2.96Å; A70-L73 PolarHBondContact O-N 2.89Å; V71-L73 VanDerWaalsContact C-N 3.3Å; V71-L73 PolarHBondContact O-N 3.42Å; L73-L75 VanDerWaalsContact C-N 3.34Å; L73-L75 PolarHBondContact O-N 3.15Å; L73-T76 PolarHBondContact O-N 2.95Å; L73-V77 HydrophobicContact CG-CG2 4.47Å; L73-V77 WeakPolarHBondContact O-CG2 3.34Å; L73-V77 PolarHBondContact O-N 3.41Å; L73-A93 HydrophobicContact CD2-CB 4.2Å; L73-A93 HydrophobicContact CG-CB 4.39Å; L73-L96 HydrophobicContact CD1-CB 3.95Å
74C83.9Confident79.2Confident1 Ų140.5 Ų40.51%0.00721%0.212CC..Hα-helixtrans-59-41.5177.6-71.10000113.1V52 I59 A70 V71 V77 E78V52-C74 HydrophobicContact CG1-CB 4.09Å; I59-C74 VanDerWaalsContact CD1-SG 3.51Å; A70-C74 PolarHBondContact O-N 3.21Å; A70-C74 PolarHBondContact O-SG 2.94Å; V71-C74 PolarHBondContact O-N 3.46Å; C74-V77 PolarHBondContact O-N 3.32Å; C74-E78 PolarHBondContact O-N 2.84Å
75L82.9Confident78.4Confident44 Ų4439.2 Ų39.223%0.2321%0.21CC..Hα-helixtrans-68.4-36.9177.3-68.7173.5000112L39 L48 V71 E72 L73 E78 S79L39-L75 HydrophobicContact CD1-CD1 3.45Å; L39-L75 VanDerWaalsContact CD1-CD1 3.45Å; L48-L75 HydrophobicContact CD2-CD1 4.38Å; L48-L75 HydrophobicContact CD2-CD2 4.15Å; V71-L75 HydrophobicContact CG1-CD1 4.03Å; V71-L75 HydrophobicContact CG1-CG 4.37Å; V71-L75 WeakPolarHBondContact O-CG 3.2Å; V71-L75 PolarHBondContact O-N 3.35Å; E72-L75 PolarHBondContact O-N 3.39Å; L73-L75 VanDerWaalsContact C-N 3.34Å; L73-L75 PolarHBondContact O-N 3.15Å; L75-E78 PolarHBondContact O-N 3.44Å; L75-S79 PolarHBondContact O-N 2.98Å; L75-S79 VanDerWaalsContact O-N 3.12Å
76T81.2Confident77.7Confident49 Ų4943.9 Ų43.930%0.30124%0.243SC..Hα-helixtrans-66-42.5174.5-53.60000110.2E72 L73 E78 S79 Q80 L96E72-T76 WeakPolarHBondContact O-CB 3.27Å; E72-T76 PolarHBondContact O-N 2.87Å; E72-T76 PolarHBondContact O-OG1 3.28Å; L73-T76 PolarHBondContact O-N 2.95Å; T76-E78 VanDerWaalsContact C-N 3.32Å; T76-E78 PolarHBondContact O-N 3.09Å; T76-S79 PolarHBondContact O-N 3.5Å; T76-S79 PolarHBondContact O-OG 3.46Å; T76-Q80 WeakPolarHBondContact O-CG 3.36Å; T76-Q80 PolarHBondContact O-N 3.11Å; T76-Q80 VanDerWaalsContact O-N 3.13Å; T76-L96 HydrophobicContact CG2-CD1 4.44Å
77V82.3Confident77.2Confident0 Ų044.7 Ų44.70%025%0.247CC..Hα-helixtrans-59.8-44.1173.51760000110.7L73 C74 S79 Q80 L81 R89 V92 A93 L96L73-V77 HydrophobicContact CG-CG2 4.47Å; L73-V77 WeakPolarHBondContact O-CG2 3.34Å; L73-V77 PolarHBondContact O-N 3.41Å; C74-V77 PolarHBondContact O-N 3.32Å; V77-S79 VanDerWaalsContact C-N 3.29Å; V77-S79 PolarHBondContact O-N 2.88Å; V77-Q80 CarbonylContact O-C 3.59Å; V77-Q80 PolarHBondContact O-N 2.87Å; V77-L81 PolarHBondContact O-N 3.05Å; V77-R89 HydrophobicContact CB-CG 4.07Å; V77-R89 HydrophobicContact CG1-CB 4.3Å; V77-R89 HydrophobicContact CG1-CG 3.5Å; V77-R89 VanDerWaalsContact CG1-CG 3.5Å; V77-V92 HydrophobicContact CB-CG1 4.5Å; V77-V92 HydrophobicContact CG1-CB 3.64Å; V77-V92 HydrophobicContact CG1-CG1 3.71Å; V77-V92 HydrophobicContact CG2-CG1 4.32Å; V77-A93 HydrophobicContact CG2-CB 3.87Å; V77-L96 HydrophobicContact CG2-CD1 3.75Å
78E80.3Confident76.9Confident91 Ų9146.1 Ų46.143%0.42526%0.264SS..Hα-helixtrans-60-40.8-179.9-165.772.4163.100111.8C74 L75 T76 Q80 R89C74-E78 PolarHBondContact O-N 2.84Å; L75-E78 PolarHBondContact O-N 3.44Å; T76-E78 VanDerWaalsContact C-N 3.32Å; T76-E78 PolarHBondContact O-N 3.09Å; E78-Q80 VanDerWaalsContact C-N 3.27Å; E78-Q80 PolarHBondContact O-N 3.18Å; E78-R89 IonicContact OE1-CZ 2.6Å; E78-R89 IonicContact OE1-NH2 3.6Å; E78-R89 PolarHBondContact OE1-NH2 3.45Å; E78-R89 IonicContact OE2-CZ 3.94Å; E78-R89 IonicContact OE2-NE 3.98Å; E78-R89 PolarHBondContact OE2-NE 3.41Å; E78-R89 IonicContact OE2-NH2 3.4Å; E78-R89 PolarHBondContact OE2-NH2 3.41Å
79S76.6Confident76.9Confident87 Ų8746.7 Ų46.761%0.60827%0.265SS*.Hα-helixtrans-69.4-25175.865.90000113.4L75 T76 V77L75-S79 PolarHBondContact O-N 2.98Å; L75-S79 VanDerWaalsContact O-N 3.12Å; T76-S79 PolarHBondContact O-N 3.5Å; T76-S79 PolarHBondContact O-OG 3.46Å; V77-S79 VanDerWaalsContact C-N 3.29Å; V77-S79 PolarHBondContact O-N 2.88Å
80Q75.1Confident76.9Confident60 Ų6043.8 Ų43.828%0.2826%0.261SS..Hα-helixtrans-100.5-2.7-179.2-65.2-175.912.500114.3T76 V77 E78 S82 L83T76-Q80 WeakPolarHBondContact O-CG 3.36Å; T76-Q80 PolarHBondContact O-N 3.11Å; T76-Q80 VanDerWaalsContact O-N 3.13Å; V77-Q80 CarbonylContact O-C 3.59Å; V77-Q80 PolarHBondContact O-N 2.87Å; E78-Q80 VanDerWaalsContact C-N 3.27Å; E78-Q80 PolarHBondContact O-N 3.18Å; Q80-S82 PolarHBondContact O-N 2.74Å; Q80-S82 VanDerWaalsContact O-N 3.12Å; Q80-L83 HydrophobicContact CB-CD1 3.99Å; Q80-L83 HydrophobicContact CG-CD1 4.12Å; Q80-L83 VanDerWaalsContact O-CB 3.27Å; Q80-L83 WeakPolarHBondContact O-CB 3.43Å; Q80-L83 PolarHBondContact O-N 2.99Å
81L75.8Confident76.9Confident61 Ų6146.7 Ų46.732%0.31927%0.274SS..G310 helixtrans-60.7-29.1-174.9-158.1145.6000111.9V77 L83 F84 R89V77-L81 PolarHBondContact O-N 3.05Å; L81-L83 PolarHBondContact O-N 2.97Å; L81-F84 PolarHBondContact O-N 2.68Å; L81-F84 VanDerWaalsContact O-N 3.17Å; L81-R89 HydrophobicContact CD1-CB 4.24Å
82S69Low76.9Confident43 Ų4346.7 Ų46.730%0.30127%0.273SS..G310 helixtrans-63.1-20.1173.366.70000114.4Q80Q80-S82 PolarHBondContact O-N 2.74Å; Q80-S82 VanDerWaalsContact O-N 3.12Å
83L66.8Low77Confident61 Ų6145.9 Ų45.932%0.31927%0.27SS..G310 helixtrans-83-21.9176.6-71.5149.2000112.9Q80 L81 P85Q80-L83 HydrophobicContact CB-CD1 3.99Å; Q80-L83 HydrophobicContact CG-CD1 4.12Å; Q80-L83 VanDerWaalsContact O-CB 3.27Å; Q80-L83 WeakPolarHBondContact O-CB 3.43Å; Q80-L83 PolarHBondContact O-N 2.99Å; L81-L83 PolarHBondContact O-N 2.97Å; L83-P85 WeakPolarHBondContact O-CD 3.36Å
84F67.4Low77.1Confident53 Ų5344.7 Ų44.723%0.23226%0.264CS..SBendtrans-115.878.1-172.9-64.4-80.7000110.9L81 C86 L87 V92L81-F84 PolarHBondContact O-N 2.68Å; L81-F84 VanDerWaalsContact O-N 3.17Å; F84-C86 PolarHBondContact O-N 2.96Å; F84-L87 HydrophobicContact CB-CB 4.31Å; F84-L87 HydrophobicContact CB-CD1 4.25Å; F84-L87 HydrophobicContact CD1-CD1 4.24Å; F84-L87 PolarHBondContact O-N 3.47Å; F84-V92 HydrophobicContact CB-CG2 3.72Å; F84-V92 HydrophobicContact CD2-CB 4.44Å; F84-V92 HydrophobicContact CD2-CG1 3.52Å; F84-V92 HydrophobicContact CD2-CG2 4Å; F84-V92 HydrophobicContact CE2-CG1 3.67Å; F84-V92 HydrophobicContact CG-CG1 4.18Å; F84-V92 HydrophobicContact CG-CG2 3.89Å; F84-V92 HydrophobicContact CZ-CG1 4.44Å
85P63.8Low77.2Confident80 Ų8045.4 Ų45.452%0.51927%0.268SS..THydrogen-bonded Turntrans-60.7137.1178.625-32.3000110.5L83 L87L83-P85 WeakPolarHBondContact O-CD 3.36Å; P85-L87 VanDerWaalsContact C-N 3.3Å; P85-L87 PolarHBondContact O-N 3.43Å
86C65.6Low77.2Confident116 Ų11644.3 Ų44.378%0.78426%0.262SS*.THydrogen-bonded Turntrans73.8-0.4177.3-49.70000117.2F84F84-C86 PolarHBondContact O-N 2.96Å
87L71.9Confident77.4Confident33 Ų3343.1 Ų43.117%0.17325%0.252CS..  trans-100.5130.8174.5-68.2170.4000110.5F84 P85 F91 V92 H175F84-L87 HydrophobicContact CB-CB 4.31Å; F84-L87 HydrophobicContact CB-CD1 4.25Å; F84-L87 HydrophobicContact CD1-CD1 4.24Å; F84-L87 PolarHBondContact O-N 3.47Å; P85-L87 VanDerWaalsContact C-N 3.3Å; P85-L87 PolarHBondContact O-N 3.43Å; L87-F91 HydrophobicContact CB-CB 4.43Å; L87-F91 HydrophobicContact CD2-CB 4.08Å; L87-F91 HydrophobicContact CD2-CD2 4.41Å; L87-F91 HydrophobicContact CD2-CG 4.41Å; L87-V92 HydrophobicContact CB-CG2 3.84Å; L87-H175 HydrophobicContact CD2-CB 4.32Å
88G76.8Confident77.6Confident37 Ų3743.3 Ų43.338%0.38125%0.253SS..  trans-71.4162.2171.500000112.7G90 F91 V92G88-G90 VanDerWaalsContact C-N 3.26Å; G88-G90 PolarHBondContact O-N 2.97Å; G88-F91 PolarHBondContact O-N 3.36Å; G88-V92 PolarHBondContact O-N 3.01Å
89R81Confident77.8Confident37 Ų3743.1 Ų43.114%0.1425%0.252CS..Hα-helixtrans-50.3-44.4-177.8-164.1179.3-55.7134.8-7.9112.7E55 V77 E78 L81 F91 V92 A93E55-R89 WeakPolarHBondContact OE2-CD 3.38Å; E55-R89 IonicContact OE2-CZ 3.32Å; E55-R89 IonicContact OE2-NE 3.05Å; E55-R89 IonicContact OE2-NH1 2.92Å; E55-R89 PolarHBondContact OE2-NH1 3.21Å; V77-R89 HydrophobicContact CB-CG 4.07Å; V77-R89 HydrophobicContact CG1-CB 4.3Å; V77-R89 HydrophobicContact CG1-CG 3.5Å; V77-R89 VanDerWaalsContact CG1-CG 3.5Å; E78-R89 IonicContact OE1-CZ 2.6Å; E78-R89 IonicContact OE1-NH2 3.6Å; E78-R89 PolarHBondContact OE1-NH2 3.45Å; E78-R89 IonicContact OE2-CZ 3.94Å; E78-R89 IonicContact OE2-NE 3.98Å; E78-R89 PolarHBondContact OE2-NE 3.41Å; E78-R89 IonicContact OE2-NH2 3.4Å; E78-R89 PolarHBondContact OE2-NH2 3.41Å; L81-R89 HydrophobicContact CD1-CB 4.24Å; R89-F91 PolarHBondContact O-N 3.3Å; R89-V92 PolarHBondContact O-N 3.32Å; R89-A93 WeakPolarHBondContact O-CB 3.48Å; R89-A93 PolarHBondContact O-N 3.43Å
90G81Confident78.1Confident23 Ų2340.9 Ų40.924%0.23724%0.237CC..Hα-helixtrans-58-42.7178.700000114.2G88 A93 V94G88-G90 VanDerWaalsContact C-N 3.26Å; G88-G90 PolarHBondContact O-N 2.97Å; G90-A93 WeakPolarHBondContact O-CB 3.44Å; G90-A93 PolarHBondContact O-N 3.16Å; G90-V94 WeakPolarHBondContact O-CG2 3.33Å; G90-V94 PolarHBondContact O-N 3.02Å
91F83.7Confident78.6Confident62 Ų6238.1 Ų38.127%0.27222%0.224SC..Hα-helixtrans-70.1-41.3-179.6-60.2-62.2000111.9L87 G88 R89 A93 V94 V95 V169 L170 G171 H175L87-F91 HydrophobicContact CB-CB 4.43Å; L87-F91 HydrophobicContact CD2-CB 4.08Å; L87-F91 HydrophobicContact CD2-CD2 4.41Å; L87-F91 HydrophobicContact CD2-CG 4.41Å; G88-F91 PolarHBondContact O-N 3.36Å; R89-F91 PolarHBondContact O-N 3.3Å; F91-A93 VanDerWaalsContact C-N 3.28Å; F91-A93 PolarHBondContact O-N 3.06Å; F91-V94 WeakPolarHBondContact O-CB 3.1Å; F91-V94 PolarHBondContact O-N 3.36Å; F91-V95 PolarHBondContact O-N 3.39Å; F91-V169 VanDerWaalsContact CD1-O 3.28Å; F91-V169 WeakPolarHBondContact CD1-O 3.23Å; F91-L170 VanDerWaalsContact CE1-C 3.49Å; F91-G171 VanDerWaalsContact CE1-N 3.29Å; F91-H175 PolarHBondContact O-CE1 3.44Å; F91-H175 VanDerWaalsContact O-CE1 3.22Å
92V83.2Confident79Confident0 Ų035.3 Ų35.30%021%0.209CC..Hα-helixtrans-65.5-35.4177.4-178.50000110.7V77 F84 L87 G88 R89 V94 V95 L96V77-V92 HydrophobicContact CB-CG1 4.5Å; V77-V92 HydrophobicContact CG1-CB 3.64Å; V77-V92 HydrophobicContact CG1-CG1 3.71Å; V77-V92 HydrophobicContact CG2-CG1 4.32Å; F84-V92 HydrophobicContact CB-CG2 3.72Å; F84-V92 HydrophobicContact CD2-CB 4.44Å; F84-V92 HydrophobicContact CD2-CG1 3.52Å; F84-V92 HydrophobicContact CD2-CG2 4Å; F84-V92 HydrophobicContact CE2-CG1 3.67Å; F84-V92 HydrophobicContact CG-CG1 4.18Å; F84-V92 HydrophobicContact CG-CG2 3.89Å; F84-V92 HydrophobicContact CZ-CG1 4.44Å; L87-V92 HydrophobicContact CB-CG2 3.84Å; G88-V92 PolarHBondContact O-N 3.01Å; R89-V92 PolarHBondContact O-N 3.32Å; V92-V94 VanDerWaalsContact C-N 3.29Å; V92-V94 PolarHBondContact O-N 2.97Å; V92-V95 PolarHBondContact O-N 3.45Å; V92-L96 HydrophobicContact CG1-CD1 4.23Å; V92-L96 HydrophobicContact CG1-CG 4.3Å; V92-L96 PolarHBondContact O-N 2.96Å
93A85.4Confident79.6Confident0 Ų036 Ų360%021%0.214CC..Hα-helixtrans-58.6-39.9173.600000112.4I59 L73 V77 R89 G90 F91 Y97I59-A93 HydrophobicContact CD1-CB 3.58Å; I59-A93 HydrophobicContact CG1-CB 4.36Å; L73-A93 HydrophobicContact CD2-CB 4.2Å; L73-A93 HydrophobicContact CG-CB 4.39Å; V77-A93 HydrophobicContact CG2-CB 3.87Å; R89-A93 WeakPolarHBondContact O-CB 3.48Å; R89-A93 PolarHBondContact O-N 3.43Å; G90-A93 WeakPolarHBondContact O-CB 3.44Å; G90-A93 PolarHBondContact O-N 3.16Å; F91-A93 VanDerWaalsContact C-N 3.28Å; F91-A93 PolarHBondContact O-N 3.06Å; A93-Y97 VanDerWaalsContact O-CB 3.22Å; A93-Y97 WeakPolarHBondContact O-CB 3.49Å; A93-Y97 PolarHBondContact O-N 2.91Å
94V86.1Confident80.4Confident1 Ų134.3 Ų34.31%0.00621%0.205CC..Hα-helixtrans-62.8-44.3175.6179.80000111.5F63 G90 F91 V92 Y97 Y98 V169 V179F63-V94 HydrophobicContact CZ-CB 4.37Å; F63-V94 HydrophobicContact CZ-CG1 4.39Å; F63-V94 HydrophobicContact CZ-CG2 4.01Å; G90-V94 WeakPolarHBondContact O-CG2 3.33Å; G90-V94 PolarHBondContact O-N 3.02Å; F91-V94 WeakPolarHBondContact O-CB 3.1Å; F91-V94 PolarHBondContact O-N 3.36Å; V92-V94 VanDerWaalsContact C-N 3.29Å; V92-V94 PolarHBondContact O-N 2.97Å; V94-Y97 PolarHBondContact O-N 3.5Å; V94-Y98 HydrophobicContact CG1-CD2 3.78Å; V94-Y98 HydrophobicContact CG1-CE2 3.67Å; V94-Y98 VanDerWaalsContact O-CD2 3.28Å; V94-Y98 WeakPolarHBondContact O-CD2 3.21Å; V94-Y98 PolarHBondContact O-N 2.98Å; V94-Y98 VanDerWaalsContact O-N 3.16Å; V94-V169 HydrophobicContact CG2-CB 4.25Å; V94-V169 HydrophobicContact CG2-CG1 3.38Å; V94-V179 HydrophobicContact CG1-CG1 4.38Å; V94-V179 HydrophobicContact CG1-CG2 4.16Å
95V84.9Confident81.2Confident15 Ų1531.8 Ų31.89%0.09119%0.194CC..Hα-helixtrans-60.6-55.3177.7-178.90000110F91 V92 Y97 Y98 E99 H175 M182F91-V95 PolarHBondContact O-N 3.39Å; V92-V95 PolarHBondContact O-N 3.45Å; V95-Y97 PolarHBondContact O-N 3.28Å; V95-Y98 PolarHBondContact O-N 2.93Å; V95-E99 VanDerWaalsContact O-CB 3.29Å; V95-E99 WeakPolarHBondContact O-CB 3.41Å; V95-E99 PolarHBondContact O-N 3.47Å; V95-H175 VanDerWaalsContact CG2-CE1 3.43Å; V95-H175 WeakPolarHBondContact CG2-CE1 3.49Å; V95-H175 WeakPolarHBondContact CG2-ND1 3.45Å; V95-M182 HydrophobicContact CG1-CE 4.37Å; V95-M182 HydrophobicContact CG1-SD 4.27Å; V95-M182 WeakPolarHBondContact O-CE 3.45Å
96L83.6Confident81.9Confident21 Ų2129.4 Ų29.411%0.1118%0.177CC..Hα-helixtrans-61.8-33.9-177.3-66.4-176.8000112.5L73 T76 V77 V92 E99 S100L73-L96 HydrophobicContact CD1-CB 3.95Å; T76-L96 HydrophobicContact CG2-CD1 4.44Å; V77-L96 HydrophobicContact CG2-CD1 3.75Å; V92-L96 HydrophobicContact CG1-CD1 4.23Å; V92-L96 HydrophobicContact CG1-CG 4.3Å; V92-L96 PolarHBondContact O-N 2.96Å; L96-E99 PolarHBondContact O-N 3.01Å; L96-S100 WeakPolarHBondContact O-CB 3.38Å; L96-S100 PolarHBondContact O-N 2.82Å
97Y85.9Confident82.7Confident24 Ų2426.2 Ų26.29%0.09415%0.154CC..Hα-helixtrans-61.5-55.1175.1177.9-99.3000111.9F18 F63 A93 V94 V95 E99 S100 H101F18-Y97 AromaticContact CD2-CE2 3.91Å; F18-Y97 HydrophobicContact CD2-CE2 3.91Å; F18-Y97 HydrophobicContact CE2-CD2 4.44Å; F18-Y97 AromaticContact CE2-CE2 3.72Å; F18-Y97 HydrophobicContact CE2-CE2 3.72Å; F63-Y97 HydrophobicContact CB-CE2 4.07Å; F63-Y97 AromaticContact CD1-CD1 3.64Å; F63-Y97 HydrophobicContact CD1-CD1 3.64Å; F63-Y97 HydrophobicContact CD1-CD2 4.5Å; F63-Y97 AromaticContact CD1-CE1 3.36Å; F63-Y97 HydrophobicContact CD1-CE1 3.36Å; F63-Y97 HydrophobicContact CD1-CE2 4.28Å; F63-Y97 HydrophobicContact CD1-CG 4.19Å; F63-Y97 AromaticContact CD1-CZ 3.7Å; F63-Y97 HydrophobicContact CD2-CD1 4.48Å; F63-Y97 HydrophobicContact CD2-CD2 4.24Å; F63-Y97 HydrophobicContact CD2-CE2 4.45Å; F63-Y97 HydrophobicContact CD2-CG 4.24Å; F63-Y97 AromaticContact CE1-CD1 3.43Å; F63-Y97 HydrophobicContact CE1-CD1 3.43Å; F63-Y97 VanDerWaalsContact CE1-CD1 3.43Å; F63-Y97 AromaticContact CE1-CE1 3.61Å; F63-Y97 HydrophobicContact CE1-CE1 3.61Å; F63-Y97 HydrophobicContact CE1-CG 4.06Å; F63-Y97 HydrophobicContact CE2-CD1 4.31Å; F63-Y97 HydrophobicContact CE2-CG 4.09Å; F63-Y97 HydrophobicContact CG-CD1 4.18Å; F63-Y97 HydrophobicContact CG-CD2 4.23Å; F63-Y97 AromaticContact CG-CE1 3.97Å; F63-Y97 HydrophobicContact CG-CE1 3.97Å; F63-Y97 HydrophobicContact CG-CE2 4.03Å; F63-Y97 HydrophobicContact CG-CG 4.28Å; F63-Y97 AromaticContact CG-CZ 3.87Å; F63-Y97 AromaticContact CZ-CD1 3.79Å; F63-Y97 HydrophobicContact CZ-CD1 3.79Å; F63-Y97 HydrophobicContact CZ-CE1 4.37Å; F63-Y97 AromaticContact CZ-CG 3.99Å; F63-Y97 HydrophobicContact CZ-CG 3.99Å; A93-Y97 VanDerWaalsContact O-CB 3.22Å; A93-Y97 WeakPolarHBondContact O-CB 3.49Å; A93-Y97 PolarHBondContact O-N 2.91Å; V94-Y97 PolarHBondContact O-N 3.5Å; V95-Y97 PolarHBondContact O-N 3.28Å; Y97-E99 VanDerWaalsContact C-N 3.29Å; Y97-E99 PolarHBondContact O-N 3.43Å; Y97-S100 WeakPolarHBondContact O-CB 3.43Å; Y97-S100 PolarHBondContact O-N 3.23Å; Y97-S100 PolarHBondContact O-OG 3.48Å; Y97-H101 AromaticContact CD1-CD2 3.93Å; Y97-H101 AromaticContact CE1-CD2 3.53Å; Y97-H101 AromaticContact CE1-NE2 3.36Å; Y97-H101 WeakPolarHBondContact CE1-NE2 3.27Å; Y97-H101 AromaticContact CE2-NE2 3.59Å; Y97-H101 AromaticContact CZ-CD2 3.71Å; Y97-H101 AromaticContact CZ-NE2 3.05Å; Y97-H101 PolarHBondContact O-CD2 3.37Å; Y97-H101 PolarHBondContact O-N 2.88Å; Y97-H101 PolarHBondContact OH-NE2 2.83Å; Y97-H101 VanDerWaalsContact OH-NE2 3.11Å
98Y86.2Confident83.2Confident5 Ų524.8 Ų24.82%0.0215%0.146CC..Hα-helixtrans-70.9-26.4179.3-69.2-62.6000112.6F63 V94 V95 S100 H101 L102 E160 L164 V179 M182 L183 I186F63-Y98 HydrophobicContact CE1-CE2 4.1Å; V94-Y98 HydrophobicContact CG1-CD2 3.78Å; V94-Y98 HydrophobicContact CG1-CE2 3.67Å; V94-Y98 VanDerWaalsContact O-CD2 3.28Å; V94-Y98 WeakPolarHBondContact O-CD2 3.21Å; V94-Y98 PolarHBondContact O-N 2.98Å; V94-Y98 VanDerWaalsContact O-N 3.16Å; V95-Y98 PolarHBondContact O-N 2.93Å; Y98-S100 VanDerWaalsContact C-N 3.32Å; Y98-H101 PolarHBondContact O-N 3.49Å; Y98-L102 VanDerWaalsContact O-CB 3.22Å; Y98-L102 WeakPolarHBondContact O-CB 3.34Å; Y98-L102 PolarHBondContact O-N 2.69Å; Y98-E160 PolarHBondContact OH-OE1 2.91Å; Y98-L164 HydrophobicContact CE2-CD1 3.75Å; Y98-V179 HydrophobicContact CD2-CG1 4.3Å; Y98-V179 HydrophobicContact CE2-CG1 4.37Å; Y98-M182 VanDerWaalsContact C-CE 3.47Å; Y98-L183 HydrophobicContact CD1-CD2 3.68Å; Y98-L183 HydrophobicContact CD2-CD2 4.42Å; Y98-L183 HydrophobicContact CE1-CD2 3.38Å; Y98-L183 HydrophobicContact CE2-CD2 4.16Å; Y98-L183 HydrophobicContact CG-CD2 4.21Å; Y98-I186 HydrophobicContact CD1-CD1 3.85Å; Y98-I186 HydrophobicContact CG-CD1 4.46Å
99E83.8Confident83.5Confident86 Ų8623.6 Ų23.640%0.40213%0.131SC..Hα-helixtrans-65.9-38.4172.8-169.4172.4-175.700110.9V95 L96 Y97 L102 S103 M182V95-E99 VanDerWaalsContact O-CB 3.29Å; V95-E99 WeakPolarHBondContact O-CB 3.41Å; V95-E99 PolarHBondContact O-N 3.47Å; L96-E99 PolarHBondContact O-N 3.01Å; Y97-E99 VanDerWaalsContact C-N 3.29Å; Y97-E99 PolarHBondContact O-N 3.43Å; E99-L102 PolarHBondContact O-N 2.86Å; E99-S103 WeakPolarHBondContact O-CB 3.2Å; E99-S103 PolarHBondContact O-N 3.21Å; E99-S103 PolarHBondContact O-OG 3.43Å; E99-M182 HydrophobicContact CB-CE 3.59Å; E99-M182 HydrophobicContact CG-CE 4.45Å
100S84Confident83.4Confident41 Ų4123.6 Ų23.629%0.28714%0.14SC..Hα-helixtrans-62.7-44.2174.280.90000112.1L96 Y97 Y98 L102 S103 I104L96-S100 WeakPolarHBondContact O-CB 3.38Å; L96-S100 PolarHBondContact O-N 2.82Å; Y97-S100 WeakPolarHBondContact O-CB 3.43Å; Y97-S100 PolarHBondContact O-N 3.23Å; Y97-S100 PolarHBondContact O-OG 3.48Å; Y98-S100 VanDerWaalsContact C-N 3.32Å; S100-L102 VanDerWaalsContact C-N 3.34Å; S100-L102 PolarHBondContact O-N 3.45Å; S100-S103 WeakPolarHBondContact CA-OG 3.35Å; S100-S103 PolarHBondContact O-N 3.35Å; S100-S103 PolarHBondContact O-OG 3.41Å; S100-I104 WeakPolarHBondContact O-CD1 3.27Å; S100-I104 VanDerWaalsContact O-CG1 3.25Å; S100-I104 WeakPolarHBondContact O-CG1 3.47Å; S100-I104 PolarHBondContact O-N 3.31Å
101H85.3Confident83.4Confident2 Ų223.5 Ų23.51%0.00913%0.134CC..Hα-helixtrans-63.2-43.1175.5-77-59.4000112.5P15 L16 F18 Y97 Y98 I104 I105 I186P15-H101 PolarHBondContact O-ND1 2.87Å; L16-H101 HydrophobicContact CD2-CB 4Å; L16-H101 WeakPolarHBondContact CD2-ND1 3.15Å; F18-H101 AromaticContact CD2-CE1 3.54Å; F18-H101 AromaticContact CD2-NE2 3.81Å; F18-H101 AromaticContact CE2-CE1 2.98Å; F18-H101 WeakPolarHBondContact CE2-CE1 3.42Å; F18-H101 AromaticContact CE2-ND1 3.81Å; F18-H101 AromaticContact CE2-NE2 3.23Å; F18-H101 WeakPolarHBondContact CE2-NE2 3.45Å; F18-H101 AromaticContact CZ-CE1 3.69Å; Y97-H101 AromaticContact CD1-CD2 3.93Å; Y97-H101 AromaticContact CE1-CD2 3.53Å; Y97-H101 AromaticContact CE1-NE2 3.36Å; Y97-H101 WeakPolarHBondContact CE1-NE2 3.27Å; Y97-H101 AromaticContact CE2-NE2 3.59Å; Y97-H101 AromaticContact CZ-CD2 3.71Å; Y97-H101 AromaticContact CZ-NE2 3.05Å; Y97-H101 PolarHBondContact O-CD2 3.37Å; Y97-H101 PolarHBondContact O-N 2.88Å; Y97-H101 PolarHBondContact OH-NE2 2.83Å; Y97-H101 VanDerWaalsContact OH-NE2 3.11Å; Y98-H101 PolarHBondContact O-N 3.49Å; H101-I104 WeakPolarHBondContact O-CB 3.4Å; H101-I104 PolarHBondContact O-N 2.98Å; H101-I105 WeakPolarHBondContact O-CG1 3.08Å; H101-I105 PolarHBondContact O-N 3.4Å; H101-I186 HydrophobicContact CB-CD1 3.92Å; H101-I186 HydrophobicContact CB-CG1 4.47Å
102L83.4Confident83.2Confident1 Ų120.7 Ų20.71%0.00512%0.121CC..Hα-helixtrans-71.3-34-176.9-172.349000111.8Y98 E99 S100 I105 D106 M182 N185 I186Y98-L102 VanDerWaalsContact O-CB 3.22Å; Y98-L102 WeakPolarHBondContact O-CB 3.34Å; Y98-L102 PolarHBondContact O-N 2.69Å; E99-L102 PolarHBondContact O-N 2.86Å; S100-L102 VanDerWaalsContact C-N 3.34Å; S100-L102 PolarHBondContact O-N 3.45Å; L102-I105 PolarHBondContact O-N 3.33Å; L102-D106 WeakPolarHBondContact O-CB 3.05Å; L102-D106 VanDerWaalsContact O-CG 3.25Å; L102-D106 PolarHBondContact O-N 3.26Å; L102-M182 HydrophobicContact CD2-CB 4.27Å; L102-M182 HydrophobicContact CD2-CG 4.32Å; L102-N185 HydrophobicContact CD1-CB 3.76Å; L102-N185 HydrophobicContact CD2-CB 3.74Å; L102-N185 HydrophobicContact CG-CB 4.43Å; L102-I186 HydrophobicContact CB-CD1 4.48Å; L102-I186 HydrophobicContact CB-CG1 3.98Å; L102-I186 HydrophobicContact CD1-CG1 4.08Å; L102-I186 HydrophobicContact CG-CG1 4.43Å
103S81.3Confident82.9Confident59 Ų5920.7 Ų20.741%0.41312%0.121SC..Hα-helixtrans-66.4-38.6170.158.20000112.3E99 S100 I105 D106 T107E99-S103 WeakPolarHBondContact O-CB 3.2Å; E99-S103 PolarHBondContact O-N 3.21Å; E99-S103 PolarHBondContact O-OG 3.43Å; S100-S103 WeakPolarHBondContact CA-OG 3.35Å; S100-S103 PolarHBondContact O-N 3.35Å; S100-S103 PolarHBondContact O-OG 3.41Å; S103-I105 VanDerWaalsContact C-N 3.34Å; S103-I105 PolarHBondContact O-N 3.46Å; S103-D106 PolarHBondContact O-N 3.18Å; S103-T107 VanDerWaalsContact O-CG2 3.26Å; S103-T107 WeakPolarHBondContact O-CG2 3.5Å; S103-T107 PolarHBondContact O-N 3.34Å; S103-T107 PolarHBondContact O-OG1 3.36Å
104I84.6Confident82.5Confident25 Ų2521.6 Ų21.613%0.12813%0.129CC..Hα-helixtrans-59.4-45.8172.1-67.1163.3000110.4L11 L12 P15 F18 S100 H101 T107 L108L11-I104 HydrophobicContact CB-CD1 4.38Å; L12-I104 HydrophobicContact CD2-CG2 4.02Å; P15-I104 HydrophobicContact CB-CG2 4.13Å; F18-I104 HydrophobicContact CZ-CD1 4.5Å; S100-I104 WeakPolarHBondContact O-CD1 3.27Å; S100-I104 VanDerWaalsContact O-CG1 3.25Å; S100-I104 WeakPolarHBondContact O-CG1 3.47Å; S100-I104 PolarHBondContact O-N 3.31Å; H101-I104 WeakPolarHBondContact O-CB 3.4Å; H101-I104 PolarHBondContact O-N 2.98Å; I104-T107 PolarHBondContact O-N 3.28Å; I104-T107 PolarHBondContact O-OG1 2.95Å; I104-L108 PolarHBondContact O-N 3.37Å
105I84.3Confident82.1Confident0 Ų023 Ų230%013%0.134CC..Hα-helixtrans-66-45.4178.3-66.9161.1000111P15 H101 L102 S103 T107 L108 V109 I186 L190P15-I105 HydrophobicContact CB-CG1 4.16Å; H101-I105 WeakPolarHBondContact O-CG1 3.08Å; H101-I105 PolarHBondContact O-N 3.4Å; L102-I105 PolarHBondContact O-N 3.33Å; S103-I105 VanDerWaalsContact C-N 3.34Å; S103-I105 PolarHBondContact O-N 3.46Å; I105-T107 PolarHBondContact O-N 3.16Å; I105-L108 WeakPolarHBondContact O-CA 3.43Å; I105-L108 WeakPolarHBondContact O-CB 3.12Å; I105-L108 PolarHBondContact O-N 3.44Å; I105-V109 HydrophobicContact CG2-CG2 4.35Å; I105-V109 WeakPolarHBondContact O-CG2 3.28Å; I105-V109 PolarHBondContact O-N 3.34Å; I105-I186 HydrophobicContact CD1-CB 4.02Å; I105-I186 HydrophobicContact CD1-CG1 4.03Å; I105-I186 HydrophobicContact CD1-CG2 3.65Å; I105-L190 HydrophobicContact CD1-CD1 4.41Å; I105-L190 HydrophobicContact CD1-CD2 4.1Å; I105-L190 HydrophobicContact CD1-CG 3.9Å; I105-L190 HydrophobicContact CG1-CD2 3.99Å; I105-L190 HydrophobicContact CG1-CG 4.28Å
106D78.2Confident81.5Confident30 Ų3024.6 Ų24.616%0.1614%0.142CC..Hα-helixtrans-59.2-37.8176.7-75.7-13.4000110.4L102 S103 A110L102-D106 WeakPolarHBondContact O-CB 3.05Å; L102-D106 VanDerWaalsContact O-CG 3.25Å; L102-D106 PolarHBondContact O-N 3.26Å; S103-D106 PolarHBondContact O-N 3.18Å; D106-A110 WeakPolarHBondContact O-CB 3.33Å; D106-A110 PolarHBondContact O-N 3.08Å
107T82.3Confident80.9Confident49 Ų4924.3 Ų24.330%0.30114%0.144SC..Hα-helixtrans-67.4-35.9173.161.90000113L12 S103 I104 I105 A110 L111L12-T107 WeakPolarHBondContact CD2-OG1 3.45Å; S103-T107 VanDerWaalsContact O-CG2 3.26Å; S103-T107 WeakPolarHBondContact O-CG2 3.5Å; S103-T107 PolarHBondContact O-N 3.34Å; S103-T107 PolarHBondContact O-OG1 3.36Å; I104-T107 PolarHBondContact O-N 3.28Å; I104-T107 PolarHBondContact O-OG1 2.95Å; I105-T107 PolarHBondContact O-N 3.16Å; T107-A110 PolarHBondContact O-N 3.49Å; T107-L111 WeakPolarHBondContact O-CB 3.31Å; T107-L111 VanDerWaalsContact O-CG 3.25Å; T107-L111 WeakPolarHBondContact O-CG 3.44Å; T107-L111 PolarHBondContact O-N 3.2Å
108L82.9Confident80.2Confident2 Ų224 Ų241%0.0114%0.143CC..Hα-helixtrans-67.9-44.7176.3-17465.8000111.1I104 I105 A110 L111 I112 L144 I148 C193I104-L108 PolarHBondContact O-N 3.37Å; I105-L108 WeakPolarHBondContact O-CA 3.43Å; I105-L108 WeakPolarHBondContact O-CB 3.12Å; I105-L108 PolarHBondContact O-N 3.44Å; L108-A110 VanDerWaalsContact C-N 3.32Å; L108-A110 PolarHBondContact O-N 3.4Å; L108-L111 PolarHBondContact O-N 3.24Å; L108-I112 HydrophobicContact CD1-CD1 4.18Å; L108-I112 HydrophobicContact CD1-CG1 4.5Å; L108-I112 HydrophobicContact CG-CD1 3.93Å; L108-I112 VanDerWaalsContact O-CG1 3.28Å; L108-I112 WeakPolarHBondContact O-CG1 3.37Å; L108-I112 PolarHBondContact O-N 3.36Å; L108-L144 HydrophobicContact CD1-CD1 4.45Å; L108-L144 HydrophobicContact CD1-CD2 4.15Å; L108-L144 HydrophobicContact CD2-CD1 4.29Å; L108-I148 HydrophobicContact CD2-CD1 3.99Å; L108-C193 HydrophobicContact CD2-CB 4.3Å
109V83.4Confident79.6Confident12 Ų1224.9 Ų24.97%0.07315%0.148CC..Hα-helixtrans-56.5-47.4173169.60000110.3I105 I112 G113 E192 C193 L196I105-V109 HydrophobicContact CG2-CG2 4.35Å; I105-V109 WeakPolarHBondContact O-CG2 3.28Å; I105-V109 PolarHBondContact O-N 3.34Å; V109-I112 PolarHBondContact O-N 2.87Å; V109-G113 PolarHBondContact O-N 3.28Å; V109-E192 HydrophobicContact CG2-CG 4.49Å; V109-C193 WeakPolarHBondContact CG2-SG 3.25Å; V109-L196 HydrophobicContact CG1-CD1 3.8Å
110A77.8Confident79Confident38 Ų3821.3 Ų21.331%0.31413%0.13SC..Hα-helixtrans-63.5-43.117800000112.7D106 T107 L108 G113 A114D106-A110 WeakPolarHBondContact O-CB 3.33Å; D106-A110 PolarHBondContact O-N 3.08Å; T107-A110 PolarHBondContact O-N 3.49Å; L108-A110 VanDerWaalsContact C-N 3.32Å; L108-A110 PolarHBondContact O-N 3.4Å; A110-G113 PolarHBondContact O-N 3.06Å; A110-A114 WeakPolarHBondContact O-CB 3.2Å; A110-A114 PolarHBondContact O-N 3.14Å
111L81.3Confident78.1Confident21 Ų2123 Ų2311%0.1114%0.142CC..Hα-helixtrans-64.7-41.8178.1-76.3169.9000112.4L5 L12 T107 L108 R115 I132 F135 T136L5-L111 HydrophobicContact CD2-CD1 3.96Å; L5-L111 HydrophobicContact CD2-CD2 4.19Å; L12-L111 HydrophobicContact CD1-CD1 4.44Å; T107-L111 WeakPolarHBondContact O-CB 3.31Å; T107-L111 VanDerWaalsContact O-CG 3.25Å; T107-L111 WeakPolarHBondContact O-CG 3.44Å; T107-L111 PolarHBondContact O-N 3.2Å; L108-L111 PolarHBondContact O-N 3.24Å; L111-R115 PolarHBondContact O-N 3.32Å; L111-I132 HydrophobicContact CD2-CG1 4.49Å; L111-F135 HydrophobicContact CD1-CD1 4.31Å; L111-F135 HydrophobicContact CD1-CE1 3.99Å; L111-T136 HydrophobicContact CB-CG2 4.46Å
112I80.4Confident77.1Confident3 Ų325 Ų252%0.01515%0.153CC..Hα-helixtrans-69.6-40.6176.8-63.3169.2000110.1L108 V109 A114 R115 C193 L196 W197L108-I112 HydrophobicContact CD1-CD1 4.18Å; L108-I112 HydrophobicContact CD1-CG1 4.5Å; L108-I112 HydrophobicContact CG-CD1 3.93Å; L108-I112 VanDerWaalsContact O-CG1 3.28Å; L108-I112 WeakPolarHBondContact O-CG1 3.37Å; L108-I112 PolarHBondContact O-N 3.36Å; V109-I112 PolarHBondContact O-N 2.87Å; I112-A114 VanDerWaalsContact C-N 3.33Å; I112-A114 PolarHBondContact O-N 3.26Å; I112-R115 WeakPolarHBondContact O-CB 3.46Å; I112-R115 PolarHBondContact O-N 3.18Å; I112-C193 HydrophobicContact CD1-CB 3.91Å; I112-L196 HydrophobicContact CG2-CB 3.69Å; I112-W197 HydrophobicContact CD1-CE3 4.34Å; I112-W197 HydrophobicContact CG1-CE3 4.19Å; I112-W197 HydrophobicContact CG2-CE3 4.25Å
113G76.6Confident76Confident0 Ų031 Ų310%019%0.192CC..Hα-helixtrans-65.9-32.417700000113.9V109 A110 R115 W120V109-G113 PolarHBondContact O-N 3.28Å; A110-G113 PolarHBondContact O-N 3.06Å; G113-R115 VanDerWaalsContact C-N 3.31Å; G113-W120 PolarHBondContact O-NE1 3.45Å
114A75.6Confident75.3Confident19 Ų1930.7 Ų30.716%0.15719%0.188CC..THydrogen-bonded Turntrans-81.2-7.7178.200000114.5A110 I112 N122 I132A110-A114 WeakPolarHBondContact O-CB 3.2Å; A110-A114 PolarHBondContact O-N 3.14Å; I112-A114 VanDerWaalsContact C-N 3.33Å; I112-A114 PolarHBondContact O-N 3.26Å; A114-N122 WeakPolarHBondContact CA-ND2 3.33Å; A114-I132 HydrophobicContact CB-CD1 3.9Å
115R77.5Confident74.7Confident30 Ų3032.4 Ų32.411%0.11320%0.202CC..SBendtrans-69.8132.9175.1-174.2-178.7174.5113.3-2109.7L111 I112 G113 G117 I132 T136 D137 Q200L111-R115 PolarHBondContact O-N 3.32Å; I112-R115 WeakPolarHBondContact O-CB 3.46Å; I112-R115 PolarHBondContact O-N 3.18Å; G113-R115 VanDerWaalsContact C-N 3.31Å; R115-G117 PolarHBondContact O-N 3.04Å; R115-I132 HydrophobicContact CB-CG2 4.41Å; R115-T136 PolarHBondContact NH1-OG1 3.39Å; R115-D137 IonicContact CZ-OD1 3.8Å; R115-D137 IonicContact NH1-OD1 3.59Å; R115-D137 PolarHBondContact NH1-OD1 2.68Å; R115-D137 IonicContact NH2-OD1 2.69Å; R115-D137 PolarHBondContact NH2-OD1 3.24Å; R115-D137 IonicContact NH2-OD2 2.67Å; R115-Q200 PolarHBondContact O-NE2 3.37Å
116D73.4Confident74.2Confident49 Ų4935.7 Ų35.726%0.26223%0.229SC..  trans-70.3127.3169.3-69-40.4000109S121 N122 C129 H133D116-S121 VanDerWaalsContact OD1-CA 3.32Å; D116-S121 WeakPolarHBondContact OD1-CA 3.37Å; D116-S121 WeakPolarHBondContact OD1-CB 3.41Å; D116-N122 PolarHBondContact OD1-N 3.3Å; D116-C129 PolarHBondContact OD2-SG 3.12Å; D116-H133 PolarHBondContact N-NE2 3.1Å; D116-H133 PolarHBondContact O-CE1 3.38Å; D116-H133 PolarHBondContact O-NE2 3.27Å
117G71.1Confident74.2Confident15 Ų1541.7 Ų41.716%0.15526%0.256CS..  trans-149.8-163.4-175.400000112.8R115 W120R115-G117 PolarHBondContact O-N 3.04Å; G117-W120 PolarHBondContact N-O 2.87Å; G117-W120 VanDerWaalsContact N-O 3.12Å
118R71.9Confident74Confident16 Ų1642.7 Ų42.76%0.0626%0.259CS..SBendtrans-68.3-39.8-171.8-179.1179165.1-151.8-18.4113.6Q200 Q258 F260 S261 I276 H280R118-Q200 PolarHBondContact N-O 3.48Å; R118-Q200 VanDerWaalsContact N-OE1 3.13Å; R118-Q258 PolarHBondContact NH1-O 3.25Å; R118-Q258 PolarHBondContact NH2-O 3.22Å; R118-F260 PolarHBondContact NH2-O 3.44Å; R118-S261 WeakPolarHBondContact O-CB 3.36Å; R118-I276 HydrophobicContact CB-CG2 3.94Å; R118-I276 HydrophobicContact CG-CG2 4.25Å; R118-H280 PolarHBondContact NH1-CD2 2.98Å; R118-H280 VanDerWaalsContact NH1-CD2 3.33Å
119M71.9Confident73.8Confident25 Ų2543 Ų4312%0.12326%0.261CS..SBendtrans-94.2-29.3-169.6-69.3-67.1-55.600112.4C199 Q200 S261 Y410M119-C199 HydrophobicContact CG-CB 4.21Å; M119-C199 WeakPolarHBondContact CG-O 3.41Å; M119-Q200 VanDerWaalsContact N-OE1 3.12Å; M119-S261 VanDerWaalsContact SD-O 3.41Å; M119-Y410 HydrophobicContact CE-CD1 4.32Å; M119-Y410 HydrophobicContact CE-CE1 3.77Å
120W72.3Confident73.7Confident11 Ų1149 Ų494%0.04229%0.288CS..  trans-151.7156.7173.765.393.4000111.1G113 G117 L196 C199 Q200 L407G113-W120 PolarHBondContact O-NE1 3.45Å; G117-W120 PolarHBondContact N-O 2.87Å; G117-W120 VanDerWaalsContact N-O 3.12Å; W120-L196 HydrophobicContact CH2-CD2 3.85Å; W120-L196 HydrophobicContact CZ2-CD2 4.27Å; W120-C199 HydrophobicContact CH2-CB 3.86Å; W120-C199 HydrophobicContact CZ3-CB 3.67Å; W120-Q200 VanDerWaalsContact CD2-NE2 3.26Å; W120-Q200 VanDerWaalsContact CE2-CD 3.5Å; W120-Q200 HydrophobicContact CH2-CG 3.68Å; W120-Q200 HydrophobicContact CZ2-CG 3.54Å; W120-Q200 HydrophobicContact CZ3-CG 4.26Å; W120-Q200 PolarHBondContact O-NE2 3.29Å; W120-Q200 PolarHBondContact O-OE1 2.95Å; W120-L407 HydrophobicContact CZ3-CD2 4.29Å
121S65.1Low73.9Confident77 Ų7748.2 Ų48.254%0.53828%0.28SS..  trans-121.7143.3165.753.10000109D116D116-S121 VanDerWaalsContact OD1-CA 3.32Å; D116-S121 WeakPolarHBondContact OD1-CA 3.37Å; D116-S121 WeakPolarHBondContact OD1-CB 3.41Å
122N64.4Low74Confident42 Ų4247.7 Ų47.723%0.22528%0.277CS..  trans-92.5147180-84.35.9000110.4A114 D116 T124A114-N122 WeakPolarHBondContact CA-ND2 3.33Å; D116-N122 PolarHBondContact OD1-N 3.3Å; N122-T124 HydrophobicContact CB-CG2 4.45Å; N122-T124 PolarHBondContact O-N 3.31Å
123P60.4Low74.1Confident129 Ų12949.9 Ų49.984%0.83829%0.287SS*.  trans-73.820178.831.5-35.7000113.8
124T66.2Low74.5Confident51 Ų5153.3 Ų53.331%0.31331%0.311SS..  trans-68.9154.8-178.637.10000112.3N122 A126 C129N122-T124 HydrophobicContact CB-CG2 4.45Å; N122-T124 PolarHBondContact O-N 3.31Å; T124-A126 PolarHBondContact O-N 2.92Å; T124-C129 PolarHBondContact OG1-SG 3.36Å
125S72.1Confident74.9Confident62 Ų6252.9 Ų52.943%0.43431%0.306SS..  trans-60.4138.5177.163.80000111E127 I128 C129S125-E127 PolarHBondContact O-N 3.4Å; S125-I128 PolarHBondContact O-N 3Å; S125-I128 VanDerWaalsContact OG-CD1 3.29Å; S125-I128 WeakPolarHBondContact OG-CD1 3.24Å; S125-I128 VanDerWaalsContact OG-CG1 3.27Å; S125-I128 WeakPolarHBondContact OG-CG1 3.28Å; S125-C129 PolarHBondContact O-N 2.82Å; S125-C129 VanDerWaalsContact O-N 3.16Å
126A73.6Confident75.2Confident69 Ų6951.7 Ų51.757%0.5730%0.301SS*.Hα-helixtrans-55-31.6-176.100000114.1T124 C129 Q130T124-A126 PolarHBondContact O-N 2.92Å; A126-C129 PolarHBondContact O-N 3.4Å; A126-Q130 WeakPolarHBondContact O-CG 3.4Å; A126-Q130 PolarHBondContact O-N 2.86Å
127E78.1Confident75.7Confident156 Ų15652.6 Ų52.673%0.72931%0.307SS*.Hα-helixtrans-63.2-48.8175.9-64.2178.6-176.800111.4S125 C129 Q130 V131S125-E127 PolarHBondContact O-N 3.4Å; E127-C129 VanDerWaalsContact C-N 3.34Å; E127-C129 PolarHBondContact O-N 2.96Å; E127-Q130 PolarHBondContact O-N 3.43Å; E127-V131 WeakPolarHBondContact O-CG2 3.48Å; E127-V131 PolarHBondContact O-N 2.64Å; E127-V131 VanDerWaalsContact O-N 3.15Å
128I78.2Confident76.4Confident70 Ų7056.1 Ų56.136%0.35932%0.319SS..Hα-helixtrans-61.2-43.2176.8-67.7174.5000110.6M1 S125 Q130 V131 I132M1-I128 HydrophobicContact CE-CG2 4.19Å; S125-I128 PolarHBondContact O-N 3Å; S125-I128 VanDerWaalsContact OG-CD1 3.29Å; S125-I128 WeakPolarHBondContact OG-CD1 3.24Å; S125-I128 VanDerWaalsContact OG-CG1 3.27Å; S125-I128 WeakPolarHBondContact OG-CG1 3.28Å; I128-Q130 VanDerWaalsContact C-N 3.35Å; I128-Q130 PolarHBondContact O-N 3.3Å; I128-V131 PolarHBondContact O-N 3.33Å; I128-I132 HydrophobicContact CG2-CD1 3.65Å; I128-I132 HydrophobicContact CG2-CG1 4.33Å; I128-I132 VanDerWaalsContact O-CG1 3.31Å; I128-I132 WeakPolarHBondContact O-CG1 3.44Å; I128-I132 PolarHBondContact O-N 3.15Å
129C77.9Confident76.9Confident9 Ų955.4 Ų55.46%0.06132%0.316CS..Hα-helixtrans-58.5-45.7176.6-65.30000111.6D116 T124 S125 A126 E127 V131 I132 H133D116-C129 PolarHBondContact OD2-SG 3.12Å; T124-C129 PolarHBondContact OG1-SG 3.36Å; S125-C129 PolarHBondContact O-N 2.82Å; S125-C129 VanDerWaalsContact O-N 3.16Å; A126-C129 PolarHBondContact O-N 3.4Å; E127-C129 VanDerWaalsContact C-N 3.34Å; E127-C129 PolarHBondContact O-N 2.96Å; C129-V131 VanDerWaalsContact C-N 3.31Å; C129-V131 PolarHBondContact O-N 2.89Å; C129-I132 PolarHBondContact O-N 2.94Å; C129-H133 WeakPolarHBondContact O-CB 3.07Å; C129-H133 PolarHBondContact O-CD2 2.84Å; C129-H133 PolarHBondContact O-N 3.3Å
130Q81.2Confident77.4Confident137 Ų13756.5 Ų56.564%0.6433%0.326SS*.Hα-helixtrans-59.6-42178.4-74.61766.700112.3A126 E127 I128 H133 S134A126-Q130 WeakPolarHBondContact O-CG 3.4Å; A126-Q130 PolarHBondContact O-N 2.86Å; E127-Q130 PolarHBondContact O-N 3.43Å; I128-Q130 VanDerWaalsContact C-N 3.35Å; I128-Q130 PolarHBondContact O-N 3.3Å; Q130-H133 PolarHBondContact O-N 3.34Å; Q130-S134 WeakPolarHBondContact O-CB 3.47Å; Q130-S134 PolarHBondContact O-N 3.12Å; Q130-S134 PolarHBondContact O-OG 2.78Å
131V83.3Confident77.8Confident22 Ų2260 Ų6013%0.13336%0.358CS..Hα-helixtrans-61.5-48.2175.3176.10000111M1 E2 E127 I128 C129 H133 S134 F135M1-V131 HydrophobicContact CE-CB 3.97Å; M1-V131 HydrophobicContact CE-CG1 3.64Å; E2-V131 HydrophobicContact CG-CB 4.45Å; E2-V131 HydrophobicContact CG-CG1 3.45Å; E2-V131 VanDerWaalsContact CG-CG1 3.45Å; E2-V131 HydrophobicContact CG-CG2 4.13Å; E2-V131 WeakPolarHBondContact OE1-CG2 3.38Å; E127-V131 WeakPolarHBondContact O-CG2 3.48Å; E127-V131 PolarHBondContact O-N 2.64Å; E127-V131 VanDerWaalsContact O-N 3.15Å; I128-V131 PolarHBondContact O-N 3.33Å; C129-V131 VanDerWaalsContact C-N 3.31Å; C129-V131 PolarHBondContact O-N 2.89Å; V131-H133 PolarHBondContact O-N 3.08Å; V131-S134 PolarHBondContact O-N 3.44Å; V131-S134 PolarHBondContact O-OG 2.84Å; V131-F135 WeakPolarHBondContact O-CB 3.16Å; V131-F135 PolarHBondContact O-N 3.04Å
132I83.5Confident78.6Confident9 Ų960.4 Ų60.45%0.04635%0.354CS..Hα-helixtrans-60.7-45.2179.5-67.7167.7000110.7L111 A114 R115 I128 C129 F135 T136L111-I132 HydrophobicContact CD2-CG1 4.49Å; A114-I132 HydrophobicContact CB-CD1 3.9Å; R115-I132 HydrophobicContact CB-CG2 4.41Å; I128-I132 HydrophobicContact CG2-CD1 3.65Å; I128-I132 HydrophobicContact CG2-CG1 4.33Å; I128-I132 VanDerWaalsContact O-CG1 3.31Å; I128-I132 WeakPolarHBondContact O-CG1 3.44Å; I128-I132 PolarHBondContact O-N 3.15Å; C129-I132 PolarHBondContact O-N 2.94Å; I132-F135 PolarHBondContact O-N 3.37Å; I132-T136 HydrophobicContact CG2-CG2 4.21Å; I132-T136 WeakPolarHBondContact O-CB 3.33Å; I132-T136 WeakPolarHBondContact O-CG2 3.34Å; I132-T136 PolarHBondContact O-N 2.99Å; I132-T136 PolarHBondContact O-OG1 2.93Å
133H82.9Confident79.4Confident49 Ų4959.3 Ų59.323%0.22735%0.352CS..Hα-helixtrans-57.7-53.3176.3-87.2-75.2000111.5D116 C129 Q130 V131 F135 T136 D137D116-H133 PolarHBondContact N-NE2 3.1Å; D116-H133 PolarHBondContact O-CE1 3.38Å; D116-H133 PolarHBondContact O-NE2 3.27Å; C129-H133 WeakPolarHBondContact O-CB 3.07Å; C129-H133 PolarHBondContact O-CD2 2.84Å; C129-H133 PolarHBondContact O-N 3.3Å; Q130-H133 PolarHBondContact O-N 3.34Å; V131-H133 PolarHBondContact O-N 3.08Å; H133-F135 VanDerWaalsContact C-N 3.28Å; H133-F135 PolarHBondContact O-N 2.87Å; H133-T136 PolarHBondContact O-N 3.26Å; H133-T136 PolarHBondContact O-OG1 3.23Å; H133-D137 VanDerWaalsContact O-CB 3.29Å; H133-D137 WeakPolarHBondContact O-CB 3.34Å; H133-D137 PolarHBondContact O-N 3.37Å
134S83.5Confident80.5Confident72 Ų7253.5 Ų53.550%0.50332%0.315SS..Hα-helixtrans-58.2-41.1-179.269.90000112.5Q130 V131 E138Q130-S134 WeakPolarHBondContact O-CB 3.47Å; Q130-S134 PolarHBondContact O-N 3.12Å; Q130-S134 PolarHBondContact O-OG 2.78Å; V131-S134 PolarHBondContact O-N 3.44Å; V131-S134 PolarHBondContact O-OG 2.84Å; S134-E138 WeakPolarHBondContact O-CB 3.38Å; S134-E138 PolarHBondContact O-N 2.84Å; S134-E138 VanDerWaalsContact O-N 3.15Å
135F84.1Confident81.3Confident11 Ų1151.8 Ų51.85%0.04830%0.303CS..Hα-helixtrans-72.3-44.1-179.2-175.6-105.3000112.7L5 K9 L12 L111 V131 I132 H133 E138 L139L5-F135 HydrophobicContact CB-CD2 4.09Å; L5-F135 HydrophobicContact CB-CE1 4.24Å; L5-F135 HydrophobicContact CB-CE2 3.8Å; L5-F135 HydrophobicContact CB-CG 4.43Å; L5-F135 HydrophobicContact CB-CZ 3.89Å; L5-F135 HydrophobicContact CD1-CD1 4.28Å; L5-F135 HydrophobicContact CD1-CG 4.31Å; L5-F135 HydrophobicContact CD2-CD1 4.46Å; L5-F135 HydrophobicContact CD2-CE1 4.07Å; L5-F135 HydrophobicContact CD2-CZ 4.4Å; K9-F135 HydrophobicContact CB-CE2 4.2Å; K9-F135 HydrophobicContact CB-CZ 4.38Å; K9-F135 HydrophobicContact CD-CE2 4.37Å; K9-F135 HydrophobicContact CG-CE2 4.1Å; K9-F135 HydrophobicContact CG-CZ 4.38Å; L12-F135 HydrophobicContact CD1-CE1 3.86Å; L12-F135 HydrophobicContact CD1-CZ 3.75Å; L111-F135 HydrophobicContact CD1-CD1 4.31Å; L111-F135 HydrophobicContact CD1-CE1 3.99Å; V131-F135 WeakPolarHBondContact O-CB 3.16Å; V131-F135 PolarHBondContact O-N 3.04Å; I132-F135 PolarHBondContact O-N 3.37Å; H133-F135 VanDerWaalsContact C-N 3.28Å; H133-F135 PolarHBondContact O-N 2.87Å; F135-E138 PolarHBondContact O-N 3.35Å; F135-L139 HydrophobicContact CD1-CD1 3.91Å; F135-L139 HydrophobicContact CD1-CG 4.43Å; F135-L139 HydrophobicContact CE1-CD1 3.43Å; F135-L139 VanDerWaalsContact CE1-CD1 3.43Å; F135-L139 HydrophobicContact CE1-CG 4.09Å; F135-L139 HydrophobicContact CZ-CD1 3.97Å; F135-L139 HydrophobicContact CZ-CD2 4.41Å; F135-L139 HydrophobicContact CZ-CG 4.25Å; F135-L139 WeakPolarHBondContact O-CG 3.22Å; F135-L139 PolarHBondContact O-N 2.95Å
136T84.6Confident81.8Confident4 Ų451.9 Ų51.93%0.02530%0.302CS..Hα-helixtrans-70.4-37.118050.20000112.1L111 R115 I132 H133 E138 L139 S140L111-T136 HydrophobicContact CB-CG2 4.46Å; R115-T136 PolarHBondContact NH1-OG1 3.39Å; I132-T136 HydrophobicContact CG2-CG2 4.21Å; I132-T136 WeakPolarHBondContact O-CB 3.33Å; I132-T136 WeakPolarHBondContact O-CG2 3.34Å; I132-T136 PolarHBondContact O-N 2.99Å; I132-T136 PolarHBondContact O-OG1 2.93Å; H133-T136 PolarHBondContact O-N 3.26Å; H133-T136 PolarHBondContact O-OG1 3.23Å; T136-E138 VanDerWaalsContact C-N 3.32Å; T136-E138 PolarHBondContact O-N 3.07Å; T136-L139 PolarHBondContact O-N 3.36Å; T136-S140 WeakPolarHBondContact O-CB 3.29Å; T136-S140 PolarHBondContact O-N 2.86Å
137D84.3Confident82.3Confident69 Ų6951.7 Ų51.737%0.36929%0.291SS..Hα-helixtrans-60.9-43.7171.9-71.1-21.1000110.6R115 H133 L139 S140 A141R115-D137 IonicContact CZ-OD1 3.8Å; R115-D137 IonicContact NH1-OD1 3.59Å; R115-D137 PolarHBondContact NH1-OD1 2.68Å; R115-D137 IonicContact NH2-OD1 2.69Å; R115-D137 PolarHBondContact NH2-OD1 3.24Å; R115-D137 IonicContact NH2-OD2 2.67Å; H133-D137 VanDerWaalsContact O-CB 3.29Å; H133-D137 WeakPolarHBondContact O-CB 3.34Å; H133-D137 PolarHBondContact O-N 3.37Å; D137-L139 PolarHBondContact O-N 3.43Å; D137-S140 PolarHBondContact O-N 3.29Å; D137-S140 PolarHBondContact O-OG 3.09Å; D137-A141 WeakPolarHBondContact O-CB 3.38Å; D137-A141 PolarHBondContact O-N 3.4Å
138E84.6Confident82.6Confident88 Ų8844.4 Ų44.441%0.41126%0.257SS..Hα-helixtrans-63.8-41.3176.4-164.3-176.7-167.100112.5K9 S134 F135 T136 A141 N142K9-E138 WeakPolarHBondContact CE-OE2 3.42Å; K9-E138 IonicContact NZ-OE1 2.78Å; K9-E138 PolarHBondContact NZ-OE1 3.2Å; K9-E138 IonicContact NZ-OE2 2.82Å; K9-E138 PolarHBondContact NZ-OE2 3.09Å; S134-E138 WeakPolarHBondContact O-CB 3.38Å; S134-E138 PolarHBondContact O-N 2.84Å; S134-E138 VanDerWaalsContact O-N 3.15Å; F135-E138 PolarHBondContact O-N 3.35Å; T136-E138 VanDerWaalsContact C-N 3.32Å; T136-E138 PolarHBondContact O-N 3.07Å; E138-A141 PolarHBondContact O-N 3.27Å; E138-N142 VanDerWaalsContact O-CG 3.3Å; E138-N142 PolarHBondContact O-N 2.72Å; E138-N142 PolarHBondContact O-ND2 2.98Å
139L82.8Confident82.9Confident2 Ų241.6 Ų41.61%0.0124%0.243CC..Hα-helixtrans-62.7-42.8174.3-74.4178.1000111.9K9 L12 L13 F135 T136 D137 N142 L144K9-L139 HydrophobicContact CG-CD2 4.01Å; L12-L139 HydrophobicContact CB-CD1 4.45Å; L13-L139 HydrophobicContact CB-CD2 4.39Å; L13-L139 HydrophobicContact CD1-CD2 4.27Å; F135-L139 HydrophobicContact CD1-CD1 3.91Å; F135-L139 HydrophobicContact CD1-CG 4.43Å; F135-L139 HydrophobicContact CE1-CD1 3.43Å; F135-L139 VanDerWaalsContact CE1-CD1 3.43Å; F135-L139 HydrophobicContact CE1-CG 4.09Å; F135-L139 HydrophobicContact CZ-CD1 3.97Å; F135-L139 HydrophobicContact CZ-CD2 4.41Å; F135-L139 HydrophobicContact CZ-CG 4.25Å; F135-L139 WeakPolarHBondContact O-CG 3.22Å; F135-L139 PolarHBondContact O-N 2.95Å; T136-L139 PolarHBondContact O-N 3.36Å; D137-L139 PolarHBondContact O-N 3.43Å; L139-N142 PolarHBondContact O-N 2.9Å; L139-L144 HydrophobicContact CB-CD2 4.24Å; L139-L144 WeakPolarHBondContact O-CB 3.24Å; L139-L144 PolarHBondContact O-N 3.27Å
140S81.7Confident83.1Confident47 Ų4743.1 Ų43.133%0.32926%0.26SS..Hα-helixtrans-62.2-43.6177.6770000112T136 D137 N142 G143 W197T136-S140 WeakPolarHBondContact O-CB 3.29Å; T136-S140 PolarHBondContact O-N 2.86Å; D137-S140 PolarHBondContact O-N 3.29Å; D137-S140 PolarHBondContact O-OG 3.09Å; S140-N142 PolarHBondContact O-N 3Å; S140-G143 PolarHBondContact O-N 3.36Å; S140-W197 VanDerWaalsContact CB-CZ2 3.5Å
141A81Confident83.2Confident86 Ų8637.9 Ų37.971%0.71124%0.238SC*.Hα-helixtrans-63.5-28.2177.900000112.8D137 E138 G143D137-A141 WeakPolarHBondContact O-CB 3.38Å; D137-A141 PolarHBondContact O-N 3.4Å; E138-A141 PolarHBondContact O-N 3.27Å; A141-G143 VanDerWaalsContact C-N 3.29Å; A141-G143 PolarHBondContact O-N 3.4Å
142N82.2Confident83.1Confident84 Ų8437.2 Ų37.245%0.44923%0.233SC..THydrogen-bonded Turntrans-84.66.1177-70.9-45.6000114.1L13 E138 L139 S140L13-N142 HydrophobicContact CD1-CB 3.7Å; L13-N142 HydrophobicContact CD2-CB 4.01Å; E138-N142 VanDerWaalsContact O-CG 3.3Å; E138-N142 PolarHBondContact O-N 2.72Å; E138-N142 PolarHBondContact O-ND2 2.98Å; L139-N142 PolarHBondContact O-N 2.9Å; S140-N142 PolarHBondContact O-N 3Å
143G82.1Confident83Confident19 Ų1943.2 Ų43.220%0.19626%0.255CS..THydrogen-bonded Turntrans87.230.1174.200000115.1S140 A141 F145 P146 N147S140-G143 PolarHBondContact O-N 3.36Å; A141-G143 VanDerWaalsContact C-N 3.29Å; A141-G143 PolarHBondContact O-N 3.4Å; G143-F145 VanDerWaalsContact C-N 3.27Å; G143-F145 PolarHBondContact O-N 3.05Å; G143-P146 WeakPolarHBondContact O-CD 3.44Å; G143-P146 VanDerWaalsContact O-CG 3.28Å; G143-P146 WeakPolarHBondContact O-CG 3.41Å; G143-N147 PolarHBondContact O-N 3.41Å; G143-N147 PolarHBondContact O-ND2 3.26Å
144L83.1Confident82.9Confident8 Ų845.3 Ų45.34%0.04228%0.276CS..Hα-helixtrans-51.2-45.8173.6179.369.7000112.6L12 L13 L108 L139 N147 I148L12-L144 WeakPolarHBondContact O-CD1 3.43Å; L13-L144 HydrophobicContact CD1-CB 4.21Å; L108-L144 HydrophobicContact CD1-CD1 4.45Å; L108-L144 HydrophobicContact CD1-CD2 4.15Å; L108-L144 HydrophobicContact CD2-CD1 4.29Å; L139-L144 HydrophobicContact CB-CD2 4.24Å; L139-L144 WeakPolarHBondContact O-CB 3.24Å; L139-L144 PolarHBondContact O-N 3.27Å; L144-N147 WeakPolarHBondContact O-CB 3.32Å; L144-N147 PolarHBondContact O-N 3.29Å; L144-I148 HydrophobicContact CD1-CD1 3.92Å; L144-I148 HydrophobicContact CD1-CG1 4.31Å; L144-I148 HydrophobicContact CD2-CD1 4.38Å; L144-I148 HydrophobicContact CG-CD1 3.78Å; L144-I148 HydrophobicContact CG-CG1 4.47Å; L144-I148 WeakPolarHBondContact O-CG1 3.25Å; L144-I148 PolarHBondContact O-N 3.09Å
145F81.4Confident82.8Confident14 Ų1443.6 Ų43.66%0.06126%0.259CS..Hα-helixtrans-62.1-53.6-174.5-164.6-98000114.5G143 N147 I148 L149 V194 L203 E207 V211G143-F145 VanDerWaalsContact C-N 3.27Å; G143-F145 PolarHBondContact O-N 3.05Å; F145-N147 VanDerWaalsContact C-N 3.26Å; F145-N147 PolarHBondContact O-N 3.02Å; F145-I148 PolarHBondContact O-N 3.44Å; F145-L149 HydrophobicContact CD1-CD1 3.91Å; F145-L149 HydrophobicContact CE1-CD1 3.59Å; F145-L149 HydrophobicContact CZ-CD1 4.27Å; F145-L149 PolarHBondContact O-N 3.41Å; F145-V194 HydrophobicContact CE2-CG1 3.8Å; F145-V194 HydrophobicContact CZ-CG1 4.02Å; F145-L203 HydrophobicContact CE2-CD2 3.66Å; F145-L203 HydrophobicContact CZ-CD1 4.31Å; F145-L203 HydrophobicContact CZ-CD2 3.6Å; F145-E207 HydrophobicContact CD1-CB 4.08Å; F145-E207 HydrophobicContact CD1-CG 3.96Å; F145-E207 HydrophobicContact CE1-CB 3.61Å; F145-E207 HydrophobicContact CE1-CG 4.03Å; F145-E207 HydrophobicContact CZ-CB 4.12Å; F145-V211 HydrophobicContact CE1-CG2 3.65Å; F145-V211 HydrophobicContact CE2-CG2 4.43Å; F145-V211 HydrophobicContact CZ-CG2 3.3Å
146P82.9Confident82.6Confident65 Ų6545 Ų4542%0.42227%0.271SS..Hα-helixtrans-64.6-29.5175.525.4-35.1000113G143 G150G143-P146 WeakPolarHBondContact O-CD 3.44Å; G143-P146 VanDerWaalsContact O-CG 3.28Å; G143-P146 WeakPolarHBondContact O-CG 3.41Å; P146-G150 PolarHBondContact O-N 2.99Å
147N84.3Confident82.4Confident64 Ų6445.4 Ų45.434%0.34227%0.273SS..Hα-helixtrans-65.2-47.8175.9-69.2-12.6000111.3L13 G143 L144 F145 L149 G150 V151L13-N147 PolarHBondContact O-ND2 2.91Å; L13-N147 VanDerWaalsContact O-ND2 3.13Å; G143-N147 PolarHBondContact O-N 3.41Å; G143-N147 PolarHBondContact O-ND2 3.26Å; L144-N147 WeakPolarHBondContact O-CB 3.32Å; L144-N147 PolarHBondContact O-N 3.29Å; F145-N147 VanDerWaalsContact C-N 3.26Å; F145-N147 PolarHBondContact O-N 3.02Å; N147-L149 PolarHBondContact O-N 2.8Å; N147-G150 PolarHBondContact O-N 3.49Å; N147-V151 VanDerWaalsContact O-CG2 3.29Å; N147-V151 WeakPolarHBondContact O-CG2 3.33Å; N147-V151 PolarHBondContact O-N 2.77Å
148I85Confident82.3Confident4 Ų448.1 Ų48.12%0.02128%0.279CS..Hα-helixtrans-60.2-46.9178.2-66.7168.9000110.7L108 L144 F145 G150 V151 L152 L190 C193 V194L108-I148 HydrophobicContact CD2-CD1 3.99Å; L144-I148 HydrophobicContact CD1-CD1 3.92Å; L144-I148 HydrophobicContact CD1-CG1 4.31Å; L144-I148 HydrophobicContact CD2-CD1 4.38Å; L144-I148 HydrophobicContact CG-CD1 3.78Å; L144-I148 HydrophobicContact CG-CG1 4.47Å; L144-I148 WeakPolarHBondContact O-CG1 3.25Å; L144-I148 PolarHBondContact O-N 3.09Å; F145-I148 PolarHBondContact O-N 3.44Å; I148-G150 VanDerWaalsContact C-N 3.35Å; I148-G150 PolarHBondContact O-N 3.3Å; I148-V151 PolarHBondContact O-N 2.98Å; I148-L152 HydrophobicContact CG2-CD1 4.06Å; I148-L152 HydrophobicContact CG2-CG 4.48Å; I148-L152 WeakPolarHBondContact O-CG 3.43Å; I148-L152 PolarHBondContact O-N 3.35Å; I148-L190 HydrophobicContact CG2-CB 4.19Å; I148-L190 HydrophobicContact CG2-CD2 4.29Å; I148-L190 WeakPolarHBondContact CG2-O 3.28Å; I148-C193 HydrophobicContact CD1-CB 4.25Å; I148-V194 HydrophobicContact CG2-CG2 3.7Å
149L83.5Confident82.1Confident11 Ų1150.9 Ų50.96%0.05829%0.289CS..Hα-helixtrans-65.7-37.1178.2-67176000112.6F145 N147 V151 L152 R153 V194 L210 V211 C214 L249F145-L149 HydrophobicContact CD1-CD1 3.91Å; F145-L149 HydrophobicContact CE1-CD1 3.59Å; F145-L149 HydrophobicContact CZ-CD1 4.27Å; F145-L149 PolarHBondContact O-N 3.41Å; N147-L149 PolarHBondContact O-N 2.8Å; L149-V151 VanDerWaalsContact C-N 3.33Å; L149-L152 HydrophobicContact CD2-CD1 4.44Å; L149-L152 PolarHBondContact O-N 3.48Å; L149-R153 PolarHBondContact O-N 3.32Å; L149-R153 VanDerWaalsContact O-N 3.1Å; L149-V194 HydrophobicContact CD2-CG2 4.16Å; L149-L210 HydrophobicContact CD1-CB 3.86Å; L149-V211 HydrophobicContact CD1-CG2 3.95Å; L149-V211 HydrophobicContact CD2-CG2 4.36Å; L149-C214 HydrophobicContact CD2-CB 4.38Å; L149-L249 HydrophobicContact CD2-CD2 3.82Å
150G82.3Confident82.2Confident41 Ų4152.5 Ų52.542%0.42330%0.297SS..Hα-helixtrans-61.9-42174.200000112P146 N147 I148 R153 S154P146-G150 PolarHBondContact O-N 2.99Å; N147-G150 PolarHBondContact O-N 3.49Å; I148-G150 VanDerWaalsContact C-N 3.35Å; I148-G150 PolarHBondContact O-N 3.3Å; G150-R153 PolarHBondContact O-N 3.02Å; G150-S154 PolarHBondContact O-N 3.31Å; G150-S154 PolarHBondContact O-OG 3.14Å
151V83.4Confident82.3Confident27 Ų2751.5 Ų51.516%0.16429%0.286CS..Hα-helixtrans-66.8-46.5175.31720000111.4L16 N147 I148 L149 R153 S154 F155 L190L16-V151 HydrophobicContact CB-CG1 4.41Å; L16-V151 HydrophobicContact CD1-CG1 3.34Å; L16-V151 HydrophobicContact CG-CG1 3.97Å; N147-V151 VanDerWaalsContact O-CG2 3.29Å; N147-V151 WeakPolarHBondContact O-CG2 3.33Å; N147-V151 PolarHBondContact O-N 2.77Å; I148-V151 PolarHBondContact O-N 2.98Å; L149-V151 VanDerWaalsContact C-N 3.33Å; V151-R153 PolarHBondContact O-N 3.49Å; V151-S154 PolarHBondContact O-N 3.3Å; V151-S154 VanDerWaalsContact O-N 3.12Å; V151-S154 PolarHBondContact O-OG 3.32Å; V151-F155 HydrophobicContact CG1-CB 4.34Å; V151-F155 WeakPolarHBondContact O-CB 3.45Å; V151-F155 PolarHBondContact O-N 2.98Å; V151-L190 HydrophobicContact CG1-CD1 3.66Å
152L82.7Confident82.4Confident7 Ų750 Ų504%0.03727%0.271CS..Hα-helixtrans-58.9-29.3177-77.2171.5000112.9I148 L149 S187 L190 A191 V194 L249I148-L152 HydrophobicContact CG2-CD1 4.06Å; I148-L152 HydrophobicContact CG2-CG 4.48Å; I148-L152 WeakPolarHBondContact O-CG 3.43Å; I148-L152 PolarHBondContact O-N 3.35Å; L149-L152 HydrophobicContact CD2-CD1 4.44Å; L149-L152 PolarHBondContact O-N 3.48Å; L152-S187 WeakPolarHBondContact CD2-O 3.4Å; L152-L190 HydrophobicContact CD1-CB 4.42Å; L152-L190 HydrophobicContact CD2-CB 3.73Å; L152-L190 HydrophobicContact CD2-CD1 4.45Å; L152-L190 HydrophobicContact CG-CB 4.05Å; L152-A191 HydrophobicContact CD1-CB 4.16Å; L152-A191 HydrophobicContact CD2-CB 4.31Å; L152-V194 HydrophobicContact CD1-CG2 4.5Å; L152-L249 HydrophobicContact CD1-CD2 4.36Å
153R81Confident82.7Confident135 Ų13549.5 Ų49.551%0.50926%0.263SS..Hα-helixtrans-78.3-34176.9-173.2176.1177-170.5-3.3113.3L149 G150 V151 N220L149-R153 PolarHBondContact O-N 3.32Å; L149-R153 VanDerWaalsContact O-N 3.1Å; G150-R153 PolarHBondContact O-N 3.02Å; V151-R153 PolarHBondContact O-N 3.49Å; R153-N220 PolarHBondContact NH2-OD1 3.19Å
154S79.8Confident82.7Confident94 Ų9448.6 Ų48.666%0.65725%0.253SS*.Hα-helixtrans-88.2-33-178.362.70000112.8G150 V151G150-S154 PolarHBondContact O-N 3.31Å; G150-S154 PolarHBondContact O-OG 3.14Å; V151-S154 PolarHBondContact O-N 3.3Å; V151-S154 VanDerWaalsContact O-N 3.12Å; V151-S154 PolarHBondContact O-OG 3.32Å
155F81.5Confident82.8Confident35 Ų3552.5 Ų52.515%0.15427%0.271CS..  trans-83.6125.7-177.1-173.6-100.3000110.9L16 V151 V157 E160 L183 I186L16-F155 HydrophobicContact CD1-CD2 3.91Å; L16-F155 HydrophobicContact CD1-CE2 4.35Å; L16-F155 HydrophobicContact CD1-CG 4.22Å; V151-F155 HydrophobicContact CG1-CB 4.34Å; V151-F155 WeakPolarHBondContact O-CB 3.45Å; V151-F155 PolarHBondContact O-N 2.98Å; F155-V157 HydrophobicContact CE1-CG2 4.24Å; F155-E160 HydrophobicContact CE2-CB 4.39Å; F155-E160 HydrophobicContact CE2-CG 4.19Å; F155-L183 HydrophobicContact CE2-CD2 4.37Å; F155-L183 HydrophobicContact CZ-CD2 3.87Å; F155-I186 HydrophobicContact CE1-CG2 4.04Å; F155-I186 HydrophobicContact CZ-CG2 4.06Å
156S80Confident82.9Confident42 Ų4258.1 Ų58.129%0.29430%0.302SS..  trans-135.4126.1170.565.90000109.8Y158 K159 E160S156-Y158 VanDerWaalsContact C-N 3.3Å; S156-Y158 PolarHBondContact O-N 3.06Å; S156-K159 PolarHBondContact O-N 3.29Å; S156-K159 WeakPolarHBondContact OG-CB 3.45Å; S156-K159 WeakPolarHBondContact OG-CD 3.31Å; S156-K159 WeakPolarHBondContact OG-CG 3.44Å; S156-E160 PolarHBondContact O-N 2.62Å
157V81.3Confident83Confident11 Ų1158.4 Ų58.47%0.06730%0.3CS..Hα-helixtrans-51.9-48.2-176.2178.70000111.5F155 E160 F161 F180 L183 S187F155-V157 HydrophobicContact CE1-CG2 4.24Å; V157-E160 PolarHBondContact O-N 3Å; V157-F161 VanDerWaalsContact O-CB 3.26Å; V157-F161 WeakPolarHBondContact O-CB 3.32Å; V157-F161 PolarHBondContact O-N 2.88Å; V157-F180 HydrophobicContact CG1-CD2 4.24Å; V157-F180 HydrophobicContact CG1-CE2 3.88Å; V157-F180 HydrophobicContact CG1-CZ 4.22Å; V157-L183 HydrophobicContact CG1-CB 3.92Å; V157-S187 WeakPolarHBondContact CG2-OG 3.34Å
158Y81.9Confident82.9Confident127 Ų12763.4 Ų63.450%0.49832%0.321SS..Hα-helixtrans-67.2-42.8-177.6-65.1-76.6000113.3S156 E160 F161 S162 F180S156-Y158 VanDerWaalsContact C-N 3.3Å; S156-Y158 PolarHBondContact O-N 3.06Å; Y158-E160 VanDerWaalsContact C-N 3.31Å; Y158-E160 PolarHBondContact O-N 3.19Å; Y158-F161 PolarHBondContact O-N 2.86Å; Y158-S162 WeakPolarHBondContact O-CB 3.23Å; Y158-S162 PolarHBondContact O-N 2.99Å; Y158-S162 PolarHBondContact O-OG 3.41Å; Y158-S162 VanDerWaalsContact O-OG 3.08Å; Y158-F180 HydrophobicContact CD1-CE2 4.23Å; Y158-F180 AromaticContact CE1-CE2 3.96Å; Y158-F180 HydrophobicContact CE1-CE2 3.96Å; Y158-F180 AromaticContact CE1-CZ 3.96Å; Y158-F180 HydrophobicContact CE1-CZ 3.96Å
159K81.3Confident82.7Confident145 Ų14563.7 Ų63.763%0.6332%0.323SS*.Hα-helixtrans-65.6-39.2177.8-62.1-179.3-172.1178.60111.3S156 R163S156-K159 PolarHBondContact O-N 3.29Å; S156-K159 WeakPolarHBondContact OG-CB 3.45Å; S156-K159 WeakPolarHBondContact OG-CD 3.31Å; S156-K159 WeakPolarHBondContact OG-CG 3.44Å; K159-R163 VanDerWaalsContact O-CB 3.28Å; K159-R163 WeakPolarHBondContact O-CB 3.12Å; K159-R163 PolarHBondContact O-N 3.08Å
160E83.4Confident82.6Confident37 Ų3763.7 Ų63.717%0.17332%0.323CS..Hα-helixtrans-68.1-43.4178.3-171.964.1-179.600111.1Y98 F155 S156 V157 Y158 S162 R163 L164 L183Y98-E160 PolarHBondContact OH-OE1 2.91Å; F155-E160 HydrophobicContact CE2-CB 4.39Å; F155-E160 HydrophobicContact CE2-CG 4.19Å; S156-E160 PolarHBondContact O-N 2.62Å; V157-E160 PolarHBondContact O-N 3Å; Y158-E160 VanDerWaalsContact C-N 3.31Å; Y158-E160 PolarHBondContact O-N 3.19Å; E160-S162 PolarHBondContact O-N 2.88Å; E160-R163 WeakPolarHBondContact O-CB 3.18Å; E160-R163 PolarHBondContact O-N 3.26Å; E160-R163 IonicContact OE1-CZ 3.5Å; E160-R163 IonicContact OE1-NE 3.57Å; E160-R163 PolarHBondContact OE1-NE 3.33Å; E160-R163 IonicContact OE1-NH2 2.65Å; E160-R163 PolarHBondContact OE1-NH2 3.26Å; E160-R163 IonicContact OE2-CZ 3.3Å; E160-R163 IonicContact OE2-NE 2.92Å; E160-R163 PolarHBondContact OE2-NE 3.21Å; E160-R163 IonicContact OE2-NH2 2.79Å; E160-L164 WeakPolarHBondContact O-CG 3.44Å; E160-L164 PolarHBondContact O-N 3.31Å; E160-L183 HydrophobicContact CB-CD1 4.49Å; E160-L183 HydrophobicContact CG-CD1 4.31Å; E160-L183 HydrophobicContact CG-CD2 3.86Å
161F84.4Confident82.5Confident25 Ų2562.5 Ų62.511%0.1131%0.31CS..Hα-helixtrans-61.3-45.7174.2-170.2-97.8000112.2V157 Y158 R163 L164 E165 L170 R176 F180 L183 I1038V157-F161 VanDerWaalsContact O-CB 3.26Å; V157-F161 WeakPolarHBondContact O-CB 3.32Å; V157-F161 PolarHBondContact O-N 2.88Å; Y158-F161 PolarHBondContact O-N 2.86Å; F161-R163 VanDerWaalsContact C-N 3.3Å; F161-R163 PolarHBondContact O-N 3.29Å; F161-L164 PolarHBondContact O-N 2.82Å; F161-E165 WeakPolarHBondContact O-CB 3.35Å; F161-E165 PolarHBondContact O-N 2.9Å; F161-L170 HydrophobicContact CD2-CD1 4.28Å; F161-L170 HydrophobicContact CE1-CD1 4.2Å; F161-L170 HydrophobicContact CE2-CD1 3.84Å; F161-L170 HydrophobicContact CE2-CD2 4.33Å; F161-L170 HydrophobicContact CZ-CD1 3.8Å; F161-R176 HydrophobicContact CZ-CB 4.29Å; F161-F180 HydrophobicContact CB-CD2 4.42Å; F161-F180 HydrophobicContact CD1-CD2 4.43Å; F161-F180 HydrophobicContact CD2-CB 4.07Å; F161-F180 AromaticContact CD2-CD2 3.83Å; F161-F180 HydrophobicContact CD2-CD2 3.83Å; F161-F180 HydrophobicContact CD2-CG 4.46Å; F161-F180 HydrophobicContact CE2-CB 3.86Å; F161-F180 HydrophobicContact CE2-CD2 4.15Å; F161-F180 AromaticContact CG-CD2 3.97Å; F161-F180 HydrophobicContact CG-CD2 3.97Å; F161-L183 HydrophobicContact CB-CD1 4.19Å; F161-L183 HydrophobicContact CD2-CD1 4.3Å; F161-I1038 HydrophobicContact CZ-CD1 4.38Å
162S84.1Confident82.4Confident54 Ų5465.3 Ų65.338%0.37833%0.325SS..Hα-helixtrans-65.3-32.6175.5-64.30000112.5Y158 E160 E165 N166Y158-S162 WeakPolarHBondContact O-CB 3.23Å; Y158-S162 PolarHBondContact O-N 2.99Å; Y158-S162 PolarHBondContact O-OG 3.41Å; Y158-S162 VanDerWaalsContact O-OG 3.08Å; E160-S162 PolarHBondContact O-N 2.88Å; S162-E165 PolarHBondContact O-N 3.46Å; S162-N166 WeakPolarHBondContact O-CB 3.49Å; S162-N166 PolarHBondContact O-N 3.44Å; S162-N166 PolarHBondContact O-ND2 3.31Å; S162-N166 VanDerWaalsContact O-ND2 3.14Å
163R86.4Confident82.2Confident74 Ų7467.2 Ų67.228%0.27934%0.338SS..Hα-helixtrans-63-46.4172.7-172.4-174.473.379.7-2.3110.5V62 K159 E160 F161 E165 N166 L167V62-R163 PolarHBondContact O-NH1 2.98Å; V62-R163 PolarHBondContact O-NH2 2.77Å; K159-R163 VanDerWaalsContact O-CB 3.28Å; K159-R163 WeakPolarHBondContact O-CB 3.12Å; K159-R163 PolarHBondContact O-N 3.08Å; E160-R163 WeakPolarHBondContact O-CB 3.18Å; E160-R163 PolarHBondContact O-N 3.26Å; E160-R163 IonicContact OE1-CZ 3.5Å; E160-R163 IonicContact OE1-NE 3.57Å; E160-R163 PolarHBondContact OE1-NE 3.33Å; E160-R163 IonicContact OE1-NH2 2.65Å; E160-R163 PolarHBondContact OE1-NH2 3.26Å; E160-R163 IonicContact OE2-CZ 3.3Å; E160-R163 IonicContact OE2-NE 2.92Å; E160-R163 PolarHBondContact OE2-NE 3.21Å; E160-R163 IonicContact OE2-NH2 2.79Å; F161-R163 VanDerWaalsContact C-N 3.3Å; F161-R163 PolarHBondContact O-N 3.29Å; R163-E165 VanDerWaalsContact C-N 3.33Å; R163-N166 PolarHBondContact O-N 3.35Å; R163-L167 HydrophobicContact CG-CD1 4.21Å; R163-L167 WeakPolarHBondContact O-CB 3.05Å; R163-L167 VanDerWaalsContact O-CG 3.25Å; R163-L167 WeakPolarHBondContact O-CG 3.42Å; R163-L167 PolarHBondContact O-N 3.04Å; R163-L167 VanDerWaalsContact O-N 3.07Å
164L83.7Confident82.1Confident0 Ų063.8 Ų63.80%033%0.327CS..Hα-helixtrans-64.8-37176.4-64.7172.3000112.2V62 F63 Y98 E160 F161 L167 Q168 V169 L170 V179 L183V62-L164 HydrophobicContact CG1-CD2 4.46Å; F63-L164 HydrophobicContact CE1-CD2 4.47Å; Y98-L164 HydrophobicContact CE2-CD1 3.75Å; E160-L164 WeakPolarHBondContact O-CG 3.44Å; E160-L164 PolarHBondContact O-N 3.31Å; F161-L164 PolarHBondContact O-N 2.82Å; L164-L167 PolarHBondContact O-N 3.13Å; L164-Q168 PolarHBondContact O-N 3.33Å; L164-V169 PolarHBondContact O-N 3.36Å; L164-V169 VanDerWaalsContact O-N 3.17Å; L164-L170 HydrophobicContact CB-CD1 4.15Å; L164-L170 HydrophobicContact CB-CD2 4.12Å; L164-L170 HydrophobicContact CB-CG 3.97Å; L164-L170 HydrophobicContact CD1-CD2 4.44Å; L164-V179 HydrophobicContact CD1-CG1 3.94Å; L164-L183 HydrophobicContact CD1-CD1 4.25Å
165E84.9Confident82.2Confident91 Ų9159.4 Ų59.443%0.42530%0.296SS..Hα-helixtrans-65.6-46175.7-171.3172.4-149.900111.8F161 S162 R163 L167 Q168 L170F161-E165 WeakPolarHBondContact O-CB 3.35Å; F161-E165 PolarHBondContact O-N 2.9Å; S162-E165 PolarHBondContact O-N 3.46Å; R163-E165 VanDerWaalsContact C-N 3.33Å; E165-L167 VanDerWaalsContact C-N 3.26Å; E165-L167 PolarHBondContact O-N 3.18Å; E165-Q168 PolarHBondContact O-N 2.9Å; E165-L170 HydrophobicContact CB-CD1 3.83Å; E165-L170 HydrophobicContact CG-CD1 4.49Å
166N84Confident82.3Confident132 Ų13262.3 Ų62.371%0.70631%0.306SS*.Hα-helixtrans-63.5-32.9177.3-72.2-27.1000112.6S162 R163 Q168S162-N166 WeakPolarHBondContact O-CB 3.49Å; S162-N166 PolarHBondContact O-N 3.44Å; S162-N166 PolarHBondContact O-ND2 3.31Å; S162-N166 VanDerWaalsContact O-ND2 3.14Å; R163-N166 PolarHBondContact O-N 3.35Å; N166-Q168 PolarHBondContact O-N 3.27Å
167L83.6Confident82.4Confident71 Ų7160.4 Ų60.437%0.37229%0.293SS..THydrogen-bonded Turntrans-79.9-1.3175.2-67.4171.8000113.2V62 R163 L164 E165 V169V62-L167 HydrophobicContact CG1-CD1 4.18Å; V62-L167 HydrophobicContact CG2-CD1 4.37Å; R163-L167 HydrophobicContact CG-CD1 4.21Å; R163-L167 WeakPolarHBondContact O-CB 3.05Å; R163-L167 VanDerWaalsContact O-CG 3.25Å; R163-L167 WeakPolarHBondContact O-CG 3.42Å; R163-L167 PolarHBondContact O-N 3.04Å; R163-L167 VanDerWaalsContact O-N 3.07Å; L164-L167 PolarHBondContact O-N 3.13Å; E165-L167 VanDerWaalsContact C-N 3.26Å; E165-L167 PolarHBondContact O-N 3.18Å; L167-V169 HydrophobicContact CB-CG2 3.66Å; L167-V169 WeakPolarHBondContact O-CG2 3.39Å; L167-V169 PolarHBondContact O-N 3.12Å
168Q81.8Confident82.3Confident168 Ų16861.9 Ų61.979%0.78530%0.3SS*.THydrogen-bonded Turntrans56.328.8-178.6-58.6-175.3-5.700114.2L164 E165 N166 L170L164-Q168 PolarHBondContact O-N 3.33Å; E165-Q168 PolarHBondContact O-N 2.9Å; N166-Q168 PolarHBondContact O-N 3.27Å; Q168-L170 VanDerWaalsContact C-N 3.29Å
169V82Confident82.5Confident10 Ų1055.8 Ų55.86%0.06128%0.276CS..  trans-94.115179-150.90000112F58 V62 F91 V94 L164 L167F58-V169 HydrophobicContact CE1-CG2 4.16Å; F58-V169 HydrophobicContact CZ-CG2 4.16Å; V62-V169 HydrophobicContact CG2-CG2 4.32Å; F91-V169 VanDerWaalsContact CD1-O 3.28Å; F91-V169 WeakPolarHBondContact CD1-O 3.23Å; V94-V169 HydrophobicContact CG2-CB 4.25Å; V94-V169 HydrophobicContact CG2-CG1 3.38Å; L164-V169 PolarHBondContact O-N 3.36Å; L164-V169 VanDerWaalsContact O-N 3.17Å; L167-V169 HydrophobicContact CB-CG2 3.66Å; L167-V169 WeakPolarHBondContact O-CG2 3.39Å; L167-V169 PolarHBondContact O-N 3.12Å
170L81.2Confident82.6Confident12 Ų1249.3 Ų49.36%0.06325%0.248CC..  trans-107.7118.4176.8-67175000110.2F91 F161 L164 E165 Q168 R176 V179F91-L170 VanDerWaalsContact CE1-C 3.49Å; F161-L170 HydrophobicContact CD2-CD1 4.28Å; F161-L170 HydrophobicContact CE1-CD1 4.2Å; F161-L170 HydrophobicContact CE2-CD1 3.84Å; F161-L170 HydrophobicContact CE2-CD2 4.33Å; F161-L170 HydrophobicContact CZ-CD1 3.8Å; L164-L170 HydrophobicContact CB-CD1 4.15Å; L164-L170 HydrophobicContact CB-CD2 4.12Å; L164-L170 HydrophobicContact CB-CG 3.97Å; L164-L170 HydrophobicContact CD1-CD2 4.44Å; E165-L170 HydrophobicContact CB-CD1 3.83Å; E165-L170 HydrophobicContact CG-CD1 4.49Å; Q168-L170 VanDerWaalsContact C-N 3.29Å; L170-R176 HydrophobicContact CB-CG 3.96Å; L170-V179 HydrophobicContact CD2-CB 4.37Å; L170-V179 HydrophobicContact CD2-CG1 4.15Å
171G80.2Confident82.5Confident15 Ų1548.1 Ų48.116%0.15524%0.243CC..  trans-71.6-136.3176.800000114.4F91 H175 R176F91-G171 VanDerWaalsContact CE1-N 3.29Å; G171-H175 PolarHBondContact N-CD2 3.07Å; G171-R176 PolarHBondContact O-NE 3.04Å
172D80.7Confident82.4Confident87 Ų8747.5 Ų47.547%0.46524%0.24SC..SBendtrans-68.9177.4-177.368.7-9.7000113.6K174 H175 R176D172-K174 VanDerWaalsContact C-N 3.26Å; D172-K174 PolarHBondContact O-N 3.34Å; D172-H175 PolarHBondContact O-N 3.07Å; D172-H175 WeakPolarHBondContact OD1-CB 3.3Å; D172-H175 PolarHBondContact OD1-N 2.98Å; D172-R176 WeakPolarHBondContact O-CB 3.29Å; D172-R176 VanDerWaalsContact O-CG 3.25Å; D172-R176 WeakPolarHBondContact O-CG 3.41Å; D172-R176 PolarHBondContact O-N 2.88Å
173S78.9Confident82.4Confident47 Ų4745 Ų4533%0.32922%0.222SC..Hα-helixtrans-57-39.7178.9490000112.4H177 L1034 E1035S173-H177 WeakPolarHBondContact O-CB 3.25Å; S173-H177 PolarHBondContact O-N 2.98Å; S173-L1034 PolarHBondContact OG-O 2.91Å; S173-E1035 WeakPolarHBondContact CB-O 2.8Å
174K79.1Confident82.3Confident62 Ų6244 Ų4427%0.2722%0.22SC..Hα-helixtrans-63.4-53.2177.2-176.3180174.9177.80111D172 R176 H177 D178 F1036D172-K174 VanDerWaalsContact C-N 3.26Å; D172-K174 PolarHBondContact O-N 3.34Å; K174-R176 VanDerWaalsContact C-N 3.3Å; K174-R176 PolarHBondContact O-N 2.84Å; K174-H177 WeakPolarHBondContact O-CB 3.22Å; K174-H177 PolarHBondContact O-N 2.9Å; K174-H177 VanDerWaalsContact O-N 3.07Å; K174-D178 VanDerWaalsContact O-CG 3.25Å; K174-D178 PolarHBondContact O-N 3.1Å; K174-F1036 HydrophobicContact CB-CD2 3.96Å; K174-F1036 HydrophobicContact CB-CE2 3.68Å; K174-F1036 HydrophobicContact CB-CZ 4.25Å; K174-F1036 HydrophobicContact CD-CE2 4.46Å; K174-F1036 HydrophobicContact CD-CZ 4.37Å; K174-F1036 HydrophobicContact CG-CE2 3.96Å; K174-F1036 HydrophobicContact CG-CZ 4.01Å
175H81.9Confident82.2Confident3 Ų345.4 Ų45.41%0.01423%0.228CC..Hα-helixtrans-60-40.5179.3177.477.8000112L87 F91 V95 G171 D172 H177 D178 V179L87-H175 HydrophobicContact CD2-CB 4.32Å; F91-H175 PolarHBondContact O-CE1 3.44Å; F91-H175 VanDerWaalsContact O-CE1 3.22Å; V95-H175 VanDerWaalsContact CG2-CE1 3.43Å; V95-H175 WeakPolarHBondContact CG2-CE1 3.49Å; V95-H175 WeakPolarHBondContact CG2-ND1 3.45Å; G171-H175 PolarHBondContact N-CD2 3.07Å; D172-H175 PolarHBondContact O-N 3.07Å; D172-H175 WeakPolarHBondContact OD1-CB 3.3Å; D172-H175 PolarHBondContact OD1-N 2.98Å; H175-H177 VanDerWaalsContact C-N 3.34Å; H175-H177 PolarHBondContact O-N 3.35Å; H175-D178 PolarHBondContact O-N 2.85Å; H175-V179 WeakPolarHBondContact O-CB 3.43Å; H175-V179 VanDerWaalsContact O-CG2 3.28Å; H175-V179 WeakPolarHBondContact O-CG2 3.09Å; H175-V179 PolarHBondContact O-N 3.49Å
176R83.4Confident82.2Confident96 Ų9641 Ų4136%0.36221%0.208SC..Hα-helixtrans-58.8-44.8173.5-73.2168.3-171.9-141.4-4.7112F161 L170 G171 D172 K174 F180F161-R176 HydrophobicContact CZ-CB 4.29Å; L170-R176 HydrophobicContact CB-CG 3.96Å; G171-R176 PolarHBondContact O-NE 3.04Å; D172-R176 WeakPolarHBondContact O-CB 3.29Å; D172-R176 VanDerWaalsContact O-CG 3.25Å; D172-R176 WeakPolarHBondContact O-CG 3.41Å; D172-R176 PolarHBondContact O-N 2.88Å; K174-R176 VanDerWaalsContact C-N 3.3Å; K174-R176 PolarHBondContact O-N 2.84Å; R176-F180 VanDerWaalsContact O-CB 3.24Å; R176-F180 WeakPolarHBondContact O-CB 3.46Å; R176-F180 PolarHBondContact O-N 3.46Å
177H81.5Confident82.3Confident1 Ų135 Ų351%0.00518%0.176CC..Hα-helixtrans-64.7-47.9177.6-177.283.9000112S173 K174 H175 V179 F180 M181 F1036S173-H177 WeakPolarHBondContact O-CB 3.25Å; S173-H177 PolarHBondContact O-N 2.98Å; K174-H177 WeakPolarHBondContact O-CB 3.22Å; K174-H177 PolarHBondContact O-N 2.9Å; K174-H177 VanDerWaalsContact O-N 3.07Å; H175-H177 VanDerWaalsContact C-N 3.34Å; H175-H177 PolarHBondContact O-N 3.35Å; H177-V179 PolarHBondContact O-N 2.98Å; H177-F180 PolarHBondContact O-N 3.48Å; H177-M181 WeakPolarHBondContact CE1-CE 3.36Å; H177-M181 WeakPolarHBondContact O-CB 3.32Å; H177-M181 VanDerWaalsContact O-CG 3.31Å; H177-M181 WeakPolarHBondContact O-CG 3.42Å; H177-M181 PolarHBondContact O-N 3.3Å; H177-F1036 HydrophobicContact CB-CB 3.74Å; H177-F1036 HydrophobicContact CB-CD1 4.29Å; H177-F1036 HydrophobicContact CB-CG 4.21Å; H177-F1036 AromaticContact CD2-CD1 3.96Å
178D79.8Confident82.4Confident42 Ų4232.2 Ų32.223%0.22516%0.161CC..Hα-helixtrans-58.6-50.4180-65.7-13.9000110.4K174 H175 F180 M181 M182 Y1139K174-D178 VanDerWaalsContact O-CG 3.25Å; K174-D178 PolarHBondContact O-N 3.1Å; H175-D178 PolarHBondContact O-N 2.85Å; D178-F180 PolarHBondContact O-N 3Å; D178-M181 PolarHBondContact O-N 3.06Å; D178-M182 WeakPolarHBondContact O-CG 3.21Å; D178-M182 PolarHBondContact O-N 3.21Å; D178-Y1139 PolarHBondContact OD1-OH 3.26Å
179V85Confident82.5Confident0 Ų024.5 Ų24.50%013%0.126CC..Hα-helixtrans-62.9-44.1178.1173.30000111.4V94 Y98 L164 L170 H175 H177 M181 M182 L183V94-V179 HydrophobicContact CG1-CG1 4.38Å; V94-V179 HydrophobicContact CG1-CG2 4.16Å; Y98-V179 HydrophobicContact CD2-CG1 4.3Å; Y98-V179 HydrophobicContact CE2-CG1 4.37Å; L164-V179 HydrophobicContact CD1-CG1 3.94Å; L170-V179 HydrophobicContact CD2-CB 4.37Å; L170-V179 HydrophobicContact CD2-CG1 4.15Å; H175-V179 WeakPolarHBondContact O-CB 3.43Å; H175-V179 VanDerWaalsContact O-CG2 3.28Å; H175-V179 WeakPolarHBondContact O-CG2 3.09Å; H175-V179 PolarHBondContact O-N 3.49Å; H177-V179 PolarHBondContact O-N 2.98Å; V179-M181 VanDerWaalsContact C-N 3.33Å; V179-M181 PolarHBondContact O-N 3.35Å; V179-M182 PolarHBondContact O-N 2.88Å; V179-L183 HydrophobicContact CG1-CD1 4.15Å; V179-L183 HydrophobicContact CG1-CG 4.38Å; V179-L183 WeakPolarHBondContact O-CG 3.32Å; V179-L183 PolarHBondContact O-N 3.09Å
180F84.4Confident82.8Confident9 Ų924 Ų244%0.03912%0.124CC..Hα-helixtrans-59.8-44.7177.5-176.2-91.5000111.7V157 Y158 F161 R176 H177 D178 M182 L183 K184 I1038 P1039V157-F180 HydrophobicContact CG1-CD2 4.24Å; V157-F180 HydrophobicContact CG1-CE2 3.88Å; V157-F180 HydrophobicContact CG1-CZ 4.22Å; Y158-F180 HydrophobicContact CD1-CE2 4.23Å; Y158-F180 AromaticContact CE1-CE2 3.96Å; Y158-F180 HydrophobicContact CE1-CE2 3.96Å; Y158-F180 AromaticContact CE1-CZ 3.96Å; Y158-F180 HydrophobicContact CE1-CZ 3.96Å; F161-F180 HydrophobicContact CB-CD2 4.42Å; F161-F180 HydrophobicContact CD1-CD2 4.43Å; F161-F180 HydrophobicContact CD2-CB 4.07Å; F161-F180 AromaticContact CD2-CD2 3.83Å; F161-F180 HydrophobicContact CD2-CD2 3.83Å; F161-F180 HydrophobicContact CD2-CG 4.46Å; F161-F180 HydrophobicContact CE2-CB 3.86Å; F161-F180 HydrophobicContact CE2-CD2 4.15Å; F161-F180 AromaticContact CG-CD2 3.97Å; F161-F180 HydrophobicContact CG-CD2 3.97Å; R176-F180 VanDerWaalsContact O-CB 3.24Å; R176-F180 WeakPolarHBondContact O-CB 3.46Å; R176-F180 PolarHBondContact O-N 3.46Å; H177-F180 PolarHBondContact O-N 3.48Å; D178-F180 PolarHBondContact O-N 3Å; F180-M182 VanDerWaalsContact C-N 3.33Å; F180-M182 PolarHBondContact O-N 2.93Å; F180-L183 PolarHBondContact O-N 3.3Å; F180-K184 WeakPolarHBondContact O-CB 3.4Å; F180-K184 PolarHBondContact O-N 2.98Å; F180-I1038 HydrophobicContact CB-CD1 4.24Å; F180-I1038 HydrophobicContact CD1-CG2 3.65Å; F180-I1038 HydrophobicContact CD2-CG2 4.19Å; F180-I1038 HydrophobicContact CE1-CG2 3.64Å; F180-I1038 HydrophobicContact CE2-CG2 4.19Å; F180-I1038 HydrophobicContact CG-CD1 4.45Å; F180-I1038 HydrophobicContact CG-CG2 3.93Å; F180-I1038 HydrophobicContact CZ-CG2 3.93Å; F180-P1039 HydrophobicContact CE1-CB 4.25Å
181M80.8Confident83.1Confident11 Ų1123.5 Ų23.55%0.05412%0.121CC..Hα-helixtrans-65.1-36.3176.8-71.2-63.6-178.400112H177 D178 V179 K184 N185 P1039H177-M181 WeakPolarHBondContact CE1-CE 3.36Å; H177-M181 WeakPolarHBondContact O-CB 3.32Å; H177-M181 VanDerWaalsContact O-CG 3.31Å; H177-M181 WeakPolarHBondContact O-CG 3.42Å; H177-M181 PolarHBondContact O-N 3.3Å; D178-M181 PolarHBondContact O-N 3.06Å; V179-M181 VanDerWaalsContact C-N 3.33Å; V179-M181 PolarHBondContact O-N 3.35Å; M181-K184 PolarHBondContact O-N 3.41Å; M181-N185 WeakPolarHBondContact O-CB 3.43Å; M181-N185 PolarHBondContact O-N 2.85Å; M181-N185 PolarHBondContact O-ND2 3.23Å; M181-N185 PolarHBondContact O-OD1 3.39Å; M181-P1039 WeakPolarHBondContact CE-O 3.32Å
182M82.3Confident83.4Confident13 Ų1323.2 Ų23.26%0.06412%0.115CC..Hα-helixtrans-65.8-44.9175-69.1168.775.700112.2V95 Y98 E99 L102 D178 V179 F180 K184 N185 I186V95-M182 HydrophobicContact CG1-CE 4.37Å; V95-M182 HydrophobicContact CG1-SD 4.27Å; V95-M182 WeakPolarHBondContact O-CE 3.45Å; Y98-M182 VanDerWaalsContact C-CE 3.47Å; E99-M182 HydrophobicContact CB-CE 3.59Å; E99-M182 HydrophobicContact CG-CE 4.45Å; L102-M182 HydrophobicContact CD2-CB 4.27Å; L102-M182 HydrophobicContact CD2-CG 4.32Å; D178-M182 WeakPolarHBondContact O-CG 3.21Å; D178-M182 PolarHBondContact O-N 3.21Å; V179-M182 PolarHBondContact O-N 2.88Å; F180-M182 VanDerWaalsContact C-N 3.33Å; F180-M182 PolarHBondContact O-N 2.93Å; M182-K184 VanDerWaalsContact C-N 3.32Å; M182-K184 PolarHBondContact O-N 2.69Å; M182-N185 PolarHBondContact O-N 2.87Å; M182-I186 VanDerWaalsContact O-CG1 3.29Å; M182-I186 WeakPolarHBondContact O-CG1 3.48Å; M182-I186 PolarHBondContact O-N 3.46Å
183L85.5Confident83.8Confident0 Ų019.1 Ų19.10%09%0.093CC..Hα-helixtrans-60.4-42.3175.6-68.8173000111.8Y98 F155 V157 E160 F161 L164 V179 F180 I186 S187Y98-L183 HydrophobicContact CD1-CD2 3.68Å; Y98-L183 HydrophobicContact CD2-CD2 4.42Å; Y98-L183 HydrophobicContact CE1-CD2 3.38Å; Y98-L183 HydrophobicContact CE2-CD2 4.16Å; Y98-L183 HydrophobicContact CG-CD2 4.21Å; F155-L183 HydrophobicContact CE2-CD2 4.37Å; F155-L183 HydrophobicContact CZ-CD2 3.87Å; V157-L183 HydrophobicContact CG1-CB 3.92Å; E160-L183 HydrophobicContact CB-CD1 4.49Å; E160-L183 HydrophobicContact CG-CD1 4.31Å; E160-L183 HydrophobicContact CG-CD2 3.86Å; F161-L183 HydrophobicContact CB-CD1 4.19Å; F161-L183 HydrophobicContact CD2-CD1 4.3Å; L164-L183 HydrophobicContact CD1-CD1 4.25Å; V179-L183 HydrophobicContact CG1-CD1 4.15Å; V179-L183 HydrophobicContact CG1-CG 4.38Å; V179-L183 WeakPolarHBondContact O-CG 3.32Å; V179-L183 PolarHBondContact O-N 3.09Å; F180-L183 PolarHBondContact O-N 3.3Å; L183-I186 WeakPolarHBondContact O-CB 3.3Å; L183-I186 PolarHBondContact O-N 2.88Å; L183-S187 PolarHBondContact O-N 3.35Å
184K83.2Confident84.2Confident53 Ų5316.9 Ų16.923%0.238%0.078CC..Hα-helixtrans-61.4-47.3174.3-177.3-178.3171.2-173.50111.7F180 M181 M182 I186 S187 E188F180-K184 WeakPolarHBondContact O-CB 3.4Å; F180-K184 PolarHBondContact O-N 2.98Å; M181-K184 PolarHBondContact O-N 3.41Å; M182-K184 VanDerWaalsContact C-N 3.32Å; M182-K184 PolarHBondContact O-N 2.69Å; K184-I186 VanDerWaalsContact C-N 3.25Å; K184-I186 PolarHBondContact O-N 3.35Å; K184-S187 PolarHBondContact O-N 2.95Å; K184-S187 PolarHBondContact O-OG 3.2Å; K184-E188 WeakPolarHBondContact CE-OE1 3.18Å; K184-E188 HydrophobicContact CG-CG 4.38Å; K184-E188 IonicContact NZ-OE1 3.06Å; K184-E188 WeakPolarHBondContact O-CB 3.32Å; K184-E188 VanDerWaalsContact O-CG 3.32Å; K184-E188 WeakPolarHBondContact O-CG 3.37Å; K184-E188 PolarHBondContact O-N 3.39Å
185N82.8Confident84.7Confident30 Ų3014 Ų1416%0.167%0.065CC..Hα-helixtrans-63.9-30.5178.3-67.7-20.9000112.7L102 M181 M182 G189L102-N185 HydrophobicContact CD1-CB 3.76Å; L102-N185 HydrophobicContact CD2-CB 3.74Å; L102-N185 HydrophobicContact CG-CB 4.43Å; M181-N185 WeakPolarHBondContact O-CB 3.43Å; M181-N185 PolarHBondContact O-N 2.85Å; M181-N185 PolarHBondContact O-ND2 3.23Å; M181-N185 PolarHBondContact O-OD1 3.39Å; M182-N185 PolarHBondContact O-N 2.87Å; N185-G189 PolarHBondContact O-N 2.87Å
186I84.5Confident84.8Confident0 Ų013.8 Ų13.80%07%0.065CC..Hα-helixtrans-65-49.8174.4-74.1167000110.6L16 Y98 H101 L102 I105 F155 M182 L183 K184 L190L16-I186 HydrophobicContact CD1-CG2 4.43Å; L16-I186 HydrophobicContact CD2-CG2 4.11Å; Y98-I186 HydrophobicContact CD1-CD1 3.85Å; Y98-I186 HydrophobicContact CG-CD1 4.46Å; H101-I186 HydrophobicContact CB-CD1 3.92Å; H101-I186 HydrophobicContact CB-CG1 4.47Å; L102-I186 HydrophobicContact CB-CD1 4.48Å; L102-I186 HydrophobicContact CB-CG1 3.98Å; L102-I186 HydrophobicContact CD1-CG1 4.08Å; L102-I186 HydrophobicContact CG-CG1 4.43Å; I105-I186 HydrophobicContact CD1-CB 4.02Å; I105-I186 HydrophobicContact CD1-CG1 4.03Å; I105-I186 HydrophobicContact CD1-CG2 3.65Å; F155-I186 HydrophobicContact CE1-CG2 4.04Å; F155-I186 HydrophobicContact CZ-CG2 4.06Å; M182-I186 VanDerWaalsContact O-CG1 3.29Å; M182-I186 WeakPolarHBondContact O-CG1 3.48Å; M182-I186 PolarHBondContact O-N 3.46Å; L183-I186 WeakPolarHBondContact O-CB 3.3Å; L183-I186 PolarHBondContact O-N 2.88Å; K184-I186 VanDerWaalsContact C-N 3.25Å; K184-I186 PolarHBondContact O-N 3.35Å; I186-L190 HydrophobicContact CG2-CD1 4.38Å; I186-L190 VanDerWaalsContact O-CG 3.29Å; I186-L190 WeakPolarHBondContact O-CG 3.49Å; I186-L190 PolarHBondContact O-N 3.47Å; I186-L190 VanDerWaalsContact O-N 3.15Å
187S85.8Confident85Confident6 Ų610.4 Ų10.44%0.0425%0.052CC..Hα-helixtrans-65.3-43.3179.459.70000111.8L152 V157 L183 K184 L190 A191 E245L152-S187 WeakPolarHBondContact CD2-O 3.4Å; V157-S187 WeakPolarHBondContact CG2-OG 3.34Å; L183-S187 PolarHBondContact O-N 3.35Å; K184-S187 PolarHBondContact O-N 2.95Å; K184-S187 PolarHBondContact O-OG 3.2Å; S187-L190 PolarHBondContact O-N 3.45Å; S187-A191 PolarHBondContact O-N 3.31Å; S187-E245 PolarHBondContact OG-OE1 3Å
188E85.5Confident85.2Confident12 Ų1210.4 Ų10.46%0.0565%0.052CC..Hα-helixtrans-65.6-45.3179.1-67.6178.6168.200111.7K184 L190 A191 E192 R244 E245K184-E188 WeakPolarHBondContact CE-OE1 3.18Å; K184-E188 HydrophobicContact CG-CG 4.38Å; K184-E188 IonicContact NZ-OE1 3.06Å; K184-E188 WeakPolarHBondContact O-CB 3.32Å; K184-E188 VanDerWaalsContact O-CG 3.32Å; K184-E188 WeakPolarHBondContact O-CG 3.37Å; K184-E188 PolarHBondContact O-N 3.39Å; E188-L190 VanDerWaalsContact C-N 3.33Å; E188-L190 PolarHBondContact O-N 3.24Å; E188-A191 PolarHBondContact O-N 3.42Å; E188-A191 VanDerWaalsContact O-N 3.16Å; E188-E192 WeakPolarHBondContact O-CB 3.37Å; E188-E192 PolarHBondContact O-N 3.07Å; E188-R244 VanDerWaalsContact CD-CD 3.48Å; E188-R244 HydrophobicContact CG-CB 4.3Å; E188-R244 HydrophobicContact CG-CG 3.93Å; E188-R244 WeakPolarHBondContact OE1-CD 3.48Å; E188-R244 IonicContact OE2-NE 3.67Å; E188-E245 HydrophobicContact CG-CG 4.31Å
189G84.9Confident85.3Confident6 Ų68.5 Ų8.56%0.0624%0.042CC..Hα-helixtrans-64.4-33.2178.900000113.6N185 C193N185-G189 PolarHBondContact O-N 2.87Å; G189-C193 PolarHBondContact O-N 2.91Å; G189-C193 PolarHBondContact O-SG 3.49Å
190L86.5Confident85.1Confident0 Ų09 Ų90%04%0.044CC..Hα-helixtrans-66.6-42.8172.3-73.8172.9000112P15 L16 I105 I148 V151 L152 I186 S187 E188 E192 C193 V194P15-L190 HydrophobicContact CB-CD2 4.25Å; P15-L190 HydrophobicContact CG-CD2 3.55Å; L16-L190 HydrophobicContact CD1-CD1 4.46Å; I105-L190 HydrophobicContact CD1-CD1 4.41Å; I105-L190 HydrophobicContact CD1-CD2 4.1Å; I105-L190 HydrophobicContact CD1-CG 3.9Å; I105-L190 HydrophobicContact CG1-CD2 3.99Å; I105-L190 HydrophobicContact CG1-CG 4.28Å; I148-L190 HydrophobicContact CG2-CB 4.19Å; I148-L190 HydrophobicContact CG2-CD2 4.29Å; I148-L190 WeakPolarHBondContact CG2-O 3.28Å; V151-L190 HydrophobicContact CG1-CD1 3.66Å; L152-L190 HydrophobicContact CD1-CB 4.42Å; L152-L190 HydrophobicContact CD2-CB 3.73Å; L152-L190 HydrophobicContact CD2-CD1 4.45Å; L152-L190 HydrophobicContact CG-CB 4.05Å; I186-L190 HydrophobicContact CG2-CD1 4.38Å; I186-L190 VanDerWaalsContact O-CG 3.29Å; I186-L190 WeakPolarHBondContact O-CG 3.49Å; I186-L190 PolarHBondContact O-N 3.47Å; I186-L190 VanDerWaalsContact O-N 3.15Å; S187-L190 PolarHBondContact O-N 3.45Å; E188-L190 VanDerWaalsContact C-N 3.33Å; E188-L190 PolarHBondContact O-N 3.24Å; L190-E192 VanDerWaalsContact C-N 3.34Å; L190-C193 WeakPolarHBondContact O-CB 3.24Å; L190-C193 PolarHBondContact O-N 2.8Å; L190-V194 PolarHBondContact O-N 3.39Å
191A87.7Confident84.9Confident0 Ų09.9 Ų9.90%05%0.052CC..Hα-helixtrans-68.7-36.3177.100000111.5L152 S187 E188 C193 V194 M195 E245 H248L152-A191 HydrophobicContact CD1-CB 4.16Å; L152-A191 HydrophobicContact CD2-CB 4.31Å; S187-A191 PolarHBondContact O-N 3.31Å; E188-A191 PolarHBondContact O-N 3.42Å; E188-A191 VanDerWaalsContact O-N 3.16Å; A191-C193 PolarHBondContact O-N 2.96Å; A191-V194 WeakPolarHBondContact O-CB 3.34Å; A191-V194 PolarHBondContact O-N 3.13Å; A191-M195 PolarHBondContact O-N 3.43Å; A191-M195 VanDerWaalsContact O-N 3.13Å; A191-E245 HydrophobicContact CB-CB 4.02Å; A191-E245 HydrophobicContact CB-CG 4.47Å; A191-H248 HydrophobicContact CB-CB 3.65Å
192E88Confident84.9Confident9 Ų910.5 Ų10.54%0.0426%0.056CC..Hα-helixtrans-59.7-42.2172.3176.4173177.700112.1V109 E188 L190 V194 M195 L196V109-E192 HydrophobicContact CG2-CG 4.49Å; E188-E192 WeakPolarHBondContact O-CB 3.37Å; E188-E192 PolarHBondContact O-N 3.07Å; L190-E192 VanDerWaalsContact C-N 3.34Å; E192-V194 PolarHBondContact O-N 3.13Å; E192-M195 HydrophobicContact CG-CE 4.37Å; E192-M195 CarbonylContact O-C 3.26Å; E192-M195 WeakPolarHBondContact O-CB 3.42Å; E192-M195 PolarHBondContact O-N 2.96Å; E192-L196 HydrophobicContact CG-CD1 3.79Å; E192-L196 HydrophobicContact CG-CG 3.96Å; E192-L196 WeakPolarHBondContact O-CG 3.39Å; E192-L196 PolarHBondContact O-N 3.06Å
193C87.4Confident85.1Confident1 Ų19.9 Ų9.91%0.0075%0.053CC..Hα-helixtrans-54.9-41.9175.1-70.20000111.9L108 V109 I112 I148 G189 L190 A191 W197L108-C193 HydrophobicContact CD2-CB 4.3Å; V109-C193 WeakPolarHBondContact CG2-SG 3.25Å; I112-C193 HydrophobicContact CD1-CB 3.91Å; I148-C193 HydrophobicContact CD1-CB 4.25Å; G189-C193 PolarHBondContact O-N 2.91Å; G189-C193 PolarHBondContact O-SG 3.49Å; L190-C193 WeakPolarHBondContact O-CB 3.24Å; L190-C193 PolarHBondContact O-N 2.8Å; A191-C193 PolarHBondContact O-N 2.96Å; C193-W197 VanDerWaalsContact O-CB 3.26Å; C193-W197 WeakPolarHBondContact O-CB 3.24Å; C193-W197 PolarHBondContact O-N 2.89Å
194V89Confident85Confident1 Ų114.1 Ų14.11%0.0068%0.075CC..Hα-helixtrans-64.7-42.3177.3179.40000111F145 I148 L149 L152 L190 A191 E192 S198 V211 L249F145-V194 HydrophobicContact CE2-CG1 3.8Å; F145-V194 HydrophobicContact CZ-CG1 4.02Å; I148-V194 HydrophobicContact CG2-CG2 3.7Å; L149-V194 HydrophobicContact CD2-CG2 4.16Å; L152-V194 HydrophobicContact CD1-CG2 4.5Å; L190-V194 PolarHBondContact O-N 3.39Å; A191-V194 WeakPolarHBondContact O-CB 3.34Å; A191-V194 PolarHBondContact O-N 3.13Å; E192-V194 PolarHBondContact O-N 3.13Å; V194-S198 PolarHBondContact O-N 2.83Å; V194-V211 HydrophobicContact CG1-CG2 4.07Å; V194-L249 HydrophobicContact CB-CD2 4.24Å; V194-L249 HydrophobicContact CG1-CD2 3.96Å; V194-L249 HydrophobicContact CG2-CD2 4.42Å
195M88.6Confident85Confident0 Ų014.2 Ų14.20%08%0.078CC..Hα-helixtrans-64.9-51.6176.7-175.4-169.565.800111.7A191 E192 W197 S198 C199 H248 M251 L407 W408A191-M195 PolarHBondContact O-N 3.43Å; A191-M195 VanDerWaalsContact O-N 3.13Å; E192-M195 HydrophobicContact CG-CE 4.37Å; E192-M195 CarbonylContact O-C 3.26Å; E192-M195 WeakPolarHBondContact O-CB 3.42Å; E192-M195 PolarHBondContact O-N 2.96Å; M195-W197 VanDerWaalsContact C-N 3.27Å; M195-W197 PolarHBondContact O-N 2.92Å; M195-S198 PolarHBondContact O-N 3.12Å; M195-S198 VanDerWaalsContact O-N 3.11Å; M195-S198 PolarHBondContact O-OG 3.21Å; M195-C199 PolarHBondContact O-N 2.79Å; M195-C199 PolarHBondContact O-SG 2.91Å; M195-H248 HydrophobicContact CB-CB 4.39Å; M195-H248 WeakPolarHBondContact CE-ND1 3.37Å; M195-H248 PolarHBondContact SD-ND1 2.92Å; M195-M251 HydrophobicContact CG-CB 4.21Å; M195-M251 HydrophobicContact SD-CB 3.99Å; M195-L407 HydrophobicContact CE-CB 4.46Å; M195-L407 HydrophobicContact CE-CD1 3.74Å; M195-W408 PolarHBondContact SD-NE1 2.91Å
196L84.9Confident85.1Confident0 Ų016.6 Ų16.60%010%0.097CC..Hα-helixtrans-60.3-39.3179.5-68177.3000111.7V109 I112 W120 E192 C199 Q200 L407V109-L196 HydrophobicContact CG1-CD1 3.8Å; I112-L196 HydrophobicContact CG2-CB 3.69Å; W120-L196 HydrophobicContact CH2-CD2 3.85Å; W120-L196 HydrophobicContact CZ2-CD2 4.27Å; E192-L196 HydrophobicContact CG-CD1 3.79Å; E192-L196 HydrophobicContact CG-CG 3.96Å; E192-L196 WeakPolarHBondContact O-CG 3.39Å; E192-L196 PolarHBondContact O-N 3.06Å; L196-C199 PolarHBondContact O-N 3.07Å; L196-Q200 PolarHBondContact O-N 3.5Å; L196-Q200 VanDerWaalsContact O-N 3.16Å; L196-L407 HydrophobicContact CD2-CD1 3.77Å
197W86.4Confident85.2Confident24 Ų2418.7 Ų18.79%0.09111%0.107CC..Hα-helixtrans-57.2-53.7172.5-169.5-94.5000110.5I112 S140 C193 M195 C199 Q200 S201I112-W197 HydrophobicContact CD1-CE3 4.34Å; I112-W197 HydrophobicContact CG1-CE3 4.19Å; I112-W197 HydrophobicContact CG2-CE3 4.25Å; S140-W197 VanDerWaalsContact CB-CZ2 3.5Å; C193-W197 VanDerWaalsContact O-CB 3.26Å; C193-W197 WeakPolarHBondContact O-CB 3.24Å; C193-W197 PolarHBondContact O-N 2.89Å; M195-W197 VanDerWaalsContact C-N 3.27Å; M195-W197 PolarHBondContact O-N 2.92Å; W197-C199 PolarHBondContact O-N 3.45Å; W197-C199 VanDerWaalsContact O-N 3.15Å; W197-Q200 PolarHBondContact O-N 3.32Å; W197-Q200 VanDerWaalsContact O-N 3.08Å; W197-S201 PolarHBondContact NE1-OG 3.36Å; W197-S201 VanDerWaalsContact NE1-OG 3.14Å; W197-S201 PolarHBondContact O-N 3.45Å; W197-S201 PolarHBondContact O-OG 2.9Å
198S86Confident85.3Confident1 Ų118.4 Ų18.41%0.00711%0.105CC..Hα-helixtrans-61.4-25.6-179.772.50000115V194 M195 S201 S252V194-S198 PolarHBondContact O-N 2.83Å; M195-S198 PolarHBondContact O-N 3.12Å; M195-S198 VanDerWaalsContact O-N 3.11Å; M195-S198 PolarHBondContact O-OG 3.21Å; S198-S201 CarbonylContact C-O 3.3Å; S198-S201 VanDerWaalsContact CA-O 3.27Å; S198-S201 WeakPolarHBondContact CA-O 3.33Å; S198-S252 WeakPolarHBondContact CB-O 3.26Å; S198-S252 WeakPolarHBondContact OG-CA 3.34Å; S198-S252 VanDerWaalsContact OG-CB 3.24Å; S198-S252 WeakPolarHBondContact OG-CB 3.29Å; S198-S252 PolarHBondContact OG-O 3.46Å
199C82.8Confident85.5Confident3 Ų322.7 Ų22.72%0.0212%0.123CC..Hα-helixtrans-73.7-41.4175.4-68.70000111.5M119 W120 M195 L196 W197 H255M119-C199 HydrophobicContact CG-CB 4.21Å; M119-C199 WeakPolarHBondContact CG-O 3.41Å; W120-C199 HydrophobicContact CH2-CB 3.86Å; W120-C199 HydrophobicContact CZ3-CB 3.67Å; M195-C199 PolarHBondContact O-N 2.79Å; M195-C199 PolarHBondContact O-SG 2.91Å; L196-C199 PolarHBondContact O-N 3.07Å; W197-C199 PolarHBondContact O-N 3.45Å; W197-C199 VanDerWaalsContact O-N 3.15Å; C199-H255 PolarHBondContact SG-CD2 3.31Å
200Q81.3Confident85.6Confident11 Ų1126.3 Ų26.35%0.05114%0.141CC..Hα-helixtrans-88.4-36-176.7-66.9-65.748.800113.5R115 R118 M119 W120 L196 W197R115-Q200 PolarHBondContact O-NE2 3.37Å; R118-Q200 PolarHBondContact N-O 3.48Å; R118-Q200 VanDerWaalsContact N-OE1 3.13Å; M119-Q200 VanDerWaalsContact N-OE1 3.12Å; W120-Q200 VanDerWaalsContact CD2-NE2 3.26Å; W120-Q200 VanDerWaalsContact CE2-CD 3.5Å; W120-Q200 HydrophobicContact CH2-CG 3.68Å; W120-Q200 HydrophobicContact CZ2-CG 3.54Å; W120-Q200 HydrophobicContact CZ3-CG 4.26Å; W120-Q200 PolarHBondContact O-NE2 3.29Å; W120-Q200 PolarHBondContact O-OE1 2.95Å; L196-Q200 PolarHBondContact O-N 3.5Å; L196-Q200 VanDerWaalsContact O-N 3.16Å; W197-Q200 PolarHBondContact O-N 3.32Å; W197-Q200 VanDerWaalsContact O-N 3.08Å
201S79.6Confident85.6Confident27 Ų2726.3 Ų26.319%0.18914%0.141CC..SBendtrans-126.6124.9176.448.90000110.2W197 S198 L203W197-S201 PolarHBondContact NE1-OG 3.36Å; W197-S201 VanDerWaalsContact NE1-OG 3.14Å; W197-S201 PolarHBondContact O-N 3.45Å; W197-S201 PolarHBondContact O-OG 2.9Å; S198-S201 CarbonylContact C-O 3.3Å; S198-S201 VanDerWaalsContact CA-O 3.27Å; S198-S201 WeakPolarHBondContact CA-O 3.33Å; S201-L203 PolarHBondContact O-N 3.37Å
202V81.3Confident85.6Confident23 Ų2326.3 Ų26.314%0.13914%0.141CC..PPolyproline II helixtrans-70135.4-178.9-174.10000110.1C256 P281V202-C256 HydrophobicContact CG1-CB 4.48Å; V202-C256 VanDerWaalsContact CG1-SG 3.55Å; V202-P281 HydrophobicContact CB-CG 4.32Å; V202-P281 HydrophobicContact CG1-CG 3.98Å
203L84.9Confident85.5Confident0 Ų028.8 Ų28.80%015%0.154CC..PPolyproline II helixtrans-67.3136.7-179.3-56.5177.4000111.6F145 S201 E207 V211 C256F145-L203 HydrophobicContact CE2-CD2 3.66Å; F145-L203 HydrophobicContact CZ-CD1 4.31Å; F145-L203 HydrophobicContact CZ-CD2 3.6Å; S201-L203 PolarHBondContact O-N 3.37Å; L203-E207 HydrophobicContact CB-CB 4.12Å; L203-E207 HydrophobicContact CD2-CB 4.33Å; L203-V211 HydrophobicContact CD1-CG2 4.19Å; L203-C256 HydrophobicContact CB-CB 4.44Å; L203-C256 HydrophobicContact CD1-CB 4.39Å; L203-C256 HydrophobicContact CG-CB 4.38Å
204N83.4Confident85.4Confident89 Ų8929.2 Ų29.248%0.47616%0.157SC..PPolyproline II helixtrans-71.2163.3170-70.1-18.7000111.2S206 E207 F208N204-S206 VanDerWaalsContact C-N 3.26Å; N204-S206 PolarHBondContact O-N 3.47Å; N204-E207 HydrophobicContact CB-CG 4.44Å; N204-E207 PolarHBondContact N-OE2 3.43Å; N204-E207 PolarHBondContact O-N 2.91Å; N204-F208 WeakPolarHBondContact O-CB 3.4Å; N204-F208 PolarHBondContact O-N 3.12Å
205L84Confident85.1Confident56 Ų5629.3 Ų29.329%0.29316%0.158SC..Hα-helixtrans-55.5-38.9-178.2-177.766.1000113.4K209 F288 S291 I292L205-K209 WeakPolarHBondContact O-CB 3.29Å; L205-K209 PolarHBondContact O-N 3.18Å; L205-F288 HydrophobicContact CB-CD2 4.32Å; L205-S291 VanDerWaalsContact CD1-OG 3.28Å; L205-S291 WeakPolarHBondContact CD1-OG 3.38Å; L205-S291 WeakPolarHBondContact CD2-OG 3.43Å; L205-I292 HydrophobicContact CD1-CG1 4.18Å
206S85.2Confident84.8Confident80 Ų8029.7 Ų29.756%0.55916%0.16SC*.Hα-helixtrans-66.5-41176.751.90000112.5N204 K209 L210N204-S206 VanDerWaalsContact C-N 3.26Å; N204-S206 PolarHBondContact O-N 3.47Å; S206-K209 PolarHBondContact O-N 2.92Å; S206-L210 WeakPolarHBondContact O-CG 3.49Å; S206-L210 PolarHBondContact O-N 3.02Å
207E86.1Confident84.3Confident43 Ų4330.7 Ų30.720%0.20117%0.167CC..Hα-helixtrans-70.6-44.1179.4-66.8169.8161.700110.8F145 L203 N204 K209 L210 V211F145-E207 HydrophobicContact CD1-CB 4.08Å; F145-E207 HydrophobicContact CD1-CG 3.96Å; F145-E207 HydrophobicContact CE1-CB 3.61Å; F145-E207 HydrophobicContact CE1-CG 4.03Å; F145-E207 HydrophobicContact CZ-CB 4.12Å; L203-E207 HydrophobicContact CB-CB 4.12Å; L203-E207 HydrophobicContact CD2-CB 4.33Å; N204-E207 HydrophobicContact CB-CG 4.44Å; N204-E207 PolarHBondContact N-OE2 3.43Å; N204-E207 PolarHBondContact O-N 2.91Å; E207-K209 VanDerWaalsContact C-N 3.28Å; E207-K209 PolarHBondContact O-N 3.48Å; E207-L210 PolarHBondContact O-N 3.26Å; E207-L210 VanDerWaalsContact O-N 3.12Å; E207-V211 WeakPolarHBondContact O-CG2 3.4Å; E207-V211 PolarHBondContact O-N 2.98Å
208F88.1Confident82.9Confident0 Ų032 Ų320%018%0.18CC..Hα-helixtrans-55.4-45.5173.4-173.4-84.8000111.1N204 V211 L212 L253 C256 L257 I292N204-F208 WeakPolarHBondContact O-CB 3.4Å; N204-F208 PolarHBondContact O-N 3.12Å; F208-V211 PolarHBondContact O-N 3.38Å; F208-L212 WeakPolarHBondContact O-CB 3.38Å; F208-L212 PolarHBondContact O-N 2.96Å; F208-L253 HydrophobicContact CD1-CD2 4.33Å; F208-L253 HydrophobicContact CD2-CD2 3.6Å; F208-L253 HydrophobicContact CE1-CD2 4.29Å; F208-L253 HydrophobicContact CE2-CB 4.17Å; F208-L253 HydrophobicContact CE2-CD2 3.57Å; F208-L253 HydrophobicContact CE2-CG 4.46Å; F208-L253 HydrophobicContact CG-CD2 4Å; F208-L253 HydrophobicContact CZ-CD2 3.93Å; F208-C256 HydrophobicContact CD2-CB 4.33Å; F208-L257 HydrophobicContact CE2-CD2 3.99Å; F208-L257 HydrophobicContact CE2-CG 4.27Å; F208-L257 HydrophobicContact CZ-CD2 4.3Å; F208-I292 HydrophobicContact CE1-CG2 4.49Å
209K89Confident81.2Confident103 Ų10334.6 Ų34.645%0.44820%0.201SC..Hα-helixtrans-62.1-45.2175.3-176.3178.3176.1-173.80112.1L205 S206 E207 V211 L212 D213 L295L205-K209 WeakPolarHBondContact O-CB 3.29Å; L205-K209 PolarHBondContact O-N 3.18Å; S206-K209 PolarHBondContact O-N 2.92Å; E207-K209 VanDerWaalsContact C-N 3.28Å; E207-K209 PolarHBondContact O-N 3.48Å; K209-V211 PolarHBondContact O-N 3.31Å; K209-L212 PolarHBondContact O-N 2.9Å; K209-D213 WeakPolarHBondContact CE-OD2 3.35Å; K209-D213 WeakPolarHBondContact CG-OD2 3.43Å; K209-D213 WeakPolarHBondContact O-CB 3.32Å; K209-D213 VanDerWaalsContact O-CG 3.26Å; K209-D213 PolarHBondContact O-N 3.45Å; K209-L295 HydrophobicContact CB-CD1 3.86Å; K209-L295 HydrophobicContact CD-CD1 4.35Å; K209-L295 HydrophobicContact CG-CD1 4Å
210L86.8Confident79Confident82 Ų8239.5 Ų39.543%0.42923%0.227SC..Hα-helixtrans-60.8-43.2179.2-75.7171.5000112.2L149 S206 E207 C214L149-L210 HydrophobicContact CD1-CB 3.86Å; S206-L210 WeakPolarHBondContact O-CG 3.49Å; S206-L210 PolarHBondContact O-N 3.02Å; E207-L210 PolarHBondContact O-N 3.26Å; E207-L210 VanDerWaalsContact O-N 3.12Å; L210-C214 VanDerWaalsContact O-CB 3.27Å; L210-C214 WeakPolarHBondContact O-CB 3.48Å; L210-C214 PolarHBondContact O-N 3.33Å
211V87.8Confident76.6Confident0 Ų046.1 Ų46.10%026%0.258CS..Hα-helixtrans-65.2-44.61761760000110.8F145 L149 V194 L203 E207 F208 K209 C214 L215 L249 S252 L253F145-V211 HydrophobicContact CE1-CG2 3.65Å; F145-V211 HydrophobicContact CE2-CG2 4.43Å; F145-V211 HydrophobicContact CZ-CG2 3.3Å; L149-V211 HydrophobicContact CD1-CG2 3.95Å; L149-V211 HydrophobicContact CD2-CG2 4.36Å; V194-V211 HydrophobicContact CG1-CG2 4.07Å; L203-V211 HydrophobicContact CD1-CG2 4.19Å; E207-V211 WeakPolarHBondContact O-CG2 3.4Å; E207-V211 PolarHBondContact O-N 2.98Å; F208-V211 PolarHBondContact O-N 3.38Å; K209-V211 PolarHBondContact O-N 3.31Å; V211-C214 WeakPolarHBondContact O-CB 3.29Å; V211-C214 PolarHBondContact O-N 3.12Å; V211-L215 WeakPolarHBondContact O-CB 3.34Å; V211-L215 PolarHBondContact O-N 3.28Å; V211-L249 HydrophobicContact CG1-CB 4.27Å; V211-L249 HydrophobicContact CG1-CD2 4.28Å; V211-S252 WeakPolarHBondContact CG1-OG 3.47Å; V211-L253 HydrophobicContact CB-CD2 3.83Å; V211-L253 HydrophobicContact CB-CG 4.41Å; V211-L253 HydrophobicContact CG1-CD1 4.15Å; V211-L253 HydrophobicContact CG1-CD2 3.67Å; V211-L253 HydrophobicContact CG1-CG 3.68Å
212L87.4Confident74.1Confident0 Ų053.2 Ų53.20%029%0.288CS..Hα-helixtrans-63.4-45.4179.2-172.972.9000111.7F208 K209 C214 L215 L216 L253 L295 L296 Q299 L318 I321F208-L212 WeakPolarHBondContact O-CB 3.38Å; F208-L212 PolarHBondContact O-N 2.96Å; K209-L212 PolarHBondContact O-N 2.9Å; L212-C214 VanDerWaalsContact C-N 3.27Å; L212-C214 PolarHBondContact O-N 3.32Å; L212-L215 PolarHBondContact O-N 2.96Å; L212-L216 HydrophobicContact CD1-CD1 3.97Å; L212-L216 HydrophobicContact CD1-CG 4.32Å; L212-L216 HydrophobicContact CD2-CD1 4.12Å; L212-L216 HydrophobicContact CG-CD1 3.67Å; L212-L216 HydrophobicContact CG-CG 4.32Å; L212-L216 WeakPolarHBondContact O-CB 3.47Å; L212-L216 VanDerWaalsContact O-CG 3.29Å; L212-L216 WeakPolarHBondContact O-CG 3.47Å; L212-L216 PolarHBondContact O-N 3.2Å; L212-L253 HydrophobicContact CB-CD1 4.27Å; L212-L253 HydrophobicContact CD1-CD1 3.71Å; L212-L295 HydrophobicContact CD2-CD2 3.14Å; L212-L296 HydrophobicContact CD2-CD2 4.41Å; L212-Q299 HydrophobicContact CD2-CG 4.09Å; L212-L318 HydrophobicContact CD1-CD2 4.31Å; L212-I321 HydrophobicContact CD1-CD1 3.66Å
213D86Confident71.9Confident60 Ų6058.3 Ų58.332%0.32132%0.322SS..Hα-helixtrans-64.4-34.2178-71.2-17.8000111.2K209 S217 Q299K209-D213 WeakPolarHBondContact CE-OD2 3.35Å; K209-D213 WeakPolarHBondContact CG-OD2 3.43Å; K209-D213 WeakPolarHBondContact O-CB 3.32Å; K209-D213 VanDerWaalsContact O-CG 3.26Å; K209-D213 PolarHBondContact O-N 3.45Å; D213-S217 WeakPolarHBondContact O-CB 3.46Å; D213-S217 PolarHBondContact O-N 3.36Å; D213-S217 VanDerWaalsContact O-N 3.17Å; D213-Q299 PolarHBondContact OD1-NE2 3.2Å
214C83.8Confident69.3Low11 Ų1162.8 Ų62.87%0.07435%0.353CS..Hα-helixtrans-65.4-48.4173.1-1730000111.4L149 L210 V211 L212 L216 S217 F236L149-C214 HydrophobicContact CD2-CB 4.38Å; L210-C214 VanDerWaalsContact O-CB 3.27Å; L210-C214 WeakPolarHBondContact O-CB 3.48Å; L210-C214 PolarHBondContact O-N 3.33Å; V211-C214 WeakPolarHBondContact O-CB 3.29Å; V211-C214 PolarHBondContact O-N 3.12Å; L212-C214 VanDerWaalsContact C-N 3.27Å; L212-C214 PolarHBondContact O-N 3.32Å; C214-L216 VanDerWaalsContact C-N 3.33Å; C214-L216 PolarHBondContact O-N 3.42Å; C214-S217 WeakPolarHBondContact O-CB 3.47Å; C214-S217 PolarHBondContact O-N 3.49Å; C214-F236 WeakPolarHBondContact O-CE2 3.16Å
215L83.8Confident66.9Low2 Ų265.3 Ų65.31%0.0137%0.372CS..Hα-helixtrans-63.9-36-179.9-17864.9000112.8V211 L212 L234 G246 L249 L250 L253 L317V211-L215 WeakPolarHBondContact O-CB 3.34Å; V211-L215 PolarHBondContact O-N 3.28Å; L212-L215 PolarHBondContact O-N 2.96Å; L215-L234 WeakPolarHBondContact O-CD2 3.43Å; L215-G246 WeakPolarHBondContact CD1-O 3.21Å; L215-L249 HydrophobicContact CD1-CB 4.17Å; L215-L250 HydrophobicContact CD2-CB 4.16Å; L215-L250 HydrophobicContact CD2-CD1 4.4Å; L215-L253 HydrophobicContact CD2-CD1 3.97Å; L215-L317 HydrophobicContact CD2-CD1 4.28Å; L215-L317 HydrophobicContact CD2-CD2 3.87Å; L215-L317 HydrophobicContact CD2-CG 4.44Å; L215-L317 HydrophobicContact CG-CD2 3.93Å
216L82.9Confident64.6Low9 Ų972.2 Ų72.25%0.04740%0.399CS..Hα-helixtrans-86.5-7.6-179.3-64.6171.9000113.9L212 C214 Q299 F303 L317 L318L212-L216 HydrophobicContact CD1-CD1 3.97Å; L212-L216 HydrophobicContact CD1-CG 4.32Å; L212-L216 HydrophobicContact CD2-CD1 4.12Å; L212-L216 HydrophobicContact CG-CD1 3.67Å; L212-L216 HydrophobicContact CG-CG 4.32Å; L212-L216 WeakPolarHBondContact O-CB 3.47Å; L212-L216 VanDerWaalsContact O-CG 3.29Å; L212-L216 WeakPolarHBondContact O-CG 3.47Å; L212-L216 PolarHBondContact O-N 3.2Å; C214-L216 VanDerWaalsContact C-N 3.33Å; C214-L216 PolarHBondContact O-N 3.42Å; L216-Q299 HydrophobicContact CD1-CB 4.46Å; L216-Q299 HydrophobicContact CD1-CG 4.23Å; L216-F303 HydrophobicContact CB-CZ 4.34Å; L216-F303 HydrophobicContact CD1-CE2 4.16Å; L216-F303 HydrophobicContact CD2-CE2 4.4Å; L216-L317 HydrophobicContact CD2-CD2 3.95Å; L216-L318 HydrophobicContact CD1-CD2 3.99Å; L216-L318 HydrophobicContact CD2-CD2 4.32Å; L216-L318 HydrophobicContact CD2-CG 4.19Å
217S74Confident62.1Low21 Ų2175.4 Ų75.415%0.14741%0.41CS..PPolyproline II helixtrans-62.1140.9-176.7-145.70000111.8D213 C214 T235D213-S217 WeakPolarHBondContact O-CB 3.46Å; D213-S217 PolarHBondContact O-N 3.36Å; D213-S217 VanDerWaalsContact O-N 3.17Å; C214-S217 WeakPolarHBondContact O-CB 3.47Å; C214-S217 PolarHBondContact O-N 3.49Å; S217-T235 PolarHBondContact O-N 2.87Å; S217-T235 PolarHBondContact O-OG1 3.05Å
218S57.1Low59.7Low51 Ų5180.5 Ų80.536%0.35744%0.439SS..BIsolated β-bridgetrans-84.3145167.764.70000109.6N220S218-N220 PolarHBondContact O-N 3.26Å
219A50Low56.9Low56 Ų5683.6 Ų83.646%0.46347%0.471SS..PPolyproline II helixtrans-52127.7172.100000109.7Q221 T235A219-Q221 PolarHBondContact O-N 2.71Å; A219-T235 HydrophobicContact CB-CG2 4.19Å
220N37.4Very low54.3Low105 Ų10586.1 Ų86.156%0.56149%0.489SS*.  trans-54.3114-175.5-74.3-23.4000109.8R153 S218 E222R153-N220 PolarHBondContact NH2-OD1 3.19Å; S218-N220 PolarHBondContact O-N 3.26Å; N220-E222 PolarHBondContact O-N 3.26Å
221Q28.8Very low51.9Low151 Ų15190.4 Ų90.471%0.70651%0.507SS*.  trans-64.3115.7167.3-71177.4-3.600108.8A219 N232A219-Q221 PolarHBondContact O-N 2.71Å; Q221-N232 PolarHBondContact NE2-OD1 2.98Å
222E27.8Very low49.7Very low176 Ų17693 Ų9382%0.82252%0.521SS*.  trans-78.7131156.8-82-167.9169.300109.1N220 S224N220-E222 PolarHBondContact O-N 3.26Å; E222-S224 VanDerWaalsContact C-N 3.32Å; E222-S224 PolarHBondContact O-N 3.19Å
223P35.6Very low47.9Very low130 Ų13097.1 Ų97.184%0.84454%0.54SS*.SBendtrans-86.669-176.435.9-33.9000110.5
224S30.4Very low46.2Very low93 Ų9394.6 Ų94.665%0.6553%0.526SS*.  trans-175.498.6156.645.70000112E222E222-S224 VanDerWaalsContact C-N 3.32Å; E222-S224 PolarHBondContact O-N 3.19Å
225T33Very low44.8Very low142 Ų14296.2 Ų96.287%0.87154%0.536SS*.  178.1115.7126.826.30000107.5N227T225-N227 PolarHBondContact O-N 3.49Å
226K34.8Very low43.8Very low201 Ų20196.9 Ų96.987%0.87454%0.539SS*.  trans-61.2108.4170.6-65.9174.9176.71790107.2
227N34Very low42.6Very low147 Ų14796.9 Ų96.979%0.78654%0.539SS*.  trans-170115.7151-89.9-22.4000111.3T225T225-N227 PolarHBondContact O-N 3.49Å
228N34.1Very low41.7Very low151 Ų15199.7 Ų99.781%0.80755%0.552SS**  trans55.498.6152.1-58.7-14.7000120.6
229G31.3Very low41.7Very low65 Ų65104.7 Ų104.767%0.6758%0.575SS**SBend59.9119.1129.900000120.2
230N34.4Very low42.1Very low155 Ų155103.2 Ų103.283%0.82957%0.565SS**  trans8851.8158.7-54.2-1.4000118.8
231Q36.1Very low43.5Very low173 Ų173102.5 Ų102.581%0.80856%0.559SS**  trans-133.959.7179.5-63.6-172.9-1.700115.3
232N40.7Very low45.7Very low54 Ų5495.5 Ų95.529%0.28953%0.526SS..  trans-115.435.9162.7-82.2-6.2000111.7Q221 E308 S310Q221-N232 PolarHBondContact NE2-OD1 2.98Å; N232-E308 PolarHBondContact ND2-OE2 2.82Å; N232-S310 WeakPolarHBondContact O-CB 3.31Å
233E49.3Very low48.1Very low86 Ų8688.1 Ų88.140%0.40249%0.493SS..  trans-69.1150.9173.7-63.5-173.1155.400111.3
234L50.5Low50.3Low7 Ų782.3 Ų82.34%0.03745%0.454CS..BIsolated β-bridgetrans-58.1148.4170.5-83.2166000110.4L215 F236 Q237 R314L215-L234 WeakPolarHBondContact O-CD2 3.43Å; L234-F236 PolarHBondContact O-N 3.02Å; L234-Q237 HydrophobicContact CB-CB 3.98Å; L234-Q237 HydrophobicContact CB-CG 3.84Å; L234-Q237 VanDerWaalsContact CD1-CD 3.5Å; L234-Q237 HydrophobicContact CD1-CG 3.99Å; L234-Q237 PolarHBondContact O-N 3.01Å; L234-Q237 VanDerWaalsContact O-N 3.08Å; L234-R314 HydrophobicContact CD1-CG 3.81Å; L234-R314 HydrophobicContact CD2-CG 3.85Å; L234-R314 HydrophobicContact CG-CG 3.88Å
235T54.8Low52.9Low45 Ų4579.2 Ų79.228%0.27643%0.429SS..THydrogen-bonded Turntrans-51.1-33.1175.440.40000113.2S217 A219S217-T235 PolarHBondContact O-N 2.87Å; S217-T235 PolarHBondContact O-OG1 3.05Å; A219-T235 HydrophobicContact CB-CG2 4.19Å
236F62.4Low55.4Low16 Ų1672.4 Ų72.47%0.0739%0.388CS..THydrogen-bonded Turntrans-11331.4-175.8-52.3-66.3000112.2C214 L234 T243 E245 L249C214-F236 WeakPolarHBondContact O-CE2 3.16Å; L234-F236 PolarHBondContact O-N 3.02Å; F236-T243 WeakPolarHBondContact CB-OG1 3.41Å; F236-T243 PolarHBondContact O-N 3.35Å; F236-T243 PolarHBondContact O-OG1 3.4Å; F236-E245 HydrophobicContact CD1-CB 4.05Å; F236-E245 HydrophobicContact CE1-CB 4.25Å; F236-L249 HydrophobicContact CD2-CD1 4.25Å; F236-L249 HydrophobicContact CE2-CD1 3.73Å; F236-L249 HydrophobicContact CZ-CD1 4.01Å
237Q57.3Low57.9Low10 Ų1062.9 Ų62.95%0.04735%0.346CS..EExtended strand (participates in β ladder)trans-120.4133.7166.2-78.4-177.2-31.100110.4L234 Q241 L242L234-Q237 HydrophobicContact CB-CB 3.98Å; L234-Q237 HydrophobicContact CB-CG 3.84Å; L234-Q237 VanDerWaalsContact CD1-CD 3.5Å; L234-Q237 HydrophobicContact CD1-CG 3.99Å; L234-Q237 PolarHBondContact O-N 3.01Å; L234-Q237 VanDerWaalsContact O-N 3.08Å; Q237-Q241 CarbonylContact C-O 3.54Å; Q237-Q241 VanDerWaalsContact CA-O 3.24Å; Q237-Q241 WeakPolarHBondContact CA-O 3.4Å; Q237-L242 HydrophobicContact CG-CD1 4.23Å
238N57Low60.6Low79 Ų7955.9 Ų55.942%0.42231%0.309SS..EExtended strand (participates in β ladder)trans-117.7121.6169.5-77.8-27.4000108.2G240 Q241 T243N238-G240 PolarHBondContact O-N 2.82Å; N238-Q241 PolarHBondContact N-O 3Å; N238-Q241 PolarHBondContact O-N 3.02Å; N238-T243 HydrophobicContact CB-CG2 4.31Å
239N56.1Low63.2Low156 Ų15648.7 Ų48.783%0.83427%0.27SS*.THydrogen-bonded Turntrans52.637.3178.6-61.3-20.1000113.6Q241N239-Q241 VanDerWaalsContact C-N 3.34Å; N239-Q241 PolarHBondContact O-N 3.1Å
240G58.1Low66.1Low26 Ų2645.6 Ų45.627%0.26824%0.238SC..THydrogen-bonded Turntrans74.113.4-178.100000115.7N238 Q395N238-G240 PolarHBondContact O-N 2.82Å; G240-Q395 PolarHBondContact O-NE2 2.75Å; G240-Q395 PolarHBondContact O-OE1 3.45Å
241Q68Low68.8Low89 Ų8938.2 Ų38.242%0.41620%0.199SC..EExtended strand (participates in β ladder)trans-110.7139.6168.3-69-174.8-13.900110.8Q237 N238 N239 T243Q237-Q241 CarbonylContact C-O 3.54Å; Q237-Q241 VanDerWaalsContact CA-O 3.24Å; Q237-Q241 WeakPolarHBondContact CA-O 3.4Å; N238-Q241 PolarHBondContact N-O 3Å; N238-Q241 PolarHBondContact O-N 3.02Å; N239-Q241 VanDerWaalsContact C-N 3.34Å; N239-Q241 PolarHBondContact O-N 3.1Å; Q241-T243 PolarHBondContact O-N 3.29Å
242L74.2Confident71.4Confident5 Ų530 Ų303%0.02616%0.161CC..EExtended strand (participates in β ladder)trans-65.1128.6174.3-15878.3000110.2Q237 L247 L250 T399Q237-L242 HydrophobicContact CG-CD1 4.23Å; L242-L247 HydrophobicContact CD2-CB 3.95Å; L242-L247 HydrophobicContact CD2-CD1 4.1Å; L242-L250 HydrophobicContact CD2-CD2 4.22Å; L242-T399 WeakPolarHBondContact O-CG2 3.01Å; L242-T399 PolarHBondContact O-OG1 3.49Å
243T78.2Confident73.8Confident20 Ų2027.4 Ų27.412%0.12315%0.147CC..  trans-70162.6173.374.60000110.5F236 N238 Q241 E245 G246 L247F236-T243 WeakPolarHBondContact CB-OG1 3.41Å; F236-T243 PolarHBondContact O-N 3.35Å; F236-T243 PolarHBondContact O-OG1 3.4Å; N238-T243 HydrophobicContact CB-CG2 4.31Å; Q241-T243 PolarHBondContact O-N 3.29Å; T243-E245 VanDerWaalsContact C-N 3.3Å; T243-E245 WeakPolarHBondContact CB-OE2 3.33Å; T243-E245 PolarHBondContact O-N 3.38Å; T243-E245 PolarHBondContact OG1-OE2 3.23Å; T243-G246 PolarHBondContact O-N 3.26Å; T243-G246 VanDerWaalsContact O-N 3.14Å; T243-G246 PolarHBondContact OG1-N 2.79Å; T243-L247 PolarHBondContact O-N 3.39Å
244R82.2Confident75.8Confident8 Ų823.3 Ų23.33%0.0313%0.128CC..Hα-helixtrans-60-39.7179.7175.4151.7179.1132.220.2112.5E188 G246 L247 H248 E405 W408E188-R244 VanDerWaalsContact CD-CD 3.48Å; E188-R244 HydrophobicContact CG-CB 4.3Å; E188-R244 HydrophobicContact CG-CG 3.93Å; E188-R244 WeakPolarHBondContact OE1-CD 3.48Å; E188-R244 IonicContact OE2-NE 3.67Å; R244-G246 VanDerWaalsContact C-N 3.35Å; R244-G246 PolarHBondContact O-N 2.95Å; R244-L247 PolarHBondContact O-N 3.37Å; R244-H248 PolarHBondContact O-CD2 3.22Å; R244-H248 VanDerWaalsContact O-CD2 3.22Å; R244-H248 PolarHBondContact O-N 2.81Å; R244-E405 IonicContact CZ-OE1 3.93Å; R244-E405 IonicContact NH1-OE1 3.18Å; R244-E405 PolarHBondContact NH1-OE1 2.76Å; R244-E405 IonicContact NH2-OE1 3.83Å; R244-E405 PolarHBondContact NH2-OE1 3Å; R244-E405 IonicContact NH2-OE2 2.77Å; R244-W408 HydrophobicContact CG-CH2 3.87Å; R244-W408 HydrophobicContact CG-CZ2 4.29Å
245E83.6Confident77.5Confident28 Ų2823.2 Ų23.213%0.13113%0.127CC..Hα-helixtrans-61.9-44.7174.6-5290.7160.500111.1S187 E188 A191 F236 T243 L247 H248 L249S187-E245 PolarHBondContact OG-OE1 3Å; E188-E245 HydrophobicContact CG-CG 4.31Å; A191-E245 HydrophobicContact CB-CB 4.02Å; A191-E245 HydrophobicContact CB-CG 4.47Å; F236-E245 HydrophobicContact CD1-CB 4.05Å; F236-E245 HydrophobicContact CE1-CB 4.25Å; T243-E245 VanDerWaalsContact C-N 3.3Å; T243-E245 WeakPolarHBondContact CB-OE2 3.33Å; T243-E245 PolarHBondContact O-N 3.38Å; T243-E245 PolarHBondContact OG1-OE2 3.23Å; E245-L247 VanDerWaalsContact C-N 3.28Å; E245-L247 PolarHBondContact O-N 2.85Å; E245-H248 PolarHBondContact O-N 3.48Å; E245-L249 WeakPolarHBondContact O-CG 3.25Å; E245-L249 PolarHBondContact O-N 2.98Å; E245-L249 VanDerWaalsContact O-N 3.12Å
246G86.7Confident79.1Confident0 Ų021 Ų210%011%0.114CC..Hα-helixtrans-60.6-37.8174.800000112.5L215 T243 R244 L249 L250L215-G246 WeakPolarHBondContact CD1-O 3.21Å; T243-G246 PolarHBondContact O-N 3.26Å; T243-G246 VanDerWaalsContact O-N 3.14Å; T243-G246 PolarHBondContact OG1-N 2.79Å; R244-G246 VanDerWaalsContact C-N 3.35Å; R244-G246 PolarHBondContact O-N 2.95Å; G246-L249 PolarHBondContact O-N 3.49Å; G246-L250 WeakPolarHBondContact O-CB 3.47Å; G246-L250 PolarHBondContact O-N 2.88Å
247L88Confident80.2Confident0 Ų020.3 Ų20.30%011%0.111CC..Hα-helixtrans-70.9-37.6178.1-171.254000112.6L242 T243 R244 E245 L249 L250 M251 I396 T399 F402 W408L242-L247 HydrophobicContact CD2-CB 3.95Å; L242-L247 HydrophobicContact CD2-CD1 4.1Å; T243-L247 PolarHBondContact O-N 3.39Å; R244-L247 PolarHBondContact O-N 3.37Å; E245-L247 VanDerWaalsContact C-N 3.28Å; E245-L247 PolarHBondContact O-N 2.85Å; L247-L249 VanDerWaalsContact C-N 3.33Å; L247-L249 PolarHBondContact O-N 3.34Å; L247-L250 HydrophobicContact CD1-CB 4.47Å; L247-L250 HydrophobicContact CD1-CD2 4.08Å; L247-L250 PolarHBondContact O-N 3.49Å; L247-M251 HydrophobicContact CD1-CE 3.77Å; L247-M251 HydrophobicContact CD1-CG 4.1Å; L247-M251 HydrophobicContact CG-CE 4.45Å; L247-M251 HydrophobicContact CG-CG 4.3Å; L247-M251 VanDerWaalsContact O-CB 3.3Å; L247-M251 WeakPolarHBondContact O-CB 3.29Å; L247-M251 WeakPolarHBondContact O-CG 3.43Å; L247-M251 PolarHBondContact O-N 3.37Å; L247-I396 HydrophobicContact CD1-CG2 3.91Å; L247-T399 HydrophobicContact CD2-CG2 3.8Å; L247-F402 HydrophobicContact CD2-CD2 3.81Å; L247-F402 HydrophobicContact CD2-CE2 4.25Å; L247-W408 HydrophobicContact CB-CH2 4.27Å; L247-W408 HydrophobicContact CB-CZ2 4.17Å; L247-W408 HydrophobicContact CD2-CD2 3.78Å; L247-W408 HydrophobicContact CD2-CE3 3.35Å; L247-W408 HydrophobicContact CD2-CH2 3.71Å; L247-W408 HydrophobicContact CD2-CZ2 4.07Å; L247-W408 HydrophobicContact CD2-CZ3 3.35Å; L247-W408 HydrophobicContact CG-CD2 4.02Å; L247-W408 HydrophobicContact CG-CE3 4.1Å; L247-W408 HydrophobicContact CG-CH2 4.15Å; L247-W408 HydrophobicContact CG-CZ2 4.02Å; L247-W408 HydrophobicContact CG-CZ3 4.2Å
248H89.4Confident81.5Confident0 Ų020.1 Ų20.10%011%0.11CC..Hα-helixtrans-59.3-43.8170.9-79.7-56.4000112.3A191 M195 R244 E245 M251 S252 W408A191-H248 HydrophobicContact CB-CB 3.65Å; M195-H248 HydrophobicContact CB-CB 4.39Å; M195-H248 WeakPolarHBondContact CE-ND1 3.37Å; M195-H248 PolarHBondContact SD-ND1 2.92Å; R244-H248 PolarHBondContact O-CD2 3.22Å; R244-H248 VanDerWaalsContact O-CD2 3.22Å; R244-H248 PolarHBondContact O-N 2.81Å; E245-H248 PolarHBondContact O-N 3.48Å; H248-M251 PolarHBondContact O-N 3.04Å; H248-S252 WeakPolarHBondContact O-CB 3.47Å; H248-S252 PolarHBondContact O-N 3.1Å; H248-W408 AromaticContact CD2-CZ2 3.96Å; H248-W408 AromaticContact CE1-CE2 3.76Å; H248-W408 AromaticContact CE1-CZ2 3.35Å; H248-W408 WeakPolarHBondContact CE1-CZ2 3.22Å; H248-W408 AromaticContact CE1-NE1 3.67Å; H248-W408 AromaticContact ND1-CE2 3.94Å; H248-W408 AromaticContact ND1-CZ2 3.74Å; H248-W408 AromaticContact ND1-NE1 3.53Å; H248-W408 AromaticContact NE2-CZ2 3.49Å; H248-W408 WeakPolarHBondContact NE2-CZ2 3.4Å
249L89.8Confident82.4Confident0 Ų016.3 Ų16.30%09%0.09CC..Hα-helixtrans-67.3-38.4176.6-64.4177.3000112.1L149 L152 V194 V211 L215 F236 E245 G246 L247 S252 L253L149-L249 HydrophobicContact CD2-CD2 3.82Å; L152-L249 HydrophobicContact CD1-CD2 4.36Å; V194-L249 HydrophobicContact CB-CD2 4.24Å; V194-L249 HydrophobicContact CG1-CD2 3.96Å; V194-L249 HydrophobicContact CG2-CD2 4.42Å; V211-L249 HydrophobicContact CG1-CB 4.27Å; V211-L249 HydrophobicContact CG1-CD2 4.28Å; L215-L249 HydrophobicContact CD1-CB 4.17Å; F236-L249 HydrophobicContact CD2-CD1 4.25Å; F236-L249 HydrophobicContact CE2-CD1 3.73Å; F236-L249 HydrophobicContact CZ-CD1 4.01Å; E245-L249 WeakPolarHBondContact O-CG 3.25Å; E245-L249 PolarHBondContact O-N 2.98Å; E245-L249 VanDerWaalsContact O-N 3.12Å; G246-L249 PolarHBondContact O-N 3.49Å; L247-L249 VanDerWaalsContact C-N 3.33Å; L247-L249 PolarHBondContact O-N 3.34Å; L249-S252 PolarHBondContact O-N 3.17Å; L249-S252 PolarHBondContact O-OG 3.03Å; L249-L253 WeakPolarHBondContact O-CG 3.37Å; L249-L253 PolarHBondContact O-N 3.41Å
250L91.1Very high83.5Confident0 Ų09 Ų90%05%0.05CC..Hα-helixtrans-63.3-46.8172.4174.557.9000110.9L215 L242 G246 L247 S252 L253 L254 L317 I321 F391 I396L215-L250 HydrophobicContact CD2-CB 4.16Å; L215-L250 HydrophobicContact CD2-CD1 4.4Å; L242-L250 HydrophobicContact CD2-CD2 4.22Å; G246-L250 WeakPolarHBondContact O-CB 3.47Å; G246-L250 PolarHBondContact O-N 2.88Å; L247-L250 HydrophobicContact CD1-CB 4.47Å; L247-L250 HydrophobicContact CD1-CD2 4.08Å; L247-L250 PolarHBondContact O-N 3.49Å; L250-S252 PolarHBondContact O-N 3.21Å; L250-L253 WeakPolarHBondContact O-CB 3.49Å; L250-L253 PolarHBondContact O-N 2.89Å; L250-L254 HydrophobicContact CD1-CD1 4.09Å; L250-L254 HydrophobicContact CD1-CD2 4.47Å; L250-L254 HydrophobicContact CD1-CG 4.08Å; L250-L254 HydrophobicContact CG-CD1 3.88Å; L250-L254 HydrophobicContact CG-CG 4.31Å; L250-L254 VanDerWaalsContact O-CG 3.28Å; L250-L254 WeakPolarHBondContact O-CG 3.27Å; L250-L254 PolarHBondContact O-N 3.28Å; L250-L317 HydrophobicContact CD1-CD1 3.79Å; L250-L317 HydrophobicContact CD2-CD1 3.78Å; L250-L317 HydrophobicContact CG-CD1 4.28Å; L250-I321 HydrophobicContact CD1-CD1 4.04Å; L250-I321 HydrophobicContact CD1-CG1 3.7Å; L250-F391 HydrophobicContact CD2-CE1 4.17Å; L250-I396 HydrophobicContact CD2-CD1 3.74Å; L250-I396 HydrophobicContact CD2-CG1 4.17Å
251M91.2Very high84Confident0 Ų08.8 Ų8.80%05%0.045CC..Hα-helixtrans-64.5-31.7-179.5-71.5-71.8174.800111.9M195 L247 H248 L254 H255 I396 F402 W408 R411 M412M195-M251 HydrophobicContact CG-CB 4.21Å; M195-M251 HydrophobicContact SD-CB 3.99Å; L247-M251 HydrophobicContact CD1-CE 3.77Å; L247-M251 HydrophobicContact CD1-CG 4.1Å; L247-M251 HydrophobicContact CG-CE 4.45Å; L247-M251 HydrophobicContact CG-CG 4.3Å; L247-M251 VanDerWaalsContact O-CB 3.3Å; L247-M251 WeakPolarHBondContact O-CB 3.29Å; L247-M251 WeakPolarHBondContact O-CG 3.43Å; L247-M251 PolarHBondContact O-N 3.37Å; H248-M251 PolarHBondContact O-N 3.04Å; M251-L254 HydrophobicContact CE-CD1 4.4Å; M251-L254 PolarHBondContact O-N 3.49Å; M251-L254 HydrophobicContact SD-CD1 3.92Å; M251-H255 WeakPolarHBondContact O-CB 3.1Å; M251-H255 PolarHBondContact O-CD2 3.18Å; M251-H255 PolarHBondContact O-N 3Å; M251-I396 HydrophobicContact CE-CG2 4.26Å; M251-F402 HydrophobicContact CE-CE2 4.04Å; M251-W408 HydrophobicContact CE-CB 3.81Å; M251-W408 HydrophobicContact CE-CG 4.11Å; M251-W408 HydrophobicContact CG-CB 4.49Å; M251-W408 VanDerWaalsContact CG-CD1 3.44Å; M251-W408 HydrophobicContact CG-CG 3.94Å; M251-W408 HydrophobicContact SD-CB 4.24Å; M251-W408 HydrophobicContact SD-CG 4.32Å; M251-R411 HydrophobicContact SD-CB 4.06Å; M251-R411 HydrophobicContact SD-CG 4.24Å; M251-M412 HydrophobicContact CE-CG 4.04Å; M251-M412 HydrophobicContact CE-SD 4.23Å
252S90.2Very high83.8Confident0 Ų06.3 Ų6.30%04%0.037CC..Hα-helixtrans-65.7-41.1175.376.40000112.5S198 V211 H248 L249 L250 C256S198-S252 WeakPolarHBondContact CB-O 3.26Å; S198-S252 WeakPolarHBondContact OG-CA 3.34Å; S198-S252 VanDerWaalsContact OG-CB 3.24Å; S198-S252 WeakPolarHBondContact OG-CB 3.29Å; S198-S252 PolarHBondContact OG-O 3.46Å; V211-S252 WeakPolarHBondContact CG1-OG 3.47Å; H248-S252 WeakPolarHBondContact O-CB 3.47Å; H248-S252 PolarHBondContact O-N 3.1Å; L249-S252 PolarHBondContact O-N 3.17Å; L249-S252 PolarHBondContact O-OG 3.03Å; L250-S252 PolarHBondContact O-N 3.21Å; S252-C256 WeakPolarHBondContact O-CB 3.26Å; S252-C256 PolarHBondContact O-N 3.21Å; S252-C256 VanDerWaalsContact O-N 3.11Å
253L91.4Very high83.2Confident0 Ų06.3 Ų6.30%04%0.037CC..Hα-helixtrans-64-44.8171.1-62.5174000110.9F208 V211 L212 L215 L249 L250 H255 C256 L257 I321F208-L253 HydrophobicContact CD1-CD2 4.33Å; F208-L253 HydrophobicContact CD2-CD2 3.6Å; F208-L253 HydrophobicContact CE1-CD2 4.29Å; F208-L253 HydrophobicContact CE2-CB 4.17Å; F208-L253 HydrophobicContact CE2-CD2 3.57Å; F208-L253 HydrophobicContact CE2-CG 4.46Å; F208-L253 HydrophobicContact CG-CD2 4Å; F208-L253 HydrophobicContact CZ-CD2 3.93Å; V211-L253 HydrophobicContact CB-CD2 3.83Å; V211-L253 HydrophobicContact CB-CG 4.41Å; V211-L253 HydrophobicContact CG1-CD1 4.15Å; V211-L253 HydrophobicContact CG1-CD2 3.67Å; V211-L253 HydrophobicContact CG1-CG 3.68Å; L212-L253 HydrophobicContact CB-CD1 4.27Å; L212-L253 HydrophobicContact CD1-CD1 3.71Å; L215-L253 HydrophobicContact CD2-CD1 3.97Å; L249-L253 WeakPolarHBondContact O-CG 3.37Å; L249-L253 PolarHBondContact O-N 3.41Å; L250-L253 WeakPolarHBondContact O-CB 3.49Å; L250-L253 PolarHBondContact O-N 2.89Å; L253-H255 PolarHBondContact O-N 2.74Å; L253-C256 WeakPolarHBondContact O-CB 3.24Å; L253-C256 PolarHBondContact O-N 2.81Å; L253-L257 WeakPolarHBondContact O-CG 3.47Å; L253-L257 PolarHBondContact O-N 3.48Å; L253-I321 HydrophobicContact CD1-CD1 3.94Å
254L91.1Very high82Confident0 Ų07.1 Ų7.10%04%0.042CC..Hα-helixtrans-65.1-38.9-178.2-65.8172.4000112.5L250 M251 L257 Q258 F320 S324 R411 I415L250-L254 HydrophobicContact CD1-CD1 4.09Å; L250-L254 HydrophobicContact CD1-CD2 4.47Å; L250-L254 HydrophobicContact CD1-CG 4.08Å; L250-L254 HydrophobicContact CG-CD1 3.88Å; L250-L254 HydrophobicContact CG-CG 4.31Å; L250-L254 VanDerWaalsContact O-CG 3.28Å; L250-L254 WeakPolarHBondContact O-CG 3.27Å; L250-L254 PolarHBondContact O-N 3.28Å; M251-L254 HydrophobicContact CE-CD1 4.4Å; M251-L254 PolarHBondContact O-N 3.49Å; M251-L254 HydrophobicContact SD-CD1 3.92Å; L254-L257 PolarHBondContact O-N 3.01Å; L254-Q258 PolarHBondContact O-N 3.05Å; L254-F320 HydrophobicContact CD1-CD1 4.19Å; L254-F320 HydrophobicContact CD1-CE1 3.62Å; L254-F320 HydrophobicContact CD2-CD1 4.22Å; L254-F320 HydrophobicContact CD2-CE1 4.1Å; L254-S324 VanDerWaalsContact CD2-CB 3.46Å; L254-R411 HydrophobicContact CB-CG 3.91Å; L254-R411 PolarHBondContact O-NE 3.44Å; L254-R411 PolarHBondContact O-NH2 3.19Å; L254-I415 HydrophobicContact CD1-CD1 4.28Å; L254-I415 HydrophobicContact CD2-CD1 4.17Å
255H87.3Confident80.7Confident5 Ų58.1 Ų8.12%0.0235%0.048CC..Hα-helixtrans-69.2-35.5175.8-80.1-62.4000112.1C199 M251 L253 L257 Q258 L407C199-H255 PolarHBondContact SG-CD2 3.31Å; M251-H255 WeakPolarHBondContact O-CB 3.1Å; M251-H255 PolarHBondContact O-CD2 3.18Å; M251-H255 PolarHBondContact O-N 3Å; L253-H255 PolarHBondContact O-N 2.74Å; H255-L257 PolarHBondContact O-N 2.71Å; H255-Q258 WeakPolarHBondContact O-CB 3.48Å; H255-Q258 PolarHBondContact O-N 3.06Å; H255-L407 PolarHBondContact NE2-O 3.47Å
256C87.2Confident79.4Confident0 Ų08.9 Ų8.90%06%0.056CC..Hα-helixtrans-59.1-30.5169.6-178.40000112.6V202 L203 F208 S252 L253 H280V202-C256 HydrophobicContact CG1-CB 4.48Å; V202-C256 VanDerWaalsContact CG1-SG 3.55Å; L203-C256 HydrophobicContact CB-CB 4.44Å; L203-C256 HydrophobicContact CD1-CB 4.39Å; L203-C256 HydrophobicContact CG-CB 4.38Å; F208-C256 HydrophobicContact CD2-CB 4.33Å; S252-C256 WeakPolarHBondContact O-CB 3.26Å; S252-C256 PolarHBondContact O-N 3.21Å; S252-C256 VanDerWaalsContact O-N 3.11Å; L253-C256 WeakPolarHBondContact O-CB 3.24Å; L253-C256 PolarHBondContact O-N 2.81Å; C256-H280 PolarHBondContact O-CE1 3.05Å; C256-H280 PolarHBondContact O-NE2 2.97Å
257L86.5Confident77.9Confident1 Ų19.1 Ų9.11%0.0056%0.058CC..THydrogen-bonded Turntrans-87.51.7176.2-56.4177.1000113.9F208 L253 L254 H255 I292 I321 W325 C328 R411F208-L257 HydrophobicContact CE2-CD2 3.99Å; F208-L257 HydrophobicContact CE2-CG 4.27Å; F208-L257 HydrophobicContact CZ-CD2 4.3Å; L253-L257 WeakPolarHBondContact O-CG 3.47Å; L253-L257 PolarHBondContact O-N 3.48Å; L254-L257 PolarHBondContact O-N 3.01Å; H255-L257 PolarHBondContact O-N 2.71Å; L257-I292 HydrophobicContact CD2-CD1 4.12Å; L257-I321 HydrophobicContact CD1-CG2 3.96Å; L257-W325 HydrophobicContact CD1-CB 4.13Å; L257-W325 HydrophobicContact CD2-CE3 3.78Å; L257-W325 HydrophobicContact CD2-CZ3 4.37Å; L257-C328 WeakPolarHBondContact O-CB 3.43Å; L257-C328 PolarHBondContact O-SG 2.85Å; L257-R411 PolarHBondContact O-NH2 2.83Å
258Q84.7Confident76.5Confident5 Ų513.7 Ų13.72%0.0238%0.082CC..  trans-78.9130.9167.4-178.666.5-4.900107.5R118 L254 H255 F260 H280R118-Q258 PolarHBondContact NH1-O 3.25Å; R118-Q258 PolarHBondContact NH2-O 3.22Å; L254-Q258 PolarHBondContact O-N 3.05Å; H255-Q258 WeakPolarHBondContact O-CB 3.48Å; H255-Q258 PolarHBondContact O-N 3.06Å; Q258-F260 WeakPolarHBondContact CG-O 3.38Å; Q258-H280 PolarHBondContact O-NE2 3.47Å; Q258-H280 VanDerWaalsContact O-NE2 3.09Å
259P76.4Confident75.1Confident0 Ų019 Ų190%011%0.107CC..  trans-89-25-176.630-32.7000115.9L282 R331 T332P259-L282 HydrophobicContact CB-CD1 4.31Å; P259-R331 HydrophobicContact CG-CB 4.04Å; P259-T332 HydrophobicContact CB-CG2 3.35Å; P259-T332 HydrophobicContact CG-CG2 3.9Å
260F78.1Confident73.9Confident2 Ų219.6 Ų19.61%0.00911%0.111CC..SBendtrans-121.4148.4-177.6-45.8-63.2000113R118 Q258 L265 A267 L273 Y283 R331 T332 L335R118-F260 PolarHBondContact NH2-O 3.44Å; Q258-F260 WeakPolarHBondContact CG-O 3.38Å; F260-L265 HydrophobicContact CB-CB 4.27Å; F260-L265 WeakPolarHBondContact CD2-O 3.47Å; F260-A267 HydrophobicContact CD1-CB 4.41Å; F260-A267 HydrophobicContact CE1-CB 3.88Å; F260-A267 HydrophobicContact CZ-CB 4.12Å; F260-L273 HydrophobicContact CD1-CD2 3.68Å; F260-L273 HydrophobicContact CE1-CD2 3.61Å; F260-Y283 WeakPolarHBondContact CE1-OH 3.42Å; F260-R331 HydrophobicContact CE2-CB 4.15Å; F260-T332 HydrophobicContact CZ-CG2 4.37Å; F260-L335 HydrophobicContact CE1-CD1 3.61Å; F260-L335 HydrophobicContact CZ-CD1 3.75Å
261S67.8Low72.5Confident22 Ų2223.8 Ų23.815%0.15414%0.14CC..SBendtrans-56.8-47.917745.50000113.9R118 M119 D277R118-S261 WeakPolarHBondContact O-CB 3.36Å; M119-S261 VanDerWaalsContact SD-O 3.41Å; S261-D277 VanDerWaalsContact CB-OD1 3.29Å; S261-D277 WeakPolarHBondContact CB-OD1 3.15Å; S261-D277 PolarHBondContact N-OD1 2.96Å; S261-D277 PolarHBondContact OG-OD1 3.35Å; S261-D277 PolarHBondContact OG-OD2 3.25Å
262S65.3Low71.4Confident37 Ų3726.3 Ų26.326%0.25915%0.153SC..SBendtrans-97.9143.7171.2175.50000111.3T264S262-T264 VanDerWaalsContact C-N 3.33Å; S262-T264 PolarHBondContact OG-N 3.07Å; S262-T264 PolarHBondContact OG-OG1 3.05Å
263N60.9Low70.4Confident5 Ų527 Ų273%0.02716%0.157CC..SBendtrans-72.3-28.2175.3-171.934.8000112.7L265 R331 Y410 C414 R528N263-L265 VanDerWaalsContact C-N 3.28Å; N263-L265 PolarHBondContact O-N 3.28Å; N263-R331 PolarHBondContact O-NH2 3.38Å; N263-R331 PolarHBondContact OD1-NH1 3.45Å; N263-R331 VanDerWaalsContact OD1-NH1 3.08Å; N263-Y410 HydrophobicContact CB-CE1 4.44Å; N263-Y410 HydrophobicContact CB-CE2 4.46Å; N263-Y410 WeakPolarHBondContact CB-OH 3.42Å; N263-Y410 PolarHBondContact N-OH 3.16Å; N263-C414 PolarHBondContact ND2-SG 3.47Å; N263-R528 VanDerWaalsContact ND2-CZ 3.34Å; N263-R528 PolarHBondContact ND2-NH1 3.12Å; N263-R528 PolarHBondContact ND2-NH2 3.47Å; N263-R528 PolarHBondContact O-NH1 2.77Å; N263-R528 PolarHBondContact OD1-NH1 2.9Å
264T53.9Low69.4Low37 Ų3729.8 Ų29.823%0.22717%0.174CC..SBendtrans-74.1-19.1178.856.20000113.1S262 C266 D525S262-T264 VanDerWaalsContact C-N 3.33Å; S262-T264 PolarHBondContact OG-N 3.07Å; S262-T264 PolarHBondContact OG-OG1 3.05Å; T264-C266 PolarHBondContact O-N 2.78Å; T264-D525 VanDerWaalsContact CB-OD1 3.25Å; T264-D525 WeakPolarHBondContact CB-OD1 3.38Å; T264-D525 WeakPolarHBondContact CG2-OD1 3.31Å
265L54.2Low68.3Low29 Ų2936.7 Ų36.715%0.15221%0.211CC..  trans-68107.3176.1-70.5163.6000110.1F260 N263 R331F260-L265 HydrophobicContact CB-CB 4.27Å; F260-L265 WeakPolarHBondContact CD2-O 3.47Å; N263-L265 VanDerWaalsContact C-N 3.28Å; N263-L265 PolarHBondContact O-N 3.28Å; L265-R331 PolarHBondContact O-NH2 3.47Å
266C55.5Low67.6Low43 Ų4340.3 Ų40.329%0.29123%0.23SC..  trans-98.392.6154.6-158.10000106.4T264 D268 L524T264-C266 PolarHBondContact O-N 2.78Å; C266-D268 VanDerWaalsContact C-N 3.32Å; C266-D268 PolarHBondContact O-N 2.75Å; C266-L524 HydrophobicContact CB-CD2 3.75Å
267A56.3Low66.9Low6 Ų640.4 Ų40.45%0.0523%0.23CC..  trans-73.890.217700000108.9F260 Q269 D272 L273 L335F260-A267 HydrophobicContact CD1-CB 4.41Å; F260-A267 HydrophobicContact CE1-CB 3.88Å; F260-A267 HydrophobicContact CZ-CB 4.12Å; A267-Q269 VanDerWaalsContact C-N 3.32Å; A267-D272 HydrophobicContact CB-CB 3.94Å; A267-L273 HydrophobicContact CB-CD2 3.92Å; A267-L273 HydrophobicContact CB-CG 4.3Å; A267-L335 HydrophobicContact CB-CD1 3.88Å; A267-L335 WeakPolarHBondContact O-CD1 3.44Å; A267-L335 WeakPolarHBondContact O-CD2 3.49Å; A267-L335 VanDerWaalsContact O-CG 3.31Å; A267-L335 WeakPolarHBondContact O-CG 3.19Å
268D58.5Low66.3Low95 Ų9544.2 Ų44.251%0.50825%0.245SC..  trans-71.7-35.1172-75.9-10.4000109.8C266 H334C266-D268 VanDerWaalsContact C-N 3.32Å; C266-D268 PolarHBondContact O-N 2.75Å; D268-H334 PolarHBondContact O-CE1 3.07Å; D268-H334 PolarHBondContact O-ND1 3.23Å
269Q60.3Low65.8Low112 Ų11248.5 Ų48.552%0.52327%0.271SS..SBendtrans-111.4145.6179.3-58.6-176.318.600111.2A267 S271 D272A267-Q269 VanDerWaalsContact C-N 3.32Å; Q269-S271 WeakPolarHBondContact CB-OG 3.33Å; Q269-S271 PolarHBondContact O-N 3.25Å; Q269-D272 PolarHBondContact N-OD2 2.95Å; Q269-D272 WeakPolarHBondContact O-CB 3.4Å; Q269-D272 PolarHBondContact O-N 3.47Å
270V63.6Low66Low13 Ų1348.5 Ų48.58%0.07927%0.271CS..G310 helixtrans-56.6-24175.9177.20000112.3D272 W278 L335 E338V270-D272 VanDerWaalsContact C-N 3.31Å; V270-W278 HydrophobicContact CG1-CH2 3.43Å; V270-W278 VanDerWaalsContact CG1-CH2 3.43Å; V270-W278 HydrophobicContact CG1-CZ2 3.25Å; V270-L335 HydrophobicContact CG2-CD2 4.07Å; V270-E338 HydrophobicContact CG2-CB 4.44Å; V270-E338 HydrophobicContact CG2-CG 3.82Å
271S62.2Low66Low87 Ų8748.9 Ų48.961%0.60827%0.274SS*.G310 helixtrans-73.8-16.2175.549.40000114.8Q269 L273Q269-S271 WeakPolarHBondContact CB-OG 3.33Å; Q269-S271 PolarHBondContact O-N 3.25Å; S271-L273 VanDerWaalsContact C-N 3.3Å
272D67.3Low66.4Low53 Ų5348.7 Ų48.728%0.28327%0.271SS..G310 helixtrans-84.6-12.7-176.8-52.8-28.8000111.6A267 Q269 V270A267-D272 HydrophobicContact CB-CB 3.94Å; Q269-D272 PolarHBondContact N-OD2 2.95Å; Q269-D272 WeakPolarHBondContact O-CB 3.4Å; Q269-D272 PolarHBondContact O-N 3.47Å; V270-D272 VanDerWaalsContact C-N 3.31Å
273L69.8Low67Low14 Ų1448.4 Ų48.47%0.07326%0.264CS..SBendtrans-73.8130.9175.9-65.9173.3000110.5F260 A267 S271 D277 W278 L335F260-L273 HydrophobicContact CD1-CD2 3.68Å; F260-L273 HydrophobicContact CE1-CD2 3.61Å; A267-L273 HydrophobicContact CB-CD2 3.92Å; A267-L273 HydrophobicContact CB-CG 4.3Å; S271-L273 VanDerWaalsContact C-N 3.3Å; L273-D277 HydrophobicContact CB-CB 4.36Å; L273-D277 HydrophobicContact CD2-CB 3.99Å; L273-W278 HydrophobicContact CD1-CD2 4.23Å; L273-W278 HydrophobicContact CD1-CH2 4.13Å; L273-W278 HydrophobicContact CD1-CZ2 3.77Å; L273-W278 HydrophobicContact CD1-CZ3 4.48Å; L273-L335 HydrophobicContact CD1-CD1 4.3Å; L273-L335 HydrophobicContact CD2-CD1 4.12Å; L273-L335 HydrophobicContact CG-CD1 4.45Å
274T70.1Confident67.6Low59 Ų5952.5 Ų52.536%0.36229%0.29SS..  trans-72.1158169.167.10000110.5I276 D277 W278T274-I276 PolarHBondContact O-N 3.11Å; T274-I276 VanDerWaalsContact O-N 3.11Å; T274-D277 WeakPolarHBondContact CB-OD2 3.38Å; T274-D277 PolarHBondContact N-OD2 2.7Å; T274-D277 WeakPolarHBondContact O-CB 2.94Å; T274-D277 PolarHBondContact O-N 3.48Å; T274-D277 PolarHBondContact OG1-N 3.43Å; T274-D277 PolarHBondContact OG1-OD2 2.63Å; T274-W278 VanDerWaalsContact O-CD1 3.29Å; T274-W278 PolarHBondContact O-N 2.78Å
275D69.6Low68.6Low145 Ų14553.6 Ų53.678%0.77530%0.295SS*.THydrogen-bonded Turntrans-55.6-29.2175.1-69-29.7000112.2
276I71.4Confident69.4Low82 Ų8260.4 Ų60.442%0.42132%0.318SS..THydrogen-bonded Turntrans-72.2-40.4176.6-56.5169.9000110.7R118 T274 W278 T279R118-I276 HydrophobicContact CB-CG2 3.94Å; R118-I276 HydrophobicContact CG-CG2 4.25Å; T274-I276 PolarHBondContact O-N 3.11Å; T274-I276 VanDerWaalsContact O-N 3.11Å; I276-W278 PolarHBondContact O-N 2.86Å; I276-T279 WeakPolarHBondContact O-CB 3.42Å; I276-T279 PolarHBondContact O-N 3.17Å; I276-T279 VanDerWaalsContact O-N 3.11Å; I276-T279 PolarHBondContact O-OG1 2.64Å
277D73.7Confident70.4Confident1 Ų162.3 Ų62.31%0.00533%0.329CS..G310 helixtrans-62.7-33177.6-60.3-51000111.7S261 L273 T274 T279 H280 Y283S261-D277 VanDerWaalsContact CB-OD1 3.29Å; S261-D277 WeakPolarHBondContact CB-OD1 3.15Å; S261-D277 PolarHBondContact N-OD1 2.96Å; S261-D277 PolarHBondContact OG-OD1 3.35Å; S261-D277 PolarHBondContact OG-OD2 3.25Å; L273-D277 HydrophobicContact CB-CB 4.36Å; L273-D277 HydrophobicContact CD2-CB 3.99Å; T274-D277 WeakPolarHBondContact CB-OD2 3.38Å; T274-D277 PolarHBondContact N-OD2 2.7Å; T274-D277 WeakPolarHBondContact O-CB 2.94Å; T274-D277 PolarHBondContact O-N 3.48Å; T274-D277 PolarHBondContact OG1-N 3.43Å; T274-D277 PolarHBondContact OG1-OD2 2.63Å; D277-T279 PolarHBondContact O-N 3Å; D277-H280 VanDerWaalsContact O-CB 3.24Å; D277-H280 WeakPolarHBondContact O-CB 3Å; D277-H280 PolarHBondContact O-N 3.43Å; D277-H280 VanDerWaalsContact O-N 3.14Å; D277-Y283 WeakPolarHBondContact O-CD2 3.43Å
278W74Confident71.6Confident81 Ų8162.1 Ų62.131%0.30733%0.327SS..G310 helixtrans-62.7-23.9175.4-79.9108.8000114.7V270 L273 T274 I276 H280 T284 L339V270-W278 HydrophobicContact CG1-CH2 3.43Å; V270-W278 VanDerWaalsContact CG1-CH2 3.43Å; V270-W278 HydrophobicContact CG1-CZ2 3.25Å; L273-W278 HydrophobicContact CD1-CD2 4.23Å; L273-W278 HydrophobicContact CD1-CH2 4.13Å; L273-W278 HydrophobicContact CD1-CZ2 3.77Å; L273-W278 HydrophobicContact CD1-CZ3 4.48Å; T274-W278 VanDerWaalsContact O-CD1 3.29Å; T274-W278 PolarHBondContact O-N 2.78Å; I276-W278 PolarHBondContact O-N 2.86Å; W278-H280 PolarHBondContact O-N 3.04Å; W278-T284 VanDerWaalsContact O-CG2 3.31Å; W278-T284 WeakPolarHBondContact O-CG2 3.4Å; W278-L339 HydrophobicContact CH2-CD1 4.46Å; W278-L339 HydrophobicContact CH2-CD2 3.84Å; W278-L339 HydrophobicContact CZ3-CD1 4.16Å; W278-L339 HydrophobicContact CZ3-CD2 4.02Å
279T72.9Confident72.6Confident95 Ų9558.8 Ų58.858%0.58331%0.312SS*.G310 helixtrans-71.8-12.7177.568.40000112.8I276 D277I276-T279 WeakPolarHBondContact O-CB 3.42Å; I276-T279 PolarHBondContact O-N 3.17Å; I276-T279 VanDerWaalsContact O-N 3.11Å; I276-T279 PolarHBondContact O-OG1 2.64Å; D277-T279 PolarHBondContact O-N 3Å
280H80.6Confident73.5Confident1 Ų155.1 Ų55.11%0.00530%0.301CS..SBendtrans-61.5132-177.6-164.2-43.1000111.7R118 C256 Q258 D277 W278 L282 Y283 T284R118-H280 PolarHBondContact NH1-CD2 2.98Å; R118-H280 VanDerWaalsContact NH1-CD2 3.33Å; C256-H280 PolarHBondContact O-CE1 3.05Å; C256-H280 PolarHBondContact O-NE2 2.97Å; Q258-H280 PolarHBondContact O-NE2 3.47Å; Q258-H280 VanDerWaalsContact O-NE2 3.09Å; D277-H280 VanDerWaalsContact O-CB 3.24Å; D277-H280 WeakPolarHBondContact O-CB 3Å; D277-H280 PolarHBondContact O-N 3.43Å; D277-H280 VanDerWaalsContact O-N 3.14Å; W278-H280 PolarHBondContact O-N 3.04Å; H280-L282 WeakPolarHBondContact CE1-CD1 3.48Å; H280-L282 VanDerWaalsContact CE1-CG 3.45Å; H280-L282 WeakPolarHBondContact CE1-CG 3.44Å; H280-L282 PolarHBondContact ND1-N 3.29Å; H280-L282 VanDerWaalsContact ND1-N 3.18Å; H280-L282 PolarHBondContact O-N 2.89Å; H280-Y283 HydrophobicContact CB-CD2 3.88Å; H280-Y283 HydrophobicContact CB-CE2 4.11Å; H280-Y283 PolarHBondContact O-N 3.44Å; H280-T284 PolarHBondContact O-N 2.94Å; H280-T284 PolarHBondContact O-OG1 2.65Å
281P78.7Confident74.5Confident10 Ų1055.7 Ų55.77%0.06531%0.306CS..Hα-helixtrans-47.8-25.1174.4-33.335.6000116.1V202 Y283 T284 D285 F288V202-P281 HydrophobicContact CB-CG 4.32Å; V202-P281 HydrophobicContact CG1-CG 3.98Å; P281-Y283 VanDerWaalsContact C-N 3.27Å; P281-Y283 PolarHBondContact O-N 2.86Å; P281-T284 VanDerWaalsContact CA-OG1 3.29Å; P281-T284 WeakPolarHBondContact CA-OG1 3.25Å; P281-D285 PolarHBondContact O-N 2.76Å; P281-F288 HydrophobicContact CB-CB 4.44Å; P281-F288 HydrophobicContact CB-CD1 3.93Å; P281-F288 HydrophobicContact CB-CD2 3.63Å; P281-F288 HydrophobicContact CB-CE1 3.96Å; P281-F288 HydrophobicContact CB-CE2 3.67Å; P281-F288 HydrophobicContact CB-CG 3.75Å; P281-F288 HydrophobicContact CB-CZ 3.81Å; P281-F288 HydrophobicContact CG-CE2 4.33Å; P281-F288 HydrophobicContact CG-CZ 4.42Å
282L75.7Confident75.6Confident17 Ų1751.5 Ų51.59%0.08928%0.277CS..Hα-helixtrans-66.5-28.4178.1-74.2168000113.3P259 H280 F288 A289 W325 C328P259-L282 HydrophobicContact CB-CD1 4.31Å; H280-L282 WeakPolarHBondContact CE1-CD1 3.48Å; H280-L282 VanDerWaalsContact CE1-CG 3.45Å; H280-L282 WeakPolarHBondContact CE1-CG 3.44Å; H280-L282 PolarHBondContact ND1-N 3.29Å; H280-L282 VanDerWaalsContact ND1-N 3.18Å; H280-L282 PolarHBondContact O-N 2.89Å; L282-F288 HydrophobicContact CD2-CD1 3.64Å; L282-F288 HydrophobicContact CD2-CE1 3.93Å; L282-F288 HydrophobicContact CG-CD1 3.95Å; L282-F288 HydrophobicContact CG-CE1 3.98Å; L282-A289 HydrophobicContact CD2-CB 4.39Å; L282-W325 HydrophobicContact CD2-CH2 3.7Å; L282-W325 HydrophobicContact CD2-CZ3 3.7Å; L282-C328 WeakPolarHBondContact CD1-SG 3.13Å
283Y78.4Confident76.4Confident31 Ų3149.6 Ų49.612%0.12227%0.269CS..Hα-helixtrans-102-27.3-179.4-51.3-58.8000112F260 D277 H280 P281 T332 L339F260-Y283 WeakPolarHBondContact CE1-OH 3.42Å; D277-Y283 WeakPolarHBondContact O-CD2 3.43Å; H280-Y283 HydrophobicContact CB-CD2 3.88Å; H280-Y283 HydrophobicContact CB-CE2 4.11Å; H280-Y283 PolarHBondContact O-N 3.44Å; P281-Y283 VanDerWaalsContact C-N 3.27Å; P281-Y283 PolarHBondContact O-N 2.86Å; Y283-T332 HydrophobicContact CE1-CG2 4.37Å; Y283-T332 WeakPolarHBondContact OH-CG2 3.46Å; Y283-L339 HydrophobicContact CD1-CD1 4Å
284T73.4Confident77.1Confident92 Ų9255.4 Ų55.456%0.56429%0.29SS*.Hα-helixtrans-87.5-44.2-178.857.60000112.8W278 H280 P281W278-T284 VanDerWaalsContact O-CG2 3.31Å; W278-T284 WeakPolarHBondContact O-CG2 3.4Å; H280-T284 PolarHBondContact O-N 2.94Å; H280-T284 PolarHBondContact O-OG1 2.65Å; P281-T284 VanDerWaalsContact CA-OG1 3.29Å; P281-T284 WeakPolarHBondContact CA-OG1 3.25Å
285D74Confident77.9Confident60 Ų6053.6 Ų53.632%0.32128%0.278SS..  trans-106.1110.6-178.1178.56.4000111.7P281 T287 F288P281-D285 PolarHBondContact O-N 2.76Å; D285-T287 PolarHBondContact O-N 3.28Å; D285-T287 PolarHBondContact OD1-N 3.21Å; D285-T287 PolarHBondContact OD1-OG1 2.88Å; D285-T287 PolarHBondContact OD2-OG1 3.38Å; D285-F288 HydrophobicContact CB-CB 4.01Å; D285-F288 WeakPolarHBondContact O-CB 3.05Å; D285-F288 PolarHBondContact O-N 3.16Å
286R70.7Confident78.6Confident171 Ų17146.9 Ų46.965%0.64524%0.243SC*.THydrogen-bonded Turntrans-62.1-25.8179.7-66.4-176.9177.1176.70.1113.5
287T77.5Confident79.2Confident84 Ų8445.9 Ų45.952%0.51524%0.238SC..THydrogen-bonded Turntrans-90.4-13.3-177.367.10000112.9D285 A289 A290 S291D285-T287 PolarHBondContact O-N 3.28Å; D285-T287 PolarHBondContact OD1-N 3.21Å; D285-T287 PolarHBondContact OD1-OG1 2.88Å; D285-T287 PolarHBondContact OD2-OG1 3.38Å; T287-A289 PolarHBondContact O-N 3.34Å; T287-A290 PolarHBondContact O-N 2.81Å; T287-S291 WeakPolarHBondContact O-CB 3.32Å; T287-S291 PolarHBondContact O-N 3.32Å; T287-S291 PolarHBondContact O-OG 3.24Å
288F80.9Confident79.7Confident2 Ų250.6 Ų50.61%0.00926%0.263CS..Hα-helixtrans-58.1-47.4-176-175.4-102.1000112.4L205 P281 L282 D285 S291 I292L205-F288 HydrophobicContact CB-CD2 4.32Å; P281-F288 HydrophobicContact CB-CB 4.44Å; P281-F288 HydrophobicContact CB-CD1 3.93Å; P281-F288 HydrophobicContact CB-CD2 3.63Å; P281-F288 HydrophobicContact CB-CE1 3.96Å; P281-F288 HydrophobicContact CB-CE2 3.67Å; P281-F288 HydrophobicContact CB-CG 3.75Å; P281-F288 HydrophobicContact CB-CZ 3.81Å; P281-F288 HydrophobicContact CG-CE2 4.33Å; P281-F288 HydrophobicContact CG-CZ 4.42Å; L282-F288 HydrophobicContact CD2-CD1 3.64Å; L282-F288 HydrophobicContact CD2-CE1 3.93Å; L282-F288 HydrophobicContact CG-CD1 3.95Å; L282-F288 HydrophobicContact CG-CE1 3.98Å; D285-F288 HydrophobicContact CB-CB 4.01Å; D285-F288 WeakPolarHBondContact O-CB 3.05Å; D285-F288 PolarHBondContact O-N 3.16Å; F288-S291 WeakPolarHBondContact CA-OG 3.44Å; F288-S291 PolarHBondContact O-N 3.36Å; F288-S291 PolarHBondContact O-OG 3.47Å; F288-I292 HydrophobicContact CD1-CD1 3.87Å; F288-I292 HydrophobicContact CD2-CD1 4.36Å; F288-I292 HydrophobicContact CE1-CD1 3.32Å; F288-I292 HydrophobicContact CE1-CG1 4.49Å; F288-I292 HydrophobicContact CE2-CD1 3.88Å; F288-I292 HydrophobicContact CG-CD1 4.37Å; F288-I292 HydrophobicContact CZ-CD1 3.34Å; F288-I292 HydrophobicContact CZ-CG1 4.42Å; F288-I292 WeakPolarHBondContact O-CG1 3.08Å; F288-I292 PolarHBondContact O-N 3.04Å
289A79.1Confident80.1Confident24 Ų2448 Ų4820%0.19826%0.255CS..Hα-helixtrans-64.3-47.9-18000000112.9L282 T287 S291 G293 W325 L329L282-A289 HydrophobicContact CD2-CB 4.39Å; T287-A289 PolarHBondContact O-N 3.34Å; A289-S291 VanDerWaalsContact C-N 3.32Å; A289-S291 PolarHBondContact O-N 3.18Å; A289-G293 PolarHBondContact O-N 3.43Å; A289-W325 HydrophobicContact CB-CH2 3.61Å; A289-W325 HydrophobicContact CB-CZ2 3.81Å; A289-W325 VanDerWaalsContact O-CZ2 3.23Å; A289-W325 WeakPolarHBondContact O-CZ2 3.4Å; A289-L329 HydrophobicContact CB-CD2 4.47Å
290A80.2Confident80.5Confident36 Ų3646.4 Ų46.430%0.29824%0.238SC..Hα-helixtrans-66.5-35.6179.200000112T287 R294T287-A290 PolarHBondContact O-N 2.81Å; A290-R294 WeakPolarHBondContact O-CB 3.45Å; A290-R294 VanDerWaalsContact O-CG 3.32Å; A290-R294 WeakPolarHBondContact O-CG 3.44Å; A290-R294 PolarHBondContact O-N 2.95Å
291S84.4Confident80.4Confident24 Ų2448.6 Ų48.617%0.16825%0.253CS..Hα-helixtrans-72-40.218057.40000112.7L205 T287 F288 A289 R294 L295L205-S291 VanDerWaalsContact CD1-OG 3.28Å; L205-S291 WeakPolarHBondContact CD1-OG 3.38Å; L205-S291 WeakPolarHBondContact CD2-OG 3.43Å; T287-S291 WeakPolarHBondContact O-CB 3.32Å; T287-S291 PolarHBondContact O-N 3.32Å; T287-S291 PolarHBondContact O-OG 3.24Å; F288-S291 WeakPolarHBondContact CA-OG 3.44Å; F288-S291 PolarHBondContact O-N 3.36Å; F288-S291 PolarHBondContact O-OG 3.47Å; A289-S291 VanDerWaalsContact C-N 3.32Å; A289-S291 PolarHBondContact O-N 3.18Å; S291-R294 PolarHBondContact O-N 3Å; S291-L295 WeakPolarHBondContact O-CB 3.13Å; S291-L295 PolarHBondContact O-N 3.45Å
292I85Confident80.3Confident0 Ų052.1 Ų52.10%027%0.271CS..Hα-helixtrans-60.2-46.8171.5-71.9179.3000110.4L205 F208 L257 F288 R294 L295 L296 W325L205-I292 HydrophobicContact CD1-CG1 4.18Å; F208-I292 HydrophobicContact CE1-CG2 4.49Å; L257-I292 HydrophobicContact CD2-CD1 4.12Å; F288-I292 HydrophobicContact CD1-CD1 3.87Å; F288-I292 HydrophobicContact CD2-CD1 4.36Å; F288-I292 HydrophobicContact CE1-CD1 3.32Å; F288-I292 HydrophobicContact CE1-CG1 4.49Å; F288-I292 HydrophobicContact CE2-CD1 3.88Å; F288-I292 HydrophobicContact CG-CD1 4.37Å; F288-I292 HydrophobicContact CZ-CD1 3.34Å; F288-I292 HydrophobicContact CZ-CG1 4.42Å; F288-I292 WeakPolarHBondContact O-CG1 3.08Å; F288-I292 PolarHBondContact O-N 3.04Å; I292-R294 PolarHBondContact O-N 2.64Å; I292-L295 PolarHBondContact O-N 3.28Å; I292-L296 HydrophobicContact CG2-CD1 4.04Å; I292-L296 HydrophobicContact CG2-CG 4.38Å; I292-L296 WeakPolarHBondContact O-CG 3.3Å; I292-L296 PolarHBondContact O-N 2.86Å; I292-W325 HydrophobicContact CB-CZ2 4.44Å; I292-W325 HydrophobicContact CG2-CD2 3.97Å; I292-W325 HydrophobicContact CG2-CE3 4.34Å; I292-W325 HydrophobicContact CG2-CG 4.26Å; I292-W325 HydrophobicContact CG2-CZ2 4.48Å
293G83.8Confident80.2Confident13 Ų1352.2 Ų52.213%0.13427%0.271CS..Hα-helixtrans-55.4-52.9176.700000112.2A289 L295 L296 D297A289-G293 PolarHBondContact O-N 3.43Å; G293-L295 VanDerWaalsContact C-N 3.3Å; G293-L295 PolarHBondContact O-N 3.26Å; G293-L296 PolarHBondContact O-N 2.88Å; G293-D297 PolarHBondContact O-N 3.26Å
294R84.8Confident80.1Confident135 Ų13555.4 Ų55.451%0.50929%0.287SS..Hα-helixtrans-60.2-37.6176.8-72.2175.4-175.8168.12.2112.8A290 S291 I292 D297 N298A290-R294 WeakPolarHBondContact O-CB 3.45Å; A290-R294 VanDerWaalsContact O-CG 3.32Å; A290-R294 WeakPolarHBondContact O-CG 3.44Å; A290-R294 PolarHBondContact O-N 2.95Å; S291-R294 PolarHBondContact O-N 3Å; I292-R294 PolarHBondContact O-N 2.64Å; R294-D297 PolarHBondContact O-N 3.3Å; R294-N298 WeakPolarHBondContact O-CB 3.49Å; R294-N298 PolarHBondContact O-N 3.22Å; R294-N298 PolarHBondContact O-ND2 3.39Å
295L86.1Confident79.9Confident21 Ų2158.6 Ų58.611%0.1130%0.295CS..Hα-helixtrans-66-45.1179.5-173.4160.2000110.9K209 L212 S291 I292 G293 D297 N298 Q299K209-L295 HydrophobicContact CB-CD1 3.86Å; K209-L295 HydrophobicContact CD-CD1 4.35Å; K209-L295 HydrophobicContact CG-CD1 4Å; L212-L295 HydrophobicContact CD2-CD2 3.14Å; S291-L295 WeakPolarHBondContact O-CB 3.13Å; S291-L295 PolarHBondContact O-N 3.45Å; I292-L295 PolarHBondContact O-N 3.28Å; G293-L295 VanDerWaalsContact C-N 3.3Å; G293-L295 PolarHBondContact O-N 3.26Å; L295-D297 VanDerWaalsContact C-N 3.35Å; L295-N298 PolarHBondContact O-N 2.74Å; L295-Q299 HydrophobicContact CD2-CG 4.34Å; L295-Q299 WeakPolarHBondContact O-CG 3.41Å; L295-Q299 PolarHBondContact O-N 2.83Å
296L85.1Confident79.5Confident5 Ų563.5 Ų63.53%0.02631%0.309CS..Hα-helixtrans-64.4-38.6175.3-66.1176.1000112L212 I292 G293 R300 L318 I321 R322 W325L212-L296 HydrophobicContact CD2-CD2 4.41Å; I292-L296 HydrophobicContact CG2-CD1 4.04Å; I292-L296 HydrophobicContact CG2-CG 4.38Å; I292-L296 WeakPolarHBondContact O-CG 3.3Å; I292-L296 PolarHBondContact O-N 2.86Å; G293-L296 PolarHBondContact O-N 2.88Å; L296-R300 WeakPolarHBondContact O-CB 3.49Å; L296-R300 PolarHBondContact O-N 3.4Å; L296-L318 HydrophobicContact CD2-CD2 4.27Å; L296-I321 HydrophobicContact CD1-CG2 4.42Å; L296-I321 HydrophobicContact CD2-CG2 3.88Å; L296-R322 HydrophobicContact CD1-CB 4.48Å; L296-W325 HydrophobicContact CD1-CB 4.3Å; L296-W325 HydrophobicContact CD1-CG 4.35Å
297D83.5Confident78.6Confident61 Ų6161.3 Ų61.333%0.32632%0.32SS..Hα-helixtrans-67.2-43.5176.5-76.8-32.2000113.1G293 R294 L295 Q299 R300 S301 R322G293-D297 PolarHBondContact O-N 3.26Å; R294-D297 PolarHBondContact O-N 3.3Å; L295-D297 VanDerWaalsContact C-N 3.35Å; D297-Q299 PolarHBondContact O-N 2.83Å; D297-R300 PolarHBondContact O-N 2.72Å; D297-S301 WeakPolarHBondContact O-CB 3.44Å; D297-S301 PolarHBondContact O-N 3.35Å; D297-S301 PolarHBondContact O-OG 3.42Å; D297-R322 IonicContact OD1-CZ 2.77Å; D297-R322 IonicContact OD1-NH1 3.77Å; D297-R322 PolarHBondContact OD1-NH1 3.38Å; D297-R322 IonicContact OD1-NH2 3.03Å; D297-R322 PolarHBondContact OD1-NH2 2.94Å; D297-R322 IonicContact OD2-NH2 2.96Å
298N85.1Confident77.6Confident99 Ų9961.9 Ų61.953%0.52932%0.317SS..Hα-helixtrans-60.1-48.4175.6-70.9-20.8000110.5R294 L295 R300 S301 L302R294-N298 WeakPolarHBondContact O-CB 3.49Å; R294-N298 PolarHBondContact O-N 3.22Å; R294-N298 PolarHBondContact O-ND2 3.39Å; L295-N298 PolarHBondContact O-N 2.74Å; N298-R300 PolarHBondContact O-N 3.43Å; N298-S301 PolarHBondContact O-N 3.25Å; N298-S301 PolarHBondContact O-OG 2.84Å; N298-L302 VanDerWaalsContact O-CG 3.28Å; N298-L302 WeakPolarHBondContact O-CG 3.43Å; N298-L302 PolarHBondContact O-N 3.45Å
299Q81.8Confident76.4Confident28 Ų2871 Ų7113%0.13136%0.359CS..Hα-helixtrans-61.1-45.7178.6-69.5-64.7-11.400111.7L212 D213 L216 L295 D297 S301 L302 F303 L318L212-Q299 HydrophobicContact CD2-CG 4.09Å; D213-Q299 PolarHBondContact OD1-NE2 3.2Å; L216-Q299 HydrophobicContact CD1-CB 4.46Å; L216-Q299 HydrophobicContact CD1-CG 4.23Å; L295-Q299 HydrophobicContact CD2-CG 4.34Å; L295-Q299 WeakPolarHBondContact O-CG 3.41Å; L295-Q299 PolarHBondContact O-N 2.83Å; D297-Q299 PolarHBondContact O-N 2.83Å; Q299-S301 VanDerWaalsContact C-N 3.34Å; Q299-S301 PolarHBondContact O-N 3.07Å; Q299-L302 WeakPolarHBondContact O-CB 3.4Å; Q299-L302 PolarHBondContact O-N 3.47Å; Q299-F303 WeakPolarHBondContact O-CD2 3.48Å; Q299-F303 PolarHBondContact O-N 2.96Å; Q299-L318 HydrophobicContact CB-CD1 4.09Å; Q299-L318 HydrophobicContact CB-CD2 4.18Å
300R80.8Confident75.3Confident61 Ų6171.7 Ų71.723%0.2336%0.363CS..Hα-helixtrans-56.1-48175.4179.4179.8174.3-178.8-0.4111.9L296 D297 N298 L302 F303 E304 L315L296-R300 WeakPolarHBondContact O-CB 3.49Å; L296-R300 PolarHBondContact O-N 3.4Å; D297-R300 PolarHBondContact O-N 2.72Å; N298-R300 PolarHBondContact O-N 3.43Å; R300-L302 VanDerWaalsContact C-N 3.26Å; R300-L302 PolarHBondContact O-N 3.16Å; R300-F303 PolarHBondContact O-N 2.67Å; R300-E304 HydrophobicContact CG-CG 4.3Å; R300-E304 IonicContact CZ-OE1 2.73Å; R300-E304 VanDerWaalsContact CZ-OE1 3.31Å; R300-E304 IonicContact NE-OE1 2.61Å; R300-E304 PolarHBondContact NE-OE1 3.32Å; R300-E304 IonicContact NH2-OE1 3.79Å; R300-E304 PolarHBondContact NH2-OE1 3.49Å; R300-E304 WeakPolarHBondContact O-CG 3.48Å; R300-E304 PolarHBondContact O-N 3.34Å; R300-L315 HydrophobicContact CG-CD2 4.29Å
301S79.8Confident74.6Confident47 Ų4770.3 Ų70.333%0.32935%0.35SS..Hα-helixtrans-62.7-32.8-179.674.70000113.1D297 N298 Q299 Q305D297-S301 WeakPolarHBondContact O-CB 3.44Å; D297-S301 PolarHBondContact O-N 3.35Å; D297-S301 PolarHBondContact O-OG 3.42Å; N298-S301 PolarHBondContact O-N 3.25Å; N298-S301 PolarHBondContact O-OG 2.84Å; Q299-S301 VanDerWaalsContact C-N 3.34Å; Q299-S301 PolarHBondContact O-N 3.07Å; S301-Q305 WeakPolarHBondContact O-CG 3.11Å; S301-Q305 PolarHBondContact O-N 3.49Å
302L77.3Confident74.1Confident84 Ų8471.8 Ų71.844%0.4436%0.361SS..Hα-helixtrans-68.4-38.1178-71.9170.6000112.1N298 Q299 R300N298-L302 VanDerWaalsContact O-CG 3.28Å; N298-L302 WeakPolarHBondContact O-CG 3.43Å; N298-L302 PolarHBondContact O-N 3.45Å; Q299-L302 WeakPolarHBondContact O-CB 3.4Å; Q299-L302 PolarHBondContact O-N 3.47Å; R300-L302 VanDerWaalsContact C-N 3.26Å; R300-L302 PolarHBondContact O-N 3.16Å
303F73.7Confident73.7Confident19 Ų1973.6 Ų73.68%0.08337%0.371CS..Hα-helixtrans-82.5-35.9179.4-67.8-66.7000112.8L216 Q299 R300 Q305 R306 L315 L318L216-F303 HydrophobicContact CB-CZ 4.34Å; L216-F303 HydrophobicContact CD1-CE2 4.16Å; L216-F303 HydrophobicContact CD2-CE2 4.4Å; Q299-F303 WeakPolarHBondContact O-CD2 3.48Å; Q299-F303 PolarHBondContact O-N 2.96Å; R300-F303 PolarHBondContact O-N 2.67Å; F303-Q305 PolarHBondContact O-N 3.41Å; F303-R306 CarbonylContact O-C 3.39Å; F303-R306 PolarHBondContact O-N 2.69Å; F303-L315 HydrophobicContact CB-CD2 3.81Å; F303-L315 HydrophobicContact CB-CG 4.2Å; F303-L318 HydrophobicContact CD2-CD1 3.78Å; F303-L318 HydrophobicContact CE2-CD1 4.13Å
304E74.6Confident73.6Confident98 Ų9873.8 Ų73.846%0.45837%0.367SS..Hα-helixtrans-60.9-29.7176-75.6179.7170.900112.6R300 R306 L315R300-E304 HydrophobicContact CG-CG 4.3Å; R300-E304 IonicContact CZ-OE1 2.73Å; R300-E304 VanDerWaalsContact CZ-OE1 3.31Å; R300-E304 IonicContact NE-OE1 2.61Å; R300-E304 PolarHBondContact NE-OE1 3.32Å; R300-E304 IonicContact NH2-OE1 3.79Å; R300-E304 PolarHBondContact NH2-OE1 3.49Å; R300-E304 WeakPolarHBondContact O-CG 3.48Å; R300-E304 PolarHBondContact O-N 3.34Å; E304-R306 VanDerWaalsContact C-N 3.33Å; E304-L315 HydrophobicContact CG-CD1 4.41Å; E304-L315 HydrophobicContact CG-CD2 4.08Å
305Q70.8Confident73.6Confident158 Ų15869.5 Ų69.574%0.73835%0.354SS*.THydrogen-bonded Turntrans-76-18.7176.1-70.1175.51200113.6S301 F303S301-Q305 WeakPolarHBondContact O-CG 3.11Å; S301-Q305 PolarHBondContact O-N 3.49Å; F303-Q305 PolarHBondContact O-N 3.41Å
306R63.8Low73.6Confident164 Ų16470.4 Ų70.462%0.61936%0.357SS*.SBendtrans-102.983.2178.6-66.4-178.8-175.2-169.52108.3F303 E304 E308 D311F303-R306 CarbonylContact O-C 3.39Å; F303-R306 PolarHBondContact O-N 2.69Å; E304-R306 VanDerWaalsContact C-N 3.33Å; R306-E308 VanDerWaalsContact C-N 3.28Å; R306-E308 PolarHBondContact O-N 3.01Å; R306-D311 VanDerWaalsContact O-OD2 3.12Å
307S52.6Low73.7Confident124 Ų12470.2 Ų70.287%0.86736%0.356SS*.  trans-70.176.4-179.6-77.60000112.8
308E56.6Low74Confident97 Ų9767.8 Ų67.845%0.45334%0.343SS..  trans-116.6143.4168.1-64.8-172.9175.200110.8N232 R306 S310 D311N232-E308 PolarHBondContact ND2-OE2 2.82Å; R306-E308 VanDerWaalsContact C-N 3.28Å; R306-E308 PolarHBondContact O-N 3.01Å; E308-S310 PolarHBondContact O-N 2.84Å; E308-D311 PolarHBondContact O-N 3.43Å
309E56.7Low74.2Confident192 Ų19263.2 Ų63.290%0.89732%0.319SS*.THydrogen-bonded Turntrans-58.4-32.7-179.4-71.8-177.9168.800112.7D311 S312E309-D311 VanDerWaalsContact C-N 3.26Å; E309-D311 PolarHBondContact O-N 3.22Å; E309-S312 WeakPolarHBondContact O-CB 3.4Å; E309-S312 PolarHBondContact O-N 3.07Å
310S55.1Low74.7Confident40 Ų4062 Ų6228%0.2831%0.313SS..THydrogen-bonded Turntrans-64.5-25.2175.847.20000113.8N232 E308 S312N232-S310 WeakPolarHBondContact O-CB 3.31Å; E308-S310 PolarHBondContact O-N 2.84Å; S310-S312 PolarHBondContact O-N 3.18Å
311D65.5Low75.3Confident6 Ų659 Ų593%0.03230%0.302CS..Hα-helixtrans-77.8-11179.6-74.5-21.7000112.4R306 E308 E309 D313 R314 L315R306-D311 VanDerWaalsContact O-OD2 3.12Å; E308-D311 PolarHBondContact O-N 3.43Å; E309-D311 VanDerWaalsContact C-N 3.26Å; E309-D311 PolarHBondContact O-N 3.22Å; D311-D313 VanDerWaalsContact C-N 3.34Å; D311-D313 PolarHBondContact O-N 3.07Å; D311-R314 PolarHBondContact O-N 3.3Å; D311-R314 WeakPolarHBondContact OD1-CD 3.31Å; D311-R314 IonicContact OD1-CZ 2.92Å; D311-R314 IonicContact OD1-NE 2.96Å; D311-R314 IonicContact OD1-NH1 3.83Å; D311-R314 PolarHBondContact OD1-NH1 3.44Å; D311-L315 WeakPolarHBondContact O-CG 3.44Å; D311-L315 PolarHBondContact O-N 2.6Å
312S73.9Confident75.8Confident56 Ų5657.4 Ų57.439%0.39229%0.289SS..Hα-helixtrans-59.6-43.5175-168.90000112E309 S310 L315 K316E309-S312 WeakPolarHBondContact O-CB 3.4Å; E309-S312 PolarHBondContact O-N 3.07Å; S310-S312 PolarHBondContact O-N 3.18Å; S312-L315 PolarHBondContact O-N 2.88Å; S312-K316 WeakPolarHBondContact O-CB 3.42Å; S312-K316 VanDerWaalsContact O-CG 3.31Å; S312-K316 WeakPolarHBondContact O-CG 3.32Å; S312-K316 PolarHBondContact O-N 3.41Å
313D77.5Confident76.5Confident37 Ų3753.4 Ų53.420%0.19827%0.268CS..Hα-helixtrans-69.5-35179.3-77.6-27.7000112D311 K316 L317 Q395D311-D313 VanDerWaalsContact C-N 3.34Å; D311-D313 PolarHBondContact O-N 3.07Å; D313-K316 PolarHBondContact O-N 3.01Å; D313-L317 WeakPolarHBondContact O-CB 3.47Å; D313-L317 PolarHBondContact O-N 3.29Å; D313-Q395 PolarHBondContact OD1-NE2 3.32Å; D313-Q395 VanDerWaalsContact OD1-NE2 3.14Å; D313-Q395 PolarHBondContact OD2-NE2 3.38Å
314R80Confident77.4Confident17 Ų1752.5 Ų52.56%0.06426%0.264CS..Hα-helixtrans-63.9-43.3173.9-69.4-176176.7143.72.4111.9L234 D311 K316 L317 L318L234-R314 HydrophobicContact CD1-CG 3.81Å; L234-R314 HydrophobicContact CD2-CG 3.85Å; L234-R314 HydrophobicContact CG-CG 3.88Å; D311-R314 PolarHBondContact O-N 3.3Å; D311-R314 WeakPolarHBondContact OD1-CD 3.31Å; D311-R314 IonicContact OD1-CZ 2.92Å; D311-R314 IonicContact OD1-NE 2.96Å; D311-R314 IonicContact OD1-NH1 3.83Å; D311-R314 PolarHBondContact OD1-NH1 3.44Å; R314-K316 VanDerWaalsContact C-N 3.34Å; R314-L317 WeakPolarHBondContact O-CB 3.38Å; R314-L317 PolarHBondContact O-N 3.49Å; R314-L318 WeakPolarHBondContact O-CB 3.21Å; R314-L318 WeakPolarHBondContact O-CG 3.25Å; R314-L318 PolarHBondContact O-N 2.77Å
315L84.8Confident78.2Confident46 Ų4648.1 Ų48.124%0.24124%0.243CC..Hα-helixtrans-64.1-40.4176.1-72171000111.4R300 F303 E304 D311 S312 L318 A319R300-L315 HydrophobicContact CG-CD2 4.29Å; F303-L315 HydrophobicContact CB-CD2 3.81Å; F303-L315 HydrophobicContact CB-CG 4.2Å; E304-L315 HydrophobicContact CG-CD1 4.41Å; E304-L315 HydrophobicContact CG-CD2 4.08Å; D311-L315 WeakPolarHBondContact O-CG 3.44Å; D311-L315 PolarHBondContact O-N 2.6Å; S312-L315 PolarHBondContact O-N 2.88Å; L315-L318 PolarHBondContact O-N 3.22Å; L315-A319 WeakPolarHBondContact O-CB 3.42Å; L315-A319 PolarHBondContact O-N 3.02Å
316K86.4Confident79.1Confident39 Ų3940.6 Ų40.617%0.1721%0.208CC..Hα-helixtrans-66.3-37175-75.9-177.9-168.5-167.80113.2S312 D313 R314 A319 F320 E390 F391S312-K316 WeakPolarHBondContact O-CB 3.42Å; S312-K316 VanDerWaalsContact O-CG 3.31Å; S312-K316 WeakPolarHBondContact O-CG 3.32Å; S312-K316 PolarHBondContact O-N 3.41Å; D313-K316 PolarHBondContact O-N 3.01Å; R314-K316 VanDerWaalsContact C-N 3.34Å; K316-A319 VanDerWaalsContact O-CB 3.31Å; K316-A319 WeakPolarHBondContact O-CB 3.38Å; K316-A319 PolarHBondContact O-N 3.08Å; K316-F320 PolarHBondContact O-N 3.04Å; K316-E390 IonicContact NZ-OE1 3.98Å; K316-E390 IonicContact NZ-OE2 2.83Å; K316-E390 PolarHBondContact NZ-OE2 3.45Å; K316-F391 HydrophobicContact CB-CB 4.01Å; K316-F391 HydrophobicContact CB-CD2 3.68Å; K316-F391 HydrophobicContact CB-CG 4.11Å
317L87.8Confident80.4Confident1 Ų133 Ų331%0.00518%0.18CC..Hα-helixtrans-63.1-50.2172.1174.673.3000111.1L215 L216 L250 D313 R314 A319 F320 I321 F391L215-L317 HydrophobicContact CD2-CD1 4.28Å; L215-L317 HydrophobicContact CD2-CD2 3.87Å; L215-L317 HydrophobicContact CD2-CG 4.44Å; L215-L317 HydrophobicContact CG-CD2 3.93Å; L216-L317 HydrophobicContact CD2-CD2 3.95Å; L250-L317 HydrophobicContact CD1-CD1 3.79Å; L250-L317 HydrophobicContact CD2-CD1 3.78Å; L250-L317 HydrophobicContact CG-CD1 4.28Å; D313-L317 WeakPolarHBondContact O-CB 3.47Å; D313-L317 PolarHBondContact O-N 3.29Å; R314-L317 WeakPolarHBondContact O-CB 3.38Å; R314-L317 PolarHBondContact O-N 3.49Å; L317-A319 VanDerWaalsContact C-N 3.25Å; L317-A319 PolarHBondContact O-N 3.2Å; L317-F320 PolarHBondContact O-N 2.82Å; L317-I321 HydrophobicContact CG-CD1 4.47Å; L317-I321 PolarHBondContact O-N 3.26Å; L317-I321 VanDerWaalsContact O-N 3.08Å; L317-F391 HydrophobicContact CB-CE1 4.2Å; L317-F391 HydrophobicContact CB-CE2 3.99Å; L317-F391 HydrophobicContact CB-CZ 3.77Å; L317-F391 HydrophobicContact CD1-CE1 3.56Å; L317-F391 HydrophobicContact CD1-CZ 3.49Å; L317-F391 VanDerWaalsContact CD1-CZ 3.49Å; L317-F391 HydrophobicContact CG-CZ 4.23Å
318L89.5Confident82.1Confident10 Ų1027.2 Ų27.25%0.05214%0.139CC..Hα-helixtrans-59-38.7175.4-76.3171.3000111.6L212 L216 L296 Q299 F303 R314 L315 F320 I321 R322L212-L318 HydrophobicContact CD1-CD2 4.31Å; L216-L318 HydrophobicContact CD1-CD2 3.99Å; L216-L318 HydrophobicContact CD2-CD2 4.32Å; L216-L318 HydrophobicContact CD2-CG 4.19Å; L296-L318 HydrophobicContact CD2-CD2 4.27Å; Q299-L318 HydrophobicContact CB-CD1 4.09Å; Q299-L318 HydrophobicContact CB-CD2 4.18Å; F303-L318 HydrophobicContact CD2-CD1 3.78Å; F303-L318 HydrophobicContact CE2-CD1 4.13Å; R314-L318 WeakPolarHBondContact O-CB 3.21Å; R314-L318 WeakPolarHBondContact O-CG 3.25Å; R314-L318 PolarHBondContact O-N 2.77Å; L315-L318 PolarHBondContact O-N 3.22Å; L318-F320 VanDerWaalsContact C-N 3.32Å; L318-F320 PolarHBondContact O-N 2.71Å; L318-I321 PolarHBondContact O-N 3.23Å; L318-R322 VanDerWaalsContact O-CB 3.29Å; L318-R322 WeakPolarHBondContact O-CB 3.45Å; L318-R322 PolarHBondContact O-N 3.27Å
319A89.4Confident83.5Confident3 Ų323.5 Ų23.53%0.02512%0.123CC..Hα-helixtrans-58.7-43.6173.600000112L315 K316 L317 R322 L323 A383 S386 A388L315-A319 WeakPolarHBondContact O-CB 3.42Å; L315-A319 PolarHBondContact O-N 3.02Å; K316-A319 VanDerWaalsContact O-CB 3.31Å; K316-A319 WeakPolarHBondContact O-CB 3.38Å; K316-A319 PolarHBondContact O-N 3.08Å; L317-A319 VanDerWaalsContact C-N 3.25Å; L317-A319 PolarHBondContact O-N 3.2Å; A319-R322 WeakPolarHBondContact O-CB 3.17Å; A319-R322 PolarHBondContact O-N 2.94Å; A319-L323 PolarHBondContact O-N 2.87Å; A319-A383 VanDerWaalsContact O-CB 3.28Å; A319-A383 WeakPolarHBondContact O-CB 3.49Å; A319-S386 WeakPolarHBondContact CB-OG 3.2Å; A319-A388 HydrophobicContact CB-CB 4.08Å
320F92.7Very high85Confident2 Ų217.1 Ų17.11%0.0099%0.09CC..Hα-helixtrans-67.1-40.5179.2-169.5-110.5000112.6L254 K316 L317 L318 R322 L323 S324 A388 F391 A392 I396 M412 I415L254-F320 HydrophobicContact CD1-CD1 4.19Å; L254-F320 HydrophobicContact CD1-CE1 3.62Å; L254-F320 HydrophobicContact CD2-CD1 4.22Å; L254-F320 HydrophobicContact CD2-CE1 4.1Å; K316-F320 PolarHBondContact O-N 3.04Å; L317-F320 PolarHBondContact O-N 2.82Å; L318-F320 VanDerWaalsContact C-N 3.32Å; L318-F320 PolarHBondContact O-N 2.71Å; F320-R322 VanDerWaalsContact C-N 3.3Å; F320-R322 PolarHBondContact O-N 2.94Å; F320-L323 HydrophobicContact CD2-CD2 4.46Å; F320-L323 HydrophobicContact CE2-CD2 4.49Å; F320-L323 WeakPolarHBondContact O-CB 3.1Å; F320-L323 PolarHBondContact O-N 3.49Å; F320-S324 PolarHBondContact O-N 3.11Å; F320-S324 VanDerWaalsContact O-N 3.1Å; F320-A388 HydrophobicContact CB-CB 4.36Å; F320-A388 HydrophobicContact CD2-CB 4.24Å; F320-A388 WeakPolarHBondContact CD2-O 3.23Å; F320-F391 HydrophobicContact CB-CD1 3.92Å; F320-F391 HydrophobicContact CG-CD1 4.29Å; F320-A392 HydrophobicContact CD2-CB 4.06Å; F320-A392 HydrophobicContact CE2-CB 3.69Å; F320-A392 HydrophobicContact CZ-CB 4.27Å; F320-I396 HydrophobicContact CD1-CD1 3.57Å; F320-I396 HydrophobicContact CE1-CD1 3.44Å; F320-I396 VanDerWaalsContact CE1-CD1 3.44Å; F320-I396 HydrophobicContact CG-CD1 4.24Å; F320-I396 HydrophobicContact CZ-CD1 4.05Å; F320-M412 HydrophobicContact CE1-CE 4.49Å; F320-M412 HydrophobicContact CE1-SD 3.93Å; F320-M412 HydrophobicContact CE2-CE 4.27Å; F320-M412 HydrophobicContact CZ-CE 3.68Å; F320-M412 HydrophobicContact CZ-SD 3.54Å; F320-M412 VanDerWaalsContact CZ-SD 3.54Å; F320-I415 HydrophobicContact CE1-CD1 4.08Å; F320-I415 HydrophobicContact CE2-CG2 4.24Å; F320-I415 HydrophobicContact CZ-CD1 3.74Å; F320-I415 HydrophobicContact CZ-CG2 4.23Å
321I92.1Very high86.3Confident0 Ų016 Ų160%08%0.08CC..Hα-helixtrans-61.3-42.3172.6-62.4169.5000110.2L212 L250 L253 L257 L296 L317 L318 L323 S324 W325L212-I321 HydrophobicContact CD1-CD1 3.66Å; L250-I321 HydrophobicContact CD1-CD1 4.04Å; L250-I321 HydrophobicContact CD1-CG1 3.7Å; L253-I321 HydrophobicContact CD1-CD1 3.94Å; L257-I321 HydrophobicContact CD1-CG2 3.96Å; L296-I321 HydrophobicContact CD1-CG2 4.42Å; L296-I321 HydrophobicContact CD2-CG2 3.88Å; L317-I321 HydrophobicContact CG-CD1 4.47Å; L317-I321 PolarHBondContact O-N 3.26Å; L317-I321 VanDerWaalsContact O-N 3.08Å; L318-I321 PolarHBondContact O-N 3.23Å; I321-L323 VanDerWaalsContact C-N 3.34Å; I321-L323 PolarHBondContact O-N 3.48Å; I321-S324 WeakPolarHBondContact O-CB 3.45Å; I321-S324 PolarHBondContact O-N 3.24Å; I321-W325 WeakPolarHBondContact O-CB 3.35Å; I321-W325 PolarHBondContact O-N 3.07Å
322R91.8Very high87.1Confident12 Ų1215.7 Ų15.75%0.0458%0.078CC..Hα-helixtrans-63.5-36.3177-167.4176-161.9142.34.3112.8L296 D297 L318 A319 F320 W325 A326 A383L296-R322 HydrophobicContact CD1-CB 4.48Å; D297-R322 IonicContact OD1-CZ 2.77Å; D297-R322 IonicContact OD1-NH1 3.77Å; D297-R322 PolarHBondContact OD1-NH1 3.38Å; D297-R322 IonicContact OD1-NH2 3.03Å; D297-R322 PolarHBondContact OD1-NH2 2.94Å; D297-R322 IonicContact OD2-NH2 2.96Å; L318-R322 VanDerWaalsContact O-CB 3.29Å; L318-R322 WeakPolarHBondContact O-CB 3.45Å; L318-R322 PolarHBondContact O-N 3.27Å; A319-R322 WeakPolarHBondContact O-CB 3.17Å; A319-R322 PolarHBondContact O-N 2.94Å; F320-R322 VanDerWaalsContact C-N 3.3Å; F320-R322 PolarHBondContact O-N 2.94Å; R322-W325 WeakPolarHBondContact O-CB 3.33Å; R322-W325 PolarHBondContact O-N 2.94Å; R322-A326 WeakPolarHBondContact O-CB 3.5Å; R322-A326 PolarHBondContact O-N 3.37Å; R322-A383 HydrophobicContact CB-CB 4.07Å; R322-A383 HydrophobicContact CG-CB 4.21Å
323L91.9Very high87.5Confident0 Ų014.9 Ų14.90%07%0.072CC..Hα-helixtrans-63.4-47.9173.3-178.562.4000111.2A319 F320 I321 W325 A326 L327 A380 A383 I384 A388 L389 L419A319-L323 PolarHBondContact O-N 2.87Å; F320-L323 HydrophobicContact CD2-CD2 4.46Å; F320-L323 HydrophobicContact CE2-CD2 4.49Å; F320-L323 WeakPolarHBondContact O-CB 3.1Å; F320-L323 PolarHBondContact O-N 3.49Å; I321-L323 VanDerWaalsContact C-N 3.34Å; I321-L323 PolarHBondContact O-N 3.48Å; L323-W325 VanDerWaalsContact C-N 3.27Å; L323-W325 PolarHBondContact O-N 3.48Å; L323-A326 PolarHBondContact O-N 2.91Å; L323-L327 HydrophobicContact CG-CD1 4.49Å; L323-L327 WeakPolarHBondContact O-CG 3.31Å; L323-L327 PolarHBondContact O-N 3.47Å; L323-A380 HydrophobicContact CD1-CB 4.33Å; L323-A383 HydrophobicContact CB-CB 3.9Å; L323-I384 HydrophobicContact CD1-CD1 4.31Å; L323-I384 HydrophobicContact CD1-CG1 4.07Å; L323-A388 HydrophobicContact CB-CB 4.17Å; L323-A388 HydrophobicContact CD2-CB 4.03Å; L323-L389 HydrophobicContact CD2-CD2 3.98Å; L323-L419 HydrophobicContact CD1-CD1 4.31Å
324S92.1Very high87.5Confident0 Ų018.4 Ų18.40%09%0.087CC..Hα-helixtrans-59.1-41175.8-174.90000111.6L254 F320 I321 L327 C328 R411L254-S324 VanDerWaalsContact CD2-CB 3.46Å; F320-S324 PolarHBondContact O-N 3.11Å; F320-S324 VanDerWaalsContact O-N 3.1Å; I321-S324 WeakPolarHBondContact O-CB 3.45Å; I321-S324 PolarHBondContact O-N 3.24Å; S324-L327 PolarHBondContact O-N 3.32Å; S324-C328 PolarHBondContact O-N 3.08Å; S324-R411 PolarHBondContact OG-NH2 3.14Å; S324-R411 VanDerWaalsContact OG-NH2 3.1Å
325W91.6Very high87.4Confident6 Ų617.6 Ų17.62%0.0239%0.085CC..Hα-helixtrans-62.5-44.8174.9175.6-126.2000112.8L257 L282 A289 I292 L296 I321 R322 L323 L327 C328 L329L257-W325 HydrophobicContact CD1-CB 4.13Å; L257-W325 HydrophobicContact CD2-CE3 3.78Å; L257-W325 HydrophobicContact CD2-CZ3 4.37Å; L282-W325 HydrophobicContact CD2-CH2 3.7Å; L282-W325 HydrophobicContact CD2-CZ3 3.7Å; A289-W325 HydrophobicContact CB-CH2 3.61Å; A289-W325 HydrophobicContact CB-CZ2 3.81Å; A289-W325 VanDerWaalsContact O-CZ2 3.23Å; A289-W325 WeakPolarHBondContact O-CZ2 3.4Å; I292-W325 HydrophobicContact CB-CZ2 4.44Å; I292-W325 HydrophobicContact CG2-CD2 3.97Å; I292-W325 HydrophobicContact CG2-CE3 4.34Å; I292-W325 HydrophobicContact CG2-CG 4.26Å; I292-W325 HydrophobicContact CG2-CZ2 4.48Å; L296-W325 HydrophobicContact CD1-CB 4.3Å; L296-W325 HydrophobicContact CD1-CG 4.35Å; I321-W325 WeakPolarHBondContact O-CB 3.35Å; I321-W325 PolarHBondContact O-N 3.07Å; R322-W325 WeakPolarHBondContact O-CB 3.33Å; R322-W325 PolarHBondContact O-N 2.94Å; L323-W325 VanDerWaalsContact C-N 3.27Å; L323-W325 PolarHBondContact O-N 3.48Å; W325-L327 VanDerWaalsContact C-N 3.32Å; W325-L327 PolarHBondContact O-N 3.11Å; W325-C328 HydrophobicContact CE3-CB 4.02Å; W325-C328 HydrophobicContact CZ3-CB 4.33Å; W325-C328 VanDerWaalsContact O-CB 3.27Å; W325-C328 WeakPolarHBondContact O-CB 3.38Å; W325-C328 PolarHBondContact O-N 2.86Å; W325-L329 HydrophobicContact CD2-CD1 4.26Å; W325-L329 HydrophobicContact CD2-CG 4.08Å; W325-L329 HydrophobicContact CE3-CG 4.34Å; W325-L329 HydrophobicContact CH2-CD2 3.53Å; W325-L329 HydrophobicContact CH2-CG 3.98Å; W325-L329 HydrophobicContact CZ2-CD1 3.82Å; W325-L329 HydrophobicContact CZ2-CD2 3.45Å; W325-L329 VanDerWaalsContact CZ2-CD2 3.45Å; W325-L329 HydrophobicContact CZ2-CG 3.68Å; W325-L329 HydrophobicContact CZ3-CD2 4.2Å; W325-L329 HydrophobicContact CZ3-CG 4.3Å; W325-L329 WeakPolarHBondContact O-CG 3.29Å; W325-L329 PolarHBondContact O-N 3.4Å
326A90.3Very high87Confident0 Ų016.7 Ų16.70%08%0.078CC..Hα-helixtrans-62.4-39.3177.500000112.4R322 L323 L329 R330 Q379 A380 M423R322-A326 WeakPolarHBondContact O-CB 3.5Å; R322-A326 PolarHBondContact O-N 3.37Å; L323-A326 PolarHBondContact O-N 2.91Å; A326-L329 PolarHBondContact O-N 3.29Å; A326-R330 WeakPolarHBondContact O-CB 3.24Å; A326-R330 PolarHBondContact O-N 3.02Å; A326-Q379 HydrophobicContact CB-CB 4.07Å; A326-A380 HydrophobicContact CB-CB 3.7Å; A326-M423 HydrophobicContact CB-CE 4.3Å; A326-M423 WeakPolarHBondContact O-CE 3.18Å
327L90.2Very high86.6Confident5 Ų516.8 Ų16.83%0.0269%0.086CC..Hα-helixtrans-64.9-40.8173.9-67.5170.7000111.9L323 S324 W325 L329 R330 R331 I415 D418 L419 M423L323-L327 HydrophobicContact CG-CD1 4.49Å; L323-L327 WeakPolarHBondContact O-CG 3.31Å; L323-L327 PolarHBondContact O-N 3.47Å; S324-L327 PolarHBondContact O-N 3.32Å; W325-L327 VanDerWaalsContact C-N 3.32Å; W325-L327 PolarHBondContact O-N 3.11Å; L327-L329 PolarHBondContact O-N 2.92Å; L327-R330 PolarHBondContact O-N 2.94Å; L327-R331 WeakPolarHBondContact O-CB 3.46Å; L327-R331 WeakPolarHBondContact O-CG 3.5Å; L327-R331 PolarHBondContact O-N 3.4Å; L327-I415 HydrophobicContact CD1-CB 4.44Å; L327-I415 HydrophobicContact CD1-CG2 3.9Å; L327-D418 HydrophobicContact CD1-CB 4.31Å; L327-D418 HydrophobicContact CD2-CB 4.25Å; L327-L419 HydrophobicContact CD1-CB 4.47Å; L327-L419 HydrophobicContact CD2-CB 4.25Å; L327-L419 HydrophobicContact CD2-CD1 4.3Å; L327-M423 HydrophobicContact CD2-CE 4.3Å; L327-M423 HydrophobicContact CD2-CG 4.2Å; L327-M423 HydrophobicContact CD2-SD 3.88Å
328C87.8Confident86Confident2 Ų218.9 Ų18.91%0.01410%0.096CC..Hα-helixtrans-58.1-47.6173.7-171.10000111.9L257 L282 S324 W325 R330 R331 T332L257-C328 WeakPolarHBondContact O-CB 3.43Å; L257-C328 PolarHBondContact O-SG 2.85Å; L282-C328 WeakPolarHBondContact CD1-SG 3.13Å; S324-C328 PolarHBondContact O-N 3.08Å; W325-C328 HydrophobicContact CE3-CB 4.02Å; W325-C328 HydrophobicContact CZ3-CB 4.33Å; W325-C328 VanDerWaalsContact O-CB 3.27Å; W325-C328 WeakPolarHBondContact O-CB 3.38Å; W325-C328 PolarHBondContact O-N 2.86Å; C328-R330 PolarHBondContact O-N 3.26Å; C328-R331 PolarHBondContact O-N 3.01Å; C328-T332 WeakPolarHBondContact O-CG2 3.4Å; C328-T332 PolarHBondContact O-N 3.22Å; C328-T332 VanDerWaalsContact O-N 3.11Å; C328-T332 PolarHBondContact O-OG1 3.49Å
329L87Confident85.3Confident20 Ų2019.9 Ų19.911%0.10510%0.101CC..Hα-helixtrans-61.7-42.9177.4-73.9178.6000112.1A289 W325 A326 L327 T332 S333 R336 D376A289-L329 HydrophobicContact CB-CD2 4.47Å; W325-L329 HydrophobicContact CD2-CD1 4.26Å; W325-L329 HydrophobicContact CD2-CG 4.08Å; W325-L329 HydrophobicContact CE3-CG 4.34Å; W325-L329 HydrophobicContact CH2-CD2 3.53Å; W325-L329 HydrophobicContact CH2-CG 3.98Å; W325-L329 HydrophobicContact CZ2-CD1 3.82Å; W325-L329 HydrophobicContact CZ2-CD2 3.45Å; W325-L329 VanDerWaalsContact CZ2-CD2 3.45Å; W325-L329 HydrophobicContact CZ2-CG 3.68Å; W325-L329 HydrophobicContact CZ3-CD2 4.2Å; W325-L329 HydrophobicContact CZ3-CG 4.3Å; W325-L329 WeakPolarHBondContact O-CG 3.29Å; W325-L329 PolarHBondContact O-N 3.4Å; A326-L329 PolarHBondContact O-N 3.29Å; L327-L329 PolarHBondContact O-N 2.92Å; L329-T332 PolarHBondContact O-N 3.36Å; L329-T332 PolarHBondContact O-OG1 3.46Å; L329-S333 WeakPolarHBondContact O-CA 3.36Å; L329-S333 PolarHBondContact O-N 2.85Å; L329-R336 PolarHBondContact O-NH2 3.31Å; L329-D376 HydrophobicContact CB-CB 3.92Å
330R86.7Confident84.4Confident58 Ų5824.2 Ų24.222%0.21912%0.117CC..Hα-helixtrans-63.2-48.2177.9174.356.353.5131.2-11.6111.7A326 L327 C328 T332 S333 D376 E377 H422 M423A326-R330 WeakPolarHBondContact O-CB 3.24Å; A326-R330 PolarHBondContact O-N 3.02Å; L327-R330 PolarHBondContact O-N 2.94Å; C328-R330 PolarHBondContact O-N 3.26Å; R330-T332 PolarHBondContact O-N 2.88Å; R330-S333 WeakPolarHBondContact O-CB 3.29Å; R330-S333 PolarHBondContact O-N 3.27Å; R330-S333 PolarHBondContact O-OG 3.05Å; R330-D376 WeakPolarHBondContact CA-OD2 3.31Å; R330-D376 WeakPolarHBondContact CB-OD2 3.46Å; R330-D376 IonicContact CZ-OD1 2.68Å; R330-D376 IonicContact CZ-OD2 3.62Å; R330-D376 IonicContact NE-OD1 3.68Å; R330-D376 IonicContact NE-OD2 3.82Å; R330-D376 PolarHBondContact NE-OD2 3.38Å; R330-D376 VanDerWaalsContact NH2-CG 3.3Å; R330-D376 IonicContact NH2-OD1 2.91Å; R330-D376 PolarHBondContact NH2-OD1 2.74Å; R330-D376 IonicContact NH2-OD2 2.7Å; R330-D376 PolarHBondContact NH2-OD2 2.72Å; R330-D376 VanDerWaalsContact NH2-OD2 3.13Å; R330-E377 IonicContact CZ-OE1 2.88Å; R330-E377 VanDerWaalsContact CZ-OE1 3.3Å; R330-E377 IonicContact NH1-OE1 3.65Å; R330-E377 PolarHBondContact NH1-OE1 3.41Å; R330-E377 VanDerWaalsContact NH2-CD 3.31Å; R330-E377 IonicContact NH2-OE1 3.55Å; R330-E377 PolarHBondContact NH2-OE1 2.77Å; R330-H422 HydrophobicContact CG-CB 3.84Å; R330-M423 HydrophobicContact CB-CE 3.55Å; R330-M423 HydrophobicContact CG-CE 4Å; R330-M423 HydrophobicContact CG-CG 4.26Å
331R83.5Confident83.5Confident16 Ų1632.3 Ų32.36%0.0615%0.147CC..Hα-helixtrans-61.5-30.8178.6-76.2-173.572.2160.48113.2P259 F260 N263 L265 L327 C328 D418P259-R331 HydrophobicContact CG-CB 4.04Å; F260-R331 HydrophobicContact CE2-CB 4.15Å; N263-R331 PolarHBondContact O-NH2 3.38Å; N263-R331 PolarHBondContact OD1-NH1 3.45Å; N263-R331 VanDerWaalsContact OD1-NH1 3.08Å; L265-R331 PolarHBondContact O-NH2 3.47Å; L327-R331 WeakPolarHBondContact O-CB 3.46Å; L327-R331 WeakPolarHBondContact O-CG 3.5Å; L327-R331 PolarHBondContact O-N 3.4Å; C328-R331 PolarHBondContact O-N 3.01Å; R331-D418 WeakPolarHBondContact CD-OD2 3.28Å; R331-D418 IonicContact CZ-OD1 3.28Å; R331-D418 IonicContact CZ-OD2 3.71Å; R331-D418 IonicContact NE-OD2 2.79Å; R331-D418 IonicContact NH1-OD1 3.83Å; R331-D418 PolarHBondContact NH1-OD1 3.17Å; R331-D418 IonicContact NH1-OD2 2.67Å; R331-D418 PolarHBondContact NH1-OD2 3.03Å
332T82.7Confident82.4Confident0 Ų038.1 Ų38.10%017%0.169CC..Hα-helixtrans-99.3-2-178.659.70000113.9P259 F260 Y283 C328 L329 R330 H334 L335 R336P259-T332 HydrophobicContact CB-CG2 3.35Å; P259-T332 HydrophobicContact CG-CG2 3.9Å; F260-T332 HydrophobicContact CZ-CG2 4.37Å; Y283-T332 HydrophobicContact CE1-CG2 4.37Å; Y283-T332 WeakPolarHBondContact OH-CG2 3.46Å; C328-T332 WeakPolarHBondContact O-CG2 3.4Å; C328-T332 PolarHBondContact O-N 3.22Å; C328-T332 VanDerWaalsContact O-N 3.11Å; C328-T332 PolarHBondContact O-OG1 3.49Å; L329-T332 PolarHBondContact O-N 3.36Å; L329-T332 PolarHBondContact O-OG1 3.46Å; R330-T332 PolarHBondContact O-N 2.88Å; T332-H334 PolarHBondContact O-N 3.49Å; T332-L335 PolarHBondContact O-N 2.97Å; T332-R336 WeakPolarHBondContact O-CB 3.19Å; T332-R336 VanDerWaalsContact O-CG 3.29Å; T332-R336 WeakPolarHBondContact O-CG 3.41Å; T332-R336 PolarHBondContact O-N 2.9Å; T332-R336 PolarHBondContact OG1-NE 2.98Å
333S80.6Confident80.9Confident38 Ų3841.6 Ų41.627%0.26619%0.186SC..Hα-helixtrans-53.6-51.8-173.957.80000112.8L329 R330 R336 A337L329-S333 WeakPolarHBondContact O-CA 3.36Å; L329-S333 PolarHBondContact O-N 2.85Å; R330-S333 WeakPolarHBondContact O-CB 3.29Å; R330-S333 PolarHBondContact O-N 3.27Å; R330-S333 PolarHBondContact O-OG 3.05Å; S333-R336 PolarHBondContact O-N 3.31Å; S333-A337 WeakPolarHBondContact O-CB 3.38Å; S333-A337 PolarHBondContact O-N 3.3Å
334H78.7Confident79.3Confident111 Ų11145.9 Ų45.951%0.51421%0.212SC..Hα-helixtrans-63.1-46179.3-176-96.6000112.5D268 T332 R336 A337 E338D268-H334 PolarHBondContact O-CE1 3.07Å; D268-H334 PolarHBondContact O-ND1 3.23Å; T332-H334 PolarHBondContact O-N 3.49Å; H334-R336 PolarHBondContact O-N 3.09Å; H334-A337 PolarHBondContact O-N 3.35Å; H334-E338 WeakPolarHBondContact O-CB 3.06Å; H334-E338 PolarHBondContact O-N 3.49Å
335L77.8Confident77.3Confident1 Ų149.5 Ų49.51%0.00523%0.234CC..Hα-helixtrans-63.3-42.3178.7-68.2174.1000112.1F260 A267 V270 L273 T332 E338 L339F260-L335 HydrophobicContact CE1-CD1 3.61Å; F260-L335 HydrophobicContact CZ-CD1 3.75Å; A267-L335 HydrophobicContact CB-CD1 3.88Å; A267-L335 WeakPolarHBondContact O-CD1 3.44Å; A267-L335 WeakPolarHBondContact O-CD2 3.49Å; A267-L335 VanDerWaalsContact O-CG 3.31Å; A267-L335 WeakPolarHBondContact O-CG 3.19Å; V270-L335 HydrophobicContact CG2-CD2 4.07Å; L273-L335 HydrophobicContact CD1-CD1 4.3Å; L273-L335 HydrophobicContact CD2-CD1 4.12Å; L273-L335 HydrophobicContact CG-CD1 4.45Å; T332-L335 PolarHBondContact O-N 2.97Å; L335-E338 PolarHBondContact O-N 3.29Å; L335-L339 WeakPolarHBondContact O-CB 3.31Å; L335-L339 WeakPolarHBondContact O-CG 3.41Å; L335-L339 PolarHBondContact O-N 2.92Å
336R77.2Confident75.1Confident26 Ų2654.5 Ų54.510%0.09826%0.261CS..Hα-helixtrans-64.4-42.8176-70.9-176-63.4110.2-0.1110.9L329 T332 S333 H334 L339 R340 D373L329-R336 PolarHBondContact O-NH2 3.31Å; T332-R336 WeakPolarHBondContact O-CB 3.19Å; T332-R336 VanDerWaalsContact O-CG 3.29Å; T332-R336 WeakPolarHBondContact O-CG 3.41Å; T332-R336 PolarHBondContact O-N 2.9Å; T332-R336 PolarHBondContact OG1-NE 2.98Å; S333-R336 PolarHBondContact O-N 3.31Å; H334-R336 PolarHBondContact O-N 3.09Å; R336-L339 PolarHBondContact O-N 3.27Å; R336-R340 VanDerWaalsContact NH1-NH2 3.17Å; R336-R340 VanDerWaalsContact O-CG 3.25Å; R336-R340 WeakPolarHBondContact O-CG 2.93Å; R336-R340 PolarHBondContact O-N 3.41Å; R336-D373 IonicContact NH1-OD1 2.65Å
337A77.4Confident73.1Confident41 Ų4160 Ų6034%0.33930%0.295SS..Hα-helixtrans-62.1-43.7175.600000112.2S333 H334 R340 R341S333-A337 WeakPolarHBondContact O-CB 3.38Å; S333-A337 PolarHBondContact O-N 3.3Å; H334-A337 PolarHBondContact O-N 3.35Å; A337-R340 PolarHBondContact O-N 3.08Å; A337-R341 PolarHBondContact O-N 2.93Å
338E75.5Confident70.9Confident45 Ų4564.7 Ų64.721%0.2133%0.328CS..Hα-helixtrans-67-41.6177.3177.459-167.900112.2V270 H334 L335 R340 R341 R342V270-E338 HydrophobicContact CG2-CB 4.44Å; V270-E338 HydrophobicContact CG2-CG 3.82Å; H334-E338 WeakPolarHBondContact O-CB 3.06Å; H334-E338 PolarHBondContact O-N 3.49Å; L335-E338 PolarHBondContact O-N 3.29Å; E338-R340 VanDerWaalsContact C-N 3.35Å; E338-R340 PolarHBondContact O-N 3.39Å; E338-R341 WeakPolarHBondContact O-CB 3.33Å; E338-R341 PolarHBondContact O-N 3.38Å; E338-R341 VanDerWaalsContact O-N 3.14Å; E338-R342 WeakPolarHBondContact O-CG 3.31Å; E338-R342 PolarHBondContact O-N 2.95Å; E338-R342 IonicContact OE1-CZ 3.33Å; E338-R342 IonicContact OE1-NE 3.13Å; E338-R342 PolarHBondContact OE1-NE 3.4Å; E338-R342 IonicContact OE1-NH2 3.96Å; E338-R342 PolarHBondContact OE1-NH2 2.86Å
339L73.8Confident68.8Low32 Ų3275.2 Ų75.217%0.16837%0.367CS..Hα-helixtrans-60.1-43.6174.3-82.5174.5000112.1W278 Y283 L335 R336 R341 Q343W278-L339 HydrophobicContact CH2-CD1 4.46Å; W278-L339 HydrophobicContact CH2-CD2 3.84Å; W278-L339 HydrophobicContact CZ3-CD1 4.16Å; W278-L339 HydrophobicContact CZ3-CD2 4.02Å; Y283-L339 HydrophobicContact CD1-CD1 4Å; L335-L339 WeakPolarHBondContact O-CB 3.31Å; L335-L339 WeakPolarHBondContact O-CG 3.41Å; L335-L339 PolarHBondContact O-N 2.92Å; R336-L339 PolarHBondContact O-N 3.27Å; L339-R341 VanDerWaalsContact C-N 3.33Å; L339-R341 PolarHBondContact O-N 2.92Å; L339-Q343 WeakPolarHBondContact O-CG 3.47Å; L339-Q343 PolarHBondContact O-N 3.24Å
340R71.3Confident66.3Low94 Ų9478.1 Ų78.136%0.35539%0.389SS..Hα-helixtrans-59.1-46.2172.9-70.6174.9-162.9130.2-12.3110.4R336 A337 E338 Q343 T344 G372 D373R336-R340 VanDerWaalsContact NH1-NH2 3.17Å; R336-R340 VanDerWaalsContact O-CG 3.25Å; R336-R340 WeakPolarHBondContact O-CG 2.93Å; R336-R340 PolarHBondContact O-N 3.41Å; A337-R340 PolarHBondContact O-N 3.08Å; E338-R340 VanDerWaalsContact C-N 3.35Å; E338-R340 PolarHBondContact O-N 3.39Å; R340-Q343 PolarHBondContact O-N 2.95Å; R340-T344 WeakPolarHBondContact O-CG2 3.44Å; R340-T344 PolarHBondContact O-N 3.2Å; R340-T344 VanDerWaalsContact O-N 3.14Å; R340-G372 PolarHBondContact NH2-O 3.25Å; R340-D373 IonicContact CZ-OD1 2.72Å; R340-D373 IonicContact CZ-OD2 3.57Å; R340-D373 IonicContact NH1-OD1 2.99Å; R340-D373 PolarHBondContact NH1-OD1 3.36Å; R340-D373 IonicContact NH1-OD2 3.54Å; R340-D373 PolarHBondContact NH1-OD2 3.31Å; R340-D373 IonicContact NH2-OD1 3.31Å
341R73.3Confident63.8Low171 Ų17181.3 Ų81.365%0.64542%0.416SS*.Hα-helixtrans-60.5-49.7179.8-170.3-175-179.4-165.72.1112.2A337 E338 L339 Q343 T344 V345A337-R341 PolarHBondContact O-N 2.93Å; E338-R341 WeakPolarHBondContact O-CB 3.33Å; E338-R341 PolarHBondContact O-N 3.38Å; E338-R341 VanDerWaalsContact O-N 3.14Å; L339-R341 VanDerWaalsContact C-N 3.33Å; L339-R341 PolarHBondContact O-N 2.92Å; R341-Q343 VanDerWaalsContact C-N 3.3Å; R341-Q343 PolarHBondContact O-N 2.9Å; R341-T344 PolarHBondContact O-N 3Å; R341-T344 PolarHBondContact O-OG1 3.06Å; R341-V345 PolarHBondContact O-N 3.13Å
342R69.5Low61.8Low123 Ų12386 Ų8646%0.46445%0.448SS..Hα-helixtrans-58.5-41.8179.7-70.8-175.4-175.9-165.71.8112.2E338 T344 V345 D346E338-R342 WeakPolarHBondContact O-CG 3.31Å; E338-R342 PolarHBondContact O-N 2.95Å; E338-R342 IonicContact OE1-CZ 3.33Å; E338-R342 IonicContact OE1-NE 3.13Å; E338-R342 PolarHBondContact OE1-NE 3.4Å; E338-R342 IonicContact OE1-NH2 3.96Å; E338-R342 PolarHBondContact OE1-NH2 2.86Å; R342-T344 PolarHBondContact O-N 3.24Å; R342-V345 WeakPolarHBondContact O-CB 3.19Å; R342-V345 PolarHBondContact O-N 3.21Å; R342-V345 VanDerWaalsContact O-N 3.14Å; R342-D346 PolarHBondContact O-N 3.5Å
343Q60.9Low59.4Low85 Ų8596.2 Ų96.240%0.39749%0.488SS..Hα-helixtrans-69.5-34.2-179.5-70.7177.9-5.400113.1L339 R340 R341 V345 D346 V347L339-Q343 WeakPolarHBondContact O-CG 3.47Å; L339-Q343 PolarHBondContact O-N 3.24Å; R340-Q343 PolarHBondContact O-N 2.95Å; R341-Q343 VanDerWaalsContact C-N 3.3Å; R341-Q343 PolarHBondContact O-N 2.9Å; Q343-V345 PolarHBondContact O-N 2.89Å; Q343-D346 PolarHBondContact O-N 3.4Å; Q343-V347 WeakPolarHBondContact O-CG2 3.5Å; Q343-V347 PolarHBondContact O-N 3.24Å; Q343-V347 VanDerWaalsContact O-N 3.13Å
344T57.4Low57Low89 Ų89100.7 Ų100.755%0.54651%0.514SS..Hα-helixtrans-62.2-30.2172.461.80000112.6R340 R341 R342 S348R340-T344 WeakPolarHBondContact O-CG2 3.44Å; R340-T344 PolarHBondContact O-N 3.2Å; R340-T344 VanDerWaalsContact O-N 3.14Å; R341-T344 PolarHBondContact O-N 3Å; R341-T344 PolarHBondContact O-OG1 3.06Å; R342-T344 PolarHBondContact O-N 3.24Å; T344-S348 PolarHBondContact O-N 3.16Å; T344-S348 PolarHBondContact O-OG 3.47Å
345V51Low55Low76 Ų76103 Ų10346%0.46154%0.535SS..Hα-helixtrans-74.9-37.7177.8179.40000111.5R341 R342 Q343 S348 R349R341-V345 PolarHBondContact O-N 3.13Å; R342-V345 WeakPolarHBondContact O-CB 3.19Å; R342-V345 PolarHBondContact O-N 3.21Å; R342-V345 VanDerWaalsContact O-N 3.14Å; Q343-V345 PolarHBondContact O-N 2.89Å; V345-S348 WeakPolarHBondContact O-CB 3.1Å; V345-S348 PolarHBondContact O-N 2.79Å; V345-R349 PolarHBondContact O-N 3.42Å
346D45Very low52.9Low111 Ų111107 Ų10759%0.59457%0.569SS**Hα-helixtrans-70.7-39.1178.7-75.4-26.2000112.7R342 Q343 S348 R349 S350R342-D346 PolarHBondContact O-N 3.5Å; Q343-D346 PolarHBondContact O-N 3.4Å; D346-S348 PolarHBondContact O-N 2.9Å; D346-R349 PolarHBondContact O-N 3.48Å; D346-S350 PolarHBondContact O-N 2.7Å
347V47.3Very low51Low116 Ų116111.4 Ų111.470%0.70360%0.595SS**Hα-helixtrans-62.5-26.9172.7178.20000111.3Q343 R349Q343-V347 WeakPolarHBondContact O-CG2 3.5Å; Q343-V347 PolarHBondContact O-N 3.24Å; Q343-V347 VanDerWaalsContact O-N 3.13Å; V347-R349 VanDerWaalsContact C-N 3.32Å; V347-R349 PolarHBondContact O-N 2.79Å
348S44.8Very low49Very low104 Ų104120.4 Ų120.473%0.72762%0.62SS**THydrogen-bonded Turntrans-77-13.5177.6-550000113.9T344 V345 D346T344-S348 PolarHBondContact O-N 3.16Å; T344-S348 PolarHBondContact O-OG 3.47Å; V345-S348 WeakPolarHBondContact O-CB 3.1Å; V345-S348 PolarHBondContact O-N 2.79Å; D346-S348 PolarHBondContact O-N 2.9Å
349R43.1Very low47.3Very low222 Ų222126.9 Ų126.984%0.83865%0.647SS**THydrogen-bonded Turntrans-108.9-18-177.6-90.5-175.4-176-177.93115.3V345 D346 V347V345-R349 PolarHBondContact O-N 3.42Å; D346-R349 PolarHBondContact O-N 3.48Å; V347-R349 VanDerWaalsContact C-N 3.32Å; V347-R349 PolarHBondContact O-N 2.79Å
350S35.4Very low45.9Very low81 Ų81130.2 Ų130.257%0.56667%0.665SS**SBendtrans-95.9106-179.359.10000113.5D346D346-S350 PolarHBondContact O-N 2.7Å
351T33.8Very low44.3Very low126 Ų126131 Ų13177%0.77368%0.676SS**  trans70.8115.6151.7430000120.3Y353T351-Y353 PolarHBondContact O-N 3.13Å
352P42.3Very low42.7Very low114 Ų114125.9 Ų125.974%0.7467%0.67SS**  trans-95.584.9176.236.1-29000111.4
353Y30.4Very low41.4Very low215 Ų215124.2 Ų124.284%0.84367%0.673SS**  trans-149.1135.8161.3-83.7-71.7000113.6T351T351-Y353 PolarHBondContact O-N 3.13Å
354T32Very low40.4Very low131 Ų131124.7 Ų124.780%0.80468%0.678SS**  trans74.695.8168.760.90000117.8A356T354-A356 PolarHBondContact O-N 3.32Å
355V36.2Very low39.3Very low159 Ų159125.6 Ų125.696%0.96468%0.68SS**  trans-6095.2159.7177.30000108.8
356A33.1Very low38.8Very low87 Ų87129.3 Ų129.372%0.71969%0.692SS**  trans-120.5113.8163.400000108.7T354T354-A356 PolarHBondContact O-N 3.32Å
357N36.7Very low38.6Very low118 Ų118129.6 Ų129.663%0.63169%0.694SS**  trans53.484.3163.7-73.8-8.2000119.6K359 D360N357-K359 PolarHBondContact O-N 2.94Å; N357-D360 PolarHBondContact O-N 3.46Å
358R36.6Very low38.2Very low230 Ų230130.4 Ų130.487%0.86869%0.688SS**THydrogen-bonded Turntrans-54-11.4163.8179.5177.4-94.5-174.1-7115.3
359K39.8Very low37.7Very low181 Ų181128.1 Ų128.179%0.78768%0.681SS**THydrogen-bonded Turntrans-81-27.3179.8-77.6-173.2175.4-178.10113.9N357 L361N357-K359 PolarHBondContact O-N 2.94Å; K359-L361 VanDerWaalsContact C-N 3.33Å
360D43.4Very low37.3Very low101 Ų101123 Ų12354%0.5467%0.669SS.*Hα-helixtrans-81.7-16.6179.2-59-31.2000112.3N357 T363 L364N357-D360 PolarHBondContact O-N 3.46Å; D360-T363 PolarHBondContact O-OG1 2.93Å; D360-L364 WeakPolarHBondContact O-CD1 3.36Å; D360-L364 WeakPolarHBondContact O-CG 3.31Å
361L38.2Very low37.6Very low111 Ų111121.6 Ų121.658%0.58167%0.667SS**Hα-helixtrans-77.6-23.7174-98.1150.2000113.5K359 N365K359-L361 VanDerWaalsContact C-N 3.33Å; L361-N365 PolarHBondContact O-N 2.76Å
362A39.1Very low38.1Very low63 Ų63116.8 Ų116.852%0.52164%0.643SS.*Hα-helixtrans-78.2-36.5179.700000112.2N365A362-N365 PolarHBondContact O-N 3.2Å
363T43.2Very low38.5Very low88 Ų88115.6 Ų115.654%0.5463%0.63SS.*Hα-helixtrans-71-34.5174.745.30000112D360 N365 E366 D367D360-T363 PolarHBondContact O-OG1 2.93Å; T363-N365 VanDerWaalsContact C-N 3.33Å; T363-N365 PolarHBondContact O-N 2.94Å; T363-E366 PolarHBondContact O-N 3.41Å; T363-D367 PolarHBondContact O-N 3.34Å
364L38.5Very low39.6Very low95 Ų95114 Ų11450%0.49763%0.631SS.*Hα-helixtrans-65.7-34.3173.9-74.2167.9000112.5D360 D367 F368D360-L364 WeakPolarHBondContact O-CD1 3.36Å; D360-L364 WeakPolarHBondContact O-CG 3.31Å; L364-D367 PolarHBondContact O-N 3.08Å; L364-F368 WeakPolarHBondContact O-CD2 3.4Å; L364-F368 PolarHBondContact O-N 3.2Å
365N36.4Very low41.5Very low109 Ų109112.5 Ų112.558%0.58361%0.614SS**Hα-helixtrans-72.1-24.7178.9-86-5.1000114.4L361 A362 T363L361-N365 PolarHBondContact O-N 2.76Å; A362-N365 PolarHBondContact O-N 3.2Å; T363-N365 VanDerWaalsContact C-N 3.33Å; T363-N365 PolarHBondContact O-N 2.94Å
366E39.2Very low43.7Very low153 Ų153105.5 Ų105.572%0.71557%0.571SS**Hα-helixtrans-75.7-33.5172.5-75.2-167.6162.400112.1T363 F368 G369T363-E366 PolarHBondContact O-N 3.41Å; E366-F368 PolarHBondContact O-N 3.11Å; E366-G369 PolarHBondContact O-N 3.49Å
367D41.3Very low46.1Very low117 Ų117105.7 Ų105.763%0.62656%0.558SS**Hα-helixtrans-70-21173.4-81.4-22.7000113T363 L364 G369T363-D367 PolarHBondContact O-N 3.34Å; L364-D367 PolarHBondContact O-N 3.08Å; D367-G369 VanDerWaalsContact C-N 3.29Å
368F39.4Very low48.4Very low133 Ų133104.4 Ų104.458%0.58355%0.55SS**THydrogen-bonded Turntrans-74.8-15169.6-79-70.4000113.6L364 E366L364-F368 WeakPolarHBondContact O-CD2 3.4Å; L364-F368 PolarHBondContact O-N 3.2Å; E366-F368 PolarHBondContact O-N 3.11Å
369G34Very low50.7Low56 Ų5694 Ų9458%0.57751%0.512SS*.THydrogen-bonded Turntrans-92.6-22.8-172.900000115.6E366 D367 G371E366-G369 PolarHBondContact O-N 3.49Å; D367-G369 VanDerWaalsContact C-N 3.29Å; G369-G371 PolarHBondContact O-N 2.92Å; G369-G371 VanDerWaalsContact O-N 3.14Å
370I33.4Very low53Low114 Ų11485.4 Ų85.459%0.58547%0.474SS*.THydrogen-bonded Turntrans-90.582.8-175.6-52.8176.7000109.3
371G42.1Very low55Low52 Ų5281.1 Ų81.154%0.53645%0.452SS..THydrogen-bonded Turntrans134.611.1172.300000116.2G369G369-G371 PolarHBondContact O-N 2.92Å; G369-G371 VanDerWaalsContact O-N 3.14Å
372G44.5Very low57.3Low25 Ų2578 Ų7826%0.25844%0.436SS..SBendtrans-59.7-77.8-165.400000116.9R340R340-G372 PolarHBondContact NH2-O 3.25Å
373D50.9Low59.6Low90 Ų9075 Ų7548%0.48141%0.412SS..SBendtrans-148.1-3.1-165-74.4-41.2000117.2R336 R340R336-D373 IonicContact NH1-OD1 2.65Å; R340-D373 IonicContact CZ-OD1 2.72Å; R340-D373 IonicContact CZ-OD2 3.57Å; R340-D373 IonicContact NH1-OD1 2.99Å; R340-D373 PolarHBondContact NH1-OD1 3.36Å; R340-D373 IonicContact NH1-OD2 3.54Å; R340-D373 PolarHBondContact NH1-OD2 3.31Å; R340-D373 IonicContact NH2-OD1 3.31Å
374E52.8Low61.6Low181 Ų18171.2 Ų71.285%0.84639%0.388SS*.SBendtrans-114.4-0.8-175.7-64.6-146.816400116.4
375E73.7Confident63.7Low99 Ų9970.5 Ų70.546%0.46338%0.382SS..  trans-92.2-9.7-176.7-72.6-167.8-17000114.6E377 L378 Q379E375-E377 PolarHBondContact O-N 3.44Å; E375-L378 HydrophobicContact CG-CD2 4.38Å; E375-L378 CarbonylContact O-C 3.52Å; E375-L378 WeakPolarHBondContact O-CA 3.27Å; E375-L378 WeakPolarHBondContact O-CB 3.4Å; E375-L378 PolarHBondContact O-N 3.21Å; E375-Q379 HydrophobicContact CB-CG 4.09Å; E375-Q379 WeakPolarHBondContact O-CB 3.32Å; E375-Q379 WeakPolarHBondContact O-CG 3.47Å; E375-Q379 PolarHBondContact O-N 3.48Å; E375-Q379 PolarHBondContact OE2-NE2 3.41Å
376D81.8Confident66Low12 Ų1267 Ų676%0.06437%0.366CS..Hα-helixtrans-61-41.3-174.965.1-12.2000113.1L329 R330 Q379 A380L329-D376 HydrophobicContact CB-CB 3.92Å; R330-D376 WeakPolarHBondContact CA-OD2 3.31Å; R330-D376 WeakPolarHBondContact CB-OD2 3.46Å; R330-D376 IonicContact CZ-OD1 2.68Å; R330-D376 IonicContact CZ-OD2 3.62Å; R330-D376 IonicContact NE-OD1 3.68Å; R330-D376 IonicContact NE-OD2 3.82Å; R330-D376 PolarHBondContact NE-OD2 3.38Å; R330-D376 VanDerWaalsContact NH2-CG 3.3Å; R330-D376 IonicContact NH2-OD1 2.91Å; R330-D376 PolarHBondContact NH2-OD1 2.74Å; R330-D376 IonicContact NH2-OD2 2.7Å; R330-D376 PolarHBondContact NH2-OD2 2.72Å; R330-D376 VanDerWaalsContact NH2-OD2 3.13Å; D376-Q379 PolarHBondContact O-N 2.86Å; D376-A380 WeakPolarHBondContact O-CB 3.43Å; D376-A380 PolarHBondContact O-N 2.97Å
377E83.4Confident68.2Low92 Ų9259.7 Ų59.743%0.4333%0.332SS..Hα-helixtrans-64.9-39.9172.4-55.6-162.7172.400111.8R330 E375 A381R330-E377 IonicContact CZ-OE1 2.88Å; R330-E377 VanDerWaalsContact CZ-OE1 3.3Å; R330-E377 IonicContact NH1-OE1 3.65Å; R330-E377 PolarHBondContact NH1-OE1 3.41Å; R330-E377 VanDerWaalsContact NH2-CD 3.31Å; R330-E377 IonicContact NH2-OE1 3.55Å; R330-E377 PolarHBondContact NH2-OE1 2.77Å; E375-E377 PolarHBondContact O-N 3.44Å; E377-A381 WeakPolarHBondContact O-CB 3.36Å; E377-A381 PolarHBondContact O-N 3.22Å
378L85.4Confident70.5Confident90 Ų9054.1 Ų54.147%0.47130%0.302SS..Hα-helixtrans-65.1-40.3177179.463.2000111.5E375 A381 L382E375-L378 HydrophobicContact CG-CD2 4.38Å; E375-L378 CarbonylContact O-C 3.52Å; E375-L378 WeakPolarHBondContact O-CA 3.27Å; E375-L378 WeakPolarHBondContact O-CB 3.4Å; E375-L378 PolarHBondContact O-N 3.21Å; L378-A381 WeakPolarHBondContact O-CB 3.44Å; L378-A381 PolarHBondContact O-N 3.14Å; L378-L382 HydrophobicContact CD1-CD1 4.45Å; L378-L382 HydrophobicContact CD1-CG 4.36Å; L378-L382 HydrophobicContact CG-CD1 4.23Å; L378-L382 VanDerWaalsContact O-CG 3.26Å; L378-L382 WeakPolarHBondContact O-CG 3.28Å; L378-L382 PolarHBondContact O-N 3.11Å
379Q84.7Confident72.8Confident13 Ų1348 Ų486%0.06128%0.275CS..Hα-helixtrans-70-43.3-179.4-65-72.9-20.300110.4A326 E375 D376 A381 A383A326-Q379 HydrophobicContact CB-CB 4.07Å; E375-Q379 HydrophobicContact CB-CG 4.09Å; E375-Q379 WeakPolarHBondContact O-CB 3.32Å; E375-Q379 WeakPolarHBondContact O-CG 3.47Å; E375-Q379 PolarHBondContact O-N 3.48Å; E375-Q379 PolarHBondContact OE2-NE2 3.41Å; D376-Q379 PolarHBondContact O-N 2.86Å; Q379-A381 PolarHBondContact O-N 2.98Å; Q379-A383 VanDerWaalsContact O-CB 3.27Å; Q379-A383 WeakPolarHBondContact O-CB 3.38Å; Q379-A383 PolarHBondContact O-N 2.8Å
380A86.9Confident75.3Confident0 Ų046.2 Ų46.20%025%0.252CS..Hα-helixtrans-60.4-39169.500000110.8L323 A326 D376 A383 I384 M423L323-A380 HydrophobicContact CD1-CB 4.33Å; A326-A380 HydrophobicContact CB-CB 3.7Å; D376-A380 WeakPolarHBondContact O-CB 3.43Å; D376-A380 PolarHBondContact O-N 2.97Å; A380-A383 PolarHBondContact O-N 2.97Å; A380-I384 WeakPolarHBondContact O-CD1 3.48Å; A380-I384 VanDerWaalsContact O-CG1 3.3Å; A380-I384 WeakPolarHBondContact O-CG1 3.33Å; A380-I384 PolarHBondContact O-N 2.9Å; A380-M423 HydrophobicContact CB-CE 3.93Å; A380-M423 HydrophobicContact CB-SD 3.55Å; A380-M423 VanDerWaalsContact CB-SD 3.55Å
381A86.3Confident77.9Confident10 Ų1040.9 Ų40.98%0.08322%0.224CC..Hα-helixtrans-62.2-53.7-179.500000112.5E377 L378 Q379 A383 I384 E385 R426E377-A381 WeakPolarHBondContact O-CB 3.36Å; E377-A381 PolarHBondContact O-N 3.22Å; L378-A381 WeakPolarHBondContact O-CB 3.44Å; L378-A381 PolarHBondContact O-N 3.14Å; Q379-A381 PolarHBondContact O-N 2.98Å; A381-A383 VanDerWaalsContact C-N 3.28Å; A381-A383 PolarHBondContact O-N 3.15Å; A381-I384 PolarHBondContact O-N 2.65Å; A381-E385 WeakPolarHBondContact O-CB 3.42Å; A381-E385 WeakPolarHBondContact O-CG 3.31Å; A381-E385 PolarHBondContact O-N 2.87Å; A381-R426 PolarHBondContact O-NH2 3.2Å; A381-R426 VanDerWaalsContact O-NH2 3.1Å
382L85.8Confident80.1Confident47 Ų4738.4 Ų38.425%0.24620%0.199CC..Hα-helixtrans-57.7-42.9176.1-68.7171.4000111.2L378 E385 S386L378-L382 HydrophobicContact CD1-CD1 4.45Å; L378-L382 HydrophobicContact CD1-CG 4.36Å; L378-L382 HydrophobicContact CG-CD1 4.23Å; L378-L382 VanDerWaalsContact O-CG 3.26Å; L378-L382 WeakPolarHBondContact O-CG 3.28Å; L378-L382 PolarHBondContact O-N 3.11Å; L382-E385 PolarHBondContact O-N 3.2Å; L382-S386 PolarHBondContact O-N 3.44Å; L382-S386 PolarHBondContact O-OG 3.4Å
383A87.8Confident82.2Confident0 Ų039.1 Ų39.10%019%0.194CC..Hα-helixtrans-61.8-45.4179.700000113.2A319 R322 L323 Q379 A380 A381 E385 S386 G387 A388A319-A383 VanDerWaalsContact O-CB 3.28Å; A319-A383 WeakPolarHBondContact O-CB 3.49Å; R322-A383 HydrophobicContact CB-CB 4.07Å; R322-A383 HydrophobicContact CG-CB 4.21Å; L323-A383 HydrophobicContact CB-CB 3.9Å; Q379-A383 VanDerWaalsContact O-CB 3.27Å; Q379-A383 WeakPolarHBondContact O-CB 3.38Å; Q379-A383 PolarHBondContact O-N 2.8Å; A380-A383 PolarHBondContact O-N 2.97Å; A381-A383 VanDerWaalsContact C-N 3.28Å; A381-A383 PolarHBondContact O-N 3.15Å; A383-E385 VanDerWaalsContact C-N 3.31Å; A383-S386 WeakPolarHBondContact CA-OG 3.49Å; A383-S386 PolarHBondContact O-N 2.89Å; A383-S386 PolarHBondContact O-OG 3.24Å; A383-S386 VanDerWaalsContact O-OG 3.06Å; A383-G387 PolarHBondContact O-N 3.39Å; A383-A388 WeakPolarHBondContact O-CB 3.47Å; A383-A388 PolarHBondContact O-N 3.48Å; A383-A388 VanDerWaalsContact O-N 3.15Å
384I86.3Confident83.8Confident7 Ų739.3 Ų39.34%0.03619%0.19CC..Hα-helixtrans-65.3-40.4177.4-68157.3000110.4L323 A380 A381 S386 G387 L389 R426 I430L323-I384 HydrophobicContact CD1-CD1 4.31Å; L323-I384 HydrophobicContact CD1-CG1 4.07Å; A380-I384 WeakPolarHBondContact O-CD1 3.48Å; A380-I384 VanDerWaalsContact O-CG1 3.3Å; A380-I384 WeakPolarHBondContact O-CG1 3.33Å; A380-I384 PolarHBondContact O-N 2.9Å; A381-I384 PolarHBondContact O-N 2.65Å; I384-S386 VanDerWaalsContact C-N 3.33Å; I384-S386 PolarHBondContact O-N 3.25Å; I384-G387 PolarHBondContact O-N 3.39Å; I384-G387 VanDerWaalsContact O-N 3.09Å; I384-L389 HydrophobicContact CG2-CD1 4.33Å; I384-R426 HydrophobicContact CD1-CG 3.49Å; I384-R426 VanDerWaalsContact CD1-CG 3.49Å; I384-I430 HydrophobicContact CD1-CD1 3.81Å; I384-I430 HydrophobicContact CD1-CG1 4.41Å; I384-I430 HydrophobicContact CG1-CD1 4.4Å; I384-I430 HydrophobicContact CG2-CD1 3.88Å; I384-I430 HydrophobicContact CG2-CG1 3.93Å
385E82.7Confident85.4Confident80 Ų8031.4 Ų31.437%0.37415%0.153SC..Hα-helixtrans-67-32.9179.8-70.5177.7-164.400113.1A381 L382 A383 G387 R426 R433A381-E385 WeakPolarHBondContact O-CB 3.42Å; A381-E385 WeakPolarHBondContact O-CG 3.31Å; A381-E385 PolarHBondContact O-N 2.87Å; L382-E385 PolarHBondContact O-N 3.2Å; A383-E385 VanDerWaalsContact C-N 3.31Å; E385-G387 PolarHBondContact O-N 2.98Å; E385-R426 IonicContact OE1-NH2 3.08Å; E385-R426 PolarHBondContact OE1-NH2 3.42Å; E385-R433 IonicContact OE1-CZ 3.4Å; E385-R433 IonicContact OE1-NH1 3.55Å; E385-R433 IonicContact OE1-NH2 2.84Å; E385-R433 PolarHBondContact OE1-NH2 3.02Å
386S83.4Confident86.1Confident35 Ų3526.7 Ų26.725%0.24513%0.131CC..THydrogen-bonded Turntrans-82.610.1172.755.20000113.8A319 L382 A383 I384A319-S386 WeakPolarHBondContact CB-OG 3.2Å; L382-S386 PolarHBondContact O-N 3.44Å; L382-S386 PolarHBondContact O-OG 3.4Å; A383-S386 WeakPolarHBondContact CA-OG 3.49Å; A383-S386 PolarHBondContact O-N 2.89Å; A383-S386 PolarHBondContact O-OG 3.24Å; A383-S386 VanDerWaalsContact O-OG 3.06Å; I384-S386 VanDerWaalsContact C-N 3.33Å; I384-S386 PolarHBondContact O-N 3.25Å
387G85.7Confident86.2Confident0 Ų027 Ų270%013%0.133CC..THydrogen-bonded Turntrans87.825168.900000117.6A383 I384 E385 L389 E390 F391 H450A383-G387 PolarHBondContact O-N 3.39Å; I384-G387 PolarHBondContact O-N 3.39Å; I384-G387 VanDerWaalsContact O-N 3.09Å; E385-G387 PolarHBondContact O-N 2.98Å; G387-L389 VanDerWaalsContact C-N 3.3Å; G387-L389 PolarHBondContact O-N 2.9Å; G387-E390 WeakPolarHBondContact O-CB 3.42Å; G387-E390 PolarHBondContact O-N 3.02Å; G387-E390 VanDerWaalsContact O-N 3.1Å; G387-F391 PolarHBondContact O-N 3.06Å; G387-H450 WeakPolarHBondContact CA-CE1 3.33Å; G387-H450 WeakPolarHBondContact CA-ND1 3.42Å
388A89Confident86.2Confident0 Ų025.8 Ų25.80%013%0.129CC..Hα-helixtrans-51.2-43.7176.300000113.9A319 F320 L323 A383 F391 A392A319-A388 HydrophobicContact CB-CB 4.08Å; F320-A388 HydrophobicContact CB-CB 4.36Å; F320-A388 HydrophobicContact CD2-CB 4.24Å; F320-A388 WeakPolarHBondContact CD2-O 3.23Å; L323-A388 HydrophobicContact CB-CB 4.17Å; L323-A388 HydrophobicContact CD2-CB 4.03Å; A383-A388 WeakPolarHBondContact O-CB 3.47Å; A383-A388 PolarHBondContact O-N 3.48Å; A383-A388 VanDerWaalsContact O-N 3.15Å; A388-F391 WeakPolarHBondContact O-CB 2.88Å; A388-F391 PolarHBondContact O-N 3.48Å; A388-A392 PolarHBondContact O-N 2.94Å
389L89.1Confident85.9Confident4 Ų421.7 Ų21.72%0.02111%0.108CC..Hα-helixtrans-73.1-31-179-59.9-179.9000112.7L323 I384 G387 R393 L419 I430 N454 F455 L458L323-L389 HydrophobicContact CD2-CD2 3.98Å; I384-L389 HydrophobicContact CG2-CD1 4.33Å; G387-L389 VanDerWaalsContact C-N 3.3Å; G387-L389 PolarHBondContact O-N 2.9Å; L389-R393 PolarHBondContact O-N 3.37Å; L389-L419 HydrophobicContact CD2-CD2 4.16Å; L389-I430 HydrophobicContact CD1-CD1 4.11Å; L389-N454 VanDerWaalsContact C-ND2 3.34Å; L389-N454 PolarHBondContact O-ND2 3.17Å; L389-N454 VanDerWaalsContact O-ND2 3.08Å; L389-F455 HydrophobicContact CD1-CB 4.16Å; L389-F455 HydrophobicContact CD1-CD2 4Å; L389-F455 HydrophobicContact CD1-CG 4.35Å; L389-F455 HydrophobicContact CD2-CD2 4.09Å; L389-F455 HydrophobicContact CD2-CE2 4.47Å; L389-L458 HydrophobicContact CD2-CD2 4.34Å
390E84.8Confident85.3Confident20 Ų2024 Ų249%0.09312%0.123CC..Hα-helixtrans-67.5-45.1174.2-164-167.8-178.800110.1K316 G387 R393 K394 G449 H450 N454K316-E390 IonicContact NZ-OE1 3.98Å; K316-E390 IonicContact NZ-OE2 2.83Å; K316-E390 PolarHBondContact NZ-OE2 3.45Å; G387-E390 WeakPolarHBondContact O-CB 3.42Å; G387-E390 PolarHBondContact O-N 3.02Å; G387-E390 VanDerWaalsContact O-N 3.1Å; E390-R393 PolarHBondContact O-N 2.83Å; E390-K394 HydrophobicContact CG-CD 3.86Å; E390-K394 HydrophobicContact CG-CG 4.26Å; E390-K394 WeakPolarHBondContact O-CB 3.39Å; E390-K394 PolarHBondContact O-N 3.08Å; E390-K394 VanDerWaalsContact OE1-CE 3.31Å; E390-K394 WeakPolarHBondContact OE1-CE 3.32Å; E390-K394 IonicContact OE1-NZ 2.63Å; E390-K394 PolarHBondContact OE1-NZ 2.97Å; E390-G449 VanDerWaalsContact CB-O 3.31Å; E390-G449 WeakPolarHBondContact CB-O 3.34Å; E390-H450 IonicContact OE2-CE1 3.9Å; E390-H450 PolarHBondContact OE2-CE1 3.42Å; E390-H450 VanDerWaalsContact OE2-CE1 3.28Å; E390-H450 IonicContact OE2-ND1 3.01Å; E390-N454 PolarHBondContact N-ND2 3.34Å
391F87.9Confident84.5Confident1 Ų125.8 Ų25.80%0.00413%0.133CC..Hα-helixtrans-57.3-50.7175.6-171.5-99.3000111.3L250 K316 L317 F320 G387 A388 R393 K394 Q395 I396L250-F391 HydrophobicContact CD2-CE1 4.17Å; K316-F391 HydrophobicContact CB-CB 4.01Å; K316-F391 HydrophobicContact CB-CD2 3.68Å; K316-F391 HydrophobicContact CB-CG 4.11Å; L317-F391 HydrophobicContact CB-CE1 4.2Å; L317-F391 HydrophobicContact CB-CE2 3.99Å; L317-F391 HydrophobicContact CB-CZ 3.77Å; L317-F391 HydrophobicContact CD1-CE1 3.56Å; L317-F391 HydrophobicContact CD1-CZ 3.49Å; L317-F391 VanDerWaalsContact CD1-CZ 3.49Å; L317-F391 HydrophobicContact CG-CZ 4.23Å; F320-F391 HydrophobicContact CB-CD1 3.92Å; F320-F391 HydrophobicContact CG-CD1 4.29Å; G387-F391 PolarHBondContact O-N 3.06Å; A388-F391 WeakPolarHBondContact O-CB 2.88Å; A388-F391 PolarHBondContact O-N 3.48Å; F391-R393 VanDerWaalsContact C-N 3.26Å; F391-R393 PolarHBondContact O-N 3.05Å; F391-K394 PolarHBondContact O-N 3Å; F391-Q395 HydrophobicContact CD2-CB 3.82Å; F391-Q395 HydrophobicContact CD2-CG 3.65Å; F391-Q395 HydrophobicContact CE1-CB 4.42Å; F391-Q395 HydrophobicContact CE2-CB 3.65Å; F391-Q395 HydrophobicContact CE2-CG 3.62Å; F391-Q395 HydrophobicContact CG-CB 4.27Å; F391-Q395 HydrophobicContact CG-CG 4.47Å; F391-Q395 HydrophobicContact CZ-CB 3.95Å; F391-Q395 HydrophobicContact CZ-CG 4.41Å; F391-Q395 WeakPolarHBondContact O-CA 2.86Å; F391-Q395 VanDerWaalsContact O-CB 3.29Å; F391-Q395 WeakPolarHBondContact O-CB 3.36Å; F391-Q395 PolarHBondContact O-N 3.28Å; F391-I396 HydrophobicContact CD1-CD1 3.9Å; F391-I396 HydrophobicContact CD1-CG1 3.96Å; F391-I396 HydrophobicContact CE1-CD1 3.83Å; F391-I396 HydrophobicContact CE1-CG1 3.71Å; F391-I396 PolarHBondContact O-N 3.38Å
392A89.6Confident83.9Confident0 Ų025.5 Ų25.50%013%0.13CC..Iπ-helixtrans-52.4-44.5176.500000112.4F320 A388 I396 L397 M412 L458F320-A392 HydrophobicContact CD2-CB 4.06Å; F320-A392 HydrophobicContact CE2-CB 3.69Å; F320-A392 HydrophobicContact CZ-CB 4.27Å; A388-A392 PolarHBondContact O-N 2.94Å; A392-I396 WeakPolarHBondContact O-CB 2.94Å; A392-L397 WeakPolarHBondContact O-CG 3.4Å; A392-L397 PolarHBondContact O-N 2.79Å; A392-M412 HydrophobicContact CB-CE 3.82Å; A392-L458 HydrophobicContact CB-CD1 3.78Å; A392-L458 HydrophobicContact CB-CD2 4.11Å
393R88.5Confident83.2Confident40 Ų4025.4 Ų25.415%0.15113%0.128CC..Iπ-helixtrans-79-46.5-177.1-166.7-178.366.1101.7-6.4113.3L389 E390 F391 N398 N454 L458L389-R393 PolarHBondContact O-N 3.37Å; E390-R393 PolarHBondContact O-N 2.83Å; F391-R393 VanDerWaalsContact C-N 3.26Å; F391-R393 PolarHBondContact O-N 3.05Å; R393-N398 PolarHBondContact O-ND2 2.82Å; R393-N454 VanDerWaalsContact CZ-OD1 3.28Å; R393-N454 PolarHBondContact NE-OD1 3Å; R393-N454 PolarHBondContact NH2-OD1 3Å; R393-L458 HydrophobicContact CB-CB 4.33Å; R393-L458 HydrophobicContact CB-CD1 3.79Å; R393-L458 HydrophobicContact CG-CB 4.47Å; R393-L458 HydrophobicContact CG-CD1 4.33Å
394K84.8Confident82.2Confident94 Ų9428.6 Ų28.641%0.40914%0.14SC..Iπ-helixtrans-85.1-34.4-170.7-69.3-170.7-178.3173.80113.1E390 F391 N398E390-K394 HydrophobicContact CG-CD 3.86Å; E390-K394 HydrophobicContact CG-CG 4.26Å; E390-K394 WeakPolarHBondContact O-CB 3.39Å; E390-K394 PolarHBondContact O-N 3.08Å; E390-K394 VanDerWaalsContact OE1-CE 3.31Å; E390-K394 WeakPolarHBondContact OE1-CE 3.32Å; E390-K394 IonicContact OE1-NZ 2.63Å; E390-K394 PolarHBondContact OE1-NZ 2.97Å; F391-K394 PolarHBondContact O-N 3Å; K394-N398 WeakPolarHBondContact CA-ND2 3.35Å; K394-N398 PolarHBondContact O-ND2 2.89Å
395Q85.3Confident81.7Confident15 Ų1529.4 Ų29.47%0.0714%0.144CC..Iπ-helixtrans-100-53.3-175.7-68.5-91.27.900111G240 D313 F391 T399G240-Q395 PolarHBondContact O-NE2 2.75Å; G240-Q395 PolarHBondContact O-OE1 3.45Å; D313-Q395 PolarHBondContact OD1-NE2 3.32Å; D313-Q395 VanDerWaalsContact OD1-NE2 3.14Å; D313-Q395 PolarHBondContact OD2-NE2 3.38Å; F391-Q395 HydrophobicContact CD2-CB 3.82Å; F391-Q395 HydrophobicContact CD2-CG 3.65Å; F391-Q395 HydrophobicContact CE1-CB 4.42Å; F391-Q395 HydrophobicContact CE2-CB 3.65Å; F391-Q395 HydrophobicContact CE2-CG 3.62Å; F391-Q395 HydrophobicContact CG-CB 4.27Å; F391-Q395 HydrophobicContact CG-CG 4.47Å; F391-Q395 HydrophobicContact CZ-CB 3.95Å; F391-Q395 HydrophobicContact CZ-CG 4.41Å; F391-Q395 WeakPolarHBondContact O-CA 2.86Å; F391-Q395 VanDerWaalsContact O-CB 3.29Å; F391-Q395 WeakPolarHBondContact O-CB 3.36Å; F391-Q395 PolarHBondContact O-N 3.28Å; Q395-T399 PolarHBondContact O-OG1 3.4Å; Q395-T399 VanDerWaalsContact O-OG1 3.12Å
396I88Confident81.2Confident0 Ų026.3 Ų26.30%013%0.13CC..Iπ-helixtrans-73.8-55.8-173.4-56.9179.4000112.3L247 L250 M251 F320 F391 A392 N398 T399 F402 M412L247-I396 HydrophobicContact CD1-CG2 3.91Å; L250-I396 HydrophobicContact CD2-CD1 3.74Å; L250-I396 HydrophobicContact CD2-CG1 4.17Å; M251-I396 HydrophobicContact CE-CG2 4.26Å; F320-I396 HydrophobicContact CD1-CD1 3.57Å; F320-I396 HydrophobicContact CE1-CD1 3.44Å; F320-I396 VanDerWaalsContact CE1-CD1 3.44Å; F320-I396 HydrophobicContact CG-CD1 4.24Å; F320-I396 HydrophobicContact CZ-CD1 4.05Å; F391-I396 HydrophobicContact CD1-CD1 3.9Å; F391-I396 HydrophobicContact CD1-CG1 3.96Å; F391-I396 HydrophobicContact CE1-CD1 3.83Å; F391-I396 HydrophobicContact CE1-CG1 3.71Å; F391-I396 PolarHBondContact O-N 3.38Å; A392-I396 WeakPolarHBondContact O-CB 2.94Å; I396-N398 PolarHBondContact O-N 3.21Å; I396-T399 WeakPolarHBondContact O-CB 3.37Å; I396-T399 PolarHBondContact O-N 3Å; I396-T399 VanDerWaalsContact O-N 3.12Å; I396-T399 PolarHBondContact O-OG1 3.23Å; I396-F402 HydrophobicContact CG2-CD2 3.97Å; I396-F402 HydrophobicContact CG2-CE2 3.48Å; I396-F402 VanDerWaalsContact CG2-CE2 3.48Å; I396-F402 HydrophobicContact CG2-CZ 4.35Å; I396-F402 WeakPolarHBondContact O-CD2 3.43Å; I396-M412 HydrophobicContact CD1-SD 4.37Å; I396-M412 HydrophobicContact CG2-SD 4.24Å
397L85.8Confident81Confident19 Ų1926.6 Ų26.610%0.09913%0.129CC..THydrogen-bonded Turntrans-68.7-17.1-176.4-66-169.8000114.2A392 F402 L458 Q461 L462A392-L397 WeakPolarHBondContact O-CG 3.4Å; A392-L397 PolarHBondContact O-N 2.79Å; L397-F402 HydrophobicContact CD2-CD1 3.82Å; L397-F402 HydrophobicContact CD2-CE1 3.45Å; L397-F402 VanDerWaalsContact CD2-CE1 3.45Å; L397-F402 HydrophobicContact CD2-CE2 4.31Å; L397-F402 HydrophobicContact CD2-CG 4.43Å; L397-F402 HydrophobicContact CD2-CZ 3.76Å; L397-L458 HydrophobicContact CD1-CD1 3.55Å; L397-L458 HydrophobicContact CG-CD1 4.04Å; L397-Q461 HydrophobicContact CD1-CB 3.68Å; L397-L462 HydrophobicContact CD1-CB 4.19Å; L397-L462 HydrophobicContact CD2-CB 4.48Å; L397-L462 HydrophobicContact CD2-CD1 3.92Å
398N82.1Confident80.9Confident66 Ų6626.9 Ų26.935%0.35313%0.13SC..THydrogen-bonded Turntrans-94.30.5176.4-63.9-41.8000112.7R393 K394 I396R393-N398 PolarHBondContact O-ND2 2.82Å; K394-N398 WeakPolarHBondContact CA-ND2 3.35Å; K394-N398 PolarHBondContact O-ND2 2.89Å; I396-N398 PolarHBondContact O-N 3.21Å
399T80.3Confident80.7Confident4 Ų426.9 Ų26.93%0.02513%0.13CC..SBendtrans-60.8140.4170.6-61.20000109.5L242 L247 Q395 I396 D401 F402L242-T399 WeakPolarHBondContact O-CG2 3.01Å; L242-T399 PolarHBondContact O-OG1 3.49Å; L247-T399 HydrophobicContact CD2-CG2 3.8Å; Q395-T399 PolarHBondContact O-OG1 3.4Å; Q395-T399 VanDerWaalsContact O-OG1 3.12Å; I396-T399 WeakPolarHBondContact O-CB 3.37Å; I396-T399 PolarHBondContact O-N 3Å; I396-T399 VanDerWaalsContact O-N 3.12Å; I396-T399 PolarHBondContact O-OG1 3.23Å; T399-D401 PolarHBondContact O-N 3.2Å; T399-F402 PolarHBondContact O-N 3.25Å
400T72.2Confident80.4Confident62 Ų6227.3 Ų27.338%0.3813%0.132SC..THydrogen-bonded Turntrans-57.1131179.652.40000111.1F402T400-F402 VanDerWaalsContact C-N 3.27Å; T400-F402 PolarHBondContact O-N 2.89Å
401D68.2Low80.4Confident37.5 Ų37.526.7 Ų26.720%0.20113%0.128CC..THydrogen-bonded Turntrans62.320.3178.6-57.9-43.7000115.8T399 E403 R404T399-D401 PolarHBondContact O-N 3.2Å; D401-E403 VanDerWaalsContact C-N 3.27Å; D401-E403 PolarHBondContact O-N 3.11Å; D401-E403 VanDerWaalsContact O-N 3.09Å; D401-R404 HydrophobicContact CB-CB 4.47Å; D401-R404 HydrophobicContact CB-CG 4.01Å; D401-R404 VanDerWaalsContact CG-CZ 3.43Å; D401-R404 WeakPolarHBondContact O-CB 3.32Å; D401-R404 PolarHBondContact O-N 2.85Å; D401-R404 IonicContact OD1-CZ 3.12Å; D401-R404 IonicContact OD1-NE 3.65Å; D401-R404 PolarHBondContact OD1-NE 3.07Å; D401-R404 IonicContact OD1-NH2 3.48Å; D401-R404 PolarHBondContact OD1-NH2 2.85Å; D401-R404 IonicContact OD2-CZ 3.27Å; D401-R404 IonicContact OD2-NE 3.52Å; D401-R404 IonicContact OD2-NH2 2.75Å; D401-R404 PolarHBondContact OD2-NH2 3.12Å
402F75.3Confident80.4Confident4.5 Ų4.526.7 Ų26.72%0.0213%0.129CC..G310 helixtrans-50.8-41.3174.7-178.5-87.1000112.6L247 M251 I396 L397 T399 T400 R404 E405 W408 V409 M412 L462L247-F402 HydrophobicContact CD2-CD2 3.81Å; L247-F402 HydrophobicContact CD2-CE2 4.25Å; M251-F402 HydrophobicContact CE-CE2 4.04Å; I396-F402 HydrophobicContact CG2-CD2 3.97Å; I396-F402 HydrophobicContact CG2-CE2 3.48Å; I396-F402 VanDerWaalsContact CG2-CE2 3.48Å; I396-F402 HydrophobicContact CG2-CZ 4.35Å; I396-F402 WeakPolarHBondContact O-CD2 3.43Å; L397-F402 HydrophobicContact CD2-CD1 3.82Å; L397-F402 HydrophobicContact CD2-CE1 3.45Å; L397-F402 VanDerWaalsContact CD2-CE1 3.45Å; L397-F402 HydrophobicContact CD2-CE2 4.31Å; L397-F402 HydrophobicContact CD2-CG 4.43Å; L397-F402 HydrophobicContact CD2-CZ 3.76Å; T399-F402 PolarHBondContact O-N 3.25Å; T400-F402 VanDerWaalsContact C-N 3.27Å; T400-F402 PolarHBondContact O-N 2.89Å; F402-R404 PolarHBondContact O-N 3.07Å; F402-R404 VanDerWaalsContact O-N 3.13Å; F402-E405 PolarHBondContact O-N 3.05Å; F402-W408 HydrophobicContact CB-CE3 4.48Å; F402-W408 HydrophobicContact CD2-CB 4.41Å; F402-W408 AromaticContact CD2-CE3 3.83Å; F402-W408 HydrophobicContact CD2-CE3 3.83Å; F402-W408 HydrophobicContact CD2-CZ3 4.48Å; F402-W408 HydrophobicContact CE2-CB 3.79Å; F402-W408 HydrophobicContact CE2-CE3 4.28Å; F402-W408 HydrophobicContact CG-CE3 4.39Å; F402-W408 HydrophobicContact CZ-CB 3.98Å; F402-V409 HydrophobicContact CD1-CG2 4.21Å; F402-V409 HydrophobicContact CE1-CB 4.45Å; F402-V409 HydrophobicContact CE1-CG2 3.75Å; F402-V409 HydrophobicContact CZ-CG2 4.44Å; F402-M412 HydrophobicContact CE2-CG 4.13Å; F402-M412 HydrophobicContact CZ-CB 4.25Å; F402-M412 HydrophobicContact CZ-CG 3.52Å; F402-L462 HydrophobicContact CE1-CD1 3.92Å; F402-L462 HydrophobicContact CZ-CD1 4.46Å
403E69.8Low80.4Confident44.5 Ų44.526.7 Ų26.721%0.20813%0.129CC..G310 helixtrans-64.7-17.2-179.29.1-125.8176.300114.4D401 Q465 H471 Y1261D401-E403 VanDerWaalsContact C-N 3.27Å; D401-E403 PolarHBondContact O-N 3.11Å; D401-E403 VanDerWaalsContact O-N 3.09Å; E403-Q465 HydrophobicContact CB-CG 3.83Å; E403-Q465 HydrophobicContact CG-CG 4.49Å; E403-Q465 VanDerWaalsContact OE1-CD 3.3Å; E403-Q465 WeakPolarHBondContact OE1-CG 3.44Å; E403-Q465 PolarHBondContact OE1-NE2 3.08Å; E403-Q465 WeakPolarHBondContact OE2-CG 3.26Å; E403-Q465 PolarHBondContact OE2-NE2 3.16Å; E403-Q465 PolarHBondContact OE2-OE1 3.24Å; E403-H471 PolarHBondContact O-CE1 2.61Å; E403-Y1261 HydrophobicContact CB-CE2 4.06Å; E403-Y1261 HydrophobicContact CG-CE2 4.16Å; E403-Y1261 WeakPolarHBondContact CG-OH 3.41Å; E403-Y1261 PolarHBondContact OE1-OH 3.24Å; E403-Y1261 WeakPolarHBondContact OE2-CE2 3.3Å; E403-Y1261 PolarHBondContact OE2-OH 3.42Å; E403-Y1261 VanDerWaalsContact OE2-OH 3.07Å
404R67.3Low80.3Confident67 Ų6724.9 Ų24.925%0.25312%0.122SC..G310 helixtrans-85-18.3-178.2-55.2-165.8-164.4-17212.4113.1D401 F402 P406D401-R404 HydrophobicContact CB-CB 4.47Å; D401-R404 HydrophobicContact CB-CG 4.01Å; D401-R404 VanDerWaalsContact CG-CZ 3.43Å; D401-R404 WeakPolarHBondContact O-CB 3.32Å; D401-R404 PolarHBondContact O-N 2.85Å; D401-R404 IonicContact OD1-CZ 3.12Å; D401-R404 IonicContact OD1-NE 3.65Å; D401-R404 PolarHBondContact OD1-NE 3.07Å; D401-R404 IonicContact OD1-NH2 3.48Å; D401-R404 PolarHBondContact OD1-NH2 2.85Å; D401-R404 IonicContact OD2-CZ 3.27Å; D401-R404 IonicContact OD2-NE 3.52Å; D401-R404 IonicContact OD2-NH2 2.75Å; D401-R404 PolarHBondContact OD2-NH2 3.12Å; F402-R404 PolarHBondContact O-N 3.07Å; F402-R404 VanDerWaalsContact O-N 3.13Å; R404-P406 VanDerWaalsContact O-CD 3.26Å; R404-P406 WeakPolarHBondContact O-CD 3.41Å
405E75.3Confident80.5Confident24.5 Ų24.520.8 Ų20.811%0.11410%0.104CC..  trans-98.599.8-171.1-67-63.6154.100110.9R244 F402 L407 W408 V409R244-E405 IonicContact CZ-OE1 3.93Å; R244-E405 IonicContact NH1-OE1 3.18Å; R244-E405 PolarHBondContact NH1-OE1 2.76Å; R244-E405 IonicContact NH2-OE1 3.83Å; R244-E405 PolarHBondContact NH2-OE1 3Å; R244-E405 IonicContact NH2-OE2 2.77Å; F402-E405 PolarHBondContact O-N 3.05Å; E405-L407 VanDerWaalsContact C-N 3.31Å; E405-L407 PolarHBondContact O-N 3.29Å; E405-L407 VanDerWaalsContact O-N 3.16Å; E405-W408 HydrophobicContact CB-CB 3.92Å; E405-W408 HydrophobicContact CB-CD2 3.28Å; E405-W408 HydrophobicContact CB-CE3 3.35Å; E405-W408 VanDerWaalsContact CB-CE3 3.4Å; E405-W408 HydrophobicContact CB-CG 3.53Å; E405-W408 VanDerWaalsContact CB-CG 3.48Å; E405-W408 HydrophobicContact CB-CZ2 4.47Å; E405-W408 HydrophobicContact CB-CZ3 3.98Å; E405-W408 HydrophobicContact CG-CD2 3.58Å; E405-W408 VanDerWaalsContact CG-CD2 3.48Å; E405-W408 HydrophobicContact CG-CE3 3.41Å; E405-W408 HydrophobicContact CG-CG 4.32Å; E405-W408 HydrophobicContact CG-CH2 3.75Å; E405-W408 HydrophobicContact CG-CZ2 3.94Å; E405-W408 HydrophobicContact CG-CZ3 3.47Å; E405-W408 WeakPolarHBondContact O-CB 3.44Å; E405-W408 PolarHBondContact O-N 3.1Å; E405-W408 VanDerWaalsContact O-N 3.16Å; E405-V409 WeakPolarHBondContact O-CG2 3.29Å; E405-V409 PolarHBondContact O-N 3.04Å
406P73.7Confident80.7Confident14.5 Ų14.520.2 Ų20.29%0.09410%0.102CC..Hα-helixtrans-64.1-34.4-17124-32.4000112.1R404 W408 Y410 L470 V1232R404-P406 VanDerWaalsContact O-CD 3.26Å; R404-P406 WeakPolarHBondContact O-CD 3.41Å; P406-W408 VanDerWaalsContact C-N 3.32Å; P406-W408 PolarHBondContact O-N 3.35Å; P406-Y410 WeakPolarHBondContact O-CB 3.49Å; P406-Y410 PolarHBondContact O-N 3.01Å; P406-L470 VanDerWaalsContact CA-CD2 3.46Å; P406-L470 HydrophobicContact CB-CD1 4.07Å; P406-L470 HydrophobicContact CB-CD2 3.83Å; P406-V1232 HydrophobicContact CB-CG1 3.98Å
407L79.2Confident80.7Confident42 Ų4220.2 Ų20.222%0.2210%0.102CC..Hα-helixtrans-67.1-32.9177.8-64.9176.3000112.4W120 M195 L196 H255 E405 R411W120-L407 HydrophobicContact CZ3-CD2 4.29Å; M195-L407 HydrophobicContact CE-CB 4.46Å; M195-L407 HydrophobicContact CE-CD1 3.74Å; L196-L407 HydrophobicContact CD2-CD1 3.77Å; H255-L407 PolarHBondContact NE2-O 3.47Å; E405-L407 VanDerWaalsContact C-N 3.31Å; E405-L407 PolarHBondContact O-N 3.29Å; E405-L407 VanDerWaalsContact O-N 3.16Å; L407-R411 WeakPolarHBondContact O-CB 3.48Å; L407-R411 PolarHBondContact O-N 2.66Å; L407-R411 VanDerWaalsContact O-N 3.15Å
408W83.7Confident80.7Confident4.5 Ų4.519.6 Ų19.62%0.01710%0.099CC..Hα-helixtrans-72.6-50.1177.6-62.5-3.6000111.2M195 R244 L247 H248 M251 F402 E405 P406 Y410 R411 M412M195-W408 PolarHBondContact SD-NE1 2.91Å; R244-W408 HydrophobicContact CG-CH2 3.87Å; R244-W408 HydrophobicContact CG-CZ2 4.29Å; L247-W408 HydrophobicContact CB-CH2 4.27Å; L247-W408 HydrophobicContact CB-CZ2 4.17Å; L247-W408 HydrophobicContact CD2-CD2 3.78Å; L247-W408 HydrophobicContact CD2-CE3 3.35Å; L247-W408 HydrophobicContact CD2-CH2 3.71Å; L247-W408 HydrophobicContact CD2-CZ2 4.07Å; L247-W408 HydrophobicContact CD2-CZ3 3.35Å; L247-W408 HydrophobicContact CG-CD2 4.02Å; L247-W408 HydrophobicContact CG-CE3 4.1Å; L247-W408 HydrophobicContact CG-CH2 4.15Å; L247-W408 HydrophobicContact CG-CZ2 4.02Å; L247-W408 HydrophobicContact CG-CZ3 4.2Å; H248-W408 AromaticContact CD2-CZ2 3.96Å; H248-W408 AromaticContact CE1-CE2 3.76Å; H248-W408 AromaticContact CE1-CZ2 3.35Å; H248-W408 WeakPolarHBondContact CE1-CZ2 3.22Å; H248-W408 AromaticContact CE1-NE1 3.67Å; H248-W408 AromaticContact ND1-CE2 3.94Å; H248-W408 AromaticContact ND1-CZ2 3.74Å; H248-W408 AromaticContact ND1-NE1 3.53Å; H248-W408 AromaticContact NE2-CZ2 3.49Å; H248-W408 WeakPolarHBondContact NE2-CZ2 3.4Å; M251-W408 HydrophobicContact CE-CB 3.81Å; M251-W408 HydrophobicContact CE-CG 4.11Å; M251-W408 HydrophobicContact CG-CB 4.49Å; M251-W408 VanDerWaalsContact CG-CD1 3.44Å; M251-W408 HydrophobicContact CG-CG 3.94Å; M251-W408 HydrophobicContact SD-CB 4.24Å; M251-W408 HydrophobicContact SD-CG 4.32Å; F402-W408 HydrophobicContact CB-CE3 4.48Å; F402-W408 HydrophobicContact CD2-CB 4.41Å; F402-W408 AromaticContact CD2-CE3 3.83Å; F402-W408 HydrophobicContact CD2-CE3 3.83Å; F402-W408 HydrophobicContact CD2-CZ3 4.48Å; F402-W408 HydrophobicContact CE2-CB 3.79Å; F402-W408 HydrophobicContact CE2-CE3 4.28Å; F402-W408 HydrophobicContact CG-CE3 4.39Å; F402-W408 HydrophobicContact CZ-CB 3.98Å; E405-W408 HydrophobicContact CB-CB 3.92Å; E405-W408 HydrophobicContact CB-CD2 3.28Å; E405-W408 HydrophobicContact CB-CE3 3.35Å; E405-W408 VanDerWaalsContact CB-CE3 3.4Å; E405-W408 HydrophobicContact CB-CG 3.53Å; E405-W408 VanDerWaalsContact CB-CG 3.48Å; E405-W408 HydrophobicContact CB-CZ2 4.47Å; E405-W408 HydrophobicContact CB-CZ3 3.98Å; E405-W408 HydrophobicContact CG-CD2 3.58Å; E405-W408 VanDerWaalsContact CG-CD2 3.48Å; E405-W408 HydrophobicContact CG-CE3 3.41Å; E405-W408 HydrophobicContact CG-CG 4.32Å; E405-W408 HydrophobicContact CG-CH2 3.75Å; E405-W408 HydrophobicContact CG-CZ2 3.94Å; E405-W408 HydrophobicContact CG-CZ3 3.47Å; E405-W408 WeakPolarHBondContact O-CB 3.44Å; E405-W408 PolarHBondContact O-N 3.1Å; E405-W408 VanDerWaalsContact O-N 3.16Å; P406-W408 VanDerWaalsContact C-N 3.32Å; P406-W408 PolarHBondContact O-N 3.35Å; W408-Y410 VanDerWaalsContact C-N 3.32Å; W408-Y410 PolarHBondContact O-N 3.02Å; W408-R411 PolarHBondContact O-N 3.39Å; W408-M412 WeakPolarHBondContact O-CG 3.41Å; W408-M412 PolarHBondContact O-N 3.1Å
409V83.8Confident81.1Confident0.5 Ų0.516.5 Ų16.50%0.0038%0.082CC..Hα-helixtrans-59.8-46178.2175.30000110.1F402 E405 R411 M412 H413 L462 L470 H471 L474F402-V409 HydrophobicContact CD1-CG2 4.21Å; F402-V409 HydrophobicContact CE1-CB 4.45Å; F402-V409 HydrophobicContact CE1-CG2 3.75Å; F402-V409 HydrophobicContact CZ-CG2 4.44Å; E405-V409 WeakPolarHBondContact O-CG2 3.29Å; E405-V409 PolarHBondContact O-N 3.04Å; V409-R411 VanDerWaalsContact C-N 3.33Å; V409-R411 PolarHBondContact O-N 2.92Å; V409-M412 PolarHBondContact O-N 2.76Å; V409-H413 WeakPolarHBondContact O-CB 3.45Å; V409-H413 PolarHBondContact O-N 3.07Å; V409-L462 HydrophobicContact CG1-CD1 4.16Å; V409-L470 HydrophobicContact CB-CD2 3.62Å; V409-L470 VanDerWaalsContact CB-CD2 3.43Å; V409-L470 HydrophobicContact CG1-CD2 3.53Å; V409-L470 HydrophobicContact CG1-CG 4.17Å; V409-L470 HydrophobicContact CG2-CD2 4.1Å; V409-H471 VanDerWaalsContact CG1-NE2 3.35Å; V409-H471 WeakPolarHBondContact CG1-NE2 3.31Å; V409-H471 WeakPolarHBondContact CG2-NE2 3.27Å; V409-L474 HydrophobicContact CG1-CD1 4.01Å
410Y82.2Confident81.5Confident12.5 Ų12.516.7 Ų16.75%0.0498%0.083CC..Hα-helixtrans-58.9-47.2177.2-175.2-99.9000111.5M119 N263 P406 W408 M412 H413 C414 L474 L1227M119-Y410 HydrophobicContact CE-CD1 4.32Å; M119-Y410 HydrophobicContact CE-CE1 3.77Å; N263-Y410 HydrophobicContact CB-CE1 4.44Å; N263-Y410 HydrophobicContact CB-CE2 4.46Å; N263-Y410 WeakPolarHBondContact CB-OH 3.42Å; N263-Y410 PolarHBondContact N-OH 3.16Å; P406-Y410 WeakPolarHBondContact O-CB 3.49Å; P406-Y410 PolarHBondContact O-N 3.01Å; W408-Y410 VanDerWaalsContact C-N 3.32Å; W408-Y410 PolarHBondContact O-N 3.02Å; Y410-M412 PolarHBondContact O-N 2.94Å; Y410-H413 WeakPolarHBondContact O-CB 3.37Å; Y410-H413 PolarHBondContact O-N 3.18Å; Y410-C414 WeakPolarHBondContact CE1-SG 3.47Å; Y410-C414 VanDerWaalsContact CZ-SG 3.52Å; Y410-C414 PolarHBondContact O-N 3.22Å; Y410-C414 PolarHBondContact O-SG 2.78Å; Y410-C414 VanDerWaalsContact O-SG 3.37Å; Y410-L474 HydrophobicContact CD2-CD2 4.19Å; Y410-L474 HydrophobicContact CE2-CD2 4.26Å; Y410-L1227 HydrophobicContact CD2-CD2 4.26Å; Y410-L1227 HydrophobicContact CE2-CD2 3.55Å
411R86.2Confident82.2Confident7 Ų715.6 Ų15.63%0.0268%0.076CC..Hα-helixtrans-63.1-42.1179.4-173.858.8-177.8152.8-3.1112.2M251 L254 L257 S324 L407 W408 V409 H413 C414 I415M251-R411 HydrophobicContact SD-CB 4.06Å; M251-R411 HydrophobicContact SD-CG 4.24Å; L254-R411 HydrophobicContact CB-CG 3.91Å; L254-R411 PolarHBondContact O-NE 3.44Å; L254-R411 PolarHBondContact O-NH2 3.19Å; L257-R411 PolarHBondContact O-NH2 2.83Å; S324-R411 PolarHBondContact OG-NH2 3.14Å; S324-R411 VanDerWaalsContact OG-NH2 3.1Å; L407-R411 WeakPolarHBondContact O-CB 3.48Å; L407-R411 PolarHBondContact O-N 2.66Å; L407-R411 VanDerWaalsContact O-N 3.15Å; W408-R411 PolarHBondContact O-N 3.39Å; V409-R411 VanDerWaalsContact C-N 3.33Å; V409-R411 PolarHBondContact O-N 2.92Å; R411-H413 VanDerWaalsContact C-N 3.35Å; R411-C414 WeakPolarHBondContact O-CB 3.31Å; R411-C414 PolarHBondContact O-N 3.11Å; R411-I415 HydrophobicContact CG-CD1 4.19Å; R411-I415 VanDerWaalsContact O-CG1 3.31Å; R411-I415 WeakPolarHBondContact O-CG1 3.29Å; R411-I415 PolarHBondContact O-N 3.1Å
412M88.1Confident83Confident2.5 Ų2.516.4 Ų16.41%0.0128%0.078CC..Hα-helixtrans-63.8-41.3175.6-70.6-56.3-80.600112M251 F320 A392 I396 F402 W408 V409 Y410 C414 I415 I416 L462M251-M412 HydrophobicContact CE-CG 4.04Å; M251-M412 HydrophobicContact CE-SD 4.23Å; F320-M412 HydrophobicContact CE1-CE 4.49Å; F320-M412 HydrophobicContact CE1-SD 3.93Å; F320-M412 HydrophobicContact CE2-CE 4.27Å; F320-M412 HydrophobicContact CZ-CE 3.68Å; F320-M412 HydrophobicContact CZ-SD 3.54Å; F320-M412 VanDerWaalsContact CZ-SD 3.54Å; A392-M412 HydrophobicContact CB-CE 3.82Å; I396-M412 HydrophobicContact CD1-SD 4.37Å; I396-M412 HydrophobicContact CG2-SD 4.24Å; F402-M412 HydrophobicContact CE2-CG 4.13Å; F402-M412 HydrophobicContact CZ-CB 4.25Å; F402-M412 HydrophobicContact CZ-CG 3.52Å; W408-M412 WeakPolarHBondContact O-CG 3.41Å; W408-M412 PolarHBondContact O-N 3.1Å; V409-M412 PolarHBondContact O-N 2.76Å; Y410-M412 PolarHBondContact O-N 2.94Å; M412-C414 VanDerWaalsContact C-N 3.35Å; M412-C414 PolarHBondContact O-N 3.47Å; M412-I415 PolarHBondContact O-N 3.16Å; M412-I416 WeakPolarHBondContact O-CG1 3.42Å; M412-I416 PolarHBondContact O-N 3.28Å; M412-L462 HydrophobicContact CB-CD1 4.25Å; M412-L462 HydrophobicContact CB-CD2 4.34Å
413H88.8Confident83.5Confident0 Ų016.6 Ų16.60%08%0.08CC..Hα-helixtrans-58.2-48173.316788.1000111.3V409 Y410 R411 I415 I416 T417 L462 Y463 L474 E477 R528V409-H413 WeakPolarHBondContact O-CB 3.45Å; V409-H413 PolarHBondContact O-N 3.07Å; Y410-H413 WeakPolarHBondContact O-CB 3.37Å; Y410-H413 PolarHBondContact O-N 3.18Å; R411-H413 VanDerWaalsContact C-N 3.35Å; H413-I415 PolarHBondContact O-N 3.23Å; H413-I416 PolarHBondContact O-N 3.26Å; H413-I416 VanDerWaalsContact O-N 3.14Å; H413-T417 VanDerWaalsContact CE1-CG2 3.45Å; H413-T417 WeakPolarHBondContact CE1-CG2 3.45Å; H413-T417 WeakPolarHBondContact O-CB 3.2Å; H413-T417 WeakPolarHBondContact O-CG2 3.34Å; H413-T417 PolarHBondContact O-N 3.05Å; H413-T417 PolarHBondContact O-OG1 3.24Å; H413-T417 VanDerWaalsContact O-OG1 3.13Å; H413-L462 HydrophobicContact CB-CD2 4.4Å; H413-Y463 AromaticContact ND1-CE1 3.78Å; H413-Y463 AromaticContact ND1-CZ 3.65Å; H413-Y463 PolarHBondContact ND1-OH 3.33Å; H413-L474 HydrophobicContact CB-CD1 3.89Å; H413-L474 PolarHBondContact CE1-O 2.95Å; H413-E477 IonicContact CE1-OE1 3.79Å; H413-E477 IonicContact CE1-OE2 3.18Å; H413-E477 PolarHBondContact CE1-OE2 3.05Å; H413-E477 VanDerWaalsContact CE1-OE2 3.27Å; H413-E477 VanDerWaalsContact NE2-CD 3.34Å; H413-E477 IonicContact NE2-OE1 3.33Å; H413-E477 PolarHBondContact NE2-OE1 2.79Å; H413-E477 IonicContact NE2-OE2 3.15Å; H413-E477 PolarHBondContact NE2-OE2 3.33Å; H413-R528 PolarHBondContact NE2-NH2 3.38Å; H413-R528 VanDerWaalsContact NE2-NH2 3.12Å
414C86.4Confident84.3Confident2 Ų217.4 Ų17.41%0.0149%0.094CC..Hα-helixtrans-58-47.7176.6-64.10000111.5N263 Y410 R411 M412 I416 T417 D418N263-C414 PolarHBondContact ND2-SG 3.47Å; Y410-C414 WeakPolarHBondContact CE1-SG 3.47Å; Y410-C414 VanDerWaalsContact CZ-SG 3.52Å; Y410-C414 PolarHBondContact O-N 3.22Å; Y410-C414 PolarHBondContact O-SG 2.78Å; Y410-C414 VanDerWaalsContact O-SG 3.37Å; R411-C414 WeakPolarHBondContact O-CB 3.31Å; R411-C414 PolarHBondContact O-N 3.11Å; M412-C414 VanDerWaalsContact C-N 3.35Å; M412-C414 PolarHBondContact O-N 3.47Å; C414-I416 VanDerWaalsContact C-N 3.3Å; C414-I416 PolarHBondContact O-N 3.34Å; C414-T417 PolarHBondContact O-N 3.33Å; C414-T417 PolarHBondContact O-OG1 3.2Å; C414-D418 WeakPolarHBondContact O-CB 3.48Å; C414-D418 PolarHBondContact O-N 3.36Å
415I88.7Confident85.3Confident6.5 Ų6.518.4 Ų18.43%0.03311%0.107CC..Hα-helixtrans-59.4-42.1179.5-68.9167.8000111.2L254 F320 L327 R411 M412 H413 L419L254-I415 HydrophobicContact CD1-CD1 4.28Å; L254-I415 HydrophobicContact CD2-CD1 4.17Å; F320-I415 HydrophobicContact CE1-CD1 4.08Å; F320-I415 HydrophobicContact CE2-CG2 4.24Å; F320-I415 HydrophobicContact CZ-CD1 3.74Å; F320-I415 HydrophobicContact CZ-CG2 4.23Å; L327-I415 HydrophobicContact CD1-CB 4.44Å; L327-I415 HydrophobicContact CD1-CG2 3.9Å; R411-I415 HydrophobicContact CG-CD1 4.19Å; R411-I415 VanDerWaalsContact O-CG1 3.31Å; R411-I415 WeakPolarHBondContact O-CG1 3.29Å; R411-I415 PolarHBondContact O-N 3.1Å; M412-I415 PolarHBondContact O-N 3.16Å; H413-I415 PolarHBondContact O-N 3.23Å; I415-L419 VanDerWaalsContact O-CB 3.28Å; I415-L419 WeakPolarHBondContact O-CB 3.42Å; I415-L419 PolarHBondContact O-N 3.36Å; I415-L419 VanDerWaalsContact O-N 3.11Å
416I89.8Confident85.8Confident4 Ų418.9 Ų18.92%0.02111%0.108CC..Hα-helixtrans-68.3-49.1179.1-69.8171.4000111.3M412 H413 C414 L419 I420 F455 L458 I459 L462 F478M412-I416 WeakPolarHBondContact O-CG1 3.42Å; M412-I416 PolarHBondContact O-N 3.28Å; H413-I416 PolarHBondContact O-N 3.26Å; H413-I416 VanDerWaalsContact O-N 3.14Å; C414-I416 VanDerWaalsContact C-N 3.3Å; C414-I416 PolarHBondContact O-N 3.34Å; I416-L419 PolarHBondContact O-N 3.39Å; I416-I420 HydrophobicContact CG2-CD1 4.05Å; I416-I420 WeakPolarHBondContact O-CG1 3.33Å; I416-I420 PolarHBondContact O-N 3.33Å; I416-I420 VanDerWaalsContact O-N 3.16Å; I416-F455 HydrophobicContact CG2-CE2 4.28Å; I416-F455 HydrophobicContact CG2-CZ 4.18Å; I416-L458 HydrophobicContact CD1-CD2 3.97Å; I416-L458 HydrophobicContact CD1-CG 3.99Å; I416-L458 HydrophobicContact CG1-CD2 4.08Å; I416-I459 HydrophobicContact CG2-CD1 4.2Å; I416-I459 HydrophobicContact CG2-CG1 3.83Å; I416-L462 HydrophobicContact CD1-CD2 3.59Å; I416-F478 HydrophobicContact CG2-CZ 4.45Å
417T87.4Confident86.4Confident0 Ų018.6 Ų18.60%011%0.106CC..Hα-helixtrans-68.6-39.3-17853.40000111.6H413 C414 L419 I420 V421 F478 R528 L532H413-T417 VanDerWaalsContact CE1-CG2 3.45Å; H413-T417 WeakPolarHBondContact CE1-CG2 3.45Å; H413-T417 WeakPolarHBondContact O-CB 3.2Å; H413-T417 WeakPolarHBondContact O-CG2 3.34Å; H413-T417 PolarHBondContact O-N 3.05Å; H413-T417 PolarHBondContact O-OG1 3.24Å; H413-T417 VanDerWaalsContact O-OG1 3.13Å; C414-T417 PolarHBondContact O-N 3.33Å; C414-T417 PolarHBondContact O-OG1 3.2Å; T417-L419 VanDerWaalsContact C-N 3.32Å; T417-L419 PolarHBondContact O-N 3.31Å; T417-I420 PolarHBondContact O-N 2.96Å; T417-I420 VanDerWaalsContact O-N 3.13Å; T417-V421 WeakPolarHBondContact O-CB 3.35Å; T417-V421 WeakPolarHBondContact O-CG2 3.42Å; T417-V421 PolarHBondContact O-N 3.17Å; T417-F478 HydrophobicContact CG2-CE2 4.3Å; T417-F478 HydrophobicContact CG2-CZ 4.15Å; T417-R528 PolarHBondContact OG1-NH2 3.35Å; T417-L532 HydrophobicContact CG2-CD1 4.07Å; T417-L532 HydrophobicContact CG2-CD2 4.05Å
418D86.9Confident86.8Confident5.5 Ų5.522.4 Ų22.43%0.02912%0.121CC..Hα-helixtrans-64.6-38.6177.4-69.9-9.3000111L327 R331 C414 I420 V421 H422L327-D418 HydrophobicContact CD1-CB 4.31Å; L327-D418 HydrophobicContact CD2-CB 4.25Å; R331-D418 WeakPolarHBondContact CD-OD2 3.28Å; R331-D418 IonicContact CZ-OD1 3.28Å; R331-D418 IonicContact CZ-OD2 3.71Å; R331-D418 IonicContact NE-OD2 2.79Å; R331-D418 IonicContact NH1-OD1 3.83Å; R331-D418 PolarHBondContact NH1-OD1 3.17Å; R331-D418 IonicContact NH1-OD2 2.67Å; R331-D418 PolarHBondContact NH1-OD2 3.03Å; C414-D418 WeakPolarHBondContact O-CB 3.48Å; C414-D418 PolarHBondContact O-N 3.36Å; D418-I420 VanDerWaalsContact C-N 3.33Å; D418-I420 PolarHBondContact O-N 3.28Å; D418-V421 PolarHBondContact O-N 2.87Å; D418-H422 WeakPolarHBondContact O-CB 3.2Å; D418-H422 PolarHBondContact O-N 3.41Å; D418-H422 IonicContact OD1-CD2 2.82Å
419L89.5Confident86.8Confident1.5 Ų1.526 Ų261%0.00814%0.138CC..Hα-helixtrans-61.8-40.7173.4-176.766.2000111.8L323 L327 L389 I415 I416 T417 M423 V427 F455L323-L419 HydrophobicContact CD1-CD1 4.31Å; L327-L419 HydrophobicContact CD1-CB 4.47Å; L327-L419 HydrophobicContact CD2-CB 4.25Å; L327-L419 HydrophobicContact CD2-CD1 4.3Å; L389-L419 HydrophobicContact CD2-CD2 4.16Å; I415-L419 VanDerWaalsContact O-CB 3.28Å; I415-L419 WeakPolarHBondContact O-CB 3.42Å; I415-L419 PolarHBondContact O-N 3.36Å; I415-L419 VanDerWaalsContact O-N 3.11Å; I416-L419 PolarHBondContact O-N 3.39Å; T417-L419 VanDerWaalsContact C-N 3.32Å; T417-L419 PolarHBondContact O-N 3.31Å; L419-M423 HydrophobicContact CD1-CB 4.12Å; L419-M423 HydrophobicContact CD1-SD 4.39Å; L419-M423 CarbonylContact O-C 3.39Å; L419-M423 VanDerWaalsContact O-C 3.26Å; L419-M423 WeakPolarHBondContact O-CA 3.47Å; L419-M423 WeakPolarHBondContact O-CB 3.33Å; L419-M423 PolarHBondContact O-N 3.38Å; L419-V427 HydrophobicContact CG-CG2 4.06Å; L419-F455 HydrophobicContact CD2-CD2 4.45Å; L419-F455 HydrophobicContact CD2-CE2 3.79Å; L419-F455 HydrophobicContact CD2-CZ 4.09Å
420I89.1Confident86.8Confident7.5 Ų7.526.4 Ų26.44%0.03814%0.139CC..Hα-helixtrans-70.9-43.9178.7-65165.2000111.4I416 T417 D418 F455 I459 F478 L532 F535I416-I420 HydrophobicContact CG2-CD1 4.05Å; I416-I420 WeakPolarHBondContact O-CG1 3.33Å; I416-I420 PolarHBondContact O-N 3.33Å; I416-I420 VanDerWaalsContact O-N 3.16Å; T417-I420 PolarHBondContact O-N 2.96Å; T417-I420 VanDerWaalsContact O-N 3.13Å; D418-I420 VanDerWaalsContact C-N 3.33Å; D418-I420 PolarHBondContact O-N 3.28Å; I420-F455 HydrophobicContact CD1-CE1 4.17Å; I420-F455 HydrophobicContact CD1-CZ 3.96Å; I420-F455 HydrophobicContact CG1-CE1 3.94Å; I420-F455 HydrophobicContact CG1-CZ 3.75Å; I420-I459 HydrophobicContact CD1-CD1 4.18Å; I420-F478 HydrophobicContact CD1-CE1 3.94Å; I420-F478 HydrophobicContact CD1-CZ 4.41Å; I420-L532 HydrophobicContact CB-CD2 4.03Å; I420-L532 HydrophobicContact CD1-CD2 4.1Å; I420-L532 HydrophobicContact CG2-CD2 3.83Å; I420-F535 HydrophobicContact CD1-CD1 3.92Å; I420-F535 HydrophobicContact CD1-CE1 3.89Å; I420-F535 HydrophobicContact CD1-CG 4.34Å; I420-F535 HydrophobicContact CD1-CZ 4.28Å; I420-F535 HydrophobicContact CG1-CD1 4.46Å; I420-F535 HydrophobicContact CG1-CD2 4.44Å; I420-F535 HydrophobicContact CG1-CE2 4.49Å; I420-F535 HydrophobicContact CG1-CG 4.43Å; I420-F535 HydrophobicContact CG2-CB 3.53Å; I420-F535 HydrophobicContact CG2-CD1 4.21Å; I420-F535 HydrophobicContact CG2-CD2 4.01Å; I420-F535 HydrophobicContact CG2-CG 3.64Å
421V86.2Confident86.8Confident39 Ų3927.1 Ų27.124%0.23614%0.142CC..Hα-helixtrans-79.5-50.8-171.9174.70000111.2T417 D418 R528 A531 L532T417-V421 WeakPolarHBondContact O-CB 3.35Å; T417-V421 WeakPolarHBondContact O-CG2 3.42Å; T417-V421 PolarHBondContact O-N 3.17Å; D418-V421 PolarHBondContact O-N 2.87Å; V421-R528 HydrophobicContact CG2-CG 3.97Å; V421-A531 HydrophobicContact CG2-CB 4.16Å; V421-L532 HydrophobicContact CG2-CD2 4.11Å; V421-L532 HydrophobicContact CG2-CG 4.29Å
422H85Confident86.6Confident54 Ų5429.8 Ų29.825%0.2516%0.157CC..Hα-helixtrans-91.1-22.6-172.5-61.4-63.6000113.8R330 D418R330-H422 HydrophobicContact CG-CB 3.84Å; D418-H422 WeakPolarHBondContact O-CB 3.2Å; D418-H422 PolarHBondContact O-N 3.41Å; D418-H422 IonicContact OD1-CD2 2.82Å
423M86.9Confident86.1Confident9.5 Ų9.535.2 Ų35.25%0.04718%0.177CC..  trans-125.941-176.9-67.6-171.2172.500112.8A326 L327 R330 A380 L419 V425 R426 V427A326-M423 HydrophobicContact CB-CE 4.3Å; A326-M423 WeakPolarHBondContact O-CE 3.18Å; L327-M423 HydrophobicContact CD2-CE 4.3Å; L327-M423 HydrophobicContact CD2-CG 4.2Å; L327-M423 HydrophobicContact CD2-SD 3.88Å; R330-M423 HydrophobicContact CB-CE 3.55Å; R330-M423 HydrophobicContact CG-CE 4Å; R330-M423 HydrophobicContact CG-CG 4.26Å; A380-M423 HydrophobicContact CB-CE 3.93Å; A380-M423 HydrophobicContact CB-SD 3.55Å; A380-M423 VanDerWaalsContact CB-SD 3.55Å; L419-M423 HydrophobicContact CD1-CB 4.12Å; L419-M423 HydrophobicContact CD1-SD 4.39Å; L419-M423 CarbonylContact O-C 3.39Å; L419-M423 VanDerWaalsContact O-C 3.26Å; L419-M423 WeakPolarHBondContact O-CA 3.47Å; L419-M423 WeakPolarHBondContact O-CB 3.33Å; L419-M423 PolarHBondContact O-N 3.38Å; M423-V425 PolarHBondContact O-N 3.24Å; M423-V425 VanDerWaalsContact O-N 3.13Å; M423-R426 HydrophobicContact CB-CB 4.28Å; M423-R426 WeakPolarHBondContact O-CB 3.2Å; M423-R426 PolarHBondContact O-N 3.09Å; M423-V427 PolarHBondContact O-N 3.05Å; M423-V427 VanDerWaalsContact O-N 3.17Å
424A86.9Confident85.6Confident60.5 Ų60.535.6 Ų35.650%0.518%0.179SC..Hα-helixtrans-55.9-31.8179.900000114.1R426 V427 K428A424-R426 VanDerWaalsContact C-N 3.34Å; A424-V427 PolarHBondContact O-N 3.17Å; A424-K428 PolarHBondContact O-N 3.22Å
425V87.5Confident85.1Confident89 Ų8937.1 Ų37.154%0.53919%0.186SC..Hα-helixtrans-62.9-42.8174.9-179.90000110.5M423 K428 E429M423-V425 PolarHBondContact O-N 3.24Å; M423-V425 VanDerWaalsContact O-N 3.13Å; V425-K428 CarbonylContact O-C 3.59Å; V425-K428 WeakPolarHBondContact O-CA 3.38Å; V425-K428 VanDerWaalsContact O-CB 3.3Å; V425-K428 WeakPolarHBondContact O-CB 3.32Å; V425-K428 PolarHBondContact O-N 3.37Å; V425-K428 VanDerWaalsContact O-N 3.13Å; V425-E429 WeakPolarHBondContact O-CG 3.37Å; V425-E429 PolarHBondContact O-N 2.91Å
426R85.9Confident84.5Confident33.5 Ų33.540.8 Ų40.813%0.12621%0.206CC..Hα-helixtrans-68-40.5179.3-168.460.7-176.1174.90.2111.6A381 I384 E385 M423 A424 K428 E429 I430A381-R426 PolarHBondContact O-NH2 3.2Å; A381-R426 VanDerWaalsContact O-NH2 3.1Å; I384-R426 HydrophobicContact CD1-CG 3.49Å; I384-R426 VanDerWaalsContact CD1-CG 3.49Å; E385-R426 IonicContact OE1-NH2 3.08Å; E385-R426 PolarHBondContact OE1-NH2 3.42Å; M423-R426 HydrophobicContact CB-CB 4.28Å; M423-R426 WeakPolarHBondContact O-CB 3.2Å; M423-R426 PolarHBondContact O-N 3.09Å; A424-R426 VanDerWaalsContact C-N 3.34Å; R426-K428 PolarHBondContact O-N 3.2Å; R426-E429 VanDerWaalsContact CD-OE2 3.22Å; R426-E429 WeakPolarHBondContact CD-OE2 3.27Å; R426-E429 IonicContact CZ-OE2 3.01Å; R426-E429 IonicContact NE-OE2 3.12Å; R426-E429 IonicContact NH1-OE2 3.42Å; R426-E429 PolarHBondContact NH1-OE2 3.16Å; R426-E429 WeakPolarHBondContact O-CB 3.45Å; R426-E429 PolarHBondContact O-N 3.18Å; R426-I430 VanDerWaalsContact O-CG1 3.3Å; R426-I430 WeakPolarHBondContact O-CG1 3.35Å; R426-I430 PolarHBondContact O-N 2.88Å
427V86.9Confident83.8Confident8.5 Ų8.542.9 Ų42.95%0.05222%0.217CC..Hα-helixtrans-57-39.5172.3178.90000111.1L419 M423 A424 R431 F452 F455 F535L419-V427 HydrophobicContact CG-CG2 4.06Å; M423-V427 PolarHBondContact O-N 3.05Å; M423-V427 VanDerWaalsContact O-N 3.17Å; A424-V427 PolarHBondContact O-N 3.17Å; V427-R431 PolarHBondContact O-N 3.16Å; V427-F452 HydrophobicContact CG1-CD2 4.27Å; V427-F452 HydrophobicContact CG1-CE2 3.75Å; V427-F455 HydrophobicContact CG1-CE1 4.38Å; V427-F535 HydrophobicContact CG1-CD2 4.28Å; V427-F535 HydrophobicContact CG1-CE2 3.81Å
428K85.8Confident83Confident122 Ų12245.3 Ų45.353%0.5323%0.229SC..Hα-helixtrans-66-39.4174.1-174.6-173.3177.3-171.70112.4A424 V425 R426 R431 L432A424-K428 PolarHBondContact O-N 3.22Å; V425-K428 CarbonylContact O-C 3.59Å; V425-K428 WeakPolarHBondContact O-CA 3.38Å; V425-K428 VanDerWaalsContact O-CB 3.3Å; V425-K428 WeakPolarHBondContact O-CB 3.32Å; V425-K428 PolarHBondContact O-N 3.37Å; V425-K428 VanDerWaalsContact O-N 3.13Å; R426-K428 PolarHBondContact O-N 3.2Å; K428-R431 WeakPolarHBondContact O-CB 3.27Å; K428-R431 PolarHBondContact O-N 3.06Å; K428-L432 HydrophobicContact CG-CD1 4.28Å; K428-L432 WeakPolarHBondContact O-CG 3.17Å; K428-L432 PolarHBondContact O-N 3.06Å
429E85.3Confident82.4Confident80.5 Ų80.552.9 Ų52.938%0.37626%0.257SS..Hα-helixtrans-66.9-41.7177.4-72.5175.7174.100112.9V425 R426 R431 L432 R433V425-E429 WeakPolarHBondContact O-CG 3.37Å; V425-E429 PolarHBondContact O-N 2.91Å; R426-E429 VanDerWaalsContact CD-OE2 3.22Å; R426-E429 WeakPolarHBondContact CD-OE2 3.27Å; R426-E429 IonicContact CZ-OE2 3.01Å; R426-E429 IonicContact NE-OE2 3.12Å; R426-E429 IonicContact NH1-OE2 3.42Å; R426-E429 PolarHBondContact NH1-OE2 3.16Å; R426-E429 WeakPolarHBondContact O-CB 3.45Å; R426-E429 PolarHBondContact O-N 3.18Å; E429-R431 PolarHBondContact O-N 3.17Å; E429-L432 PolarHBondContact O-N 3.06Å; E429-L432 VanDerWaalsContact O-N 3.17Å; E429-R433 WeakPolarHBondContact O-CB 3.37Å; E429-R433 PolarHBondContact O-N 3.42Å
430I82.8Confident81.7Confident8 Ų857.3 Ų57.34%0.04129%0.288CS..Hα-helixtrans-55.1-44.8174.2-61.5167.7000109.5I384 L389 R426 R433 D434 F452I384-I430 HydrophobicContact CD1-CD1 3.81Å; I384-I430 HydrophobicContact CD1-CG1 4.41Å; I384-I430 HydrophobicContact CG1-CD1 4.4Å; I384-I430 HydrophobicContact CG2-CD1 3.88Å; I384-I430 HydrophobicContact CG2-CG1 3.93Å; L389-I430 HydrophobicContact CD1-CD1 4.11Å; R426-I430 VanDerWaalsContact O-CG1 3.3Å; R426-I430 WeakPolarHBondContact O-CG1 3.35Å; R426-I430 PolarHBondContact O-N 2.88Å; I430-R433 PolarHBondContact O-N 3.4Å; I430-D434 PolarHBondContact O-N 3.17Å; I430-D434 VanDerWaalsContact O-N 3.11Å; I430-F452 HydrophobicContact CG2-CB 4.08Å; I430-F452 VanDerWaalsContact CG2-N 3.33Å
431R82Confident80.9Confident27.5 Ų27.560.8 Ų60.810%0.10431%0.31CS..Hα-helixtrans-65.6-46.7177-175.6-169.167.1106.6-2.6112.7V427 K428 E429 R433 D434 E435 F452 M542V427-R431 PolarHBondContact O-N 3.16Å; K428-R431 WeakPolarHBondContact O-CB 3.27Å; K428-R431 PolarHBondContact O-N 3.06Å; E429-R431 PolarHBondContact O-N 3.17Å; R431-R433 VanDerWaalsContact C-N 3.27Å; R431-R433 PolarHBondContact O-N 3.45Å; R431-D434 WeakPolarHBondContact O-CB 3.33Å; R431-D434 PolarHBondContact O-N 3.06Å; R431-E435 IonicContact CZ-OE1 3.16Å; R431-E435 IonicContact NE-OE1 3.08Å; R431-E435 IonicContact NH1-OE1 3.18Å; R431-E435 PolarHBondContact NH1-OE1 2.9Å; R431-E435 PolarHBondContact O-N 3.48Å; R431-F452 HydrophobicContact CB-CB 4.08Å; R431-F452 HydrophobicContact CB-CD1 4.22Å; R431-F452 HydrophobicContact CB-CD2 4.1Å; R431-F452 HydrophobicContact CB-CG 3.88Å; R431-F452 HydrophobicContact CG-CB 4.44Å; R431-F452 HydrophobicContact CG-CD1 4Å; R431-F452 HydrophobicContact CG-CE1 4.29Å; R431-F452 HydrophobicContact CG-CG 4.18Å; R431-M542 PolarHBondContact NH1-SD 3.43Å
432L83Confident79.9Confident63.5 Ų63.561.9 Ų61.933%0.33233%0.33SS..Hα-helixtrans-61.4-38.9179.2-72.7173000111.2K428 E429 E435 D436K428-L432 HydrophobicContact CG-CD1 4.28Å; K428-L432 WeakPolarHBondContact O-CG 3.17Å; K428-L432 PolarHBondContact O-N 3.06Å; E429-L432 PolarHBondContact O-N 3.06Å; E429-L432 VanDerWaalsContact O-N 3.17Å; L432-E435 PolarHBondContact O-N 3.02Å; L432-D436 WeakPolarHBondContact O-CB 3.3Å; L432-D436 PolarHBondContact O-N 3.02Å
433R78Confident78.9Confident116 Ų11665.8 Ų65.844%0.43835%0.346SS..Hα-helixtrans-60.7-45.9174.2-177-177.6-82.1-153.61.5111.6E385 E429 I430 R431 E435 D436 I437E385-R433 IonicContact OE1-CZ 3.4Å; E385-R433 IonicContact OE1-NH1 3.55Å; E385-R433 IonicContact OE1-NH2 2.84Å; E385-R433 PolarHBondContact OE1-NH2 3.02Å; E429-R433 WeakPolarHBondContact O-CB 3.37Å; E429-R433 PolarHBondContact O-N 3.42Å; I430-R433 PolarHBondContact O-N 3.4Å; R431-R433 VanDerWaalsContact C-N 3.27Å; R431-R433 PolarHBondContact O-N 3.45Å; R433-E435 VanDerWaalsContact C-N 3.32Å; R433-E435 PolarHBondContact O-N 3.49Å; R433-D436 PolarHBondContact O-N 3.29Å; R433-I437 HydrophobicContact CG-CD1 3.88Å; R433-I437 HydrophobicContact CG-CG1 4.45Å; R433-I437 WeakPolarHBondContact O-CB 3.21Å; R433-I437 VanDerWaalsContact O-CG1 3.24Å; R433-I437 WeakPolarHBondContact O-CG1 3.45Å; R433-I437 PolarHBondContact O-N 3.41Å
434D77.2Confident77.7Confident8.5 Ų8.568.4 Ų68.45%0.04536%0.36CS..Hα-helixtrans-61.4-42.7176.1-80.54.9000112.3I430 R431 D436 I437 L438 P445 G451 F452 A453I430-D434 PolarHBondContact O-N 3.17Å; I430-D434 VanDerWaalsContact O-N 3.11Å; R431-D434 WeakPolarHBondContact O-CB 3.33Å; R431-D434 PolarHBondContact O-N 3.06Å; D434-D436 VanDerWaalsContact C-N 3.32Å; D434-D436 PolarHBondContact O-N 3.37Å; D434-I437 PolarHBondContact O-N 3.29Å; D434-L438 WeakPolarHBondContact O-CB 3.34Å; D434-L438 PolarHBondContact O-N 3.2Å; D434-P445 HydrophobicContact CB-CB 3.83Å; D434-P445 HydrophobicContact CB-CG 3.92Å; D434-G451 VanDerWaalsContact CG-CA 3.46Å; D434-G451 WeakPolarHBondContact OD1-CA 3.4Å; D434-G451 VanDerWaalsContact OD2-C 3.25Å; D434-G451 WeakPolarHBondContact OD2-CA 3.39Å; D434-F452 PolarHBondContact OD2-N 2.92Å; D434-A453 PolarHBondContact OD2-N 2.91Å
435E76.3Confident76.4Confident33.5 Ų33.565.6 Ų65.616%0.15734%0.337CS..Hα-helixtrans-63.2-39.5175.6-73.4-178.7-162.700111.8R431 L432 R433 L438 R439R431-E435 IonicContact CZ-OE1 3.16Å; R431-E435 IonicContact NE-OE1 3.08Å; R431-E435 IonicContact NH1-OE1 3.18Å; R431-E435 PolarHBondContact NH1-OE1 2.9Å; R431-E435 PolarHBondContact O-N 3.48Å; L432-E435 PolarHBondContact O-N 3.02Å; R433-E435 VanDerWaalsContact C-N 3.32Å; R433-E435 PolarHBondContact O-N 3.49Å; E435-L438 PolarHBondContact O-N 3.15Å; E435-R439 WeakPolarHBondContact O-CB 3.21Å; E435-R439 VanDerWaalsContact O-CG 3.22Å; E435-R439 WeakPolarHBondContact O-CG 3.34Å; E435-R439 PolarHBondContact O-N 3.35Å; E435-R439 IonicContact OE2-CZ 2.8Å; E435-R439 IonicContact OE2-NH1 3.71Å; E435-R439 IonicContact OE2-NH2 3.09Å; E435-R439 PolarHBondContact OE2-NH2 3.17Å
436D76.4Confident74.9Confident85 Ų8563.7 Ų63.746%0.45533%0.327SS..Hα-helixtrans-72.2-36.5179-69.6-20.4000111.9L432 R433 D434 R439 S440L432-D436 WeakPolarHBondContact O-CB 3.3Å; L432-D436 PolarHBondContact O-N 3.02Å; R433-D436 PolarHBondContact O-N 3.29Å; D434-D436 VanDerWaalsContact C-N 3.32Å; D434-D436 PolarHBondContact O-N 3.37Å; D436-R439 PolarHBondContact O-N 2.93Å; D436-R439 IonicContact OD1-NH1 3.59Å; D436-R439 PolarHBondContact OD1-NH1 3.26Å; D436-S440 VanDerWaalsContact O-CB 3.23Å; D436-S440 WeakPolarHBondContact O-CB 3.39Å; D436-S440 PolarHBondContact O-N 3.17Å; D436-S440 PolarHBondContact O-OG 3.13Å
437I74.7Confident73.7Confident48.5 Ų48.566.5 Ų66.525%0.24935%0.348CS..Hα-helixtrans-62.6-46.7171.1-69.6165.6000109.8R433 D434 R439 S440 T441 P445R433-I437 HydrophobicContact CG-CD1 3.88Å; R433-I437 HydrophobicContact CG-CG1 4.45Å; R433-I437 WeakPolarHBondContact O-CB 3.21Å; R433-I437 VanDerWaalsContact O-CG1 3.24Å; R433-I437 WeakPolarHBondContact O-CG1 3.45Å; R433-I437 PolarHBondContact O-N 3.41Å; D434-I437 PolarHBondContact O-N 3.29Å; I437-R439 VanDerWaalsContact C-N 3.34Å; I437-R439 PolarHBondContact O-N 3.16Å; I437-S440 PolarHBondContact O-N 3.15Å; I437-S440 PolarHBondContact O-OG 3.09Å; I437-T441 HydrophobicContact CG2-CG2 4.49Å; I437-T441 WeakPolarHBondContact O-CB 3.47Å; I437-T441 PolarHBondContact O-N 3.34Å; I437-T441 PolarHBondContact O-OG1 3.27Å; I437-P445 HydrophobicContact CG2-CB 4.5Å
438L70.9Confident72.5Confident49 Ų4968.6 Ų68.626%0.25736%0.361SS..Hα-helixtrans-60.4-44.1177.1-17765.7000111.4D434 E435 G442 F443 P445 A545D434-L438 WeakPolarHBondContact O-CB 3.34Å; D434-L438 PolarHBondContact O-N 3.2Å; E435-L438 PolarHBondContact O-N 3.15Å; L438-G442 VanDerWaalsContact O-CA 3.26Å; L438-G442 WeakPolarHBondContact O-CA 3.11Å; L438-G442 PolarHBondContact O-N 3.14Å; L438-F443 WeakPolarHBondContact CD1-O 3.33Å; L438-P445 HydrophobicContact CB-CG 4.38Å; L438-A545 HydrophobicContact CD2-CB 4.23Å
439R74.1Confident71.4Confident165.5 Ų165.562.9 Ų62.963%0.62534%0.337SS*.Hα-helixtrans-66.7-39.6178.2-75173.5-167.6126.49.8113E435 D436 I437E435-R439 WeakPolarHBondContact O-CB 3.21Å; E435-R439 VanDerWaalsContact O-CG 3.22Å; E435-R439 WeakPolarHBondContact O-CG 3.34Å; E435-R439 PolarHBondContact O-N 3.35Å; E435-R439 IonicContact OE2-CZ 2.8Å; E435-R439 IonicContact OE2-NH1 3.71Å; E435-R439 IonicContact OE2-NH2 3.09Å; E435-R439 PolarHBondContact OE2-NH2 3.17Å; D436-R439 PolarHBondContact O-N 2.93Å; D436-R439 IonicContact OD1-NH1 3.59Å; D436-R439 PolarHBondContact OD1-NH1 3.26Å; I437-R439 VanDerWaalsContact C-N 3.34Å; I437-R439 PolarHBondContact O-N 3.16Å
440S75.7Confident70.4Confident94.5 Ų94.562.2 Ų62.266%0.66133%0.334SS*.Hα-helixtrans-84.6-38.5-173.357.20000113.3D436 I437D436-S440 VanDerWaalsContact O-CB 3.23Å; D436-S440 WeakPolarHBondContact O-CB 3.39Å; D436-S440 PolarHBondContact O-N 3.17Å; D436-S440 PolarHBondContact O-OG 3.13Å; I437-S440 PolarHBondContact O-N 3.15Å; I437-S440 PolarHBondContact O-OG 3.09Å
441T70.9Confident70.1Confident81 Ų8161.8 Ų61.850%0.49733%0.332SS..Hα-helixtrans-104.8-20.1-174.168.10000113.4I437 F443I437-T441 HydrophobicContact CG2-CG2 4.49Å; I437-T441 WeakPolarHBondContact O-CB 3.47Å; I437-T441 PolarHBondContact O-N 3.34Å; I437-T441 PolarHBondContact O-OG1 3.27Å; T441-F443 PolarHBondContact O-N 3.38Å; T441-F443 VanDerWaalsContact O-N 3.16Å; T441-F443 VanDerWaalsContact OG1-CB 3.28Å; T441-F443 WeakPolarHBondContact OG1-CB 3.34Å; T441-F443 PolarHBondContact OG1-N 3.1Å; T441-F443 VanDerWaalsContact OG1-N 3.13Å
442G65.7Low70.2Confident62.5 Ų62.560.8 Ų60.864%0.64433%0.328SS*.  trans67.71-169.200000114L438L438-G442 VanDerWaalsContact O-CA 3.26Å; L438-G442 WeakPolarHBondContact O-CA 3.11Å; L438-G442 PolarHBondContact O-N 3.14Å
443F63.3Low70.3Confident136 Ų13657.8 Ų57.860%0.59631%0.313SS*.  trans-80139.6177.1-115.2-88.3000110.2L438 T441 P445 T447L438-F443 WeakPolarHBondContact CD1-O 3.33Å; T441-F443 PolarHBondContact O-N 3.38Å; T441-F443 VanDerWaalsContact O-N 3.16Å; T441-F443 VanDerWaalsContact OG1-CB 3.28Å; T441-F443 WeakPolarHBondContact OG1-CB 3.34Å; T441-F443 PolarHBondContact OG1-N 3.1Å; T441-F443 VanDerWaalsContact OG1-N 3.13Å; F443-P445 VanDerWaalsContact O-CD 3.24Å; F443-P445 WeakPolarHBondContact O-CD 3.33Å; F443-T447 WeakPolarHBondContact CD1-OG1 3.39Å; F443-T447 HydrophobicContact CE1-CG2 4.06Å; F443-T447 WeakPolarHBondContact CE1-OG1 3.33Å
444D62.4Low70.6Confident64 Ų6452.4 Ų52.434%0.34229%0.293SS..  trans-66.3114.1173.5-129.8-19.8000109.7S446 T447 C547D444-S446 PolarHBondContact O-N 3.05Å; D444-S446 WeakPolarHBondContact OD1-CB 3.06Å; D444-S446 PolarHBondContact OD1-N 2.86Å; D444-S446 VanDerWaalsContact OD1-N 3.08Å; D444-S446 PolarHBondContact OD1-OG 3.05Å; D444-S446 VanDerWaalsContact OD1-OG 3.12Å; D444-S446 PolarHBondContact OD2-OG 2.8Å; D444-T447 PolarHBondContact O-N 3.06Å; D444-T447 VanDerWaalsContact O-N 3.08Å; D444-T447 PolarHBondContact O-OG1 2.82Å; D444-C547 WeakPolarHBondContact OD1-CB 3.49Å
445P58.9Low71.2Confident1.5 Ų1.552.1 Ų52.11%0.0129%0.291CS..G310 helixtrans-62.9-14.4-177.526.8-36000112.6D434 I437 L438 F443 T447 T448 C547D434-P445 HydrophobicContact CB-CB 3.83Å; D434-P445 HydrophobicContact CB-CG 3.92Å; I437-P445 HydrophobicContact CG2-CB 4.5Å; L438-P445 HydrophobicContact CB-CG 4.38Å; F443-P445 VanDerWaalsContact O-CD 3.24Å; F443-P445 WeakPolarHBondContact O-CD 3.33Å; P445-T447 PolarHBondContact O-N 3.06Å; P445-T447 VanDerWaalsContact O-N 3.15Å; P445-T448 PolarHBondContact O-N 3.09Å; P445-T448 PolarHBondContact O-OG1 3.19Å; P445-C547 HydrophobicContact CG-CB 4.26Å
446S57.9Low71.9Confident48.5 Ų48.550.5 Ų50.534%0.33928%0.284SS..G310 helixtrans-56.7-23.9174.374.50000113.4D444D444-S446 PolarHBondContact O-N 3.05Å; D444-S446 WeakPolarHBondContact OD1-CB 3.06Å; D444-S446 PolarHBondContact OD1-N 2.86Å; D444-S446 VanDerWaalsContact OD1-N 3.08Å; D444-S446 PolarHBondContact OD1-OG 3.05Å; D444-S446 VanDerWaalsContact OD1-OG 3.12Å; D444-S446 PolarHBondContact OD2-OG 2.8Å
447T58.8Low72.4Confident92 Ų9247.7 Ų47.756%0.56427%0.268SS*.G310 helixtrans-82-22.917960.80000113.9F443 D444 P445 G449F443-T447 WeakPolarHBondContact CD1-OG1 3.39Å; F443-T447 HydrophobicContact CE1-CG2 4.06Å; F443-T447 WeakPolarHBondContact CE1-OG1 3.33Å; D444-T447 PolarHBondContact O-N 3.06Å; D444-T447 VanDerWaalsContact O-N 3.08Å; D444-T447 PolarHBondContact O-OG1 2.82Å; P445-T447 PolarHBondContact O-N 3.06Å; P445-T447 VanDerWaalsContact O-N 3.15Å; T447-G449 PolarHBondContact O-N 3.3Å
448T62.5Low73.1Confident52.5 Ų52.545.5 Ų45.532%0.32226%0.257SS..SBendtrans-74-8.2-173.364.20000113.3P445 H450P445-T448 PolarHBondContact O-N 3.09Å; P445-T448 PolarHBondContact O-OG1 3.19Å; T448-H450 PolarHBondContact O-CD2 2.79Å; T448-H450 PolarHBondContact O-N 3.46Å
449G62.6Low74.1Confident2.5 Ų2.543.2 Ų43.23%0.02625%0.245CC..SBendtrans74-28.4177.500000114.7E390 T447 N454E390-G449 VanDerWaalsContact CB-O 3.31Å; E390-G449 WeakPolarHBondContact CB-O 3.34Å; T447-G449 PolarHBondContact O-N 3.3Å; G449-N454 VanDerWaalsContact O-CB 3.28Å; G449-N454 WeakPolarHBondContact O-CB 3.21Å; G449-N454 VanDerWaalsContact O-CG 3.28Å; G449-N454 PolarHBondContact O-ND2 3.16Å
450H64.3Low74.8Confident65.5 Ų65.535.7 Ų35.730%0.30322%0.218SC..SBendtrans-92.8-5.5-175-53.4-42.3000114.6G387 E390 T448G387-H450 WeakPolarHBondContact CA-CE1 3.33Å; G387-H450 WeakPolarHBondContact CA-ND1 3.42Å; E390-H450 IonicContact OE2-CE1 3.9Å; E390-H450 PolarHBondContact OE2-CE1 3.42Å; E390-H450 VanDerWaalsContact OE2-CE1 3.28Å; E390-H450 IonicContact OE2-ND1 3.01Å; T448-H450 PolarHBondContact O-CD2 2.79Å; T448-H450 PolarHBondContact O-N 3.46Å
451G76Confident75.3Confident0.5 Ų0.534.5 Ų34.51%0.00520%0.202CC..SBendtrans-77.9169.3-169.500000117.2D434 A453 N454 F455D434-G451 VanDerWaalsContact CG-CA 3.46Å; D434-G451 WeakPolarHBondContact OD1-CA 3.4Å; D434-G451 VanDerWaalsContact OD2-C 3.25Å; D434-G451 WeakPolarHBondContact OD2-CA 3.39Å; G451-A453 VanDerWaalsContact C-N 3.26Å; G451-A453 PolarHBondContact O-N 3.26Å; G451-N454 WeakPolarHBondContact O-CA 3.39Å; G451-N454 VanDerWaalsContact O-CB 3.31Å; G451-N454 WeakPolarHBondContact O-CB 3.48Å; G451-N454 PolarHBondContact O-N 2.84Å; G451-F455 PolarHBondContact O-N 3.33Å; G451-F455 VanDerWaalsContact O-N 3.13Å
452F85.4Confident76.1Confident7 Ų730.7 Ų30.73%0.03118%0.179CC..Hα-helixtrans-57.5-36.1171.1-174.4-110.1000111.7V427 I430 R431 D434 N454 F455 L456 F535 A539 L548V427-F452 HydrophobicContact CG1-CD2 4.27Å; V427-F452 HydrophobicContact CG1-CE2 3.75Å; I430-F452 HydrophobicContact CG2-CB 4.08Å; I430-F452 VanDerWaalsContact CG2-N 3.33Å; R431-F452 HydrophobicContact CB-CB 4.08Å; R431-F452 HydrophobicContact CB-CD1 4.22Å; R431-F452 HydrophobicContact CB-CD2 4.1Å; R431-F452 HydrophobicContact CB-CG 3.88Å; R431-F452 HydrophobicContact CG-CB 4.44Å; R431-F452 HydrophobicContact CG-CD1 4Å; R431-F452 HydrophobicContact CG-CE1 4.29Å; R431-F452 HydrophobicContact CG-CG 4.18Å; D434-F452 PolarHBondContact OD2-N 2.92Å; F452-N454 VanDerWaalsContact C-N 3.29Å; F452-N454 PolarHBondContact O-N 3.12Å; F452-F455 HydrophobicContact CD2-CD1 4.37Å; F452-F455 HydrophobicContact CE2-CD1 4.29Å; F452-F455 WeakPolarHBondContact O-CB 3.18Å; F452-F455 PolarHBondContact O-N 2.96Å; F452-F455 VanDerWaalsContact O-N 3.13Å; F452-L456 HydrophobicContact CD1-CD1 4.09Å; F452-L456 HydrophobicContact CD1-CG 4.34Å; F452-L456 HydrophobicContact CE1-CD1 3.75Å; F452-L456 HydrophobicContact CE1-CD2 4.15Å; F452-L456 HydrophobicContact CE1-CG 4.04Å; F452-L456 HydrophobicContact CZ-CD1 4.41Å; F452-L456 HydrophobicContact CZ-CD2 3.97Å; F452-L456 HydrophobicContact CZ-CG 4.29Å; F452-L456 WeakPolarHBondContact O-CG 3.33Å; F452-L456 PolarHBondContact O-N 3.3Å; F452-F535 AromaticContact CE2-CE2 3.89Å; F452-F535 HydrophobicContact CE2-CE2 3.89Å; F452-F535 HydrophobicContact CE2-CZ 4.32Å; F452-F535 HydrophobicContact CZ-CE2 4.03Å; F452-F535 HydrophobicContact CZ-CZ 4.33Å; F452-A539 HydrophobicContact CZ-CB 4.3Å; F452-L548 HydrophobicContact CD1-CD1 4.31Å; F452-L548 HydrophobicContact CD1-CD2 3.82Å; F452-L548 HydrophobicContact CE1-CD1 4.48Å
453A83.9Confident77.1Confident0.5 Ų0.527.8 Ų27.80%0.00415%0.148CC..Hα-helixtrans-58.2-40.717200000112.2D434 G451 F455 L456 L457 L548 P551D434-A453 PolarHBondContact OD2-N 2.91Å; G451-A453 VanDerWaalsContact C-N 3.26Å; G451-A453 PolarHBondContact O-N 3.26Å; A453-F455 VanDerWaalsContact C-N 3.34Å; A453-L456 PolarHBondContact O-N 3.25Å; A453-L457 WeakPolarHBondContact O-CG 3.39Å; A453-L457 PolarHBondContact O-N 3.31Å; A453-L457 VanDerWaalsContact O-N 3.12Å; A453-L548 HydrophobicContact CB-CD2 4.14Å; A453-P551 HydrophobicContact CB-CB 4.45Å; A453-P551 HydrophobicContact CB-CG 3.9Å
454N85.4Confident78Confident2.5 Ų2.523.3 Ų23.31%0.01313%0.131CC..Hα-helixtrans-67.9-37.3175.9-177.260.8000111.4L389 E390 R393 G449 G451 F452 L456 L457 L458L389-N454 VanDerWaalsContact C-ND2 3.34Å; L389-N454 PolarHBondContact O-ND2 3.17Å; L389-N454 VanDerWaalsContact O-ND2 3.08Å; E390-N454 PolarHBondContact N-ND2 3.34Å; R393-N454 VanDerWaalsContact CZ-OD1 3.28Å; R393-N454 PolarHBondContact NE-OD1 3Å; R393-N454 PolarHBondContact NH2-OD1 3Å; G449-N454 VanDerWaalsContact O-CB 3.28Å; G449-N454 WeakPolarHBondContact O-CB 3.21Å; G449-N454 VanDerWaalsContact O-CG 3.28Å; G449-N454 PolarHBondContact O-ND2 3.16Å; G451-N454 WeakPolarHBondContact O-CA 3.39Å; G451-N454 VanDerWaalsContact O-CB 3.31Å; G451-N454 WeakPolarHBondContact O-CB 3.48Å; G451-N454 PolarHBondContact O-N 2.84Å; F452-N454 VanDerWaalsContact C-N 3.29Å; F452-N454 PolarHBondContact O-N 3.12Å; N454-L456 PolarHBondContact O-N 3.34Å; N454-L457 CarbonylContact O-C 3.57Å; N454-L457 PolarHBondContact O-N 3.3Å; N454-L458 WeakPolarHBondContact O-CB 3.41Å; N454-L458 PolarHBondContact O-N 3.09Å
455F89.7Confident78.5Confident1 Ų121 Ų210%0.00412%0.118CC..Hα-helixtrans-61.3-44.4173.8-174.6-120.3000112.6L389 I416 L419 I420 V427 G451 F452 A453 L457 L458 I459 F535L389-F455 HydrophobicContact CD1-CB 4.16Å; L389-F455 HydrophobicContact CD1-CD2 4Å; L389-F455 HydrophobicContact CD1-CG 4.35Å; L389-F455 HydrophobicContact CD2-CD2 4.09Å; L389-F455 HydrophobicContact CD2-CE2 4.47Å; I416-F455 HydrophobicContact CG2-CE2 4.28Å; I416-F455 HydrophobicContact CG2-CZ 4.18Å; L419-F455 HydrophobicContact CD2-CD2 4.45Å; L419-F455 HydrophobicContact CD2-CE2 3.79Å; L419-F455 HydrophobicContact CD2-CZ 4.09Å; I420-F455 HydrophobicContact CD1-CE1 4.17Å; I420-F455 HydrophobicContact CD1-CZ 3.96Å; I420-F455 HydrophobicContact CG1-CE1 3.94Å; I420-F455 HydrophobicContact CG1-CZ 3.75Å; V427-F455 HydrophobicContact CG1-CE1 4.38Å; G451-F455 PolarHBondContact O-N 3.33Å; G451-F455 VanDerWaalsContact O-N 3.13Å; F452-F455 HydrophobicContact CD2-CD1 4.37Å; F452-F455 HydrophobicContact CE2-CD1 4.29Å; F452-F455 WeakPolarHBondContact O-CB 3.18Å; F452-F455 PolarHBondContact O-N 2.96Å; F452-F455 VanDerWaalsContact O-N 3.13Å; A453-F455 VanDerWaalsContact C-N 3.34Å; F455-L457 VanDerWaalsContact C-N 3.32Å; F455-L457 PolarHBondContact O-N 3.1Å; F455-L458 HydrophobicContact CD2-CD2 4.32Å; F455-L458 WeakPolarHBondContact O-CB 3.47Å; F455-L458 PolarHBondContact O-N 3.25Å; F455-I459 HydrophobicContact CD1-CD1 4.33Å; F455-I459 HydrophobicContact CE1-CD1 3.93Å; F455-I459 HydrophobicContact CZ-CD1 4.07Å; F455-I459 WeakPolarHBondContact O-CG1 3.44Å; F455-I459 PolarHBondContact O-N 3.26Å; F455-I459 VanDerWaalsContact O-N 3.13Å; F455-F535 HydrophobicContact CD1-CZ 4.24Å; F455-F535 HydrophobicContact CE1-CE2 4.14Å; F455-F535 AromaticContact CE1-CZ 3.81Å; F455-F535 HydrophobicContact CE1-CZ 3.81Å
456L89.7Confident78.8Confident1.5 Ų1.521.1 Ų21.11%0.00812%0.119CC..Hα-helixtrans-63.3-38.5174.7-62.7177.8000111.9F452 A453 N454 L458 I459 A460 F535 P551 M555F452-L456 HydrophobicContact CD1-CD1 4.09Å; F452-L456 HydrophobicContact CD1-CG 4.34Å; F452-L456 HydrophobicContact CE1-CD1 3.75Å; F452-L456 HydrophobicContact CE1-CD2 4.15Å; F452-L456 HydrophobicContact CE1-CG 4.04Å; F452-L456 HydrophobicContact CZ-CD1 4.41Å; F452-L456 HydrophobicContact CZ-CD2 3.97Å; F452-L456 HydrophobicContact CZ-CG 4.29Å; F452-L456 WeakPolarHBondContact O-CG 3.33Å; F452-L456 PolarHBondContact O-N 3.3Å; A453-L456 PolarHBondContact O-N 3.25Å; N454-L456 PolarHBondContact O-N 3.34Å; L456-L458 VanDerWaalsContact C-N 3.34Å; L456-I459 PolarHBondContact O-N 3.02Å; L456-A460 WeakPolarHBondContact O-CB 3.17Å; L456-A460 PolarHBondContact O-N 3.25Å; L456-F535 HydrophobicContact CD2-CZ 3.97Å; L456-P551 HydrophobicContact CB-CB 3.85Å; L456-P551 HydrophobicContact CD1-CB 4.06Å; L456-M555 HydrophobicContact CD2-CE 3.95Å; L456-M555 HydrophobicContact CD2-SD 3.46Å; L456-M555 WeakPolarHBondContact CD2-SD 3.45Å
457L88.4Confident78.9Confident25 Ų2519.1 Ų19.113%0.13111%0.106CC..Hα-helixtrans-69.2-30.8175.1-71.4172.6000112.9A453 N454 F455 A460 Q461 P551 R554A453-L457 WeakPolarHBondContact O-CG 3.39Å; A453-L457 PolarHBondContact O-N 3.31Å; A453-L457 VanDerWaalsContact O-N 3.12Å; N454-L457 CarbonylContact O-C 3.57Å; N454-L457 PolarHBondContact O-N 3.3Å; F455-L457 VanDerWaalsContact C-N 3.32Å; F455-L457 PolarHBondContact O-N 3.1Å; L457-A460 WeakPolarHBondContact O-CB 3.38Å; L457-A460 PolarHBondContact O-N 3.28Å; L457-Q461 WeakPolarHBondContact O-CB 3.44Å; L457-Q461 WeakPolarHBondContact O-CG 3.38Å; L457-Q461 PolarHBondContact O-N 3.07Å; L457-P551 HydrophobicContact CD1-CG 4.44Å; L457-P551 HydrophobicContact CD2-CB 4.36Å; L457-P551 HydrophobicContact CG-CB 4.09Å; L457-P551 HydrophobicContact CG-CG 4.4Å; L457-R554 HydrophobicContact CD2-CB 4.18Å
458L89.5Confident79.3Confident3 Ų315.9 Ų15.92%0.0169%0.087CC..Hα-helixtrans-62.8-47.7172.7177.172.3000110.3L389 A392 R393 L397 I416 N454 F455 L456 Q461 L462L389-L458 HydrophobicContact CD2-CD2 4.34Å; A392-L458 HydrophobicContact CB-CD1 3.78Å; A392-L458 HydrophobicContact CB-CD2 4.11Å; R393-L458 HydrophobicContact CB-CB 4.33Å; R393-L458 HydrophobicContact CB-CD1 3.79Å; R393-L458 HydrophobicContact CG-CB 4.47Å; R393-L458 HydrophobicContact CG-CD1 4.33Å; L397-L458 HydrophobicContact CD1-CD1 3.55Å; L397-L458 HydrophobicContact CG-CD1 4.04Å; I416-L458 HydrophobicContact CD1-CD2 3.97Å; I416-L458 HydrophobicContact CD1-CG 3.99Å; I416-L458 HydrophobicContact CG1-CD2 4.08Å; N454-L458 WeakPolarHBondContact O-CB 3.41Å; N454-L458 PolarHBondContact O-N 3.09Å; F455-L458 HydrophobicContact CD2-CD2 4.32Å; F455-L458 WeakPolarHBondContact O-CB 3.47Å; F455-L458 PolarHBondContact O-N 3.25Å; L456-L458 VanDerWaalsContact C-N 3.34Å; L458-Q461 PolarHBondContact O-N 2.97Å; L458-L462 WeakPolarHBondContact O-CB 3.45Å; L458-L462 PolarHBondContact O-N 2.99Å
459I90.9Very high79.5Confident0 Ų016.5 Ų16.50%08%0.083CC..Hα-helixtrans-59.9-48.4174-62.6172.3000109.7I416 I420 F455 L456 Q461 L462 Y463 F478 F535 M555 L559I416-I459 HydrophobicContact CG2-CD1 4.2Å; I416-I459 HydrophobicContact CG2-CG1 3.83Å; I420-I459 HydrophobicContact CD1-CD1 4.18Å; F455-I459 HydrophobicContact CD1-CD1 4.33Å; F455-I459 HydrophobicContact CE1-CD1 3.93Å; F455-I459 HydrophobicContact CZ-CD1 4.07Å; F455-I459 WeakPolarHBondContact O-CG1 3.44Å; F455-I459 PolarHBondContact O-N 3.26Å; F455-I459 VanDerWaalsContact O-N 3.13Å; L456-I459 PolarHBondContact O-N 3.02Å; I459-Q461 VanDerWaalsContact C-N 3.31Å; I459-Q461 PolarHBondContact O-N 3.03Å; I459-L462 PolarHBondContact O-N 3.26Å; I459-Y463 HydrophobicContact CG2-CD2 3.7Å; I459-Y463 HydrophobicContact CG2-CE2 3.77Å; I459-Y463 WeakPolarHBondContact O-CD2 3.34Å; I459-Y463 PolarHBondContact O-N 3.27Å; I459-Y463 VanDerWaalsContact O-N 3.15Å; I459-F478 HydrophobicContact CG2-CE1 4.48Å; I459-F478 HydrophobicContact CG2-CZ 4.4Å; I459-F535 HydrophobicContact CD1-CE1 3.89Å; I459-F535 HydrophobicContact CD1-CZ 4.13Å; I459-M555 HydrophobicContact CB-CG 4.01Å; I459-M555 HydrophobicContact CB-SD 4.32Å; I459-M555 HydrophobicContact CD1-SD 3.99Å; I459-M555 HydrophobicContact CG2-CG 3.54Å; I459-M555 HydrophobicContact CG2-SD 4.01Å; I459-L559 HydrophobicContact CG2-CD1 4.42Å; I459-L559 HydrophobicContact CG2-CD2 4.28Å; I459-L559 HydrophobicContact CG2-CG 4.41Å
460A88.2Confident79.9Confident7.5 Ų7.516.9 Ų16.96%0.0629%0.085CC..Hα-helixtrans-55.2-45178.700000112.6L456 L457 N464 R554 M555L456-A460 WeakPolarHBondContact O-CB 3.17Å; L456-A460 PolarHBondContact O-N 3.25Å; L457-A460 WeakPolarHBondContact O-CB 3.38Å; L457-A460 PolarHBondContact O-N 3.28Å; A460-N464 WeakPolarHBondContact O-CB 3.38Å; A460-N464 PolarHBondContact O-N 3.36Å; A460-N464 VanDerWaalsContact O-N 3.13Å; A460-R554 VanDerWaalsContact CB-C 3.46Å; A460-R554 HydrophobicContact CB-CB 4.02Å; A460-R554 VanDerWaalsContact CB-O 3.3Å; A460-R554 WeakPolarHBondContact CB-O 3.39Å; A460-M555 HydrophobicContact CB-CB 4.47Å
461Q87.2Confident80.6Confident69.5 Ų69.513.8 Ų13.833%0.3257%0.071SC..Hα-helixtrans-74.1-38.8-177.8-74.8-179.2-1200112.8L397 L457 L458 I459L397-Q461 HydrophobicContact CD1-CB 3.68Å; L457-Q461 WeakPolarHBondContact O-CB 3.44Å; L457-Q461 WeakPolarHBondContact O-CG 3.38Å; L457-Q461 PolarHBondContact O-N 3.07Å; L458-Q461 PolarHBondContact O-N 2.97Å; I459-Q461 VanDerWaalsContact C-N 3.31Å; I459-Q461 PolarHBondContact O-N 3.03Å
462L87.4Confident80.6Confident2 Ų213.8 Ų13.81%0.017%0.071CC..Hα-helixtrans-61.1-50.7178.7-179.266.4000110.8L397 F402 V409 M412 H413 I416 L458 I459 H471L397-L462 HydrophobicContact CD1-CB 4.19Å; L397-L462 HydrophobicContact CD2-CB 4.48Å; L397-L462 HydrophobicContact CD2-CD1 3.92Å; F402-L462 HydrophobicContact CE1-CD1 3.92Å; F402-L462 HydrophobicContact CZ-CD1 4.46Å; V409-L462 HydrophobicContact CG1-CD1 4.16Å; M412-L462 HydrophobicContact CB-CD1 4.25Å; M412-L462 HydrophobicContact CB-CD2 4.34Å; H413-L462 HydrophobicContact CB-CD2 4.4Å; I416-L462 HydrophobicContact CD1-CD2 3.59Å; L458-L462 WeakPolarHBondContact O-CB 3.45Å; L458-L462 PolarHBondContact O-N 2.99Å; I459-L462 PolarHBondContact O-N 3.26Å; L462-H471 PolarHBondContact O-CD2 2.96Å
463Y86.8Confident80.1Confident0.5 Ų0.515.7 Ų15.70%0.0028%0.078CC..Hα-helixtrans-84.6-16.1-173-61.3-72.4000114.6H413 I459 Q465 L474 F478 G558 L559 C561H413-Y463 AromaticContact ND1-CE1 3.78Å; H413-Y463 AromaticContact ND1-CZ 3.65Å; H413-Y463 PolarHBondContact ND1-OH 3.33Å; I459-Y463 HydrophobicContact CG2-CD2 3.7Å; I459-Y463 HydrophobicContact CG2-CE2 3.77Å; I459-Y463 WeakPolarHBondContact O-CD2 3.34Å; I459-Y463 PolarHBondContact O-N 3.27Å; I459-Y463 VanDerWaalsContact O-N 3.15Å; Y463-Q465 PolarHBondContact O-N 3.35Å; Y463-L474 HydrophobicContact CE1-CB 3.89Å; Y463-F478 HydrophobicContact CD2-CE2 4.45Å; Y463-F478 HydrophobicContact CE1-CE2 4.26Å; Y463-F478 HydrophobicContact CE2-CD2 4.44Å; Y463-F478 AromaticContact CE2-CE2 3.58Å; Y463-F478 HydrophobicContact CE2-CE2 3.58Å; Y463-F478 AromaticContact CE2-CZ 3.91Å; Y463-F478 HydrophobicContact CE2-CZ 3.91Å; Y463-F478 AromaticContact CZ-CE2 3.47Å; Y463-F478 VanDerWaalsContact CZ-CE2 3.47Å; Y463-F478 WeakPolarHBondContact OH-CE2 3.19Å; Y463-G558 CarbonylContact C-O 3.51Å; Y463-G558 WeakPolarHBondContact CB-O 3.3Å; Y463-G558 VanDerWaalsContact O-O 3.1Å; Y463-L559 HydrophobicContact CD1-CD2 4.49Å; Y463-L559 HydrophobicContact CD2-CD2 3.53Å; Y463-L559 HydrophobicContact CD2-CG 4.49Å; Y463-L559 HydrophobicContact CE2-CD2 4.11Å; Y463-L559 HydrophobicContact CG-CD2 3.81Å; Y463-C561 PolarHBondContact O-SG 3.45Å
464N81.4Confident79.9Confident42 Ų4215.8 Ų15.823%0.2258%0.078CC..  trans-72.352-177.3-174.154.2000113.8A460 P466 H557 G558 R693A460-N464 WeakPolarHBondContact O-CB 3.38Å; A460-N464 PolarHBondContact O-N 3.36Å; A460-N464 VanDerWaalsContact O-N 3.13Å; N464-P466 VanDerWaalsContact O-CD 3.3Å; N464-P466 WeakPolarHBondContact O-CD 3.49Å; N464-H557 PolarHBondContact OD1-CE1 2.7Å; N464-H557 VanDerWaalsContact OD1-CE1 3.26Å; N464-H557 PolarHBondContact OD1-ND1 2.88Å; N464-H557 VanDerWaalsContact OD1-ND1 3.16Å; N464-G558 PolarHBondContact N-O 3.13Å; N464-R693 PolarHBondContact OD1-NH1 3.16Å; N464-R693 PolarHBondContact OD1-NH2 2.89Å
465Q74.5Confident79.8Confident16.5 Ų16.515.7 Ų15.78%0.0778%0.078CC..  trans-127.768.4173.9-65.4-126.811.600109.7E403 Y463 G467 S468 H471E403-Q465 HydrophobicContact CB-CG 3.83Å; E403-Q465 HydrophobicContact CG-CG 4.49Å; E403-Q465 VanDerWaalsContact OE1-CD 3.3Å; E403-Q465 WeakPolarHBondContact OE1-CG 3.44Å; E403-Q465 PolarHBondContact OE1-NE2 3.08Å; E403-Q465 WeakPolarHBondContact OE2-CG 3.26Å; E403-Q465 PolarHBondContact OE2-NE2 3.16Å; E403-Q465 PolarHBondContact OE2-OE1 3.24Å; Y463-Q465 PolarHBondContact O-N 3.35Å; Q465-G467 PolarHBondContact O-N 3.1Å; Q465-S468 VanDerWaalsContact O-CB 3.28Å; Q465-S468 WeakPolarHBondContact O-CB 3.5Å; Q465-S468 PolarHBondContact O-N 3.36Å; Q465-H471 HydrophobicContact CB-CB 4.26Å; Q465-H471 VanDerWaalsContact CD-CE1 3.43Å; Q465-H471 PolarHBondContact NE2-NE2 2.73Å; Q465-H471 PolarHBondContact OE1-CE1 3.37Å; Q465-H471 PolarHBondContact OE1-ND1 3.11Å; Q465-H471 VanDerWaalsContact OE1-ND1 3.1Å; Q465-H471 PolarHBondContact OE1-NE2 3.44Å
466P63.8Low79.4Confident4 Ų416.9 Ų16.93%0.0268%0.084CC..THydrogen-bonded Turntrans-64.8144.6177.729.7-35.3000109.6N464 R693 M697 W1267 E1268N464-P466 VanDerWaalsContact O-CD 3.3Å; N464-P466 WeakPolarHBondContact O-CD 3.49Å; P466-R693 VanDerWaalsContact CG-NH1 3.31Å; P466-M697 HydrophobicContact CB-CE 3.69Å; P466-M697 VanDerWaalsContact CB-CE 3.44Å; P466-M697 HydrophobicContact CG-CE 4.03Å; P466-W1267 HydrophobicContact CB-CH2 3.77Å; P466-W1267 HydrophobicContact CB-CZ2 3.19Å; P466-W1267 HydrophobicContact CG-CH2 3.96Å; P466-W1267 HydrophobicContact CG-CZ2 3.1Å; P466-W1267 VanDerWaalsContact O-CE2 3.31Å; P466-W1267 WeakPolarHBondContact O-CZ2 3.33Å; P466-W1267 PolarHBondContact O-NE1 3.29Å; P466-E1268 HydrophobicContact CG-CG 4.43Å; P466-E1268 WeakPolarHBondContact CG-OE1 3.41Å
467G61.3Low79Confident6.5 Ų6.518.5 Ų18.57%0.0679%0.091CC..THydrogen-bonded Turntrans89.7-9.4-170.300000115.2Q465 S1241Q465-G467 PolarHBondContact O-N 3.1Å; G467-S1241 WeakPolarHBondContact O-CB 3.36Å; G467-S1241 PolarHBondContact O-OG 2.94Å
468S66.7Low78.9Confident24.5 Ų24.517.3 Ų17.317%0.1719%0.085CC..  trans-87120.1168.8-1770000110.3Q465 L470 H471 G472Q465-S468 VanDerWaalsContact O-CB 3.28Å; Q465-S468 WeakPolarHBondContact O-CB 3.5Å; Q465-S468 PolarHBondContact O-N 3.36Å; S468-L470 VanDerWaalsContact C-N 3.27Å; S468-L470 PolarHBondContact O-N 2.91Å; S468-H471 VanDerWaalsContact CB-ND1 3.25Å; S468-H471 WeakPolarHBondContact CB-ND1 3.29Å; S468-H471 PolarHBondContact O-N 2.99Å; S468-H471 PolarHBondContact OG-N 3.12Å; S468-H471 PolarHBondContact OG-ND1 2.95Å; S468-G472 PolarHBondContact O-N 3.26Å
469R66.5Low78.6Confident63.5 Ų63.517.5 Ų17.524%0.249%0.086CC..Hα-helixtrans-56.7-41.6175.9-177.1171.7177-165.3-2.3112R473 W1217 L1218 Y1219R469-R473 WeakPolarHBondContact O-CB 3.39Å; R469-R473 PolarHBondContact O-N 3.44Å; R469-R473 VanDerWaalsContact O-N 3.1Å; R469-W1217 HydrophobicContact CB-CE3 4.1Å; R469-W1217 HydrophobicContact CB-CZ3 3.65Å; R469-W1217 HydrophobicContact CG-CE3 4.2Å; R469-W1217 HydrophobicContact CG-CZ3 4.15Å; R469-W1217 PolarHBondContact NE-O 3.3Å; R469-L1218 HydrophobicContact CG-CD2 4.36Å; R469-L1218 PolarHBondContact NE-O 2.92Å; R469-L1218 PolarHBondContact NH2-O 2.87Å; R469-Y1219 PolarHBondContact NH2-O 3.36Å
470L71.1Confident77.8Confident12 Ų1220.4 Ų20.46%0.06310%0.097CC..Hα-helixtrans-62.7-54.5177.9-178.285.2000111.1P406 V409 S468 G472 R473 L474 V1232P406-L470 VanDerWaalsContact CA-CD2 3.46Å; P406-L470 HydrophobicContact CB-CD1 4.07Å; P406-L470 HydrophobicContact CB-CD2 3.83Å; V409-L470 HydrophobicContact CB-CD2 3.62Å; V409-L470 VanDerWaalsContact CB-CD2 3.43Å; V409-L470 HydrophobicContact CG1-CD2 3.53Å; V409-L470 HydrophobicContact CG1-CG 4.17Å; V409-L470 HydrophobicContact CG2-CD2 4.1Å; S468-L470 VanDerWaalsContact C-N 3.27Å; S468-L470 PolarHBondContact O-N 2.91Å; L470-G472 VanDerWaalsContact C-N 3.35Å; L470-G472 PolarHBondContact O-N 3.02Å; L470-R473 PolarHBondContact O-N 3.1Å; L470-L474 HydrophobicContact CD1-CD1 4.02Å; L470-L474 HydrophobicContact CD1-CG 4.05Å; L470-L474 HydrophobicContact CD2-CD1 3.95Å; L470-L474 HydrophobicContact CG-CD1 3.79Å; L470-L474 HydrophobicContact CG-CG 4.36Å; L470-L474 WeakPolarHBondContact O-CB 3.24Å; L470-L474 VanDerWaalsContact O-CG 3.25Å; L470-L474 WeakPolarHBondContact O-CG 3.32Å; L470-L474 PolarHBondContact O-N 3.15Å; L470-V1232 HydrophobicContact CB-CG1 4.41Å; L470-V1232 HydrophobicContact CD1-CG1 3.53Å
471H79Confident76.5Confident0.5 Ų0.523.2 Ų23.20%0.00211%0.114CC..Hα-helixtrans-67.2-36.1-177.1-61.680000112.6E403 V409 L462 Q465 S468 G475E403-H471 PolarHBondContact O-CE1 2.61Å; V409-H471 VanDerWaalsContact CG1-NE2 3.35Å; V409-H471 WeakPolarHBondContact CG1-NE2 3.31Å; V409-H471 WeakPolarHBondContact CG2-NE2 3.27Å; L462-H471 PolarHBondContact O-CD2 2.96Å; Q465-H471 HydrophobicContact CB-CB 4.26Å; Q465-H471 VanDerWaalsContact CD-CE1 3.43Å; Q465-H471 PolarHBondContact NE2-NE2 2.73Å; Q465-H471 PolarHBondContact OE1-CE1 3.37Å; Q465-H471 PolarHBondContact OE1-ND1 3.11Å; Q465-H471 VanDerWaalsContact OE1-ND1 3.1Å; Q465-H471 PolarHBondContact OE1-NE2 3.44Å; S468-H471 VanDerWaalsContact CB-ND1 3.25Å; S468-H471 WeakPolarHBondContact CB-ND1 3.29Å; S468-H471 PolarHBondContact O-N 2.99Å; S468-H471 PolarHBondContact OG-N 3.12Å; S468-H471 PolarHBondContact OG-ND1 2.95Å; H471-G475 WeakPolarHBondContact O-CA 3.43Å; H471-G475 PolarHBondContact O-N 3.26Å
472G75.3Confident74.5Confident1 Ų122.3 Ų22.31%0.0111%0.113CC..Hα-helixtrans-60.3-47.4173.300000112S468 L470 G475 L476S468-G472 PolarHBondContact O-N 3.26Å; L470-G472 VanDerWaalsContact C-N 3.35Å; L470-G472 PolarHBondContact O-N 3.02Å; G472-G475 PolarHBondContact O-N 2.71Å; G472-L476 WeakPolarHBondContact O-CG 3.46Å; G472-L476 PolarHBondContact O-N 2.87Å; G472-L476 VanDerWaalsContact O-N 3.17Å
473R75Confident72.5Confident46.5 Ų46.525 Ų2518%0.17514%0.142CC..Hα-helixtrans-68.4-43.8178.7-171.4175.4-179.5165.3-0.6112.9R469 L470 G475 L476 N1225 L1227R469-R473 WeakPolarHBondContact O-CB 3.39Å; R469-R473 PolarHBondContact O-N 3.44Å; R469-R473 VanDerWaalsContact O-N 3.1Å; L470-R473 PolarHBondContact O-N 3.1Å; R473-G475 VanDerWaalsContact C-N 3.31Å; R473-G475 PolarHBondContact O-N 3.23Å; R473-L476 WeakPolarHBondContact O-CB 3.22Å; R473-L476 PolarHBondContact O-N 2.99Å; R473-N1225 PolarHBondContact NH2-O 3.29Å; R473-N1225 VanDerWaalsContact NH2-O 3.13Å; R473-L1227 VanDerWaalsContact CD-CD1 3.44Å; R473-L1227 HydrophobicContact CG-CD1 4.26Å
474L80.8Confident70.2Confident2 Ų231.8 Ų31.81%0.0117%0.173CC..Hα-helixtrans-67.1-34177.4-66.1179000111.9V409 Y410 H413 Y463 L470 L476 E477V409-L474 HydrophobicContact CG1-CD1 4.01Å; Y410-L474 HydrophobicContact CD2-CD2 4.19Å; Y410-L474 HydrophobicContact CE2-CD2 4.26Å; H413-L474 HydrophobicContact CB-CD1 3.89Å; H413-L474 PolarHBondContact CE1-O 2.95Å; Y463-L474 HydrophobicContact CE1-CB 3.89Å; L470-L474 HydrophobicContact CD1-CD1 4.02Å; L470-L474 HydrophobicContact CD1-CG 4.05Å; L470-L474 HydrophobicContact CD2-CD1 3.95Å; L470-L474 HydrophobicContact CG-CD1 3.79Å; L470-L474 HydrophobicContact CG-CG 4.36Å; L470-L474 WeakPolarHBondContact O-CB 3.24Å; L470-L474 VanDerWaalsContact O-CG 3.25Å; L470-L474 WeakPolarHBondContact O-CG 3.32Å; L470-L474 PolarHBondContact O-N 3.15Å; L474-L476 VanDerWaalsContact C-N 3.32Å; L474-L476 PolarHBondContact O-N 2.98Å; L474-E477 PolarHBondContact O-N 3.04Å
475G83.3Confident68.1Low0.5 Ų0.534.7 Ų34.71%0.00519%0.188CC..Hα-helixtrans-67.9-30.7174.300000113H471 G472 R473 E477 F478 W479H471-G475 WeakPolarHBondContact O-CA 3.43Å; H471-G475 PolarHBondContact O-N 3.26Å; G472-G475 PolarHBondContact O-N 2.71Å; R473-G475 VanDerWaalsContact C-N 3.31Å; R473-G475 PolarHBondContact O-N 3.23Å; G475-E477 VanDerWaalsContact C-N 3.26Å; G475-E477 PolarHBondContact O-N 3.31Å; G475-F478 PolarHBondContact O-N 3.2Å; G475-W479 VanDerWaalsContact O-CD1 3.26Å
476L81.2Confident66.2Low26 Ų2639.4 Ų39.414%0.13622%0.218CC..Hα-helixtrans-64.5-25176.6-81.9170.1000113.8G472 R473 L474 F478 W479 S562 S564 A565 L1218G472-L476 WeakPolarHBondContact O-CG 3.46Å; G472-L476 PolarHBondContact O-N 2.87Å; G472-L476 VanDerWaalsContact O-N 3.17Å; R473-L476 WeakPolarHBondContact O-CB 3.22Å; R473-L476 PolarHBondContact O-N 2.99Å; L474-L476 VanDerWaalsContact C-N 3.32Å; L474-L476 PolarHBondContact O-N 2.98Å; L476-F478 PolarHBondContact O-N 3.12Å; L476-F478 VanDerWaalsContact O-N 3.16Å; L476-W479 PolarHBondContact O-N 3.14Å; L476-S562 WeakPolarHBondContact CD2-OG 3.38Å; L476-S564 WeakPolarHBondContact CD2-OG 3.48Å; L476-A565 HydrophobicContact CD2-CB 4.08Å; L476-L1218 HydrophobicContact CD1-CD1 3.59Å
477E81.4Confident64.7Low34.5 Ų34.546.6 Ų46.616%0.16126%0.256CS..THydrogen-bonded Turntrans-61.2-23.9175.8-64.6-168.8-175.300113.5H413 L474 G475 W479 R528 Q529 L532H413-E477 IonicContact CE1-OE1 3.79Å; H413-E477 IonicContact CE1-OE2 3.18Å; H413-E477 PolarHBondContact CE1-OE2 3.05Å; H413-E477 VanDerWaalsContact CE1-OE2 3.27Å; H413-E477 VanDerWaalsContact NE2-CD 3.34Å; H413-E477 IonicContact NE2-OE1 3.33Å; H413-E477 PolarHBondContact NE2-OE1 2.79Å; H413-E477 IonicContact NE2-OE2 3.15Å; H413-E477 PolarHBondContact NE2-OE2 3.33Å; L474-E477 PolarHBondContact O-N 3.04Å; G475-E477 VanDerWaalsContact C-N 3.26Å; G475-E477 PolarHBondContact O-N 3.31Å; E477-W479 VanDerWaalsContact C-N 3.28Å; E477-W479 PolarHBondContact O-N 3.11Å; E477-R528 IonicContact OE1-NH1 3.16Å; E477-R528 IonicContact OE1-NH2 3.71Å; E477-R528 IonicContact OE2-CZ 3.26Å; E477-R528 VanDerWaalsContact OE2-CZ 3.23Å; E477-R528 IonicContact OE2-NE 2.98Å; E477-R528 PolarHBondContact OE2-NE 3.12Å; E477-R528 VanDerWaalsContact OE2-NE 3.08Å; E477-R528 IonicContact OE2-NH1 3.31Å; E477-R528 PolarHBondContact OE2-NH1 2.84Å; E477-R528 VanDerWaalsContact OE2-NH1 3.1Å; E477-R528 IonicContact OE2-NH2 3.11Å; E477-R528 PolarHBondContact OE2-NH2 3.24Å; E477-Q529 WeakPolarHBondContact O-CG 3.23Å; E477-L532 HydrophobicContact CB-CD1 3.97Å; E477-L532 WeakPolarHBondContact O-CD1 3.29Å
478F85.1Confident63.1Low0 Ų052 Ų520%028%0.283CS..THydrogen-bonded Turntrans-75.8-17.6176.3-72.6-95.6000113.1I416 T417 I420 I459 Y463 G475 L476 L532 L536 L559I416-F478 HydrophobicContact CG2-CZ 4.45Å; T417-F478 HydrophobicContact CG2-CE2 4.3Å; T417-F478 HydrophobicContact CG2-CZ 4.15Å; I420-F478 HydrophobicContact CD1-CE1 3.94Å; I420-F478 HydrophobicContact CD1-CZ 4.41Å; I459-F478 HydrophobicContact CG2-CE1 4.48Å; I459-F478 HydrophobicContact CG2-CZ 4.4Å; Y463-F478 HydrophobicContact CD2-CE2 4.45Å; Y463-F478 HydrophobicContact CE1-CE2 4.26Å; Y463-F478 HydrophobicContact CE2-CD2 4.44Å; Y463-F478 AromaticContact CE2-CE2 3.58Å; Y463-F478 HydrophobicContact CE2-CE2 3.58Å; Y463-F478 AromaticContact CE2-CZ 3.91Å; Y463-F478 HydrophobicContact CE2-CZ 3.91Å; Y463-F478 AromaticContact CZ-CE2 3.47Å; Y463-F478 VanDerWaalsContact CZ-CE2 3.47Å; Y463-F478 WeakPolarHBondContact OH-CE2 3.19Å; G475-F478 PolarHBondContact O-N 3.2Å; L476-F478 PolarHBondContact O-N 3.12Å; L476-F478 VanDerWaalsContact O-N 3.16Å; F478-L532 HydrophobicContact CD1-CB 4.24Å; F478-L532 HydrophobicContact CD1-CD2 4.38Å; F478-L532 HydrophobicContact CE1-CD2 4.05Å; F478-L532 HydrophobicContact CZ-CD2 4.43Å; F478-L536 HydrophobicContact CB-CD1 3.92Å; F478-L536 HydrophobicContact CD1-CD2 4.47Å; F478-L536 HydrophobicContact CD1-CG 4.44Å; F478-L536 WeakPolarHBondContact O-CD1 3.17Å; F478-L559 HydrophobicContact CB-CD1 4.15Å; F478-L559 HydrophobicContact CB-CD2 4.15Å; F478-L559 HydrophobicContact CD1-CD1 4.29Å; F478-L559 HydrophobicContact CD1-CD2 4.46Å; F478-L559 HydrophobicContact CD2-CD2 3.61Å; F478-L559 HydrophobicContact CE2-CD2 4.13Å; F478-L559 HydrophobicContact CG-CD1 4.15Å; F478-L559 HydrophobicContact CG-CD2 3.81Å
479W83.7Confident61.1Low7.5 Ų7.554.5 Ų54.53%0.02830%0.304CS..  trans-106.8130.8-171.4-60.6106.2000110.9G475 L476 E477 I533 L536 L556 L559 A565 L568 C569 L572G475-W479 VanDerWaalsContact O-CD1 3.26Å; L476-W479 PolarHBondContact O-N 3.14Å; E477-W479 VanDerWaalsContact C-N 3.28Å; E477-W479 PolarHBondContact O-N 3.11Å; W479-I533 HydrophobicContact CE3-CD1 4.38Å; W479-L536 HydrophobicContact CD2-CD1 4.47Å; W479-L536 HydrophobicContact CD2-CD2 4.37Å; W479-L536 HydrophobicContact CE3-CD1 4.3Å; W479-L536 HydrophobicContact CE3-CD2 3.82Å; W479-L536 HydrophobicContact CH2-CD1 4.42Å; W479-L536 HydrophobicContact CH2-CD2 3.73Å; W479-L536 HydrophobicContact CZ2-CD2 4.29Å; W479-L536 HydrophobicContact CZ3-CD1 4.27Å; W479-L536 HydrophobicContact CZ3-CD2 3.48Å; W479-L536 VanDerWaalsContact CZ3-CD2 3.48Å; W479-L556 HydrophobicContact CH2-CD2 3.91Å; W479-L556 HydrophobicContact CZ2-CD2 4.45Å; W479-L559 HydrophobicContact CZ2-CB 3.84Å; W479-L559 HydrophobicContact CZ2-CD1 4.48Å; W479-L559 PolarHBondContact NE1-O 3.16Å; W479-A565 HydrophobicContact CG-CB 4.42Å; W479-L568 HydrophobicContact CB-CB 4.3Å; W479-L568 HydrophobicContact CB-CD1 3.58Å; W479-L568 HydrophobicContact CD2-CB 4.2Å; W479-L568 HydrophobicContact CE3-CB 3.8Å; W479-L568 HydrophobicContact CG-CB 4.44Å; W479-L568 HydrophobicContact CG-CD1 4.44Å; W479-L568 HydrophobicContact CZ3-CB 4.42Å; W479-C569 HydrophobicContact CH2-CB 3.44Å; W479-C569 VanDerWaalsContact CH2-CB 3.49Å; W479-C569 HydrophobicContact CZ2-CB 3.93Å; W479-C569 VanDerWaalsContact CZ3-CA 3.5Å; W479-C569 HydrophobicContact CZ3-CB 4Å; W479-L572 HydrophobicContact CZ3-CB 4.45Å; W479-L572 HydrophobicContact CZ3-CD1 3.96Å
480W73.5Confident59.3Low62 Ų6257.5 Ų57.524%0.23533%0.332CS..  trans-119.3137.3172-176.8-90.4000109.2V482 L485 N526 Q529 I533W480-V482 WeakPolarHBondContact O-CG2 3.23Å; W480-V482 PolarHBondContact O-N 3.18Å; W480-L485 HydrophobicContact CG-CD2 4.49Å; W480-L485 HydrophobicContact CG-CG 4.45Å; W480-N526 HydrophobicContact CH2-CB 4.03Å; W480-N526 WeakPolarHBondContact CH2-OD1 3.43Å; W480-N526 HydrophobicContact CZ3-CB 4.13Å; W480-N526 VanDerWaalsContact CZ3-OD1 3.23Å; W480-N526 WeakPolarHBondContact CZ3-OD1 3.33Å; W480-Q529 HydrophobicContact CE3-CB 3.96Å; W480-Q529 HydrophobicContact CZ3-CB 4.3Å; W480-Q529 VanDerWaalsContact CZ3-OE1 3.23Å; W480-I533 HydrophobicContact CB-CB 4.15Å; W480-I533 HydrophobicContact CB-CG1 4.2Å; W480-I533 HydrophobicContact CB-CG2 4.02Å
481P60.9Low57.1Low65 Ų6562.6 Ų62.642%0.42236%0.364SS..  trans-55.4104.2173.4-24.133.9000111.3G483 E484P481-G483 VanDerWaalsContact C-N 3.26Å; P481-G483 PolarHBondContact O-N 2.97Å; P481-E484 PolarHBondContact O-N 3.41Å; P481-E484 VanDerWaalsContact O-N 3.1Å
482V46.6Very low54.6Low51.5 Ų51.566.7 Ų66.731%0.31240%0.398SS..THydrogen-bonded Turntrans-65.125.6-178178.60000109.8W480 E484 A575W480-V482 WeakPolarHBondContact O-CG2 3.23Å; W480-V482 PolarHBondContact O-N 3.18Å; V482-E484 PolarHBondContact O-N 2.95Å; V482-A575 HydrophobicContact CG1-CB 3.99Å
483G44.4Very low52.2Low58.5 Ų58.575 Ų7560%0.60344%0.441SS*.THydrogen-bonded Turntrans-121.7-32.4-179.400000116.3P481 L485 T486P481-G483 VanDerWaalsContact C-N 3.26Å; P481-G483 PolarHBondContact O-N 2.97Å; G483-L485 VanDerWaalsContact C-N 3.3Å; G483-L485 PolarHBondContact O-N 3.46Å; G483-L485 VanDerWaalsContact O-N 3.16Å; G483-T486 PolarHBondContact O-OG1 2.67Å
484E38.7Very low49.8Very low142.5 Ų142.576.1 Ų76.167%0.66647%0.467SS*.G310 helixtrans-86.46.9-173.5-67.6-173.8172.900114P481 V482 T486 N487P481-E484 PolarHBondContact O-N 3.41Å; P481-E484 VanDerWaalsContact O-N 3.1Å; V482-E484 PolarHBondContact O-N 2.95Å; E484-T486 PolarHBondContact O-N 3.27Å; E484-T486 VanDerWaalsContact O-N 3.17Å; E484-N487 PolarHBondContact O-N 3.17Å; E484-N487 VanDerWaalsContact O-N 3.07Å
485L37.1Very low47.1Very low104.5 Ų104.581.7 Ų81.755%0.54751%0.506SS..G310 helixtrans-71-5.3171.3-75.5169.5000113.3W480 G483 N487 I488 I533W480-L485 HydrophobicContact CG-CD2 4.49Å; W480-L485 HydrophobicContact CG-CG 4.45Å; G483-L485 VanDerWaalsContact C-N 3.3Å; G483-L485 PolarHBondContact O-N 3.46Å; G483-L485 VanDerWaalsContact O-N 3.16Å; L485-N487 PolarHBondContact O-N 3.26Å; L485-I488 HydrophobicContact CD2-CD1 4.14Å; L485-I488 PolarHBondContact O-N 3.18Å; L485-I533 HydrophobicContact CD1-CG1 4.13Å; L485-I533 HydrophobicContact CD1-CG2 3.88Å; L485-I533 HydrophobicContact CD2-CG2 4.42Å
486T35.1Very low44.2Very low114 Ų11486.8 Ų86.870%0.69954%0.541SS*.G310 helixtrans-107.137.8173.657.80000112.5G483 E484 I488G483-T486 PolarHBondContact O-OG1 2.67Å; E484-T486 PolarHBondContact O-N 3.27Å; E484-T486 VanDerWaalsContact O-N 3.17Å; T486-I488 PolarHBondContact O-N 3.3Å; T486-I488 VanDerWaalsContact O-N 3.16Å
487N31.8Very low41.6Very low155.5 Ų155.592.5 Ų92.583%0.83257%0.572SS**G310 helixtrans-42.140.3165.8-72.1-11.1000115.5E484 L485 A489E484-N487 PolarHBondContact O-N 3.17Å; E484-N487 VanDerWaalsContact O-N 3.07Å; L485-N487 PolarHBondContact O-N 3.26Å; N487-A489 PolarHBondContact O-N 3.3Å; N487-A489 VanDerWaalsContact O-N 3.15Å
488I27.6Very low38.9Very low120.5 Ų120.598.4 Ų98.462%0.61860%0.604SS**  trans-11598.7160.4-53.5-177.6000107.3L485 T486L485-I488 HydrophobicContact CD2-CD1 4.14Å; L485-I488 PolarHBondContact O-N 3.18Å; T486-I488 PolarHBondContact O-N 3.3Å; T486-I488 VanDerWaalsContact O-N 3.16Å
489A25.9Very low36.1Very low76 Ų76106.6 Ų106.663%0.62865%0.647SS**  trans-55.4143.6168.900000109.6N487 V491N487-A489 PolarHBondContact O-N 3.3Å; N487-A489 VanDerWaalsContact O-N 3.15Å; A489-V491 PolarHBondContact O-N 3.06Å
490P26.9Very low33.3Very low126 Ų126111.4 Ų111.482%0.81868%0.682SS**  trans-61.2111.5-174.125.7-32.7000108.8A492P490-A492 VanDerWaalsContact C-N 3.29Å; P490-A492 PolarHBondContact O-N 2.91Å
491V25.8Very low31.6Very low120.5 Ų120.5114.5 Ų114.573%0.7371%0.71SS**  trans-68.590.4167.8-179.90000105.9A489 L493A489-V491 PolarHBondContact O-N 3.06Å; V491-L493 VanDerWaalsContact C-N 3.31Å; V491-L493 PolarHBondContact O-N 3Å; V491-L493 VanDerWaalsContact O-N 3.17Å
492A27.2Very low30Very low87 Ų87116.6 Ų116.672%0.71973%0.726SS**  trans-59.7106.1157.500000106.2P490 G494P490-A492 VanDerWaalsContact C-N 3.29Å; P490-A492 PolarHBondContact O-N 2.91Å; A492-G494 PolarHBondContact O-N 3.07Å
493L23.9Very low29.2Very low175 Ų175120.8 Ų120.892%0.91675%0.752SS**SBendtrans-58.9108.1167.7-86.2140.3000108.1V491V491-L493 VanDerWaalsContact C-N 3.31Å; V491-L493 PolarHBondContact O-N 3Å; V491-L493 VanDerWaalsContact O-N 3.17Å
494G24.2Very low28.4Very low69.5 Ų69.5122.8 Ų122.872%0.71676%0.762SS**  trans119.196.6166.100000114.9A492A492-G494 PolarHBondContact O-N 3.07Å
495S24.2Very low27.8Very low120 Ų120123.7 Ų123.784%0.83977%0.772SS**  trans132.692.5144-108.30000114.3D497S495-D497 PolarHBondContact O-N 3.41Å
496S23.4Very low27.4Very low106 Ų106128.4 Ų128.474%0.74179%0.788SS**  trans-75.9108.1156.2167.90000107.6
497D25.6Very low26.9Very low147 Ų147128.1 Ų128.179%0.78679%0.791SS**  trans-168.4130.7140.8-87.3-22.9000109.8S495S495-D497 PolarHBondContact O-N 3.41Å
498L25.7Very low26.9Very low158 Ų158127 Ų12783%0.82779%0.792SS**  trans5.8127.2174.7-58.9163.1000112.6
499L26Very low26.7Very low172 Ų172132 Ų13290%0.90180%0.803SS**  142.2111.8129.6-69.6166000113.5
500S25.3Very low26.8Very low109 Ų109133.9 Ų133.976%0.76281%0.809SS**  trans-126.2135.6137-170.30000111.7
501P36.9Very low26.6Very low126 Ų126136.6 Ų136.682%0.81881%0.808SS**  trans-86126-177.533.4-29.6000110.4
502S26.6Very low26.6Very low109.5 Ų109.5140.1 Ų140.177%0.76681%0.813SS**  trans-127.1122168610000111.5
503T30.1Very low26.4Very low140.5 Ų140.5143.7 Ų143.786%0.86282%0.815SS**  trans0.7111.2164.353.60000114.8
504A28.3Very low26.5Very low99 Ų99140.8 Ų140.882%0.81881%0.805SS**  trans-101.9117.8159.600000111.8
505D26.7Very low26.5Very low163 Ų163148.1 Ų148.187%0.87281%0.812SS**  trans-98.6113.7155.9-97-31.8000109.9
506K27.6Very low26.7Very low202 Ų202145.8 Ų145.888%0.87881%0.808SS**  trans-152.8118.9148.1-85.9174.2-178.6-179.70111.6
507S25.4Very low27Very low108 Ų108144.9 Ų144.976%0.75580%0.801SS**  trans12.6139.9156.965.50000115R509S507-R509 PolarHBondContact O-N 3.29Å
508P31.7Very low27.2Very low131.5 Ų131.5144.3 Ų144.385%0.85479%0.794SS**  trans-87.6113-167.434.1-30.4000111
509R23.7Very low27.7Very low226 Ų226141.5 Ų141.585%0.85379%0.787SS**  trans-90.8149.4162.8-83.8-177177.3175.9-0.2109.7S507 K511S507-R509 PolarHBondContact O-N 3.29Å; R509-K511 PolarHBondContact O-N 3.13Å
510P27.2Very low28.1Very low115.5 Ų115.5141.5 Ų141.575%0.7578%0.775SS**  trans-66.2126.2-166.727.4-32.6000110.3F512P510-F512 PolarHBondContact O-N 3.35Å; P510-F512 VanDerWaalsContact O-N 3.1Å
511K23.2Very low28.6Very low184.5 Ų184.5139.1 Ų139.180%0.80275%0.754SS**  trans-66.3104.5-177.6-64.8174.6178.61780109.2R509 H513R509-K511 PolarHBondContact O-N 3.13Å; K511-H513 PolarHBondContact O-N 2.8Å
512F25Very low29.1Very low192.5 Ų192.5135.5 Ų135.584%0.84474%0.735SS**  trans-64.2116.2154.9-90.4-90.9000107.3P510 T514P510-F512 PolarHBondContact O-N 3.35Å; P510-F512 VanDerWaalsContact O-N 3.1Å; F512-T514 PolarHBondContact O-N 3.16Å; F512-T514 VanDerWaalsContact O-N 3.13Å
513H24.1Very low30.1Very low163.5 Ų163.5136 Ų13676%0.75773%0.725SS**  trans-73.386.1176.7-85.4-84.6000109.8K511 Y515K511-H513 PolarHBondContact O-N 2.8Å; H513-Y515 PolarHBondContact O-N 3.4Å
514T25.9Very low31Very low113 Ų113132 Ų13269%0.69370%0.698SS**  trans-102.778163.9-20.80000108.2F512 G516F512-T514 PolarHBondContact O-N 3.16Å; F512-T514 VanDerWaalsContact O-N 3.13Å; T514-G516 PolarHBondContact O-N 3.23Å
515Y24.6Very low32.4Very low223 Ų223130.2 Ų130.288%0.87568%0.675SS**  trans-87.3104.8168.5-88.4-88000108.2H513 S517H513-Y515 PolarHBondContact O-N 3.4Å; Y515-S517 PolarHBondContact O-N 3.44Å
516G28.3Very low34.3Very low72.5 Ų72.5125.6 Ų125.675%0.74765%0.65SS**SBendtrans-13342175.500000113.5T514T514-G516 PolarHBondContact O-N 3.23Å
517S28.5Very low36.5Very low86 Ų86121.4 Ų121.460%0.60164%0.636SS**SBendtrans-133.227.1166.9-175.80000111.7Y515 S519 R520 N521Y515-S517 PolarHBondContact O-N 3.44Å; S517-S519 VanDerWaalsContact C-N 3.32Å; S517-S519 PolarHBondContact O-N 2.97Å; S517-R520 PolarHBondContact O-N 3.36Å; S517-N521 PolarHBondContact O-N 3.15Å
518Q29.7Very low39Very low136 Ų136117.7 Ų117.764%0.63661%0.606SS**Hα-helixtrans-127.822.1170.3-79.7175.117.200111.6R520 A522Q518-R520 VanDerWaalsContact C-N 3.33Å; Q518-R520 PolarHBondContact O-N 3.17Å; Q518-A522 PolarHBondContact O-N 3.42Å
519S37.4Very low41.2Very low98 Ų98113.9 Ų113.969%0.68558%0.577SS**THydrogen-bonded Turntrans-71.1-16.9-170.5-171.90000115.2S517S517-S519 VanDerWaalsContact C-N 3.32Å; S517-S519 PolarHBondContact O-N 2.97Å
520R33.2Very low44Very low171.5 Ų171.5105 Ų10565%0.64755%0.551SS**Hα-helixtrans-95.9-38.1-176.8-74.6-174.2178172.60113.4S517 Q518 A522 E523 L524S517-R520 PolarHBondContact O-N 3.36Å; Q518-R520 VanDerWaalsContact C-N 3.33Å; Q518-R520 PolarHBondContact O-N 3.17Å; R520-A522 VanDerWaalsContact C-N 3.27Å; R520-A522 PolarHBondContact O-N 3.03Å; R520-E523 WeakPolarHBondContact O-CB 3.4Å; R520-E523 PolarHBondContact O-N 2.93Å; R520-E523 VanDerWaalsContact O-N 3.09Å; R520-L524 VanDerWaalsContact O-CD1 3.25Å; R520-L524 WeakPolarHBondContact O-CD1 3.46Å; R520-L524 PolarHBondContact O-N 3.29Å
521N36.9Very low46.7Very low60.5 Ų60.5100.9 Ų100.932%0.32453%0.527SS..Hα-helixtrans-61.1-40177.1-67.7-6.5000111.1S517 E523 L524 D525S517-N521 PolarHBondContact O-N 3.15Å; N521-E523 VanDerWaalsContact C-N 3.3Å; N521-E523 PolarHBondContact O-N 3.37Å; N521-L524 PolarHBondContact O-N 2.91Å; N521-D525 WeakPolarHBondContact O-CB 3.39Å; N521-D525 VanDerWaalsContact O-CG 3.22Å; N521-D525 PolarHBondContact O-N 3.34Å
522A47.7Very low49.8Very low50.5 Ų50.592.1 Ų92.142%0.41749%0.489SS..Hα-helixtrans-59.2-38.8174.300000112.6Q518 R520 L524 N526Q518-A522 PolarHBondContact O-N 3.42Å; R520-A522 VanDerWaalsContact C-N 3.27Å; R520-A522 PolarHBondContact O-N 3.03Å; A522-L524 PolarHBondContact O-N 3.49Å; A522-N526 WeakPolarHBondContact O-CB 3.5Å; A522-N526 PolarHBondContact O-N 3.34Å; A522-N526 PolarHBondContact O-ND2 3.28Å; A522-N526 VanDerWaalsContact O-ND2 3.08Å; A522-N526 PolarHBondContact O-OD1 3.14Å
523E47.7Very low52.7Low119 Ų11983.3 Ų83.356%0.55645%0.45SS*.Hα-helixtrans-67.8-38.2179.4-118.2176.9-178.600112.5R520 N521 N526 I527R520-E523 WeakPolarHBondContact O-CB 3.4Å; R520-E523 PolarHBondContact O-N 2.93Å; R520-E523 VanDerWaalsContact O-N 3.09Å; N521-E523 VanDerWaalsContact C-N 3.3Å; N521-E523 PolarHBondContact O-N 3.37Å; E523-N526 WeakPolarHBondContact O-CB 3.33Å; E523-N526 PolarHBondContact O-N 3.32Å; E523-I527 WeakPolarHBondContact O-CG1 3.47Å; E523-I527 PolarHBondContact O-N 3.18Å
524L48.4Very low55.6Low56 Ų5683.8 Ų83.829%0.29345%0.446SS..Hα-helixtrans-72.3-41.8177.2-92.883000112.6C266 R520 N521 A522 N526 I527 R528C266-L524 HydrophobicContact CB-CD2 3.75Å; R520-L524 VanDerWaalsContact O-CD1 3.25Å; R520-L524 WeakPolarHBondContact O-CD1 3.46Å; R520-L524 PolarHBondContact O-N 3.29Å; N521-L524 PolarHBondContact O-N 2.91Å; A522-L524 PolarHBondContact O-N 3.49Å; L524-N526 PolarHBondContact O-N 2.94Å; L524-I527 WeakPolarHBondContact O-CB 3.32Å; L524-I527 PolarHBondContact O-N 3.34Å; L524-R528 PolarHBondContact O-N 2.98Å
525D57Low58.7Low62 Ų6279.3 Ų79.333%0.33242%0.416SS..Hα-helixtrans-56.4-37.1172.4-74.7-23.5000110.2T264 N521 I527 R528 Q529T264-D525 VanDerWaalsContact CB-OD1 3.25Å; T264-D525 WeakPolarHBondContact CB-OD1 3.38Å; T264-D525 WeakPolarHBondContact CG2-OD1 3.31Å; N521-D525 WeakPolarHBondContact O-CB 3.39Å; N521-D525 VanDerWaalsContact O-CG 3.22Å; N521-D525 PolarHBondContact O-N 3.34Å; D525-I527 PolarHBondContact O-N 3.4Å; D525-R528 PolarHBondContact O-N 3.41Å; D525-Q529 VanDerWaalsContact O-CB 3.32Å; D525-Q529 WeakPolarHBondContact O-CB 3.48Å; D525-Q529 VanDerWaalsContact O-CG 3.27Å; D525-Q529 WeakPolarHBondContact O-CG 3.11Å; D525-Q529 PolarHBondContact O-N 2.93Å
526N67Low61.6Low66.5 Ų66.568.7 Ų68.736%0.35638%0.375SS..Hα-helixtrans-64.6-38.6174-61.6-20.4000112.7W480 A522 E523 L524 A530W480-N526 HydrophobicContact CH2-CB 4.03Å; W480-N526 WeakPolarHBondContact CH2-OD1 3.43Å; W480-N526 HydrophobicContact CZ3-CB 4.13Å; W480-N526 VanDerWaalsContact CZ3-OD1 3.23Å; W480-N526 WeakPolarHBondContact CZ3-OD1 3.33Å; A522-N526 WeakPolarHBondContact O-CB 3.5Å; A522-N526 PolarHBondContact O-N 3.34Å; A522-N526 PolarHBondContact O-ND2 3.28Å; A522-N526 VanDerWaalsContact O-ND2 3.08Å; A522-N526 PolarHBondContact O-OD1 3.14Å; E523-N526 WeakPolarHBondContact O-CB 3.33Å; E523-N526 PolarHBondContact O-N 3.32Å; L524-N526 PolarHBondContact O-N 2.94Å; N526-A530 WeakPolarHBondContact O-CB 3.39Å; N526-A530 PolarHBondContact O-N 3.2Å
527I73.4Confident64.3Low114 Ų11469.8 Ų69.859%0.58536%0.356SS*.Hα-helixtrans-66.5-45.3177.5-64.4166.8000110.5E523 L524 D525 A530 A531E523-I527 WeakPolarHBondContact O-CG1 3.47Å; E523-I527 PolarHBondContact O-N 3.18Å; L524-I527 WeakPolarHBondContact O-CB 3.32Å; L524-I527 PolarHBondContact O-N 3.34Å; D525-I527 PolarHBondContact O-N 3.4Å; I527-A530 PolarHBondContact O-N 3.22Å; I527-A531 PolarHBondContact O-N 3.39Å
528R77.9Confident66.9Low30 Ų3069.4 Ų69.411%0.11335%0.347CS..Hα-helixtrans-61.5-50.5177.9-178.9176.1172.2-171.9-6.4110.8N263 H413 T417 V421 E477 L524 D525 A530 A531 L532N263-R528 VanDerWaalsContact ND2-CZ 3.34Å; N263-R528 PolarHBondContact ND2-NH1 3.12Å; N263-R528 PolarHBondContact ND2-NH2 3.47Å; N263-R528 PolarHBondContact O-NH1 2.77Å; N263-R528 PolarHBondContact OD1-NH1 2.9Å; H413-R528 PolarHBondContact NE2-NH2 3.38Å; H413-R528 VanDerWaalsContact NE2-NH2 3.12Å; T417-R528 PolarHBondContact OG1-NH2 3.35Å; V421-R528 HydrophobicContact CG2-CG 3.97Å; E477-R528 IonicContact OE1-NH1 3.16Å; E477-R528 IonicContact OE1-NH2 3.71Å; E477-R528 IonicContact OE2-CZ 3.26Å; E477-R528 VanDerWaalsContact OE2-CZ 3.23Å; E477-R528 IonicContact OE2-NE 2.98Å; E477-R528 PolarHBondContact OE2-NE 3.12Å; E477-R528 VanDerWaalsContact OE2-NE 3.08Å; E477-R528 IonicContact OE2-NH1 3.31Å; E477-R528 PolarHBondContact OE2-NH1 2.84Å; E477-R528 VanDerWaalsContact OE2-NH1 3.1Å; E477-R528 IonicContact OE2-NH2 3.11Å; E477-R528 PolarHBondContact OE2-NH2 3.24Å; L524-R528 PolarHBondContact O-N 2.98Å; D525-R528 PolarHBondContact O-N 3.41Å; R528-A530 VanDerWaalsContact C-N 3.31Å; R528-A530 PolarHBondContact O-N 3.04Å; R528-A531 WeakPolarHBondContact O-CB 3.32Å; R528-A531 PolarHBondContact O-N 3.25Å; R528-A531 VanDerWaalsContact O-N 3.12Å; R528-L532 HydrophobicContact CG-CD1 4.33Å; R528-L532 WeakPolarHBondContact O-CG 3.39Å; R528-L532 PolarHBondContact O-N 3.14Å
529Q79Confident69.5Low51.5 Ų51.563.2 Ų63.224%0.24132%0.319CS..Hα-helixtrans-61.9-38.9177.1-70.3178.33.300111.7E477 W480 D525 A531 L532 I533E477-Q529 WeakPolarHBondContact O-CG 3.23Å; W480-Q529 HydrophobicContact CE3-CB 3.96Å; W480-Q529 HydrophobicContact CZ3-CB 4.3Å; W480-Q529 VanDerWaalsContact CZ3-OE1 3.23Å; D525-Q529 VanDerWaalsContact O-CB 3.32Å; D525-Q529 WeakPolarHBondContact O-CB 3.48Å; D525-Q529 VanDerWaalsContact O-CG 3.27Å; D525-Q529 WeakPolarHBondContact O-CG 3.11Å; D525-Q529 PolarHBondContact O-N 2.93Å; Q529-A531 VanDerWaalsContact C-N 3.33Å; Q529-A531 PolarHBondContact O-N 3.01Å; Q529-L532 PolarHBondContact O-N 3.22Å; Q529-I533 WeakPolarHBondContact O-CG2 3.32Å; Q529-I533 PolarHBondContact O-N 3.03Å
530A81.7Confident71.6Confident38 Ų3858.6 Ų58.631%0.31429%0.287SS..Hα-helixtrans-61.7-38174.600000112.5N526 I527 R528 I533 R534N526-A530 WeakPolarHBondContact O-CB 3.39Å; N526-A530 PolarHBondContact O-N 3.2Å; I527-A530 PolarHBondContact O-N 3.22Å; R528-A530 VanDerWaalsContact C-N 3.31Å; R528-A530 PolarHBondContact O-N 3.04Å; A530-I533 VanDerWaalsContact O-CG2 3.29Å; A530-I533 WeakPolarHBondContact O-CG2 3.33Å; A530-R534 WeakPolarHBondContact O-CB 3.34Å; A530-R534 PolarHBondContact O-N 2.99Å
531A84.5Confident73.8Confident29.5 Ų29.553.3 Ų53.324%0.24427%0.272CS..Hα-helixtrans-67.6-41.8174.600000111.9V421 I527 R528 Q529 R534 F535V421-A531 HydrophobicContact CG2-CB 4.16Å; I527-A531 PolarHBondContact O-N 3.39Å; R528-A531 WeakPolarHBondContact O-CB 3.32Å; R528-A531 PolarHBondContact O-N 3.25Å; R528-A531 VanDerWaalsContact O-N 3.12Å; Q529-A531 VanDerWaalsContact C-N 3.33Å; Q529-A531 PolarHBondContact O-N 3.01Å; A531-R534 PolarHBondContact O-N 2.8Å; A531-F535 WeakPolarHBondContact O-CB 3.47Å; A531-F535 PolarHBondContact O-N 3.47Å
532L87Confident75.6Confident0 Ų053.6 Ų53.60%027%0.272CS..Hα-helixtrans-67.6-44.2179.4-64.4173.2000112.5T417 I420 V421 E477 F478 R528 Q529 R534 F535 L536T417-L532 HydrophobicContact CG2-CD1 4.07Å; T417-L532 HydrophobicContact CG2-CD2 4.05Å; I420-L532 HydrophobicContact CB-CD2 4.03Å; I420-L532 HydrophobicContact CD1-CD2 4.1Å; I420-L532 HydrophobicContact CG2-CD2 3.83Å; V421-L532 HydrophobicContact CG2-CD2 4.11Å; V421-L532 HydrophobicContact CG2-CG 4.29Å; E477-L532 HydrophobicContact CB-CD1 3.97Å; E477-L532 WeakPolarHBondContact O-CD1 3.29Å; F478-L532 HydrophobicContact CD1-CB 4.24Å; F478-L532 HydrophobicContact CD1-CD2 4.38Å; F478-L532 HydrophobicContact CE1-CD2 4.05Å; F478-L532 HydrophobicContact CZ-CD2 4.43Å; R528-L532 HydrophobicContact CG-CD1 4.33Å; R528-L532 WeakPolarHBondContact O-CG 3.39Å; R528-L532 PolarHBondContact O-N 3.14Å; Q529-L532 PolarHBondContact O-N 3.22Å; L532-R534 VanDerWaalsContact C-N 3.32Å; L532-R534 PolarHBondContact O-N 2.84Å; L532-F535 WeakPolarHBondContact O-CB 3.31Å; L532-F535 PolarHBondContact O-N 2.83Å; L532-L536 PolarHBondContact O-N 3.33Å
533I85.8Confident76.8Confident8 Ų851.4 Ų51.44%0.04125%0.253CS..Hα-helixtrans-67.5-34.7175.2-170.360.6000111.5W479 W480 L485 Q529 A530 F535 L536 R537 L572W479-I533 HydrophobicContact CE3-CD1 4.38Å; W480-I533 HydrophobicContact CB-CB 4.15Å; W480-I533 HydrophobicContact CB-CG1 4.2Å; W480-I533 HydrophobicContact CB-CG2 4.02Å; L485-I533 HydrophobicContact CD1-CG1 4.13Å; L485-I533 HydrophobicContact CD1-CG2 3.88Å; L485-I533 HydrophobicContact CD2-CG2 4.42Å; Q529-I533 WeakPolarHBondContact O-CG2 3.32Å; Q529-I533 PolarHBondContact O-N 3.03Å; A530-I533 VanDerWaalsContact O-CG2 3.29Å; A530-I533 WeakPolarHBondContact O-CG2 3.33Å; I533-F535 VanDerWaalsContact C-N 3.34Å; I533-L536 HydrophobicContact CD1-CB 4.41Å; I533-L536 HydrophobicContact CD1-CD1 4.07Å; I533-L536 HydrophobicContact CD1-CD2 3.93Å; I533-L536 WeakPolarHBondContact O-CB 3.47Å; I533-L536 PolarHBondContact O-N 3.33Å; I533-R537 WeakPolarHBondContact O-CG 3.46Å; I533-R537 PolarHBondContact O-N 3.23Å; I533-L572 HydrophobicContact CD1-CD1 4.2Å
534R86.6Confident77.8Confident174 Ų17450 Ų5066%0.65725%0.253SS*.Hα-helixtrans-63.9-41.9172.9-178.6178.5179.3-179.90.1110.6A530 A531 L532 L536 R537 L538A530-R534 WeakPolarHBondContact O-CB 3.34Å; A530-R534 PolarHBondContact O-N 2.99Å; A531-R534 PolarHBondContact O-N 2.8Å; L532-R534 VanDerWaalsContact C-N 3.32Å; L532-R534 PolarHBondContact O-N 2.84Å; R534-L536 VanDerWaalsContact C-N 3.34Å; R534-R537 PolarHBondContact O-N 3.19Å; R534-L538 HydrophobicContact CG-CD1 3.88Å; R534-L538 HydrophobicContact CG-CG 4.23Å; R534-L538 VanDerWaalsContact O-CB 3.31Å; R534-L538 WeakPolarHBondContact O-CB 3.35Å; R534-L538 VanDerWaalsContact O-CG 3.23Å; R534-L538 WeakPolarHBondContact O-CG 3.3Å; R534-L538 PolarHBondContact O-N 2.92Å
535F90Very high78.8Confident19 Ų1948.2 Ų48.28%0.08325%0.246CC..Hα-helixtrans-58.5-46.3172.1166.1-98000111.4I420 V427 F452 F455 L456 I459 A531 L532 I533 R537 L538 A539 M555I420-F535 HydrophobicContact CD1-CD1 3.92Å; I420-F535 HydrophobicContact CD1-CE1 3.89Å; I420-F535 HydrophobicContact CD1-CG 4.34Å; I420-F535 HydrophobicContact CD1-CZ 4.28Å; I420-F535 HydrophobicContact CG1-CD1 4.46Å; I420-F535 HydrophobicContact CG1-CD2 4.44Å; I420-F535 HydrophobicContact CG1-CE2 4.49Å; I420-F535 HydrophobicContact CG1-CG 4.43Å; I420-F535 HydrophobicContact CG2-CB 3.53Å; I420-F535 HydrophobicContact CG2-CD1 4.21Å; I420-F535 HydrophobicContact CG2-CD2 4.01Å; I420-F535 HydrophobicContact CG2-CG 3.64Å; V427-F535 HydrophobicContact CG1-CD2 4.28Å; V427-F535 HydrophobicContact CG1-CE2 3.81Å; F452-F535 AromaticContact CE2-CE2 3.89Å; F452-F535 HydrophobicContact CE2-CE2 3.89Å; F452-F535 HydrophobicContact CE2-CZ 4.32Å; F452-F535 HydrophobicContact CZ-CE2 4.03Å; F452-F535 HydrophobicContact CZ-CZ 4.33Å; F455-F535 HydrophobicContact CD1-CZ 4.24Å; F455-F535 HydrophobicContact CE1-CE2 4.14Å; F455-F535 AromaticContact CE1-CZ 3.81Å; F455-F535 HydrophobicContact CE1-CZ 3.81Å; L456-F535 HydrophobicContact CD2-CZ 3.97Å; I459-F535 HydrophobicContact CD1-CE1 3.89Å; I459-F535 HydrophobicContact CD1-CZ 4.13Å; A531-F535 WeakPolarHBondContact O-CB 3.47Å; A531-F535 PolarHBondContact O-N 3.47Å; L532-F535 WeakPolarHBondContact O-CB 3.31Å; L532-F535 PolarHBondContact O-N 2.83Å; I533-F535 VanDerWaalsContact C-N 3.34Å; F535-R537 VanDerWaalsContact C-N 3.35Å; F535-R537 PolarHBondContact O-N 3.32Å; F535-L538 PolarHBondContact O-N 3.3Å; F535-A539 VanDerWaalsContact O-CB 3.27Å; F535-A539 WeakPolarHBondContact O-CB 3.45Å; F535-A539 PolarHBondContact O-N 3.05Å; F535-M555 HydrophobicContact CE1-SD 4.12Å
536L87Confident79.3Confident0 Ų049.1 Ų49.10%026%0.255CS..Hα-helixtrans-59.6-42.3178-123.4123.8000113.1F478 W479 L532 I533 R534 G540 Y552 M555 L556 L559 L572F478-L536 HydrophobicContact CB-CD1 3.92Å; F478-L536 HydrophobicContact CD1-CD2 4.47Å; F478-L536 HydrophobicContact CD1-CG 4.44Å; F478-L536 WeakPolarHBondContact O-CD1 3.17Å; W479-L536 HydrophobicContact CD2-CD1 4.47Å; W479-L536 HydrophobicContact CD2-CD2 4.37Å; W479-L536 HydrophobicContact CE3-CD1 4.3Å; W479-L536 HydrophobicContact CE3-CD2 3.82Å; W479-L536 HydrophobicContact CH2-CD1 4.42Å; W479-L536 HydrophobicContact CH2-CD2 3.73Å; W479-L536 HydrophobicContact CZ2-CD2 4.29Å; W479-L536 HydrophobicContact CZ3-CD1 4.27Å; W479-L536 HydrophobicContact CZ3-CD2 3.48Å; W479-L536 VanDerWaalsContact CZ3-CD2 3.48Å; L532-L536 PolarHBondContact O-N 3.33Å; I533-L536 HydrophobicContact CD1-CB 4.41Å; I533-L536 HydrophobicContact CD1-CD1 4.07Å; I533-L536 HydrophobicContact CD1-CD2 3.93Å; I533-L536 WeakPolarHBondContact O-CB 3.47Å; I533-L536 PolarHBondContact O-N 3.33Å; R534-L536 VanDerWaalsContact C-N 3.34Å; L536-G540 PolarHBondContact O-N 2.91Å; L536-G540 VanDerWaalsContact O-N 3.1Å; L536-Y552 HydrophobicContact CD1-CE2 4.35Å; L536-Y552 WeakPolarHBondContact O-CE2 3.28Å; L536-Y552 PolarHBondContact O-OH 2.97Å; L536-Y552 VanDerWaalsContact O-OH 3.09Å; L536-M555 HydrophobicContact CD1-CE 3.4Å; L536-M555 HydrophobicContact CD2-CE 3.4Å; L536-M555 HydrophobicContact CD2-SD 3.97Å; L536-L556 HydrophobicContact CD1-CD2 3.78Å; L536-L556 HydrophobicContact CD2-CD2 4.39Å; L536-L556 HydrophobicContact CG-CD2 4.37Å; L536-L559 HydrophobicContact CD1-CD1 4.2Å; L536-L559 HydrophobicContact CD2-CD1 3.69Å; L536-L572 HydrophobicContact CD2-CD1 3.86Å; L536-L572 HydrophobicContact CG-CD1 4.26Å
537R84.1Confident79.7Confident95.5 Ų95.546.7 Ų46.736%0.3624%0.243SC..Hα-helixtrans-68.6-47.5176.6-71.8-176.6-178.9-178.41.8112I533 R534 F535 A539 G540 D541 L572I533-R537 WeakPolarHBondContact O-CG 3.46Å; I533-R537 PolarHBondContact O-N 3.23Å; R534-R537 PolarHBondContact O-N 3.19Å; F535-R537 VanDerWaalsContact C-N 3.35Å; F535-R537 PolarHBondContact O-N 3.32Å; R537-A539 VanDerWaalsContact C-N 3.29Å; R537-A539 PolarHBondContact O-N 2.91Å; R537-G540 CarbonylContact O-C 3.58Å; R537-G540 WeakPolarHBondContact O-CA 3.45Å; R537-G540 PolarHBondContact O-N 3.41Å; R537-G540 VanDerWaalsContact O-N 3.08Å; R537-D541 PolarHBondContact O-N 3.24Å; R537-L572 HydrophobicContact CG-CD1 4.43Å
538L83.5Confident80.1Confident77.5 Ų77.541.6 Ų41.641%0.40622%0.218SC..Hα-helixtrans-62-38.3177.6-72.6175.4000111.7R534 F535 G540 M542R534-L538 HydrophobicContact CG-CD1 3.88Å; R534-L538 HydrophobicContact CG-CG 4.23Å; R534-L538 VanDerWaalsContact O-CB 3.31Å; R534-L538 WeakPolarHBondContact O-CB 3.35Å; R534-L538 VanDerWaalsContact O-CG 3.23Å; R534-L538 WeakPolarHBondContact O-CG 3.3Å; R534-L538 PolarHBondContact O-N 2.92Å; F535-L538 PolarHBondContact O-N 3.3Å; L538-G540 VanDerWaalsContact C-N 3.3Å; L538-G540 PolarHBondContact O-N 3.41Å; L538-M542 WeakPolarHBondContact O-CB 3.23Å; L538-M542 WeakPolarHBondContact O-CG 3.37Å; L538-M542 PolarHBondContact O-N 3.01Å
539A84Confident80.4Confident6 Ų641.4 Ų41.45%0.0522%0.218CC..Hα-helixtrans-62.5-39.7174.100000111.1F452 F535 R537 M542 V543 Y552F452-A539 HydrophobicContact CZ-CB 4.3Å; F535-A539 VanDerWaalsContact O-CB 3.27Å; F535-A539 WeakPolarHBondContact O-CB 3.45Å; F535-A539 PolarHBondContact O-N 3.05Å; R537-A539 VanDerWaalsContact C-N 3.29Å; R537-A539 PolarHBondContact O-N 2.91Å; A539-M542 PolarHBondContact O-N 3.38Å; A539-V543 VanDerWaalsContact O-CG2 3.26Å; A539-V543 WeakPolarHBondContact O-CG2 3.44Å; A539-Y552 HydrophobicContact CB-CD2 3.9Å; A539-Y552 HydrophobicContact CB-CE2 3.76Å
540G81.6Confident80.7Confident1 Ų141 Ų411%0.0122%0.217CC..Hα-helixtrans-68.4-45176.200000113.9L536 R537 L538 M542 V543 Y552 I587L536-G540 PolarHBondContact O-N 2.91Å; L536-G540 VanDerWaalsContact O-N 3.1Å; R537-G540 CarbonylContact O-C 3.58Å; R537-G540 WeakPolarHBondContact O-CA 3.45Å; R537-G540 PolarHBondContact O-N 3.41Å; R537-G540 VanDerWaalsContact O-N 3.08Å; L538-G540 VanDerWaalsContact C-N 3.3Å; L538-G540 PolarHBondContact O-N 3.41Å; G540-M542 PolarHBondContact O-N 2.99Å; G540-V543 PolarHBondContact O-N 3Å; G540-Y552 VanDerWaalsContact CA-CZ 3.41Å; G540-Y552 WeakPolarHBondContact CA-OH 3.23Å; G540-Y552 VanDerWaalsContact N-CE2 3.31Å; G540-I587 WeakPolarHBondContact O-CD1 3.35Å
541D79.2Confident81Confident61.5 Ų61.539.5 Ų39.533%0.32920%0.204SC..Hα-helixtrans-59.4-21.9178.2-72.6-24.9000113.2R537 G583 A584R537-D541 PolarHBondContact O-N 3.24Å; D541-G583 VanDerWaalsContact O-CA 3.3Å; D541-G583 WeakPolarHBondContact O-CA 3.33Å; D541-A584 WeakPolarHBondContact OD1-CB 3.32Å
542M73.9Confident81.3Confident66 Ų6638.2 Ų38.233%0.32519%0.193SC..THydrogen-bonded Turntrans-99.2-0.3-175.6-60.3-68.1-169.600113.8R431 L538 A539 G540 T544R431-M542 PolarHBondContact NH1-SD 3.43Å; L538-M542 WeakPolarHBondContact O-CB 3.23Å; L538-M542 WeakPolarHBondContact O-CG 3.37Å; L538-M542 PolarHBondContact O-N 3.01Å; A539-M542 PolarHBondContact O-N 3.38Å; G540-M542 PolarHBondContact O-N 2.99Å; M542-T544 PolarHBondContact O-N 3.24Å
543V74.6Confident81.4Confident3.5 Ų3.538.2 Ų38.22%0.02119%0.193CC..  trans-71.945.9177.4177.20000111.5A539 G540 A545 F549 Y552 I587A539-V543 VanDerWaalsContact O-CG2 3.26Å; A539-V543 WeakPolarHBondContact O-CG2 3.44Å; G540-V543 PolarHBondContact O-N 3Å; V543-A545 PolarHBondContact O-N 2.95Å; V543-A545 VanDerWaalsContact O-N 3.09Å; V543-F549 HydrophobicContact CG1-CB 3.7Å; V543-F549 HydrophobicContact CG1-CD2 3.58Å; V543-F549 HydrophobicContact CG1-CG 4.12Å; V543-Y552 HydrophobicContact CG2-CD1 4.03Å; V543-Y552 HydrophobicContact CG2-CD2 4.32Å; V543-Y552 HydrophobicContact CG2-CG 3.8Å; V543-I587 HydrophobicContact CB-CD1 3.48Å; V543-I587 VanDerWaalsContact CB-CD1 3.43Å; V543-I587 HydrophobicContact CB-CG1 4.13Å; V543-I587 HydrophobicContact CG1-CD1 3.93Å; V543-I587 HydrophobicContact CG1-CG1 4.2Å; V543-I587 HydrophobicContact CG2-CD1 3.46Å; V543-I587 VanDerWaalsContact CG2-CD1 3.4Å; V543-I587 HydrophobicContact CG2-CG1 4.4Å
544T67.2Low81.6Confident90.5 Ų90.543.3 Ų43.356%0.55521%0.211SC*.THydrogen-bonded Turntrans-85-16.417055.70000112.7M542 L586M542-T544 PolarHBondContact O-N 3.24Å; T544-L586 HydrophobicContact CG2-CD1 4.41Å
545A69.2Low81.8Confident17.5 Ų17.535 Ų3515%0.14518%0.18CC..SBendtrans-97.3130.2176.300000110.9L438 V543 C547 L548 F549L438-A545 HydrophobicContact CD2-CB 4.23Å; V543-A545 PolarHBondContact O-N 2.95Å; V543-A545 VanDerWaalsContact O-N 3.09Å; A545-C547 VanDerWaalsContact CB-SG 3.51Å; A545-C547 PolarHBondContact O-N 3.1Å; A545-C547 VanDerWaalsContact O-N 3.13Å; A545-L548 HydrophobicContact CB-CD1 4.25Å; A545-L548 HydrophobicContact CB-CG 4.24Å; A545-L548 PolarHBondContact O-N 3.05Å; A545-L548 VanDerWaalsContact O-N 3.13Å; A545-F549 PolarHBondContact O-N 2.92Å
546P68.6Low81.9Confident81.5 Ų81.534.1 Ų34.153%0.52918%0.176SC..Hα-helixtrans-53.2-35.3179.4-27.834.9000113.9L548 F549 Y628P546-L548 PolarHBondContact O-N 3.24Å; P546-F549 WeakPolarHBondContact O-CB 3.2Å; P546-F549 PolarHBondContact O-N 2.96Å; P546-Y628 HydrophobicContact CB-CD1 4.43Å; P546-Y628 HydrophobicContact CB-CE1 3.86Å; P546-Y628 HydrophobicContact CB-CE2 4.23Å; P546-Y628 HydrophobicContact CG-CD1 4.04Å; P546-Y628 HydrophobicContact CG-CD2 4.15Å; P546-Y628 HydrophobicContact CG-CE1 3.95Å; P546-Y628 HydrophobicContact CG-CE2 4.05Å; P546-Y628 HydrophobicContact CG-CG 4.14Å
547C74.7Confident82Confident15.5 Ų15.535.3 Ų35.311%0.10518%0.182CC..Hα-helixtrans-63-23.318062.40000114.4D444 P445 A545 P551D444-C547 WeakPolarHBondContact OD1-CB 3.49Å; P445-C547 HydrophobicContact CG-CB 4.26Å; A545-C547 VanDerWaalsContact CB-SG 3.51Å; A545-C547 PolarHBondContact O-N 3.1Å; A545-C547 VanDerWaalsContact O-N 3.13Å; C547-P551 VanDerWaalsContact O-CD 3.27Å; C547-P551 WeakPolarHBondContact O-CD 3.38Å; C547-P551 VanDerWaalsContact O-CG 3.28Å; C547-P551 WeakPolarHBondContact O-CG 3.11Å
548L81.5Confident82.1Confident8 Ų830.8 Ų30.84%0.04217%0.165CC..Hα-helixtrans-97.8-20.3178.8-64.9-176.9000113.2F452 A453 A545 P546 P551 Y552F452-L548 HydrophobicContact CD1-CD1 4.31Å; F452-L548 HydrophobicContact CD1-CD2 3.82Å; F452-L548 HydrophobicContact CE1-CD1 4.48Å; A453-L548 HydrophobicContact CB-CD2 4.14Å; A545-L548 HydrophobicContact CB-CD1 4.25Å; A545-L548 HydrophobicContact CB-CG 4.24Å; A545-L548 PolarHBondContact O-N 3.05Å; A545-L548 VanDerWaalsContact O-N 3.13Å; P546-L548 PolarHBondContact O-N 3.24Å; L548-P551 WeakPolarHBondContact O-CD 3.25Å; L548-Y552 WeakPolarHBondContact O-CB 3.29Å; L548-Y552 PolarHBondContact O-N 2.94Å
549F84.6Confident82.4Confident26 Ų2627.1 Ų27.111%0.11415%0.146CC..Hα-helixtrans-58.9-52.8-177.5-178.4-98.6000112.4V543 A545 P546 Y552 L553 I587 F592 L627 Y628 V687V543-F549 HydrophobicContact CG1-CB 3.7Å; V543-F549 HydrophobicContact CG1-CD2 3.58Å; V543-F549 HydrophobicContact CG1-CG 4.12Å; A545-F549 PolarHBondContact O-N 2.92Å; P546-F549 WeakPolarHBondContact O-CB 3.2Å; P546-F549 PolarHBondContact O-N 2.96Å; F549-Y552 PolarHBondContact O-N 3.11Å; F549-L553 HydrophobicContact CD1-CD1 4.05Å; F549-L553 HydrophobicContact CE1-CD1 3.39Å; F549-L553 VanDerWaalsContact CE1-CD1 3.43Å; F549-L553 HydrophobicContact CE1-CG 4.34Å; F549-L553 HydrophobicContact CE2-CD1 4.15Å; F549-L553 HydrophobicContact CE2-CG 4.49Å; F549-L553 HydrophobicContact CZ-CD1 3.45Å; F549-L553 VanDerWaalsContact CZ-CD1 3.45Å; F549-L553 HydrophobicContact CZ-CG 4.26Å; F549-L553 WeakPolarHBondContact O-CG 3.4Å; F549-L553 PolarHBondContact O-N 2.93Å; F549-I587 HydrophobicContact CE2-CG1 4.48Å; F549-F592 AromaticContact CE2-CE1 3.94Å; F549-F592 HydrophobicContact CE2-CE1 3.94Å; F549-F592 AromaticContact CZ-CE1 3.92Å; F549-F592 HydrophobicContact CZ-CE1 3.92Å; F549-F592 HydrophobicContact CZ-CZ 4.48Å; F549-L627 HydrophobicContact CD1-CD2 4.17Å; F549-L627 HydrophobicContact CE1-CD2 3.39Å; F549-L627 HydrophobicContact CE2-CD2 4.08Å; F549-L627 HydrophobicContact CZ-CD2 3.35Å; F549-Y628 HydrophobicContact CB-CE1 4.12Å; F549-Y628 HydrophobicContact CD1-CE1 4.12Å; F549-Y628 HydrophobicContact CG-CE1 4.07Å; F549-V687 HydrophobicContact CZ-CG2 4.16Å
550L85.9Confident82.5Confident42.5 Ų42.526.8 Ų26.822%0.22314%0.143CC..Hα-helixtrans-67.2-47.2-178.1179.368.4000113Y552 L553 R554 A682 A686L550-Y552 VanDerWaalsContact C-N 3.31Å; L550-Y552 PolarHBondContact O-N 3.38Å; L550-L553 PolarHBondContact O-N 3.2Å; L550-R554 HydrophobicContact CD1-CG 4.44Å; L550-R554 WeakPolarHBondContact O-CB 3.47Å; L550-R554 WeakPolarHBondContact O-CG 3.4Å; L550-R554 PolarHBondContact O-N 3.14Å; L550-A682 HydrophobicContact CD2-CB 4.46Å; L550-A686 HydrophobicContact CD1-CB 3.49Å; L550-A686 VanDerWaalsContact CD1-CB 3.45Å
551P87.7Confident82.4Confident7.5 Ų7.527 Ų275%0.04914%0.144CC..Hα-helixtrans-56.1-41.5172.5-28.836.4000113.9A453 L456 L457 C547 L548 R554 M555A453-P551 HydrophobicContact CB-CB 4.45Å; A453-P551 HydrophobicContact CB-CG 3.9Å; L456-P551 HydrophobicContact CB-CB 3.85Å; L456-P551 HydrophobicContact CD1-CB 4.06Å; L457-P551 HydrophobicContact CD1-CG 4.44Å; L457-P551 HydrophobicContact CD2-CB 4.36Å; L457-P551 HydrophobicContact CG-CB 4.09Å; L457-P551 HydrophobicContact CG-CG 4.4Å; C547-P551 VanDerWaalsContact O-CD 3.27Å; C547-P551 WeakPolarHBondContact O-CD 3.38Å; C547-P551 VanDerWaalsContact O-CG 3.28Å; C547-P551 WeakPolarHBondContact O-CG 3.11Å; L548-P551 WeakPolarHBondContact O-CD 3.25Å; P551-R554 PolarHBondContact O-N 3Å; P551-M555 WeakPolarHBondContact O-CB 3.24Å; P551-M555 PolarHBondContact O-N 3.03Å
552Y90.1Very high82.3Confident1 Ų124.1 Ų24.10%0.00413%0.129CC..Hα-helixtrans-65.5-46.3179.5-178.7-99.7000112.2L536 A539 G540 V543 L548 F549 L550 R554 M555 L556 I587L536-Y552 HydrophobicContact CD1-CE2 4.35Å; L536-Y552 WeakPolarHBondContact O-CE2 3.28Å; L536-Y552 PolarHBondContact O-OH 2.97Å; L536-Y552 VanDerWaalsContact O-OH 3.09Å; A539-Y552 HydrophobicContact CB-CD2 3.9Å; A539-Y552 HydrophobicContact CB-CE2 3.76Å; G540-Y552 VanDerWaalsContact CA-CZ 3.41Å; G540-Y552 WeakPolarHBondContact CA-OH 3.23Å; G540-Y552 VanDerWaalsContact N-CE2 3.31Å; V543-Y552 HydrophobicContact CG2-CD1 4.03Å; V543-Y552 HydrophobicContact CG2-CD2 4.32Å; V543-Y552 HydrophobicContact CG2-CG 3.8Å; L548-Y552 WeakPolarHBondContact O-CB 3.29Å; L548-Y552 PolarHBondContact O-N 2.94Å; F549-Y552 PolarHBondContact O-N 3.11Å; L550-Y552 VanDerWaalsContact C-N 3.31Å; L550-Y552 PolarHBondContact O-N 3.38Å; Y552-R554 VanDerWaalsContact C-N 3.31Å; Y552-R554 PolarHBondContact O-N 3.14Å; Y552-M555 HydrophobicContact CD2-CE 3.56Å; Y552-M555 HydrophobicContact CE2-CE 3.6Å; Y552-M555 HydrophobicContact CG-CE 4.5Å; Y552-M555 WeakPolarHBondContact O-CB 3.4Å; Y552-M555 PolarHBondContact O-N 3.3Å; Y552-M555 VanDerWaalsContact O-N 3.15Å; Y552-L556 HydrophobicContact CD1-CD1 4.04Å; Y552-L556 HydrophobicContact CD1-CG 4.37Å; Y552-L556 HydrophobicContact CE1-CD1 3.42Å; Y552-L556 VanDerWaalsContact CE1-CD1 3.42Å; Y552-L556 HydrophobicContact CE1-CD2 4.43Å; Y552-L556 HydrophobicContact CE1-CG 3.94Å; Y552-L556 PolarHBondContact O-N 2.89Å; Y552-I587 HydrophobicContact CD1-CD1 3.58Å; Y552-I587 HydrophobicContact CD1-CG2 4.44Å; Y552-I587 HydrophobicContact CE1-CD1 3.41Å; Y552-I587 VanDerWaalsContact CE1-CD1 3.49Å; Y552-I587 HydrophobicContact CE1-CG1 4.49Å; Y552-I587 HydrophobicContact CE1-CG2 3.87Å; Y552-I587 HydrophobicContact CG-CD1 4.44Å
553L89.7Confident82.7Confident1 Ų124.7 Ų24.71%0.00513%0.128CC..Hα-helixtrans-62.5-38.6175.8-71.4-175.5000112.4F549 L550 M555 L556 H557 F592 A686 V687 L690F549-L553 HydrophobicContact CD1-CD1 4.05Å; F549-L553 HydrophobicContact CE1-CD1 3.39Å; F549-L553 VanDerWaalsContact CE1-CD1 3.43Å; F549-L553 HydrophobicContact CE1-CG 4.34Å; F549-L553 HydrophobicContact CE2-CD1 4.15Å; F549-L553 HydrophobicContact CE2-CG 4.49Å; F549-L553 HydrophobicContact CZ-CD1 3.45Å; F549-L553 VanDerWaalsContact CZ-CD1 3.45Å; F549-L553 HydrophobicContact CZ-CG 4.26Å; F549-L553 WeakPolarHBondContact O-CG 3.4Å; F549-L553 PolarHBondContact O-N 2.93Å; L550-L553 PolarHBondContact O-N 3.2Å; L553-M555 VanDerWaalsContact C-N 3.33Å; L553-L556 HydrophobicContact CD2-CD1 4.46Å; L553-L556 PolarHBondContact O-N 3.11Å; L553-H557 VanDerWaalsContact O-CB 3.32Å; L553-H557 WeakPolarHBondContact O-CB 3.37Å; L553-H557 PolarHBondContact O-N 3.27Å; L553-F592 HydrophobicContact CD2-CE2 4.48Å; L553-F592 HydrophobicContact CD2-CZ 3.97Å; L553-A686 HydrophobicContact CB-CB 4.23Å; L553-A686 HydrophobicContact CD1-CB 3.97Å; L553-V687 HydrophobicContact CD1-CG2 3.52Å; L553-L690 HydrophobicContact CD2-CD2 4.02Å
554R89.4Confident83Confident114 Ų11426.1 Ų26.143%0.4314%0.138SC..Hα-helixtrans-65.2-37.1174.6-73.4177.7178-174.32.7111.9L457 A460 L550 P551 Y552 H557 G558L457-R554 HydrophobicContact CD2-CB 4.18Å; A460-R554 VanDerWaalsContact CB-C 3.46Å; A460-R554 HydrophobicContact CB-CB 4.02Å; A460-R554 VanDerWaalsContact CB-O 3.3Å; A460-R554 WeakPolarHBondContact CB-O 3.39Å; L550-R554 HydrophobicContact CD1-CG 4.44Å; L550-R554 WeakPolarHBondContact O-CB 3.47Å; L550-R554 WeakPolarHBondContact O-CG 3.4Å; L550-R554 PolarHBondContact O-N 3.14Å; P551-R554 PolarHBondContact O-N 3Å; Y552-R554 VanDerWaalsContact C-N 3.31Å; Y552-R554 PolarHBondContact O-N 3.14Å; R554-H557 PolarHBondContact O-N 3.05Å; R554-G558 PolarHBondContact O-N 3.13Å
555M91.5Very high83.9Confident0 Ų021.9 Ų21.90%011%0.112CC..Hα-helixtrans-62.2-49.2173.4-177.1-173.263.600111L456 I459 A460 F535 L536 P551 Y552 L553 H557 G558 L559L456-M555 HydrophobicContact CD2-CE 3.95Å; L456-M555 HydrophobicContact CD2-SD 3.46Å; L456-M555 WeakPolarHBondContact CD2-SD 3.45Å; I459-M555 HydrophobicContact CB-CG 4.01Å; I459-M555 HydrophobicContact CB-SD 4.32Å; I459-M555 HydrophobicContact CD1-SD 3.99Å; I459-M555 HydrophobicContact CG2-CG 3.54Å; I459-M555 HydrophobicContact CG2-SD 4.01Å; A460-M555 HydrophobicContact CB-CB 4.47Å; F535-M555 HydrophobicContact CE1-SD 4.12Å; L536-M555 HydrophobicContact CD1-CE 3.4Å; L536-M555 HydrophobicContact CD2-CE 3.4Å; L536-M555 HydrophobicContact CD2-SD 3.97Å; P551-M555 WeakPolarHBondContact O-CB 3.24Å; P551-M555 PolarHBondContact O-N 3.03Å; Y552-M555 HydrophobicContact CD2-CE 3.56Å; Y552-M555 HydrophobicContact CE2-CE 3.6Å; Y552-M555 HydrophobicContact CG-CE 4.5Å; Y552-M555 WeakPolarHBondContact O-CB 3.4Å; Y552-M555 PolarHBondContact O-N 3.3Å; Y552-M555 VanDerWaalsContact O-N 3.15Å; L553-M555 VanDerWaalsContact C-N 3.33Å; M555-H557 VanDerWaalsContact C-N 3.31Å; M555-H557 PolarHBondContact O-N 3.36Å; M555-G558 PolarHBondContact O-N 3.3Å; M555-L559 HydrophobicContact CG-CD1 4.01Å; M555-L559 WeakPolarHBondContact O-CG 3.27Å; M555-L559 PolarHBondContact O-N 3.2Å
556L91.2Very high84.7Confident0 Ų021 Ų210%011%0.105CC..Hα-helixtrans-58.8-44.1176.1-69.5-177.8000111.8W479 L536 Y552 L553 G558 L559 C560 L573 L690W479-L556 HydrophobicContact CH2-CD2 3.91Å; W479-L556 HydrophobicContact CZ2-CD2 4.45Å; L536-L556 HydrophobicContact CD1-CD2 3.78Å; L536-L556 HydrophobicContact CD2-CD2 4.39Å; L536-L556 HydrophobicContact CG-CD2 4.37Å; Y552-L556 HydrophobicContact CD1-CD1 4.04Å; Y552-L556 HydrophobicContact CD1-CG 4.37Å; Y552-L556 HydrophobicContact CE1-CD1 3.42Å; Y552-L556 VanDerWaalsContact CE1-CD1 3.42Å; Y552-L556 HydrophobicContact CE1-CD2 4.43Å; Y552-L556 HydrophobicContact CE1-CG 3.94Å; Y552-L556 PolarHBondContact O-N 2.89Å; L553-L556 HydrophobicContact CD2-CD1 4.46Å; L553-L556 PolarHBondContact O-N 3.11Å; L556-G558 VanDerWaalsContact C-N 3.33Å; L556-G558 PolarHBondContact O-N 3.17Å; L556-L559 PolarHBondContact O-N 3.17Å; L556-C560 PolarHBondContact O-N 3.39Å; L556-C560 VanDerWaalsContact O-N 3.17Å; L556-C560 PolarHBondContact O-SG 3.15Å; L556-L573 HydrophobicContact CD1-CD1 4.38Å; L556-L573 HydrophobicContact CD1-CD2 4.23Å; L556-L690 HydrophobicContact CB-CD1 4.12Å; L556-L690 HydrophobicContact CB-CD2 4.38Å; L556-L690 HydrophobicContact CD1-CD2 4.4Å
557H89.5Confident85.6Confident26 Ų2618.2 Ų18.212%0.129%0.091CC..Hα-helixtrans-59.5-44.2176.2176.1-78.4000111.9N464 L553 R554 M555 L559 C560 L690 R693N464-H557 PolarHBondContact OD1-CE1 2.7Å; N464-H557 VanDerWaalsContact OD1-CE1 3.26Å; N464-H557 PolarHBondContact OD1-ND1 2.88Å; N464-H557 VanDerWaalsContact OD1-ND1 3.16Å; L553-H557 VanDerWaalsContact O-CB 3.32Å; L553-H557 WeakPolarHBondContact O-CB 3.37Å; L553-H557 PolarHBondContact O-N 3.27Å; R554-H557 PolarHBondContact O-N 3.05Å; M555-H557 VanDerWaalsContact C-N 3.31Å; M555-H557 PolarHBondContact O-N 3.36Å; H557-L559 VanDerWaalsContact C-N 3.34Å; H557-L559 PolarHBondContact O-N 3.19Å; H557-C560 PolarHBondContact O-N 3.04Å; H557-L690 HydrophobicContact CB-CD1 4.1Å; H557-R693 PolarHBondContact CE1-NH2 3.14Å; H557-R693 PolarHBondContact NE2-NH2 3.43Å
558G87.4Confident86.1Confident0 Ų018.9 Ų18.90%09%0.093CC..Hα-helixtrans-67.1-30.5177.400000113.8Y463 N464 R554 M555 L556 C561Y463-G558 CarbonylContact C-O 3.51Å; Y463-G558 WeakPolarHBondContact CB-O 3.3Å; Y463-G558 VanDerWaalsContact O-O 3.1Å; N464-G558 PolarHBondContact N-O 3.13Å; R554-G558 PolarHBondContact O-N 3.13Å; M555-G558 PolarHBondContact O-N 3.3Å; L556-G558 VanDerWaalsContact C-N 3.33Å; L556-G558 PolarHBondContact O-N 3.17Å; G558-C561 PolarHBondContact O-SG 3.11Å
559L89.3Confident86.5Confident0 Ų018.5 Ų18.50%09%0.091CC..Hα-helixtrans-80.9-13.6177.8-70.5172.2000113.7I459 Y463 F478 W479 L536 M555 L556 H557 C561 A565I459-L559 HydrophobicContact CG2-CD1 4.42Å; I459-L559 HydrophobicContact CG2-CD2 4.28Å; I459-L559 HydrophobicContact CG2-CG 4.41Å; Y463-L559 HydrophobicContact CD1-CD2 4.49Å; Y463-L559 HydrophobicContact CD2-CD2 3.53Å; Y463-L559 HydrophobicContact CD2-CG 4.49Å; Y463-L559 HydrophobicContact CE2-CD2 4.11Å; Y463-L559 HydrophobicContact CG-CD2 3.81Å; F478-L559 HydrophobicContact CB-CD1 4.15Å; F478-L559 HydrophobicContact CB-CD2 4.15Å; F478-L559 HydrophobicContact CD1-CD1 4.29Å; F478-L559 HydrophobicContact CD1-CD2 4.46Å; F478-L559 HydrophobicContact CD2-CD2 3.61Å; F478-L559 HydrophobicContact CE2-CD2 4.13Å; F478-L559 HydrophobicContact CG-CD1 4.15Å; F478-L559 HydrophobicContact CG-CD2 3.81Å; W479-L559 HydrophobicContact CZ2-CB 3.84Å; W479-L559 HydrophobicContact CZ2-CD1 4.48Å; W479-L559 PolarHBondContact NE1-O 3.16Å; L536-L559 HydrophobicContact CD1-CD1 4.2Å; L536-L559 HydrophobicContact CD2-CD1 3.69Å; M555-L559 HydrophobicContact CG-CD1 4.01Å; M555-L559 WeakPolarHBondContact O-CG 3.27Å; M555-L559 PolarHBondContact O-N 3.2Å; L556-L559 PolarHBondContact O-N 3.17Å; H557-L559 VanDerWaalsContact C-N 3.34Å; H557-L559 PolarHBondContact O-N 3.19Å; L559-C561 VanDerWaalsContact C-N 3.29Å; L559-C561 PolarHBondContact O-N 3.31Å; L559-C561 VanDerWaalsContact O-N 3.11Å; L559-A565 WeakPolarHBondContact O-CB 3.37Å
560C86.7Confident86.6Confident0 Ų018.3 Ų18.30%09%0.09CC..  trans-8367.6177.6-680000111.6L556 H557 C569 R693L556-C560 PolarHBondContact O-N 3.39Å; L556-C560 VanDerWaalsContact O-N 3.17Å; L556-C560 PolarHBondContact O-SG 3.15Å; H557-C560 PolarHBondContact O-N 3.04Å; C560-C569 VanDerWaalsContact SG-CB 3.53Å; C560-C569 WeakPolarHBondContact SG-CB 3.15Å; C560-C569 VanDerWaalsContact SG-SG 3.7Å; C560-R693 HydrophobicContact CB-CG 3.84Å
561C79Confident86.6Confident4 Ų418.1 Ų18.13%0.0279%0.092CC..  trans-103.9-8-177-71.20000115.2Y463 G558 L559Y463-C561 PolarHBondContact O-SG 3.45Å; G558-C561 PolarHBondContact O-SG 3.11Å; L559-C561 VanDerWaalsContact C-N 3.29Å; L559-C561 PolarHBondContact O-N 3.31Å; L559-C561 VanDerWaalsContact O-N 3.11Å
562S76.7Confident86.5Confident2.5 Ų2.518 Ų182%0.0179%0.091CC..SBendtrans-134.3167.3178.272.50000110.9L476 S564 A565 A566 D1215L476-S562 WeakPolarHBondContact CD2-OG 3.38Å; S562-S564 PolarHBondContact OG-OG 3.18Å; S562-A565 PolarHBondContact O-N 2.91Å; S562-A565 VanDerWaalsContact OG-CB 3.31Å; S562-A565 WeakPolarHBondContact OG-CB 3.36Å; S562-A565 PolarHBondContact OG-N 3.14Å; S562-A565 VanDerWaalsContact OG-N 3.1Å; S562-A566 WeakPolarHBondContact O-CB 3.35Å; S562-A566 PolarHBondContact O-N 3.3Å; S562-D1215 WeakPolarHBondContact CB-OD1 3.33Å
563R82.6Confident86.3Confident78 Ų7818 Ų1829%0.2949%0.091SC..Hα-helixtrans-63.5-45.9176.4178.4176180-174.5-0.7111.4A566 G567 M697 D698 F1213 D1215R563-A566 PolarHBondContact O-N 3.35Å; R563-G567 PolarHBondContact O-N 3.14Å; R563-M697 WeakPolarHBondContact CB-O 3.42Å; R563-M697 WeakPolarHBondContact CG-O 3.18Å; R563-D698 HydrophobicContact CG-CB 4.42Å; R563-D698 IonicContact NE-OD1 3.06Å; R563-F1213 WeakPolarHBondContact CB-O 3.47Å; R563-F1213 WeakPolarHBondContact CD-O 3.3Å; R563-D1215 PolarHBondContact N-OD1 3.01Å
564S80.9Confident86.1Confident33 Ų3323.7 Ų23.723%0.23112%0.116CC..Hα-helixtrans-57.5-47.7173.644.20000112.4L476 S562 A566 G567 L568 D1215L476-S564 WeakPolarHBondContact CD2-OG 3.48Å; S562-S564 PolarHBondContact OG-OG 3.18Å; S564-A566 VanDerWaalsContact C-N 3.32Å; S564-A566 PolarHBondContact O-N 3.17Å; S564-G567 PolarHBondContact O-N 3.12Å; S564-L568 VanDerWaalsContact O-CB 3.31Å; S564-L568 WeakPolarHBondContact O-CB 3.36Å; S564-L568 VanDerWaalsContact O-CG 3.23Å; S564-L568 WeakPolarHBondContact O-CG 3.28Å; S564-L568 PolarHBondContact O-N 3.2Å; S564-D1215 WeakPolarHBondContact CB-OD2 3.35Å; S564-D1215 PolarHBondContact N-OD2 3.45Å; S564-D1215 PolarHBondContact OG-OD2 3.13Å
565A85.8Confident85.6Confident1 Ų119.9 Ų19.91%0.00811%0.109CC..Hα-helixtrans-60.6-41.4178.300000111.9L476 W479 L559 S562 L568 C569L476-A565 HydrophobicContact CD2-CB 4.08Å; W479-A565 HydrophobicContact CG-CB 4.42Å; L559-A565 WeakPolarHBondContact O-CB 3.37Å; S562-A565 PolarHBondContact O-N 2.91Å; S562-A565 VanDerWaalsContact OG-CB 3.31Å; S562-A565 WeakPolarHBondContact OG-CB 3.36Å; S562-A565 PolarHBondContact OG-N 3.14Å; S562-A565 VanDerWaalsContact OG-N 3.1Å; A565-L568 PolarHBondContact O-N 3.17Å; A565-C569 VanDerWaalsContact O-CB 3.23Å; A565-C569 WeakPolarHBondContact O-CB 3.38Å; A565-C569 PolarHBondContact O-N 3.01Å
566A86.3Confident85.1Confident0 Ų020.7 Ų20.70%011%0.113CC..Hα-helixtrans-66.4-43.1176.700000112.6S562 R563 S564 L568 C569 F570 V694 M697 D698S562-A566 WeakPolarHBondContact O-CB 3.35Å; S562-A566 PolarHBondContact O-N 3.3Å; R563-A566 PolarHBondContact O-N 3.35Å; S564-A566 VanDerWaalsContact C-N 3.32Å; S564-A566 PolarHBondContact O-N 3.17Å; A566-L568 VanDerWaalsContact C-N 3.34Å; A566-C569 PolarHBondContact O-N 2.94Å; A566-F570 WeakPolarHBondContact O-CB 3.4Å; A566-F570 PolarHBondContact O-N 3.36Å; A566-V694 HydrophobicContact CB-CG1 4.45Å; A566-M697 HydrophobicContact CB-CB 3.52Å; A566-M697 HydrophobicContact CB-CG 4.39Å; A566-D698 HydrophobicContact CB-CB 4.13Å
567G86.6Confident84.1Confident22.5 Ų22.522.9 Ų22.923%0.23213%0.131CC..Hα-helixtrans-63.4-39.5174.200000112.6R563 S564 F570 S571R563-G567 PolarHBondContact O-N 3.14Å; S564-G567 PolarHBondContact O-N 3.12Å; G567-F570 PolarHBondContact O-N 3.28Å; G567-S571 WeakPolarHBondContact O-CB 3.34Å; G567-S571 PolarHBondContact O-N 3.12Å; G567-S571 PolarHBondContact O-OG 2.9Å; G567-S571 VanDerWaalsContact O-OG 3.1Å
568L86.4Confident83.2Confident30.5 Ų30.526.8 Ų26.816%0.1616%0.157CC..Hα-helixtrans-69.2-39.2175.9-68.9171.6000111.8W479 S564 A565 A566 S571 L572W479-L568 HydrophobicContact CB-CB 4.3Å; W479-L568 HydrophobicContact CB-CD1 3.58Å; W479-L568 HydrophobicContact CD2-CB 4.2Å; W479-L568 HydrophobicContact CE3-CB 3.8Å; W479-L568 HydrophobicContact CG-CB 4.44Å; W479-L568 HydrophobicContact CG-CD1 4.44Å; W479-L568 HydrophobicContact CZ3-CB 4.42Å; S564-L568 VanDerWaalsContact O-CB 3.31Å; S564-L568 WeakPolarHBondContact O-CB 3.36Å; S564-L568 VanDerWaalsContact O-CG 3.23Å; S564-L568 WeakPolarHBondContact O-CG 3.28Å; S564-L568 PolarHBondContact O-N 3.2Å; A565-L568 PolarHBondContact O-N 3.17Å; A566-L568 VanDerWaalsContact C-N 3.34Å; L568-S571 WeakPolarHBondContact CA-OG 3.25Å; L568-S571 PolarHBondContact O-N 2.98Å; L568-S571 PolarHBondContact O-OG 3.09Å; L568-L572 VanDerWaalsContact O-CB 3.27Å; L568-L572 WeakPolarHBondContact O-CB 3.47Å; L568-L572 PolarHBondContact O-N 3.13Å
569C88.9Confident82.2Confident0 Ų032 Ų320%019%0.185CC..Hα-helixtrans-61.2-46.6171.3-175.10000111.8W479 C560 A565 A566 S571 L572 L573W479-C569 HydrophobicContact CH2-CB 3.44Å; W479-C569 VanDerWaalsContact CH2-CB 3.49Å; W479-C569 HydrophobicContact CZ2-CB 3.93Å; W479-C569 VanDerWaalsContact CZ3-CA 3.5Å; W479-C569 HydrophobicContact CZ3-CB 4Å; C560-C569 VanDerWaalsContact SG-CB 3.53Å; C560-C569 WeakPolarHBondContact SG-CB 3.15Å; C560-C569 VanDerWaalsContact SG-SG 3.7Å; A565-C569 VanDerWaalsContact O-CB 3.23Å; A565-C569 WeakPolarHBondContact O-CB 3.38Å; A565-C569 PolarHBondContact O-N 3.01Å; A566-C569 PolarHBondContact O-N 2.94Å; C569-S571 VanDerWaalsContact C-N 3.31Å; C569-S571 PolarHBondContact O-N 3.25Å; C569-L572 PolarHBondContact O-N 2.94Å; C569-L573 PolarHBondContact O-N 3.04Å; C569-L573 VanDerWaalsContact O-N 3.11Å
570F87.9Confident80.7Confident20 Ų2037.2 Ų37.29%0.08822%0.219CC..Hα-helixtrans-57.4-46.8175.7179.5-96.9000111.7A566 G567 K574 W589 V694 A701 T704 F705 W711A566-F570 WeakPolarHBondContact O-CB 3.4Å; A566-F570 PolarHBondContact O-N 3.36Å; G567-F570 PolarHBondContact O-N 3.28Å; F570-K574 HydrophobicContact CE1-CD 4.08Å; F570-K574 HydrophobicContact CZ-CD 4.45Å; F570-K574 VanDerWaalsContact O-CB 3.29Å; F570-K574 WeakPolarHBondContact O-CB 3.26Å; F570-K574 PolarHBondContact O-N 3.14Å; F570-K574 VanDerWaalsContact O-N 3.07Å; F570-W589 AromaticContact CD2-CE2 3.97Å; F570-W589 HydrophobicContact CD2-CZ2 4.14Å; F570-W589 AromaticContact CD2-NE1 3.63Å; F570-W589 AromaticContact CE2-NE1 3.95Å; F570-W589 PolarHBondContact O-NE1 3.41Å; F570-W589 VanDerWaalsContact O-NE1 3.13Å; F570-V694 HydrophobicContact CB-CG1 4.14Å; F570-V694 HydrophobicContact CD2-CG1 4.47Å; F570-A701 HydrophobicContact CB-CB 4.26Å; F570-A701 HydrophobicContact CD1-CB 4.49Å; F570-A701 HydrophobicContact CD2-CB 3.96Å; F570-A701 HydrophobicContact CE2-CB 4.47Å; F570-A701 HydrophobicContact CG-CB 4Å; F570-T704 WeakPolarHBondContact CE2-OG1 3.37Å; F570-T704 WeakPolarHBondContact CZ-OG1 3.21Å; F570-F705 HydrophobicContact CD2-CE1 4.25Å; F570-F705 AromaticContact CD2-CE2 3.66Å; F570-F705 HydrophobicContact CD2-CE2 3.66Å; F570-F705 AromaticContact CD2-CZ 3.49Å; F570-F705 HydrophobicContact CD2-CZ 3.49Å; F570-F705 VanDerWaalsContact CD2-CZ 3.48Å; F570-F705 HydrophobicContact CE2-CD1 4.37Å; F570-F705 HydrophobicContact CE2-CD2 4.27Å; F570-F705 AromaticContact CE2-CE1 3.86Å; F570-F705 HydrophobicContact CE2-CE1 3.86Å; F570-F705 AromaticContact CE2-CE2 3.76Å; F570-F705 HydrophobicContact CE2-CE2 3.76Å; F570-F705 AromaticContact CE2-CZ 3.54Å; F570-F705 HydrophobicContact CE2-CZ 3.54Å; F570-W711 HydrophobicContact CE2-CH2 4.29Å; F570-W711 HydrophobicContact CE2-CZ3 4.42Å; F570-W711 HydrophobicContact CZ-CH2 4.32Å
571S85.8Confident79.5Confident39 Ų3938.7 Ų38.727%0.27323%0.234SC..Hα-helixtrans-67.3-37.2179.170.60000113G567 L568 C569 K574 A575G567-S571 WeakPolarHBondContact O-CB 3.34Å; G567-S571 PolarHBondContact O-N 3.12Å; G567-S571 PolarHBondContact O-OG 2.9Å; G567-S571 VanDerWaalsContact O-OG 3.1Å; L568-S571 WeakPolarHBondContact CA-OG 3.25Å; L568-S571 PolarHBondContact O-N 2.98Å; L568-S571 PolarHBondContact O-OG 3.09Å; C569-S571 VanDerWaalsContact C-N 3.31Å; C569-S571 PolarHBondContact O-N 3.25Å; S571-K574 PolarHBondContact O-N 3.08Å; S571-A575 VanDerWaalsContact O-CB 3.25Å; S571-A575 WeakPolarHBondContact O-CB 3.46Å; S571-A575 PolarHBondContact O-N 3.16Å
572L85.6Confident78.5Confident6 Ų650.2 Ų50.23%0.03128%0.277CS..Hα-helixtrans-61.5-51.6177-178.1153.2000110.8W479 I533 L536 R537 L568 C569 K574 A575 N576W479-L572 HydrophobicContact CZ3-CB 4.45Å; W479-L572 HydrophobicContact CZ3-CD1 3.96Å; I533-L572 HydrophobicContact CD1-CD1 4.2Å; L536-L572 HydrophobicContact CD2-CD1 3.86Å; L536-L572 HydrophobicContact CG-CD1 4.26Å; R537-L572 HydrophobicContact CG-CD1 4.43Å; L568-L572 VanDerWaalsContact O-CB 3.27Å; L568-L572 WeakPolarHBondContact O-CB 3.47Å; L568-L572 PolarHBondContact O-N 3.13Å; C569-L572 PolarHBondContact O-N 2.94Å; L572-K574 VanDerWaalsContact C-N 3.27Å; L572-K574 PolarHBondContact O-N 3.42Å; L572-A575 PolarHBondContact O-N 3.37Å; L572-A575 VanDerWaalsContact O-N 3.16Å; L572-N576 VanDerWaalsContact O-CG 3.29Å; L572-N576 PolarHBondContact O-N 3.02Å; L572-N576 PolarHBondContact O-OD1 2.83Å
573L85.5Confident77.7Confident0 Ų050.2 Ų50.20%028%0.277CS..Hα-helixtrans-68.9-26.6-179.2-68.1-177.2000113.1L556 C569 I587 W589 F592 L690L556-L573 HydrophobicContact CD1-CD1 4.38Å; L556-L573 HydrophobicContact CD1-CD2 4.23Å; C569-L573 PolarHBondContact O-N 3.04Å; C569-L573 VanDerWaalsContact O-N 3.11Å; L573-I587 HydrophobicContact CD2-CB 4.36Å; L573-I587 HydrophobicContact CD2-CG2 3.24Å; L573-I587 WeakPolarHBondContact CD2-O 3.3Å; L573-W589 HydrophobicContact CB-CD2 4.16Å; L573-W589 HydrophobicContact CB-CG 4.32Å; L573-W589 HydrophobicContact CB-CZ2 3.96Å; L573-W589 HydrophobicContact CD1-CD2 4.36Å; L573-W589 HydrophobicContact CD1-CE3 4.47Å; L573-W589 HydrophobicContact CD1-CH2 3.56Å; L573-W589 HydrophobicContact CD1-CZ2 3.39Å; L573-W589 VanDerWaalsContact CD1-CZ2 3.42Å; L573-W589 HydrophobicContact CD1-CZ3 4.13Å; L573-W589 HydrophobicContact CG-CZ2 4.23Å; L573-F592 HydrophobicContact CD1-CE2 4.37Å; L573-L690 HydrophobicContact CD1-CD2 3.98Å
574K84.8Confident76.6Confident122 Ų12246.5 Ų46.553%0.5326%0.263SS..Hα-helixtrans-73.9-41.2170.5-171.4176-179.2178.80112F570 S571 L572 N576 A577F570-K574 HydrophobicContact CE1-CD 4.08Å; F570-K574 HydrophobicContact CZ-CD 4.45Å; F570-K574 VanDerWaalsContact O-CB 3.29Å; F570-K574 WeakPolarHBondContact O-CB 3.26Å; F570-K574 PolarHBondContact O-N 3.14Å; F570-K574 VanDerWaalsContact O-N 3.07Å; S571-K574 PolarHBondContact O-N 3.08Å; L572-K574 VanDerWaalsContact C-N 3.27Å; L572-K574 PolarHBondContact O-N 3.42Å; K574-N576 VanDerWaalsContact C-N 3.33Å; K574-N576 PolarHBondContact O-N 3.43Å; K574-A577 WeakPolarHBondContact O-CB 3.32Å; K574-A577 PolarHBondContact O-N 3.17Å
575A80Confident76Confident33.5 Ų33.547.1 Ų47.128%0.27727%0.267SS..Hα-helixtrans-66.8-34.1178.900000112.3V482 S571 L572 A577 T578 N579V482-A575 HydrophobicContact CG1-CB 3.99Å; S571-A575 VanDerWaalsContact O-CB 3.25Å; S571-A575 WeakPolarHBondContact O-CB 3.46Å; S571-A575 PolarHBondContact O-N 3.16Å; L572-A575 PolarHBondContact O-N 3.37Å; L572-A575 VanDerWaalsContact O-N 3.16Å; A575-A577 PolarHBondContact O-N 2.96Å; A575-A577 VanDerWaalsContact O-N 3.14Å; A575-T578 PolarHBondContact O-N 3.04Å; A575-T578 PolarHBondContact O-OG1 3.13Å; A575-N579 PolarHBondContact O-N 3.12Å; A575-N579 VanDerWaalsContact O-N 3.1Å
576N79.5Confident75.6Confident16.5 Ų16.548.8 Ų48.89%0.08828%0.276CS..THydrogen-bonded Turntrans-56.3-28.4174.5-73.3-4.8000113.1L572 K574 T578 N579 A584 I587 T588L572-N576 VanDerWaalsContact O-CG 3.29Å; L572-N576 PolarHBondContact O-N 3.02Å; L572-N576 PolarHBondContact O-OD1 2.83Å; K574-N576 VanDerWaalsContact C-N 3.33Å; K574-N576 PolarHBondContact O-N 3.43Å; N576-T578 PolarHBondContact O-N 3.35Å; N576-N579 CarbonylContact O-C 3.53Å; N576-N579 PolarHBondContact O-N 2.64Å; N576-A584 HydrophobicContact CB-CB 4.41Å; N576-I587 WeakPolarHBondContact CB-O 3.36Å; N576-I587 PolarHBondContact ND2-O 3.09Å; N576-I587 VanDerWaalsContact ND2-O 3.15Å; N576-T588 HydrophobicContact CB-CG2 3.93Å
577A71.7Confident75.5Confident45.5 Ų45.548.9 Ų48.938%0.37628%0.276SS..THydrogen-bonded Turntrans-68.5-28.917600000112.9K574 A575 T588K574-A577 WeakPolarHBondContact O-CB 3.32Å; K574-A577 PolarHBondContact O-N 3.17Å; A575-A577 PolarHBondContact O-N 2.96Å; A575-A577 VanDerWaalsContact O-N 3.14Å; A577-T588 HydrophobicContact CB-CG2 4.03Å
578T70.7Confident75.4Confident108 Ų10848.2 Ų48.266%0.66327%0.268SS*.THydrogen-bonded Turntrans-87.9-24.3179.359.40000113.4A575 N576 P580A575-T578 PolarHBondContact O-N 3.04Å; A575-T578 PolarHBondContact O-OG1 3.13Å; N576-T578 PolarHBondContact O-N 3.35Å; T578-P580 VanDerWaalsContact C-CD 3.47Å; T578-P580 WeakPolarHBondContact O-CD 3.4Å
579N66.3Low75.5Confident109 Ų10946.9 Ų46.958%0.58326%0.261SS*.SBendtrans-108.295.6-179.9-75.2-27.4000110.4A575 N576 G581A575-N579 PolarHBondContact O-N 3.12Å; A575-N579 VanDerWaalsContact O-N 3.1Å; N576-N579 CarbonylContact O-C 3.53Å; N576-N579 PolarHBondContact O-N 2.64Å; N579-G581 PolarHBondContact O-N 3.14Å
580P56.5Low75.4Confident110.5 Ų110.549.6 Ų49.672%0.71828%0.275SS*.  trans-73.762.3-174.629.9-34.9000112.7T578T578-P580 VanDerWaalsContact C-CD 3.47Å; T578-P580 WeakPolarHBondContact O-CD 3.4Å
581G61.4Low75.3Confident30.5 Ų30.550.6 Ų50.631%0.31428%0.28SS..  trans-61.4147162.400000110.6N579 G583 A584 S585N579-G581 PolarHBondContact O-N 3.14Å; G581-G583 VanDerWaalsContact C-N 3.34Å; G581-G583 PolarHBondContact O-N 3.3Å; G581-A584 PolarHBondContact O-N 3.18Å; G581-S585 PolarHBondContact O-N 2.85Å
582R58.9Low75.5Confident246.5 Ų246.548.9 Ų48.993%0.9327%0.268SS*.THydrogen-bonded Turntrans-53.7-37.9-175.7-80.4-147.8-162.9-161.88.6113.7S585R582-S585 PolarHBondContact O-OG 2.75Å
583G59.7Low75.6Confident2 Ų248.8 Ų48.82%0.02127%0.267CS..THydrogen-bonded Turntrans-92.4-23.8176.600000114.6D541 G581 S585 L586D541-G583 VanDerWaalsContact O-CA 3.3Å; D541-G583 WeakPolarHBondContact O-CA 3.33Å; G581-G583 VanDerWaalsContact C-N 3.34Å; G581-G583 PolarHBondContact O-N 3.3Å; G583-S585 PolarHBondContact O-N 3.32Å; G583-S585 VanDerWaalsContact O-N 3.11Å; G583-L586 PolarHBondContact O-N 2.96Å
584A59.8Low75.8Confident0 Ų052.8 Ų52.80%029%0.289CS..G310 helixtrans-57.8-29.3179.600000112.6D541 N576 G581 L586 I587 T588D541-A584 WeakPolarHBondContact OD1-CB 3.32Å; N576-A584 HydrophobicContact CB-CB 4.41Å; G581-A584 PolarHBondContact O-N 3.18Å; A584-L586 VanDerWaalsContact C-N 3.3Å; A584-L586 PolarHBondContact O-N 3.11Å; A584-I587 CarbonylContact O-C 3.59Å; A584-I587 PolarHBondContact O-N 3.21Å; A584-I587 VanDerWaalsContact O-N 3.16Å; A584-T588 VanDerWaalsContact O-CG2 3.3Å; A584-T588 WeakPolarHBondContact O-CG2 3.32Å
585S68.2Low75.9Confident46.5 Ų46.547.5 Ų47.533%0.32527%0.267SS..G310 helixtrans-61.1-30.5178.965.30000114G581 R582 G583 I587 T588 H591G581-S585 PolarHBondContact O-N 2.85Å; R582-S585 PolarHBondContact O-OG 2.75Å; G583-S585 PolarHBondContact O-N 3.32Å; G583-S585 VanDerWaalsContact O-N 3.11Å; S585-I587 VanDerWaalsContact C-N 3.32Å; S585-T588 PolarHBondContact O-OG1 2.93Å; S585-H591 WeakPolarHBondContact O-CB 3.29Å
586L76.8Confident76.2Confident37 Ų3746.3 Ų46.319%0.19426%0.255CS..G310 helixtrans-77-19178.4-64.8174.9000112.8T544 G583 A584 H591 F592T544-L586 HydrophobicContact CG2-CD1 4.41Å; G583-L586 PolarHBondContact O-N 2.96Å; A584-L586 VanDerWaalsContact C-N 3.3Å; A584-L586 PolarHBondContact O-N 3.11Å; L586-H591 PolarHBondContact O-CD2 2.91Å; L586-H591 VanDerWaalsContact O-CD2 3.23Å; L586-F592 VanDerWaalsContact O-CE1 3.24Å; L586-F592 WeakPolarHBondContact O-CE1 3.39Å
587I84.1Confident76.6Confident0.5 Ų0.550.6 Ų50.60%0.00327%0.271CS..SBendtrans-11564.7-179.1-45.8177.5000109.5G540 V543 F549 Y552 L573 N576 A584 S585 F592G540-I587 WeakPolarHBondContact O-CD1 3.35Å; V543-I587 HydrophobicContact CB-CD1 3.48Å; V543-I587 VanDerWaalsContact CB-CD1 3.43Å; V543-I587 HydrophobicContact CB-CG1 4.13Å; V543-I587 HydrophobicContact CG1-CD1 3.93Å; V543-I587 HydrophobicContact CG1-CG1 4.2Å; V543-I587 HydrophobicContact CG2-CD1 3.46Å; V543-I587 VanDerWaalsContact CG2-CD1 3.4Å; V543-I587 HydrophobicContact CG2-CG1 4.4Å; F549-I587 HydrophobicContact CE2-CG1 4.48Å; Y552-I587 HydrophobicContact CD1-CD1 3.58Å; Y552-I587 HydrophobicContact CD1-CG2 4.44Å; Y552-I587 HydrophobicContact CE1-CD1 3.41Å; Y552-I587 VanDerWaalsContact CE1-CD1 3.49Å; Y552-I587 HydrophobicContact CE1-CG1 4.49Å; Y552-I587 HydrophobicContact CE1-CG2 3.87Å; Y552-I587 HydrophobicContact CG-CD1 4.44Å; L573-I587 HydrophobicContact CD2-CB 4.36Å; L573-I587 HydrophobicContact CD2-CG2 3.24Å; L573-I587 WeakPolarHBondContact CD2-O 3.3Å; N576-I587 WeakPolarHBondContact CB-O 3.36Å; N576-I587 PolarHBondContact ND2-O 3.09Å; N576-I587 VanDerWaalsContact ND2-O 3.15Å; A584-I587 CarbonylContact O-C 3.59Å; A584-I587 PolarHBondContact O-N 3.21Å; A584-I587 VanDerWaalsContact O-N 3.16Å; S585-I587 VanDerWaalsContact C-N 3.32Å; I587-F592 HydrophobicContact CB-CZ 4.5Å; I587-F592 HydrophobicContact CG2-CZ 3.96Å
588T85.4Confident77.3Confident8.5 Ų8.553.5 Ų53.55%0.05228%0.276CS..SBendtrans-131.1150.417560.90000109.7N576 A577 A584 S585 D590 H591 F592N576-T588 HydrophobicContact CB-CG2 3.93Å; A577-T588 HydrophobicContact CB-CG2 4.03Å; A584-T588 VanDerWaalsContact O-CG2 3.3Å; A584-T588 WeakPolarHBondContact O-CG2 3.32Å; S585-T588 PolarHBondContact O-OG1 2.93Å; T588-D590 VanDerWaalsContact C-N 3.26Å; T588-D590 PolarHBondContact O-N 3.1Å; T588-H591 PolarHBondContact O-N 3.12Å; T588-H591 WeakPolarHBondContact OG1-CB 3.38Å; T588-H591 PolarHBondContact OG1-N 2.95Å; T588-H591 VanDerWaalsContact OG1-N 3.09Å; T588-F592 WeakPolarHBondContact O-CD2 3.14Å; T588-F592 VanDerWaalsContact O-CG 3.26Å; T588-F592 WeakPolarHBondContact O-CG 3.11Å; T588-F592 PolarHBondContact O-N 3.26Å; T588-F592 VanDerWaalsContact O-N 3.11Å
589W87.9Confident78Confident2.5 Ų2.549.7 Ų49.71%0.00925%0.25CS..Hα-helixtrans-57.7-40.4173.6-64.5123.5000111.7F570 L573 F592 F593 L690 V691 F705 W711F570-W589 AromaticContact CD2-CE2 3.97Å; F570-W589 HydrophobicContact CD2-CZ2 4.14Å; F570-W589 AromaticContact CD2-NE1 3.63Å; F570-W589 AromaticContact CE2-NE1 3.95Å; F570-W589 PolarHBondContact O-NE1 3.41Å; F570-W589 VanDerWaalsContact O-NE1 3.13Å; L573-W589 HydrophobicContact CB-CD2 4.16Å; L573-W589 HydrophobicContact CB-CG 4.32Å; L573-W589 HydrophobicContact CB-CZ2 3.96Å; L573-W589 HydrophobicContact CD1-CD2 4.36Å; L573-W589 HydrophobicContact CD1-CE3 4.47Å; L573-W589 HydrophobicContact CD1-CH2 3.56Å; L573-W589 HydrophobicContact CD1-CZ2 3.39Å; L573-W589 VanDerWaalsContact CD1-CZ2 3.42Å; L573-W589 HydrophobicContact CD1-CZ3 4.13Å; L573-W589 HydrophobicContact CG-CZ2 4.23Å; W589-F592 AromaticContact CE3-CD2 3.86Å; W589-F592 HydrophobicContact CE3-CD2 3.86Å; W589-F592 HydrophobicContact CE3-CE2 4.36Å; W589-F592 HydrophobicContact CZ3-CD2 4.15Å; W589-F592 HydrophobicContact CZ3-CE2 4.4Å; W589-F592 PolarHBondContact O-N 3.27Å; W589-F593 HydrophobicContact CB-CD2 4.34Å; W589-F593 HydrophobicContact CB-CE2 4.02Å; W589-F593 HydrophobicContact CE3-CE2 4.32Å; W589-F593 HydrophobicContact CE3-CZ 4.34Å; W589-F593 WeakPolarHBondContact O-CD2 3.21Å; W589-F593 WeakPolarHBondContact O-CG 3.3Å; W589-F593 PolarHBondContact O-N 3.44Å; W589-L690 HydrophobicContact CH2-CD2 4.32Å; W589-L690 HydrophobicContact CH2-CG 4.37Å; W589-V691 HydrophobicContact CE3-CG2 4.34Å; W589-V691 HydrophobicContact CH2-CG2 4.4Å; W589-V691 HydrophobicContact CZ3-CG2 3.61Å; W589-F705 AromaticContact CD2-CE1 3.84Å; W589-F705 HydrophobicContact CD2-CE1 3.84Å; W589-F705 HydrophobicContact CD2-CZ 4.01Å; W589-F705 AromaticContact CE2-CZ 3.85Å; W589-F705 AromaticContact CE3-CE1 3.79Å; W589-F705 HydrophobicContact CE3-CE1 3.79Å; W589-F705 AromaticContact CE3-CZ 4Å; W589-F705 HydrophobicContact CE3-CZ 4.01Å; W589-F705 HydrophobicContact CG-CE1 4.37Å; W589-F705 HydrophobicContact CH2-CE1 4.41Å; W589-F705 AromaticContact CH2-CZ 3.8Å; W589-F705 HydrophobicContact CH2-CZ 3.8Å; W589-F705 HydrophobicContact CZ2-CE1 4.42Å; W589-F705 AromaticContact CZ2-CZ 3.74Å; W589-F705 HydrophobicContact CZ2-CZ 3.74Å; W589-F705 HydrophobicContact CZ3-CE1 4.12Å; W589-F705 AromaticContact CZ3-CZ 3.94Å; W589-F705 HydrophobicContact CZ3-CZ 3.94Å; W589-W711 HydrophobicContact CB-CH2 4.09Å; W589-W711 HydrophobicContact CB-CZ2 3.63Å; W589-W711 HydrophobicContact CG-CH2 4.37Å; W589-W711 HydrophobicContact CG-CZ2 4.35Å
590D86.6Confident78.8Confident57 Ų5745.1 Ų45.131%0.30523%0.226SC..Hα-helixtrans-63.4-44.1179.2-61.1-45.8000112.1T588 N594 W711T588-D590 VanDerWaalsContact C-N 3.26Å; T588-D590 PolarHBondContact O-N 3.1Å; D590-N594 WeakPolarHBondContact O-CB 3.29Å; D590-N594 PolarHBondContact O-N 2.98Å; D590-N594 PolarHBondContact O-ND2 3.11Å; D590-W711 PolarHBondContact OD1-NE1 3.22Å
591H87Confident80.2Confident42 Ų4243.9 Ų43.919%0.19421%0.213CC..Hα-helixtrans-62.4-44.6176.2-178.566.1000111.6S585 L586 T588 F593 N594 S595 L627S585-H591 WeakPolarHBondContact O-CB 3.29Å; L586-H591 PolarHBondContact O-CD2 2.91Å; L586-H591 VanDerWaalsContact O-CD2 3.23Å; T588-H591 PolarHBondContact O-N 3.12Å; T588-H591 WeakPolarHBondContact OG1-CB 3.38Å; T588-H591 PolarHBondContact OG1-N 2.95Å; T588-H591 VanDerWaalsContact OG1-N 3.09Å; H591-F593 PolarHBondContact O-N 2.85Å; H591-N594 PolarHBondContact O-N 2.95Å; H591-S595 VanDerWaalsContact O-CB 3.32Å; H591-S595 WeakPolarHBondContact O-CB 3.34Å; H591-S595 PolarHBondContact O-N 3.16Å; H591-S595 PolarHBondContact O-OG 3.34Å; H591-L627 PolarHBondContact NE2-O 3.27Å
592F88.6Confident81.2Confident3 Ų345.7 Ų45.71%0.01321%0.213CC..Hα-helixtrans-57.1-54.2177.7-65.4-19.8000111.7F549 L553 L573 L586 I587 T588 W589 N594 S595 F596 V687F549-F592 AromaticContact CE2-CE1 3.94Å; F549-F592 HydrophobicContact CE2-CE1 3.94Å; F549-F592 AromaticContact CZ-CE1 3.92Å; F549-F592 HydrophobicContact CZ-CE1 3.92Å; F549-F592 HydrophobicContact CZ-CZ 4.48Å; L553-F592 HydrophobicContact CD2-CE2 4.48Å; L553-F592 HydrophobicContact CD2-CZ 3.97Å; L573-F592 HydrophobicContact CD1-CE2 4.37Å; L586-F592 VanDerWaalsContact O-CE1 3.24Å; L586-F592 WeakPolarHBondContact O-CE1 3.39Å; I587-F592 HydrophobicContact CB-CZ 4.5Å; I587-F592 HydrophobicContact CG2-CZ 3.96Å; T588-F592 WeakPolarHBondContact O-CD2 3.14Å; T588-F592 VanDerWaalsContact O-CG 3.26Å; T588-F592 WeakPolarHBondContact O-CG 3.11Å; T588-F592 PolarHBondContact O-N 3.26Å; T588-F592 VanDerWaalsContact O-N 3.11Å; W589-F592 AromaticContact CE3-CD2 3.86Å; W589-F592 HydrophobicContact CE3-CD2 3.86Å; W589-F592 HydrophobicContact CE3-CE2 4.36Å; W589-F592 HydrophobicContact CZ3-CD2 4.15Å; W589-F592 HydrophobicContact CZ3-CE2 4.4Å; W589-F592 PolarHBondContact O-N 3.27Å; F592-N594 PolarHBondContact O-N 2.9Å; F592-S595 WeakPolarHBondContact O-CB 3.38Å; F592-S595 PolarHBondContact O-N 3.09Å; F592-F596 WeakPolarHBondContact O-CD2 3.33Å; F592-F596 PolarHBondContact O-N 3.45Å; F592-V687 HydrophobicContact CB-CG1 3.84Å; F592-V687 HydrophobicContact CD1-CG1 4.4Å; F592-V687 HydrophobicContact CD1-CG2 3.97Å; F592-V687 HydrophobicContact CD2-CG1 3.65Å; F592-V687 HydrophobicContact CD2-CG2 4.31Å; F592-V687 HydrophobicContact CE1-CG2 4.08Å; F592-V687 HydrophobicContact CE2-CG1 4.32Å; F592-V687 HydrophobicContact CE2-CG2 4.4Å; F592-V687 HydrophobicContact CG-CG1 3.71Å; F592-V687 HydrophobicContact CG-CG2 4.11Å; F592-V687 HydrophobicContact CZ-CG2 4.3Å
593F89.1Confident82.1Confident4 Ų435.3 Ų35.32%0.01818%0.175CC..Hα-helixtrans-70-32.2-177.2-60-51.6000113.2W589 H591 F596 R597 V691 F705 W711 L713W589-F593 HydrophobicContact CB-CD2 4.34Å; W589-F593 HydrophobicContact CB-CE2 4.02Å; W589-F593 HydrophobicContact CE3-CE2 4.32Å; W589-F593 HydrophobicContact CE3-CZ 4.34Å; W589-F593 WeakPolarHBondContact O-CD2 3.21Å; W589-F593 WeakPolarHBondContact O-CG 3.3Å; W589-F593 PolarHBondContact O-N 3.44Å; H591-F593 PolarHBondContact O-N 2.85Å; F593-F596 HydrophobicContact CD1-CD2 4.17Å; F593-F596 PolarHBondContact O-N 3.02Å; F593-R597 PolarHBondContact O-N 3.24Å; F593-V691 HydrophobicContact CE1-CG2 4.42Å; F593-V691 HydrophobicContact CZ-CG2 4.27Å; F593-F705 AromaticContact CE2-CD1 3.94Å; F593-F705 HydrophobicContact CE2-CD1 3.94Å; F593-F705 AromaticContact CE2-CE1 3.91Å; F593-F705 HydrophobicContact CE2-CE1 3.91Å; F593-F705 AromaticContact CZ-CD1 3.73Å; F593-F705 HydrophobicContact CZ-CD1 3.73Å; F593-F705 AromaticContact CZ-CE1 3.74Å; F593-F705 HydrophobicContact CZ-CE1 3.74Å; F593-W711 HydrophobicContact CB-CB 4.33Å; F593-W711 HydrophobicContact CB-CG 4.33Å; F593-W711 HydrophobicContact CD2-CB 3.83Å; F593-W711 AromaticContact CD2-CD1 3.5Å; F593-W711 VanDerWaalsContact CD2-CD1 3.49Å; F593-W711 AromaticContact CD2-CD2 3.48Å; F593-W711 HydrophobicContact CD2-CD2 3.48Å; F593-W711 VanDerWaalsContact CD2-CD2 3.48Å; F593-W711 AromaticContact CD2-CE2 3.75Å; F593-W711 HydrophobicContact CD2-CE3 4.15Å; F593-W711 AromaticContact CD2-CG 3.33Å; F593-W711 HydrophobicContact CD2-CG 3.33Å; F593-W711 AromaticContact CD2-NE1 3.75Å; F593-W711 HydrophobicContact CE2-CB 4.36Å; F593-W711 AromaticContact CE2-CD2 3.53Å; F593-W711 HydrophobicContact CE2-CD2 3.53Å; F593-W711 AromaticContact CE2-CE2 3.9Å; F593-W711 AromaticContact CE2-CE3 3.71Å; F593-W711 HydrophobicContact CE2-CE3 3.71Å; F593-W711 AromaticContact CE2-CG 3.86Å; F593-W711 HydrophobicContact CE2-CG 3.86Å; F593-W711 HydrophobicContact CE2-CZ2 4.39Å; F593-W711 HydrophobicContact CE2-CZ3 4.22Å; F593-W711 HydrophobicContact CG-CB 4.11Å; F593-W711 HydrophobicContact CG-CG 4.04Å; F593-L713 HydrophobicContact CD1-CD1 3.77Å; F593-L713 HydrophobicContact CE1-CD1 3.57Å; F593-L713 HydrophobicContact CE1-CD2 3.79Å; F593-L713 HydrophobicContact CE1-CG 4.3Å; F593-L713 HydrophobicContact CZ-CD2 4.03Å
594N88.1Confident82.9Confident83.5 Ų83.540.6 Ų40.645%0.44720%0.198SC..Hα-helixtrans-63.6-42.4170-74.9-31.1000111.6D590 H591 F592 R597 Q598D590-N594 WeakPolarHBondContact O-CB 3.29Å; D590-N594 PolarHBondContact O-N 2.98Å; D590-N594 PolarHBondContact O-ND2 3.11Å; H591-N594 PolarHBondContact O-N 2.95Å; F592-N594 PolarHBondContact O-N 2.9Å; N594-R597 PolarHBondContact O-N 3.34Å; N594-Q598 WeakPolarHBondContact O-CG 3.35Å; N594-Q598 PolarHBondContact O-N 2.94Å
595S86.7Confident83.3Confident12 Ų1246.2 Ų46.28%0.08422%0.224CC..Hα-helixtrans-62-46.8175.2-620000111H591 F592 R597 Q598 Y599H591-S595 VanDerWaalsContact O-CB 3.32Å; H591-S595 WeakPolarHBondContact O-CB 3.34Å; H591-S595 PolarHBondContact O-N 3.16Å; H591-S595 PolarHBondContact O-OG 3.34Å; F592-S595 WeakPolarHBondContact O-CB 3.38Å; F592-S595 PolarHBondContact O-N 3.09Å; S595-R597 VanDerWaalsContact C-N 3.29Å; S595-R597 PolarHBondContact O-N 3.43Å; S595-Q598 PolarHBondContact O-N 3.14Å; S595-Q598 VanDerWaalsContact O-N 3.12Å; S595-Y599 WeakPolarHBondContact O-CD2 3.45Å; S595-Y599 PolarHBondContact O-N 2.98Å
596F87.2Confident82.7Confident6.5 Ų6.549.7 Ų49.73%0.02924%0.243CC..Hα-helixtrans-54.2-44.9173.1-81.2-76.5000112.1F592 F593 Q598 Y599 L600 L684 V687 L688 I716 F720F592-F596 WeakPolarHBondContact O-CD2 3.33Å; F592-F596 PolarHBondContact O-N 3.45Å; F593-F596 HydrophobicContact CD1-CD2 4.17Å; F593-F596 PolarHBondContact O-N 3.02Å; F596-Q598 PolarHBondContact O-N 3.16Å; F596-Y599 PolarHBondContact O-N 2.96Å; F596-L600 VanDerWaalsContact O-CB 3.31Å; F596-L600 WeakPolarHBondContact O-CB 3.43Å; F596-L600 PolarHBondContact O-N 3.08Å; F596-L684 HydrophobicContact CD1-CD1 3.36Å; F596-L684 HydrophobicContact CD1-CD2 3.98Å; F596-L684 HydrophobicContact CD1-CG 3.93Å; F596-L684 HydrophobicContact CD2-CD1 4.09Å; F596-L684 HydrophobicContact CE1-CB 4.03Å; F596-L684 HydrophobicContact CE1-CD1 3.08Å; F596-L684 HydrophobicContact CE1-CD2 3.76Å; F596-L684 HydrophobicContact CE1-CG 3.83Å; F596-L684 HydrophobicContact CE2-CD1 3.83Å; F596-L684 HydrophobicContact CE2-CD2 4.28Å; F596-L684 HydrophobicContact CG-CD1 3.84Å; F596-L684 HydrophobicContact CG-CD2 4.24Å; F596-L684 HydrophobicContact CZ-CB 4.25Å; F596-L684 HydrophobicContact CZ-CD1 3.31Å; F596-L684 HydrophobicContact CZ-CD2 3.75Å; F596-L684 HydrophobicContact CZ-CG 3.83Å; F596-V687 HydrophobicContact CE2-CB 4.27Å; F596-V687 HydrophobicContact CE2-CG1 3.75Å; F596-V687 HydrophobicContact CZ-CB 4.33Å; F596-V687 HydrophobicContact CZ-CG1 4.23Å; F596-L688 HydrophobicContact CE1-CD1 4.19Å; F596-L688 HydrophobicContact CE1-CD2 3.74Å; F596-L688 HydrophobicContact CE1-CG 3.82Å; F596-L688 HydrophobicContact CE2-CD2 4.44Å; F596-L688 HydrophobicContact CZ-CD1 4.43Å; F596-L688 HydrophobicContact CZ-CD2 3.62Å; F596-L688 HydrophobicContact CZ-CG 3.64Å; F596-I716 HydrophobicContact CB-CG2 3.85Å; F596-F720 HydrophobicContact CB-CE2 4.07Å; F596-F720 HydrophobicContact CD1-CD2 4.43Å; F596-F720 AromaticContact CD1-CE2 3.76Å; F596-F720 HydrophobicContact CD1-CE2 3.76Å; F596-F720 HydrophobicContact CD1-CZ 4.19Å; F596-F720 HydrophobicContact CG-CE2 4.41Å; F596-F720 VanDerWaalsContact O-CE2 3.29Å; F596-F720 WeakPolarHBondContact O-CE2 3.32Å; F596-F720 WeakPolarHBondContact O-CZ 3.19Å
597R88.2Confident81.2Confident108.5 Ų108.552.3 Ų52.341%0.40926%0.26SS..Hα-helixtrans-64.6-39.8178.2-171.8177.7-141.2176-1.8112.2F593 N594 S595 L600 N601 I716F593-R597 PolarHBondContact O-N 3.24Å; N594-R597 PolarHBondContact O-N 3.34Å; S595-R597 VanDerWaalsContact C-N 3.29Å; S595-R597 PolarHBondContact O-N 3.43Å; R597-L600 PolarHBondContact O-N 2.82Å; R597-N601 WeakPolarHBondContact O-CB 3.4Å; R597-N601 PolarHBondContact O-N 3Å; R597-N601 PolarHBondContact O-ND2 3.22Å; R597-I716 HydrophobicContact CB-CD1 4.21Å
598Q86.4Confident79.2Confident105 Ų10558.2 Ų58.249%0.49130%0.296SS..Hα-helixtrans-64.8-46.4176.4-71.4177.915.500111.9N594 S595 F596 L600 N601 H602 P625N594-Q598 WeakPolarHBondContact O-CG 3.35Å; N594-Q598 PolarHBondContact O-N 2.94Å; S595-Q598 PolarHBondContact O-N 3.14Å; S595-Q598 VanDerWaalsContact O-N 3.12Å; F596-Q598 PolarHBondContact O-N 3.16Å; Q598-L600 VanDerWaalsContact C-N 3.34Å; Q598-L600 PolarHBondContact O-N 3.43Å; Q598-N601 PolarHBondContact O-N 3.38Å; Q598-H602 WeakPolarHBondContact O-CB 3.41Å; Q598-H602 PolarHBondContact O-N 3.08Å; Q598-P625 HydrophobicContact CB-CB 3.8Å
599Y84.4Confident76.7Confident29.5 Ų29.564.9 Ų64.912%0.11633%0.327CS..Hα-helixtrans-61.3-42.3175-75.8-64.7000111.7S595 F596 N601 H602 M603 P625 L627 I676 E680 L684S595-Y599 WeakPolarHBondContact O-CD2 3.45Å; S595-Y599 PolarHBondContact O-N 2.98Å; F596-Y599 PolarHBondContact O-N 2.96Å; Y599-N601 PolarHBondContact O-N 3.18Å; Y599-H602 WeakPolarHBondContact O-CB 3.34Å; Y599-H602 PolarHBondContact O-N 3.08Å; Y599-M603 VanDerWaalsContact O-CG 3.29Å; Y599-M603 WeakPolarHBondContact O-CG 3.37Å; Y599-M603 PolarHBondContact O-N 3.34Å; Y599-P625 HydrophobicContact CD1-CG 4.13Å; Y599-P625 HydrophobicContact CE1-CG 4.27Å; Y599-P625 VanDerWaalsContact CE1-O 3.23Å; Y599-P625 WeakPolarHBondContact CE1-O 3.13Å; Y599-P625 VanDerWaalsContact CZ-O 3.32Å; Y599-P625 PolarHBondContact OH-O 3.07Å; Y599-P625 VanDerWaalsContact OH-O 3.13Å; Y599-L627 HydrophobicContact CE2-CB 4.13Å; Y599-L627 HydrophobicContact CE2-CD1 4.18Å; Y599-L627 PolarHBondContact OH-N 3.09Å; Y599-I676 HydrophobicContact CE1-CG2 4.4Å; Y599-E680 WeakPolarHBondContact CE1-OE2 3.32Å; Y599-E680 PolarHBondContact OH-OE1 3.25Å; Y599-E680 PolarHBondContact OH-OE2 3.34Å; Y599-L684 HydrophobicContact CD2-CD1 4.18Å; Y599-L684 HydrophobicContact CD2-CD2 3.84Å; Y599-L684 HydrophobicContact CD2-CG 4.37Å; Y599-L684 HydrophobicContact CE2-CD1 4.15Å; Y599-L684 HydrophobicContact CE2-CD2 4.03Å; Y599-L684 HydrophobicContact CE2-CG 4.38Å; Y599-L684 HydrophobicContact CG-CD1 4.17Å
600L84.1Confident74.4Confident12.5 Ų12.570.4 Ų70.47%0.06536%0.363CS..Hα-helixtrans-61.1-45.9175.9-178.7104.4000111.8F596 R597 Q598 H602 M603 K604 I716 F720F596-L600 VanDerWaalsContact O-CB 3.31Å; F596-L600 WeakPolarHBondContact O-CB 3.43Å; F596-L600 PolarHBondContact O-N 3.08Å; R597-L600 PolarHBondContact O-N 2.82Å; Q598-L600 VanDerWaalsContact C-N 3.34Å; Q598-L600 PolarHBondContact O-N 3.43Å; L600-H602 VanDerWaalsContact C-N 3.31Å; L600-H602 PolarHBondContact O-N 3.23Å; L600-M603 PolarHBondContact O-N 3.25Å; L600-K604 HydrophobicContact CD1-CD 4.25Å; L600-K604 HydrophobicContact CD1-CG 4.45Å; L600-K604 HydrophobicContact CD2-CD 3.85Å; L600-K604 HydrophobicContact CG-CD 4.37Å; L600-K604 WeakPolarHBondContact O-CG 3.38Å; L600-K604 PolarHBondContact O-N 3.11Å; L600-I716 HydrophobicContact CD1-CG2 4.21Å; L600-I716 WeakPolarHBondContact CD1-O 3.15Å; L600-I716 HydrophobicContact CD2-CG2 4.42Å; L600-F720 HydrophobicContact CB-CD2 4.36Å; L600-F720 HydrophobicContact CB-CE1 4.31Å; L600-F720 HydrophobicContact CB-CE2 3.8Å; L600-F720 HydrophobicContact CB-CZ 3.79Å; L600-F720 HydrophobicContact CD1-CD1 4.3Å; L600-F720 HydrophobicContact CD1-CD2 4.02Å; L600-F720 HydrophobicContact CD1-CE2 4.25Å; L600-F720 HydrophobicContact CD1-CG 4.22Å
601N85.4Confident71.8Confident83.6667 Ų83.666775.8 Ų75.845%0.44739%0.386SS..Hα-helixtrans-63.7-39.4176.6-72.5-17.5000111.7R597 Q598 Y599 M603 K604 Q605R597-N601 WeakPolarHBondContact O-CB 3.4Å; R597-N601 PolarHBondContact O-N 3Å; R597-N601 PolarHBondContact O-ND2 3.22Å; Q598-N601 PolarHBondContact O-N 3.38Å; Y599-N601 PolarHBondContact O-N 3.18Å; N601-M603 VanDerWaalsContact C-N 3.33Å; N601-M603 PolarHBondContact O-N 3.1Å; N601-K604 PolarHBondContact O-N 3.21Å; N601-Q605 WeakPolarHBondContact O-CG 3.38Å; N601-Q605 PolarHBondContact O-N 3.17Å; N601-Q605 VanDerWaalsContact O-N 3.12Å
602H82.6Confident69.5Low69 Ų6979.2 Ų79.232%0.31941%0.412SS..Hα-helixtrans-63.2-40.1176.7-175.583.3000112.3Q598 Y599 L600 P625 R674Q598-H602 WeakPolarHBondContact O-CB 3.41Å; Q598-H602 PolarHBondContact O-N 3.08Å; Y599-H602 WeakPolarHBondContact O-CB 3.34Å; Y599-H602 PolarHBondContact O-N 3.08Å; L600-H602 VanDerWaalsContact C-N 3.31Å; L600-H602 PolarHBondContact O-N 3.23Å; H602-P625 HydrophobicContact CB-CG 3.78Å; H602-R674 PolarHBondContact O-NH1 3.4Å
603M77.7Confident67Low28.3333 Ų28.333384.4 Ų84.414%0.1444%0.444CS..Hα-helixtrans-72.9-29.2177.7-66.8-60.3-72.300113.2Y599 L600 N601 Q605 R674 I676 C723 P724 V725Y599-M603 VanDerWaalsContact O-CG 3.29Å; Y599-M603 WeakPolarHBondContact O-CG 3.37Å; Y599-M603 PolarHBondContact O-N 3.34Å; L600-M603 PolarHBondContact O-N 3.25Å; N601-M603 VanDerWaalsContact C-N 3.33Å; N601-M603 PolarHBondContact O-N 3.1Å; M603-Q605 VanDerWaalsContact C-N 3.32Å; M603-Q605 PolarHBondContact O-N 2.87Å; M603-R674 HydrophobicContact SD-CB 4.33Å; M603-I676 HydrophobicContact SD-CG1 4.23Å; M603-C723 HydrophobicContact CB-CB 4.29Å; M603-P724 HydrophobicContact CE-CG 4.09Å; M603-P724 WeakPolarHBondContact CE-O 3.39Å; M603-V725 HydrophobicContact CE-CG2 4.33Å
604K76.3Confident64.4Low114 Ų11491.1 Ų91.150%0.49648%0.48SS..Hα-helixtrans-82-15.8178.9-75-173.5176.2-174.80114.8L600 N601 V606L600-K604 HydrophobicContact CD1-CD 4.25Å; L600-K604 HydrophobicContact CD1-CG 4.45Å; L600-K604 HydrophobicContact CD2-CD 3.85Å; L600-K604 HydrophobicContact CG-CD 4.37Å; L600-K604 WeakPolarHBondContact O-CG 3.38Å; L600-K604 PolarHBondContact O-N 3.11Å; N601-K604 PolarHBondContact O-N 3.21Å; K604-V606 PolarHBondContact O-N 2.98Å; K604-V606 VanDerWaalsContact O-N 3.17Å
605Q69.1Low61.8Low116.667 Ų116.66797.1 Ų97.155%0.54550%0.503SS..  trans-70.7104.1-180-80.2175.81.500111.9N601 M603 V607 R674N601-Q605 WeakPolarHBondContact O-CG 3.38Å; N601-Q605 PolarHBondContact O-N 3.17Å; N601-Q605 VanDerWaalsContact O-N 3.12Å; M603-Q605 VanDerWaalsContact C-N 3.32Å; M603-Q605 PolarHBondContact O-N 2.87Å; Q605-V607 HydrophobicContact CB-CG2 4.45Å; Q605-V607 PolarHBondContact O-N 3.3Å; Q605-R674 PolarHBondContact O-NH1 3.37Å
606V54.6Low59.2Low120 Ų120108.1 Ų108.173%0.72754%0.542SS*.  trans-71.6118168.7-176.80000108.7K604 V608 F629K604-V606 PolarHBondContact O-N 2.98Å; K604-V606 VanDerWaalsContact O-N 3.17Å; V606-V608 HydrophobicContact CG1-CG2 4.1Å; V606-V608 PolarHBondContact O-N 3.29Å; V606-V608 VanDerWaalsContact O-N 3.07Å; V606-F629 HydrophobicContact CG1-CZ 4.27Å
607V45.5Very low56.5Low92.3333 Ų92.3333115.2 Ų115.256%0.5658%0.58SS**  trans-84.8100.7173.4-179.90000108.9Q605 Q609Q605-V607 HydrophobicContact CB-CG2 4.45Å; Q605-V607 PolarHBondContact O-N 3.3Å; V607-Q609 HydrophobicContact CG1-CG 3.99Å; V607-Q609 PolarHBondContact O-N 3.05Å
608V41Very low53.7Low124 Ų124118.8 Ų118.875%0.75260%0.601SS**  trans-75.899.9165.2-177.70000107.1V606 P610V606-V608 HydrophobicContact CG1-CG2 4.1Å; V606-V608 PolarHBondContact O-N 3.29Å; V606-V608 VanDerWaalsContact O-N 3.07Å; V608-P610 WeakPolarHBondContact O-CD 3.35Å
609Q34.1Very low51.1Low149 Ų149118.4 Ų118.470%0.69662%0.616SS**PPolyproline II helixtrans-78.3126.5167.2-78.8-173-3.800109V607 E611V607-Q609 HydrophobicContact CG1-CG 3.99Å; V607-Q609 PolarHBondContact O-N 3.05Å; Q609-E611 PolarHBondContact O-N 3.25Å
610P38.7Very low48.6Very low117.667 Ų117.667121.1 Ų121.176%0.76464%0.639SS**PPolyproline II helixtrans-74.2125.5171.329-29.7000109.5V608 P612V608-P610 WeakPolarHBondContact O-CD 3.35Å; P610-P612 WeakPolarHBondContact O-CD 3.25Å
611E32.1Very low46.1Very low170 Ų170127.8 Ų127.879%0.79468%0.675SS**PPolyproline II helixtrans-48142.8174.3-78.7-106152.500112.7Q609 T613Q609-E611 PolarHBondContact O-N 3.25Å; E611-T613 VanDerWaalsContact C-N 3.28Å; E611-T613 PolarHBondContact O-N 3.03Å; E611-T613 PolarHBondContact OE2-N 3.39Å
612P39.2Very low43.9Very low113 Ų113128.8 Ų128.873%0.73468%0.677SS**  trans-113107.2147.833.1-23.9000111.9P610P610-P612 WeakPolarHBondContact O-CD 3.25Å
613T35.6Very low41.9Very low112.333 Ų112.333131.5 Ų131.569%0.68969%0.693SS**  trans-61.7126.2159.549.90000114E611 F615E611-T613 VanDerWaalsContact C-N 3.28Å; E611-T613 PolarHBondContact O-N 3.03Å; E611-T613 PolarHBondContact OE2-N 3.39Å; T613-F615 PolarHBondContact O-N 3.2Å
614N34.5Very low40.4Very low146 Ų146133.9 Ų133.978%0.78170%0.701SS**  trans36.493165.7-61.5-34.7000116.2
615F34.9Very low39.1Very low209.333 Ų209.333131.2 Ų131.292%0.91870%0.695SS**  trans-146.4134136.1-95.2-76.5000110.7T613 L617T613-F615 PolarHBondContact O-N 3.2Å; F615-L617 PolarHBondContact O-N 2.67Å
616R30.6Very low38.3Very low242.667 Ų242.667130.9 Ų130.992%0.91669%0.694SS**  trans-79.8127.9-178.1-101.1-178-178.3178.80.7110Q618R616-Q618 PolarHBondContact O-N 3.37Å
617L31Very low38.1Very low155 Ų155126.5 Ų126.581%0.81267%0.666SS**  trans-67.2130.4173-64.2161.3000111.2F615 A619F615-L617 PolarHBondContact O-N 2.67Å; L617-A619 PolarHBondContact O-N 3.48Å
618Q29.9Very low38.4Very low184.333 Ų184.333125.8 Ų125.886%0.86165%0.654SS**  trans-104.2133.4149.9-125.2165.8-19.500109.7R616 S620R616-Q618 PolarHBondContact O-N 3.37Å; Q618-S620 PolarHBondContact O-N 3.08Å; Q618-S620 VanDerWaalsContact O-N 3.07Å
619A30.8Very low38.7Very low96.3333 Ų96.3333126.3 Ų126.380%0.79665%0.646SS**  trans-33.8111.3172.900000114.2L617 N621L617-A619 PolarHBondContact O-N 3.48Å; A619-N621 VanDerWaalsContact C-N 3.33Å; A619-N621 PolarHBondContact O-N 3.05Å
620S31.8Very low38.9Very low87.6667 Ų87.6667125.3 Ų125.361%0.61365%0.645SS**  trans-95.9110.7147.956.20000110Q618 Q622Q618-S620 PolarHBondContact O-N 3.08Å; Q618-S620 VanDerWaalsContact O-N 3.07Å; S620-Q622 VanDerWaalsContact C-N 3.3Å; S620-Q622 PolarHBondContact O-N 2.95Å
621N32.7Very low38.9Very low153 Ų153126.6 Ų126.682%0.81865%0.646SS**  trans-87.483.8162.5-88.6-9.1000110.7A619 L623A619-N621 VanDerWaalsContact C-N 3.33Å; A619-N621 PolarHBondContact O-N 3.05Å; N621-L623 VanDerWaalsContact C-N 3.3Å; N621-L623 PolarHBondContact O-N 2.89Å
622Q38.3Very low39.2Very low103.667 Ų103.667121.5 Ų121.548%0.48464%0.639SS.*  trans-81.5118.4171.3-65.4-176.2-4.200107.1S620 Y624 R674 P724S620-Q622 VanDerWaalsContact C-N 3.3Å; S620-Q622 PolarHBondContact O-N 2.95Å; Q622-Y624 PolarHBondContact O-N 2.98Å; Q622-Y624 VanDerWaalsContact O-N 3.16Å; Q622-R674 PolarHBondContact NE2-O 3.35Å; Q622-P724 PolarHBondContact NE2-O 3.03Å
623L42.1Very low38.9Very low127 Ų127122.4 Ų122.467%0.66564%0.643SS**SBendtrans-83.7106.3157.1-102.685.9000109.9N621N621-L623 VanDerWaalsContact C-N 3.3Å; N621-L623 PolarHBondContact O-N 2.89Å
624Y45.9Very low38.9Very low77.6667 Ų77.6667123 Ų12331%0.30565%0.646SS.*  trans-114.896.4-164.4-73.5-75.6000110.8Q622 H626 L627 Y628 V784 R787Q622-Y624 PolarHBondContact O-N 2.98Å; Q622-Y624 VanDerWaalsContact O-N 3.16Å; Y624-H626 WeakPolarHBondContact CB-NE2 2.99Å; Y624-H626 AromaticContact CD1-CE1 3.72Å; Y624-H626 PolarHBondContact O-CD2 2.8Å; Y624-H626 PolarHBondContact O-N 3.1Å; Y624-L627 HydrophobicContact CG-CD1 4.31Å; Y624-L627 PolarHBondContact O-N 3.28Å; Y624-Y628 VanDerWaalsContact O-CD2 3.32Å; Y624-Y628 WeakPolarHBondContact O-CD2 3.47Å; Y624-V784 HydrophobicContact CD2-CG1 3.94Å; Y624-V784 HydrophobicContact CE2-CG1 4.01Å; Y624-R787 PolarHBondContact OH-NE 3.16Å
625P48Very low38.7Very low57.3333 Ų57.3333121.7 Ų121.737%0.37265%0.645SS.*G310 helixtrans-65.57.4179.2-6.514.5000112.5Q598 Y599 H602 L627 Y628 F629 P673Q598-P625 HydrophobicContact CB-CB 3.8Å; Y599-P625 HydrophobicContact CD1-CG 4.13Å; Y599-P625 HydrophobicContact CE1-CG 4.27Å; Y599-P625 VanDerWaalsContact CE1-O 3.23Å; Y599-P625 WeakPolarHBondContact CE1-O 3.13Å; Y599-P625 VanDerWaalsContact CZ-O 3.32Å; Y599-P625 PolarHBondContact OH-O 3.07Å; Y599-P625 VanDerWaalsContact OH-O 3.13Å; H602-P625 HydrophobicContact CB-CG 3.78Å; P625-L627 PolarHBondContact O-N 3.2Å; P625-L627 VanDerWaalsContact O-N 3.15Å; P625-Y628 PolarHBondContact O-N 3.14Å; P625-F629 VanDerWaalsContact O-CD2 3.32Å; P625-F629 WeakPolarHBondContact O-CD2 3.25Å; P625-P673 HydrophobicContact CB-CG 4.2Å; P625-P673 HydrophobicContact CG-CG 4.28Å
626H52.6Low38.5Very low110.333 Ų110.333123.1 Ų123.151%0.51165%0.645SS.*G310 helixtrans-89.520-17630.5-84.7000112.7Y624 Y628 F629 E680Y624-H626 WeakPolarHBondContact CB-NE2 2.99Å; Y624-H626 AromaticContact CD1-CE1 3.72Å; Y624-H626 PolarHBondContact O-CD2 2.8Å; Y624-H626 PolarHBondContact O-N 3.1Å; H626-Y628 VanDerWaalsContact C-N 3.26Å; H626-Y628 PolarHBondContact O-N 3.04Å; H626-F629 HydrophobicContact CB-CB 4.08Å; H626-F629 PolarHBondContact O-N 3.34Å; H626-F629 VanDerWaalsContact O-N 3.11Å; H626-E680 IonicContact CE1-OE1 3.62Å; H626-E680 IonicContact CG-OE1 3.16Å; H626-E680 IonicContact ND1-OE1 3.6Å; H626-E680 PolarHBondContact ND1-OE1 3.4Å
627L51.5Low38.5Very low27 Ų27116.9 Ų116.914%0.14164%0.639CS.*G310 helixtrans-75.9-8.3176.9-93.1160.8000113.3F549 H591 Y599 Y624 P625 L684 H775 E783 V784F549-L627 HydrophobicContact CD1-CD2 4.17Å; F549-L627 HydrophobicContact CE1-CD2 3.39Å; F549-L627 HydrophobicContact CE2-CD2 4.08Å; F549-L627 HydrophobicContact CZ-CD2 3.35Å; H591-L627 PolarHBondContact NE2-O 3.27Å; Y599-L627 HydrophobicContact CE2-CB 4.13Å; Y599-L627 HydrophobicContact CE2-CD1 4.18Å; Y599-L627 PolarHBondContact OH-N 3.09Å; Y624-L627 HydrophobicContact CG-CD1 4.31Å; Y624-L627 PolarHBondContact O-N 3.28Å; P625-L627 PolarHBondContact O-N 3.2Å; P625-L627 VanDerWaalsContact O-N 3.15Å; L627-L684 HydrophobicContact CD1-CD2 3.45Å; L627-L684 VanDerWaalsContact CD1-CD2 3.45Å; L627-L684 HydrophobicContact CD1-CG 3.91Å; L627-H775 PolarHBondContact O-CD2 3.13Å; L627-H775 PolarHBondContact O-CE1 3.33Å; L627-H775 PolarHBondContact O-NE2 3.05Å; L627-H775 VanDerWaalsContact O-NE2 3.08Å; L627-E783 WeakPolarHBondContact CD2-OE2 3.21Å; L627-V784 HydrophobicContact CD1-CG2 3.51Å
628Y51.5Low38.3Very low79 Ų79120.9 Ų120.931%0.3164%0.643SS.*THydrogen-bonded Turntrans-116.3-0.2-172.5-60.4-74000115.2P546 F549 Y624 P625 H626 E680 P724P546-Y628 HydrophobicContact CB-CD1 4.43Å; P546-Y628 HydrophobicContact CB-CE1 3.86Å; P546-Y628 HydrophobicContact CB-CE2 4.23Å; P546-Y628 HydrophobicContact CG-CD1 4.04Å; P546-Y628 HydrophobicContact CG-CD2 4.15Å; P546-Y628 HydrophobicContact CG-CE1 3.95Å; P546-Y628 HydrophobicContact CG-CE2 4.05Å; P546-Y628 HydrophobicContact CG-CG 4.14Å; F549-Y628 HydrophobicContact CB-CE1 4.12Å; F549-Y628 HydrophobicContact CD1-CE1 4.12Å; F549-Y628 HydrophobicContact CG-CE1 4.07Å; Y624-Y628 VanDerWaalsContact O-CD2 3.32Å; Y624-Y628 WeakPolarHBondContact O-CD2 3.47Å; P625-Y628 PolarHBondContact O-N 3.14Å; H626-Y628 VanDerWaalsContact C-N 3.26Å; H626-Y628 PolarHBondContact O-N 3.04Å; Y628-E680 HydrophobicContact CD2-CG 4.44Å; Y628-E680 HydrophobicContact CE2-CG 3.89Å; Y628-P724 HydrophobicContact CD1-CB 3.6Å; Y628-P724 HydrophobicContact CD2-CB 4.07Å; Y628-P724 HydrophobicContact CE1-CB 3.64Å; Y628-P724 HydrophobicContact CE2-CB 4.13Å; Y628-P724 HydrophobicContact CG-CB 3.79Å
629F46.6Very low38.4Very low133.333 Ų133.333118.5 Ų118.559%0.58564%0.641SS**  trans-130.2126.7-178.9-89.8-82.4000112.6V606 P625 H626 D631 I671 P673V606-F629 HydrophobicContact CG1-CZ 4.27Å; P625-F629 VanDerWaalsContact O-CD2 3.32Å; P625-F629 WeakPolarHBondContact O-CD2 3.25Å; H626-F629 HydrophobicContact CB-CB 4.08Å; H626-F629 PolarHBondContact O-N 3.34Å; H626-F629 VanDerWaalsContact O-N 3.11Å; F629-D631 PolarHBondContact O-N 3.41Å; F629-I671 HydrophobicContact CE1-CB 4.4Å; F629-I671 HydrophobicContact CE1-CG2 3.75Å; F629-I671 HydrophobicContact CZ-CG2 3.84Å; F629-P673 HydrophobicContact CE2-CB 4.04Å; F629-P673 HydrophobicContact CZ-CB 4.26Å
630N38.7Very low38.4Very low127.667 Ų127.667119.4 Ų119.468%0.68364%0.641SS**  trans-115102.3168.3-169.729.1000109.9G632N630-G632 PolarHBondContact O-N 3.32Å; N630-G632 PolarHBondContact OD1-N 3.29Å; N630-G632 VanDerWaalsContact OD1-N 3.12Å
631D38.4Very low38.3Very low145.333 Ų145.333118.5 Ų118.578%0.77765%0.645SS**  trans-81.996.6174.3-106.5-17.4000111.3F629 V633F629-D631 PolarHBondContact O-N 3.41Å; D631-V633 PolarHBondContact O-N 3.02Å; D631-V633 VanDerWaalsContact O-N 3.15Å
632G38.3Very low38.2Very low63.3333 Ų63.3333121 Ų12165%0.65365%0.649SS**  trans-56.187.1171.400000114.9N630 T634N630-G632 PolarHBondContact O-N 3.32Å; N630-G632 PolarHBondContact OD1-N 3.29Å; N630-G632 VanDerWaalsContact OD1-N 3.12Å; G632-T634 PolarHBondContact O-N 2.86Å
633V33.9Very low38.2Very low132.667 Ų132.667121.7 Ų121.780%0.80466%0.662SS**  trans-82.7111.2164.6179.70000110.1D631D631-V633 PolarHBondContact O-N 3.02Å; D631-V633 VanDerWaalsContact O-N 3.15Å
634T33.9Very low37.5Very low125 Ų125127 Ų12777%0.76767%0.674SS**  trans-88.4134.9156.243.50000110G632 R636G632-T634 PolarHBondContact O-N 2.86Å; T634-R636 PolarHBondContact O-N 3.09Å
635P31.3Very low36.7Very low117.667 Ų117.667128 Ų12876%0.76469%0.692SS**  trans-85.4117-170.332.3-32.4000111.7S637P635-S637 PolarHBondContact O-N 3.13Å
636R29.9Very low35.7Very low239.333 Ų239.333131 Ų13190%0.90371%0.71SS**  trans-35.2115.2168.4-82.4179.7169.5175.8-2.6110T634 R638T634-R636 PolarHBondContact O-N 3.09Å; R636-R638 PolarHBondContact O-N 3.35Å
637S30.8Very low34.6Very low113 Ų113131.5 Ų131.579%0.7972%0.721SS**  trans-71.9129.5141.9-1720000111.1P635 V639P635-S637 PolarHBondContact O-N 3.13Å; S637-V639 PolarHBondContact O-N 3.26Å
638R27.8Very low33.4Very low238.333 Ų238.333138.6 Ų138.690%0.89975%0.753SS**  trans-59.5115.3174.5-71.3175-145.5171.71.3109.8R636 S640R636-R638 PolarHBondContact O-N 3.35Å; R638-S640 PolarHBondContact O-N 2.72Å
639V31.9Very low32.4Very low133.667 Ų133.667140.2 Ų140.281%0.8178%0.776SS**  -105.2119.8128.91710000108.6S637 G641S637-V639 PolarHBondContact O-N 3.26Å; V639-G641 PolarHBondContact O-N 2.5Å
640S29.3Very low31.3Very low115.667 Ų115.667141.8 Ų141.881%0.80979%0.787SS**  trans-32.2131.2166.7139.80000115.1R638R638-S640 PolarHBondContact O-N 2.72Å
641G30.5Very low30.8Very low67.6667 Ų67.6667146.6 Ų146.670%0.69880%0.797SS**  trans178.273.3171.500000115.8V639V639-G641 PolarHBondContact O-N 2.5Å
642F30.3Very low30.5Very low207 Ų207143.2 Ų143.291%0.90880%0.797SS**  trans42142.2156-77.8-84000118
643P37.9Very low30.1Very low116.667 Ų116.667148.7 Ų148.776%0.75881%0.806SS**  trans-105.8153.3-168.133.8-21.7000113
644R27.9Very low30Very low239 Ų239153.1 Ų153.190%0.90281%0.808SS**  trans-100.9118.6158.9-113.4173165.9163.8-4.8111.1T646R644-T646 PolarHBondContact O-N 3.37Å
645S28.9Very low29.8Very low99.3333 Ų99.3333156.8 Ų156.870%0.69581%0.813SS**  -153.5114.3127.864.20000113.1
646T27.4Very low29.7Very low121 Ų121154.4 Ų154.474%0.74281%0.81SS**  trans44.5128.4141.854.10000117.7R644 E648R644-T646 PolarHBondContact O-N 3.37Å; T646-E648 PolarHBondContact O-N 2.83Å
647T29.2Very low29.7Very low120.333 Ų120.333148.5 Ų148.574%0.73881%0.805SS**  trans61.4103148.553.80000118.6
648E26.9Very low29.7Very low176.333 Ų176.333148.4 Ų148.482%0.82481%0.805SS**  trans72.4141.9133.2-73.3177.2173.100118.4T646T646-E648 PolarHBondContact O-N 2.83Å
649S29.5Very low29.9Very low112.667 Ų112.667142.3 Ų142.379%0.78880%0.799SS**  trans73.1120.2148.978.10000118.8
650M25.2Very low29.9Very low167 Ų167140.7 Ų140.782%0.82379%0.793SS**  -169.5125.2106-112.817587.900111.3
651Y28.5Very low30.2Very low226.667 Ų226.667142.8 Ų142.889%0.88980%0.796SS**  trans51.299.5152.4-76.1-81.2000115.6
652G30.3Very low30.4Very low75.6667 Ų75.6667147.9 Ų147.978%0.7881%0.805SS**  trans-152.1109.6156.700000111.8R654G652-R654 PolarHBondContact O-N 3.46Å
653H30.3Very low30.4Very low178.333 Ų178.333141.1 Ų141.183%0.82679%0.793SS**  trans-123.5119.4178.2-123.81.9000108.4
654R32.2Very low30.2Very low225.667 Ų225.667140.2 Ų140.285%0.85280%0.796SS**  trans178.6114148.8-106.1177.7-171.1-165.53.9115.7G652G652-R654 PolarHBondContact O-N 3.46Å
655K30.8Very low30.3Very low201 Ų201134.9 Ų134.987%0.87479%0.79SS**  trans-23.8135.6146.8-66.8175.9175.2-176.40113.6
656G29.1Very low30.5Very low68 Ų68136.7 Ų136.770%0.70180%0.797SS**  trans149.996.8131.900000110
657S29.1Very low30.8Very low114.667 Ų114.667136.5 Ų136.580%0.80280%0.795SS**  trans26134.4141570000117
658S31Very low31.1Very low112 Ų112136.3 Ų136.378%0.78380%0.796SS**  144.5141.4103.656.90000111.6
659S31.8Very low31.3Very low111 Ų111136 Ų13678%0.77680%0.797SS**  cis-163.9161.33839.30000109.2
660S32.6Very low31.5Very low98.3333 Ų98.3333137.3 Ų137.369%0.68880%0.795SS**  trans-41.2129171.151.90000114.9
661D34.6Very low32.3Very low161.333 Ų161.333136 Ų13686%0.86379%0.79SS**  -154146112.7-94.3-31.5000111.5G663D661-G663 VanDerWaalsContact C-N 3.34Å; D661-G663 PolarHBondContact O-N 3.09Å
662I34.6Very low32.9Very low173 Ų173132.6 Ų132.689%0.88778%0.782SS**  trans-85.6112-168.2-65.7160.9000109.8
663G31.5Very low33.9Very low65 Ų65133 Ų13367%0.6777%0.771SS**  trans-142.795.7158.900000112.4D661 T665D661-G663 VanDerWaalsContact C-N 3.34Å; D661-G663 PolarHBondContact O-N 3.09Å; G663-T665 PolarHBondContact O-N 3.29Å
664A32.3Very low35.4Very low97.6667 Ų97.6667128.6 Ų128.681%0.80775%0.747SS**  trans-87.5104.5168.300000111T666A664-T666 PolarHBondContact O-N 2.99Å
665T31.2Very low37.2Very low127.667 Ų127.667121.5 Ų121.578%0.78373%0.732SS**  trans-88.999.1168.445.70000108.9G663 V667G663-T665 PolarHBondContact O-N 3.29Å; T665-V667 VanDerWaalsContact C-N 3.35Å; T665-V667 PolarHBondContact O-N 3.03Å
666T33Very low39.5Very low138 Ų138112.9 Ų112.985%0.84770%0.695SS**  trans-64.697.3165.843.80000109A664A664-T666 PolarHBondContact O-N 2.99Å
667V34Very low42Very low115.333 Ų115.333114.9 Ų114.970%0.69969%0.686SS**  trans-68.4129.4170.8-175.30000107.7T665 M669T665-V667 VanDerWaalsContact C-N 3.35Å; T665-V667 PolarHBondContact O-N 3.03Å; V667-M669 PolarHBondContact O-N 3.28Å
668P34Very low44.3Very low116 Ų116113.7 Ų113.775%0.75368%0.676SS**  trans-65.1120.6178.326.2-31.8000109.4N670P668-N670 PolarHBondContact O-N 3.01Å; P668-N670 VanDerWaalsContact O-N 3.12Å
669M31.1Very low46.6Very low170.333 Ų170.333115.2 Ų115.284%0.83967%0.67SS**  trans-63.5112.7179.5-70.2-90.8-103.200109.8V667 I671V667-M669 PolarHBondContact O-N 3.28Å; M669-I671 PolarHBondContact O-N 3.14Å
670N34.8Very low49Very low140.333 Ų140.333112.7 Ų112.775%0.7565%0.647SS**  trans-84.2110.6-179.8-158.49.5000109.7P668 Q672P668-N670 PolarHBondContact O-N 3.01Å; P668-N670 VanDerWaalsContact O-N 3.12Å; N670-Q672 PolarHBondContact O-N 3.02Å; N670-Q672 VanDerWaalsContact O-N 3.13Å
671I40.6Very low51.5Low140.667 Ų140.667110 Ų11072%0.72162%0.623SS**  trans-77.6101.4177.5-59167.8000107.8F629 M669 P673F629-I671 HydrophobicContact CE1-CB 4.4Å; F629-I671 HydrophobicContact CE1-CG2 3.75Å; F629-I671 HydrophobicContact CZ-CG2 3.84Å; M669-I671 PolarHBondContact O-N 3.14Å; I671-P673 WeakPolarHBondContact O-CD 3.48Å
672Q42.8Very low53.8Low155 Ų155103.7 Ų103.772%0.72459%0.594SS**PPolyproline II helixtrans-80.4128.6172.8-71.7-175.8-16.700110N670 R674N670-Q672 PolarHBondContact O-N 3.02Å; N670-Q672 VanDerWaalsContact O-N 3.13Å; Q672-R674 PolarHBondContact O-N 2.98Å
673P51.5Low56.3Low83.3333 Ų83.333395.8 Ų95.854%0.54155%0.554SS.*PPolyproline II helixtrans-65.8137.517427.8-33.1000110.1P625 F629 I671 S675P625-P673 HydrophobicContact CB-CG 4.2Å; P625-P673 HydrophobicContact CG-CG 4.28Å; F629-P673 HydrophobicContact CE2-CB 4.04Å; F629-P673 HydrophobicContact CZ-CB 4.26Å; I671-P673 WeakPolarHBondContact O-CD 3.48Å; P673-S675 PolarHBondContact O-N 3.17Å
674R61.5Low58.9Low86 Ų8693 Ų9333%0.32552%0.524SS..PPolyproline II helixtrans-64.9120.7176.5-69.3178.3176.7-176.9-2.5109.4H602 M603 Q605 Q622 Q672H602-R674 PolarHBondContact O-NH1 3.4Å; M603-R674 HydrophobicContact SD-CB 4.33Å; Q605-R674 PolarHBondContact O-NH1 3.37Å; Q622-R674 PolarHBondContact NE2-O 3.35Å; Q672-R674 PolarHBondContact O-N 2.98Å
675S69.5Low61.6Low76 Ų7689.3 Ų89.353%0.53149%0.49SS..  trans-109.6141.3174.458.30000110.8P673P673-S675 PolarHBondContact O-N 3.17Å
676I79.4Confident64.3Low21 Ų2183.7 Ų83.711%0.10846%0.457CS..  trans-70.8140.1166.3-57.6170.7000107.4Y599 M603 E680 Q681 L684 V725 L729Y599-I676 HydrophobicContact CE1-CG2 4.4Å; M603-I676 HydrophobicContact SD-CG1 4.23Å; I676-E680 HydrophobicContact CG2-CB 3.9Å; I676-Q681 HydrophobicContact CG2-CB 4.14Å; I676-L684 HydrophobicContact CD1-CD1 4.33Å; I676-L684 HydrophobicContact CG2-CD1 4.41Å; I676-V725 HydrophobicContact CD1-CG1 4.33Å; I676-L729 HydrophobicContact CD1-CD2 4.48Å
677Q80.4Confident67Low110 Ų11077.3 Ų77.351%0.51442%0.417SS..  trans-63.4143.8176-67.2-63.7-20.700110.2E679 E680 Q681Q677-E679 VanDerWaalsContact C-N 3.27Å; Q677-E679 PolarHBondContact O-N 3.11Å; Q677-E680 HydrophobicContact CB-CB 4.37Å; Q677-E680 HydrophobicContact CB-CG 4.13Å; Q677-E680 WeakPolarHBondContact CB-OE2 3.38Å; Q677-E680 PolarHBondContact N-OE2 3.19Å; Q677-E680 PolarHBondContact O-N 3.28Å; Q677-E680 VanDerWaalsContact O-N 3.13Å; Q677-Q681 WeakPolarHBondContact O-CB 3.44Å; Q677-Q681 PolarHBondContact O-N 3.19Å
678P79.2Confident69.7Low89.3333 Ų89.333372 Ų7258%0.5839%0.385SS*.Hα-helixtrans-61.5-34-173.823.9-33.7000112.9Q681 A682P678-Q681 PolarHBondContact O-N 3.47Å; P678-A682 WeakPolarHBondContact O-CB 3.37Å; P678-A682 PolarHBondContact O-N 3.01Å
679E77.5Confident72.3Confident143.333 Ų143.33369.8 Ų69.867%0.6736%0.362SS*.Hα-helixtrans-67.1-44175.6-66.6172.7-161.900112.1Q677 Q681 A682 G683Q677-E679 VanDerWaalsContact C-N 3.27Å; Q677-E679 PolarHBondContact O-N 3.11Å; E679-Q681 VanDerWaalsContact C-N 3.33Å; E679-Q681 PolarHBondContact O-N 3.17Å; E679-A682 PolarHBondContact O-N 2.92Å; E679-G683 PolarHBondContact O-N 3.03Å
680E83Confident75.1Confident59.6667 Ų59.666761.7 Ų61.728%0.27932%0.322SS..Hα-helixtrans-65.3-40.4175.7-65.7-177.8149.200111.2Y599 H626 Y628 I676 Q677 A682 G683 L684Y599-E680 WeakPolarHBondContact CE1-OE2 3.32Å; Y599-E680 PolarHBondContact OH-OE1 3.25Å; Y599-E680 PolarHBondContact OH-OE2 3.34Å; H626-E680 IonicContact CE1-OE1 3.62Å; H626-E680 IonicContact CG-OE1 3.16Å; H626-E680 IonicContact ND1-OE1 3.6Å; H626-E680 PolarHBondContact ND1-OE1 3.4Å; Y628-E680 HydrophobicContact CD2-CG 4.44Å; Y628-E680 HydrophobicContact CE2-CG 3.89Å; I676-E680 HydrophobicContact CG2-CB 3.9Å; Q677-E680 HydrophobicContact CB-CB 4.37Å; Q677-E680 HydrophobicContact CB-CG 4.13Å; Q677-E680 WeakPolarHBondContact CB-OE2 3.38Å; Q677-E680 PolarHBondContact N-OE2 3.19Å; Q677-E680 PolarHBondContact O-N 3.28Å; Q677-E680 VanDerWaalsContact O-N 3.13Å; E680-A682 VanDerWaalsContact C-N 3.34Å; E680-A682 PolarHBondContact O-N 3.5Å; E680-G683 PolarHBondContact O-N 3.31Å; E680-L684 WeakPolarHBondContact O-CB 3.31Å; E680-L684 WeakPolarHBondContact O-CG 3.23Å; E680-L684 PolarHBondContact O-N 2.92Å
681Q84.6Confident77.7Confident41.6667 Ų41.666755.1 Ų55.120%0.19529%0.286CS..Hα-helixtrans-61.6-44.1174.5-172.5-171-59.400111.2I676 Q677 P678 E679 G683 L684 Q685 S726 L729I676-Q681 HydrophobicContact CG2-CB 4.14Å; Q677-Q681 WeakPolarHBondContact O-CB 3.44Å; Q677-Q681 PolarHBondContact O-N 3.19Å; P678-Q681 PolarHBondContact O-N 3.47Å; E679-Q681 VanDerWaalsContact C-N 3.33Å; E679-Q681 PolarHBondContact O-N 3.17Å; Q681-G683 VanDerWaalsContact C-N 3.31Å; Q681-G683 PolarHBondContact O-N 3.22Å; Q681-L684 WeakPolarHBondContact O-CB 3.22Å; Q681-L684 PolarHBondContact O-N 3.18Å; Q681-Q685 VanDerWaalsContact O-CG 3.32Å; Q681-Q685 WeakPolarHBondContact O-CG 3.33Å; Q681-Q685 PolarHBondContact O-N 3.18Å; Q681-S726 VanDerWaalsContact NE2-CB 3.31Å; Q681-S726 PolarHBondContact NE2-OG 3.33Å; Q681-S726 PolarHBondContact OE1-OG 3.15Å; Q681-L729 HydrophobicContact CG-CD1 4.07Å; Q681-L729 HydrophobicContact CG-CD2 4.29Å
682A83.8Confident80Confident29.3333 Ų29.333349.1 Ų49.124%0.24226%0.258CS..Hα-helixtrans-63.2-37.9176.300000111.9L550 P678 E679 E680 A686L550-A682 HydrophobicContact CD2-CB 4.46Å; P678-A682 WeakPolarHBondContact O-CB 3.37Å; P678-A682 PolarHBondContact O-N 3.01Å; E679-A682 PolarHBondContact O-N 2.92Å; E680-A682 VanDerWaalsContact C-N 3.34Å; E680-A682 PolarHBondContact O-N 3.5Å; A682-A686 WeakPolarHBondContact O-CB 3.37Å; A682-A686 PolarHBondContact O-N 3.31Å
683G86.1Confident82Confident5.33333 Ų5.3333341.8 Ų41.86%0.05522%0.224CC..Hα-helixtrans-61.2-47.7171.200000112.3E679 E680 Q681 Q685 A686 V687E679-G683 PolarHBondContact O-N 3.03Å; E680-G683 PolarHBondContact O-N 3.31Å; Q681-G683 VanDerWaalsContact C-N 3.31Å; Q681-G683 PolarHBondContact O-N 3.22Å; G683-Q685 PolarHBondContact O-N 3.27Å; G683-A686 WeakPolarHBondContact O-CB 3.41Å; G683-A686 PolarHBondContact O-N 3.16Å; G683-V687 WeakPolarHBondContact O-CG2 3.33Å; G683-V687 PolarHBondContact O-N 3.06Å
684L87.5Confident83.7Confident7.66667 Ų7.6666737.8 Ų37.84%0.0420%0.198CC..Hα-helixtrans-61.2-44.7178.7-131.899.7000112F596 Y599 L627 I676 E680 Q681 A686 V687 L688 F720 L729F596-L684 HydrophobicContact CD1-CD1 3.36Å; F596-L684 HydrophobicContact CD1-CD2 3.98Å; F596-L684 HydrophobicContact CD1-CG 3.93Å; F596-L684 HydrophobicContact CD2-CD1 4.09Å; F596-L684 HydrophobicContact CE1-CB 4.03Å; F596-L684 HydrophobicContact CE1-CD1 3.08Å; F596-L684 HydrophobicContact CE1-CD2 3.76Å; F596-L684 HydrophobicContact CE1-CG 3.83Å; F596-L684 HydrophobicContact CE2-CD1 3.83Å; F596-L684 HydrophobicContact CE2-CD2 4.28Å; F596-L684 HydrophobicContact CG-CD1 3.84Å; F596-L684 HydrophobicContact CG-CD2 4.24Å; F596-L684 HydrophobicContact CZ-CB 4.25Å; F596-L684 HydrophobicContact CZ-CD1 3.31Å; F596-L684 HydrophobicContact CZ-CD2 3.75Å; F596-L684 HydrophobicContact CZ-CG 3.83Å; Y599-L684 HydrophobicContact CD2-CD1 4.18Å; Y599-L684 HydrophobicContact CD2-CD2 3.84Å; Y599-L684 HydrophobicContact CD2-CG 4.37Å; Y599-L684 HydrophobicContact CE2-CD1 4.15Å; Y599-L684 HydrophobicContact CE2-CD2 4.03Å; Y599-L684 HydrophobicContact CE2-CG 4.38Å; Y599-L684 HydrophobicContact CG-CD1 4.17Å; L627-L684 HydrophobicContact CD1-CD2 3.45Å; L627-L684 VanDerWaalsContact CD1-CD2 3.45Å; L627-L684 HydrophobicContact CD1-CG 3.91Å; I676-L684 HydrophobicContact CD1-CD1 4.33Å; I676-L684 HydrophobicContact CG2-CD1 4.41Å; E680-L684 WeakPolarHBondContact O-CB 3.31Å; E680-L684 WeakPolarHBondContact O-CG 3.23Å; E680-L684 PolarHBondContact O-N 2.92Å; Q681-L684 WeakPolarHBondContact O-CB 3.22Å; Q681-L684 PolarHBondContact O-N 3.18Å; L684-A686 PolarHBondContact O-N 3.25Å; L684-V687 PolarHBondContact O-N 3.19Å; L684-L688 WeakPolarHBondContact O-CG 3.39Å; L684-L688 PolarHBondContact O-N 3.22Å; L684-F720 HydrophobicContact CD2-CE1 4.49Å; L684-F720 HydrophobicContact CD2-CZ 4.41Å; L684-L729 HydrophobicContact CB-CD1 4.16Å; L684-L729 HydrophobicContact CD2-CD1 3.63Å; L684-L729 HydrophobicContact CD2-CG 4.36Å; L684-L729 HydrophobicContact CG-CD1 4.04Å
685Q89Confident84.9Confident19 Ų1933.7 Ų33.79%0.08918%0.182CC..Hα-helixtrans-62.1-41.3174.8-71.8179-6.500112.2Q681 G683 V687 L688 R689 L729 D732Q681-Q685 VanDerWaalsContact O-CG 3.32Å; Q681-Q685 WeakPolarHBondContact O-CG 3.33Å; Q681-Q685 PolarHBondContact O-N 3.18Å; G683-Q685 PolarHBondContact O-N 3.27Å; Q685-V687 VanDerWaalsContact C-N 3.32Å; Q685-V687 PolarHBondContact O-N 2.82Å; Q685-L688 PolarHBondContact O-N 3.06Å; Q685-R689 WeakPolarHBondContact O-CB 3.26Å; Q685-R689 VanDerWaalsContact O-CG 3.27Å; Q685-R689 WeakPolarHBondContact O-CG 3.37Å; Q685-R689 PolarHBondContact O-N 3.12Å; Q685-L729 HydrophobicContact CG-CB 4.34Å; Q685-L729 HydrophobicContact CG-CD1 4.11Å; Q685-L729 HydrophobicContact CG-CG 4.48Å; Q685-D732 WeakPolarHBondContact CB-OD2 3.37Å; Q685-D732 VanDerWaalsContact CG-OD2 3.28Å; Q685-D732 WeakPolarHBondContact CG-OD2 3.24Å
686A87.2Confident85.4Confident10.3333 Ų10.333330.4 Ų30.49%0.08516%0.158CC..Hα-helixtrans-62.9-39.4177.600000112.1L550 L553 A682 G683 L684 L690L550-A686 HydrophobicContact CD1-CB 3.49Å; L550-A686 VanDerWaalsContact CD1-CB 3.45Å; L553-A686 HydrophobicContact CB-CB 4.23Å; L553-A686 HydrophobicContact CD1-CB 3.97Å; A682-A686 WeakPolarHBondContact O-CB 3.37Å; A682-A686 PolarHBondContact O-N 3.31Å; G683-A686 WeakPolarHBondContact O-CB 3.41Å; G683-A686 PolarHBondContact O-N 3.16Å; L684-A686 PolarHBondContact O-N 3.25Å; A686-L690 WeakPolarHBondContact O-CB 3.17Å; A686-L690 PolarHBondContact O-N 3.01Å
687V90.3Very high85.3Confident3 Ų329.7 Ų29.72%0.01815%0.154CC..Hα-helixtrans-65.8-46.7173.7176.40000111.2F549 L553 F592 F596 G683 L684 Q685 R689 L690 V691F549-V687 HydrophobicContact CZ-CG2 4.16Å; L553-V687 HydrophobicContact CD1-CG2 3.52Å; F592-V687 HydrophobicContact CB-CG1 3.84Å; F592-V687 HydrophobicContact CD1-CG1 4.4Å; F592-V687 HydrophobicContact CD1-CG2 3.97Å; F592-V687 HydrophobicContact CD2-CG1 3.65Å; F592-V687 HydrophobicContact CD2-CG2 4.31Å; F592-V687 HydrophobicContact CE1-CG2 4.08Å; F592-V687 HydrophobicContact CE2-CG1 4.32Å; F592-V687 HydrophobicContact CE2-CG2 4.4Å; F592-V687 HydrophobicContact CG-CG1 3.71Å; F592-V687 HydrophobicContact CG-CG2 4.11Å; F592-V687 HydrophobicContact CZ-CG2 4.3Å; F596-V687 HydrophobicContact CE2-CB 4.27Å; F596-V687 HydrophobicContact CE2-CG1 3.75Å; F596-V687 HydrophobicContact CZ-CB 4.33Å; F596-V687 HydrophobicContact CZ-CG1 4.23Å; G683-V687 WeakPolarHBondContact O-CG2 3.33Å; G683-V687 PolarHBondContact O-N 3.06Å; L684-V687 PolarHBondContact O-N 3.19Å; Q685-V687 VanDerWaalsContact C-N 3.32Å; Q685-V687 PolarHBondContact O-N 2.82Å; V687-R689 VanDerWaalsContact C-N 3.32Å; V687-R689 PolarHBondContact O-N 3.09Å; V687-L690 PolarHBondContact O-N 3.11Å; V687-V691 HydrophobicContact CG1-CG2 4.29Å; V687-V691 WeakPolarHBondContact O-CG2 3.38Å; V687-V691 PolarHBondContact O-N 3.24Å
688L89.6Confident85.5Confident3.66667 Ų3.6666725.1 Ų25.12%0.01913%0.133CC..Hα-helixtrans-57.2-45.4177.4-73.6175000111.9F596 L684 Q685 L690 V691 A692 L729 D732 I733 L736F596-L688 HydrophobicContact CE1-CD1 4.19Å; F596-L688 HydrophobicContact CE1-CD2 3.74Å; F596-L688 HydrophobicContact CE1-CG 3.82Å; F596-L688 HydrophobicContact CE2-CD2 4.44Å; F596-L688 HydrophobicContact CZ-CD1 4.43Å; F596-L688 HydrophobicContact CZ-CD2 3.62Å; F596-L688 HydrophobicContact CZ-CG 3.64Å; L684-L688 WeakPolarHBondContact O-CG 3.39Å; L684-L688 PolarHBondContact O-N 3.22Å; Q685-L688 PolarHBondContact O-N 3.06Å; L688-L690 PolarHBondContact O-N 3Å; L688-V691 PolarHBondContact O-N 3.43Å; L688-A692 WeakPolarHBondContact O-CB 3.42Å; L688-A692 PolarHBondContact O-N 3Å; L688-L729 HydrophobicContact CD1-CD1 3.32Å; L688-L729 HydrophobicContact CD1-CG 4.27Å; L688-D732 HydrophobicContact CB-CB 4.36Å; L688-D732 HydrophobicContact CD1-CB 4.06Å; L688-I733 HydrophobicContact CD1-CG1 3.73Å; L688-I733 HydrophobicContact CD2-CG1 4.39Å; L688-L736 HydrophobicContact CD2-CD1 4.14Å; L688-L736 HydrophobicContact CD2-CD2 3.71Å
689R88.6Confident85.6Confident71.6667 Ų71.666722.3 Ų22.327%0.2712%0.115SC..Hα-helixtrans-65.3-37.9178.2-69.4174.7-170.3150.38.7112.1Q685 V687 A692 R693 D732 T1257Q685-R689 WeakPolarHBondContact O-CB 3.26Å; Q685-R689 VanDerWaalsContact O-CG 3.27Å; Q685-R689 WeakPolarHBondContact O-CG 3.37Å; Q685-R689 PolarHBondContact O-N 3.12Å; V687-R689 VanDerWaalsContact C-N 3.32Å; V687-R689 PolarHBondContact O-N 3.09Å; R689-A692 PolarHBondContact O-N 3.26Å; R689-R693 VanDerWaalsContact O-CB 3.24Å; R689-R693 WeakPolarHBondContact O-CB 3.3Å; R689-R693 PolarHBondContact O-N 3.21Å; R689-D732 IonicContact CZ-OD1 3.59Å; R689-D732 IonicContact CZ-OD2 2.99Å; R689-D732 VanDerWaalsContact CZ-OD2 3.24Å; R689-D732 IonicContact NE-OD1 3.06Å; R689-D732 PolarHBondContact NE-OD1 3.35Å; R689-D732 IonicContact NE-OD2 3.33Å; R689-D732 PolarHBondContact NE-OD2 3.19Å; R689-D732 VanDerWaalsContact NE-OD2 3.15Å; R689-D732 IonicContact NH2-OD1 2.98Å; R689-D732 PolarHBondContact NH2-OD1 3.14Å; R689-D732 IonicContact NH2-OD2 3.56Å; R689-D732 PolarHBondContact NH2-OD2 3.01Å; R689-T1257 HydrophobicContact CG-CG2 4.34Å
690L89.7Confident85.9Confident0 Ų019.3 Ų19.30%011%0.107CC..Hα-helixtrans-63.3-45.9173.4-178.363.9000111.7L553 L556 H557 L573 W589 A686 V687 L688 A692 R693 V694L553-L690 HydrophobicContact CD2-CD2 4.02Å; L556-L690 HydrophobicContact CB-CD1 4.12Å; L556-L690 HydrophobicContact CB-CD2 4.38Å; L556-L690 HydrophobicContact CD1-CD2 4.4Å; H557-L690 HydrophobicContact CB-CD1 4.1Å; L573-L690 HydrophobicContact CD1-CD2 3.98Å; W589-L690 HydrophobicContact CH2-CD2 4.32Å; W589-L690 HydrophobicContact CH2-CG 4.37Å; A686-L690 WeakPolarHBondContact O-CB 3.17Å; A686-L690 PolarHBondContact O-N 3.01Å; V687-L690 PolarHBondContact O-N 3.11Å; L688-L690 PolarHBondContact O-N 3Å; L690-A692 VanDerWaalsContact C-N 3.34Å; L690-A692 PolarHBondContact O-N 2.92Å; L690-R693 PolarHBondContact O-N 3.06Å; L690-V694 HydrophobicContact CD1-CG2 4.39Å; L690-V694 WeakPolarHBondContact O-CG2 3.4Å; L690-V694 PolarHBondContact O-N 3.32Å
691V90.4Very high86Confident1.33333 Ų1.3333316.5 Ų16.51%0.0089%0.094CC..Hα-helixtrans-61.3-46176.5-1800000110.3W589 F593 V687 L688 R693 V694 C695 F705 L713 L736W589-V691 HydrophobicContact CE3-CG2 4.34Å; W589-V691 HydrophobicContact CH2-CG2 4.4Å; W589-V691 HydrophobicContact CZ3-CG2 3.61Å; F593-V691 HydrophobicContact CE1-CG2 4.42Å; F593-V691 HydrophobicContact CZ-CG2 4.27Å; V687-V691 HydrophobicContact CG1-CG2 4.29Å; V687-V691 WeakPolarHBondContact O-CG2 3.38Å; V687-V691 PolarHBondContact O-N 3.24Å; L688-V691 PolarHBondContact O-N 3.43Å; V691-R693 VanDerWaalsContact C-N 3.33Å; V691-R693 PolarHBondContact O-N 3.03Å; V691-V694 PolarHBondContact O-N 3Å; V691-C695 VanDerWaalsContact O-CB 3.31Å; V691-C695 WeakPolarHBondContact O-CB 3.36Å; V691-C695 PolarHBondContact O-N 3.02Å; V691-C695 PolarHBondContact O-SG 3.3Å; V691-F705 HydrophobicContact CG1-CD1 4.37Å; V691-F705 HydrophobicContact CG1-CD2 4.41Å; V691-F705 HydrophobicContact CG1-CE1 4.33Å; V691-F705 HydrophobicContact CG1-CE2 4.31Å; V691-F705 HydrophobicContact CG1-CG 4.41Å; V691-F705 HydrophobicContact CG1-CZ 4.26Å; V691-L713 HydrophobicContact CG1-CD2 4.4Å; V691-L736 HydrophobicContact CB-CD1 4.02Å; V691-L736 HydrophobicContact CG1-CD1 3.67Å; V691-L736 HydrophobicContact CG1-CD2 4.48Å
692A87.7Confident86.2Confident14.3333 Ų14.333315 Ų1512%0.1189%0.086CC..Hα-helixtrans-59.4-44.2177.400000111.5L688 R689 L690 C695 R696 L736 E739L688-A692 WeakPolarHBondContact O-CB 3.42Å; L688-A692 PolarHBondContact O-N 3Å; R689-A692 PolarHBondContact O-N 3.26Å; L690-A692 VanDerWaalsContact C-N 3.34Å; L690-A692 PolarHBondContact O-N 2.92Å; A692-C695 PolarHBondContact O-N 3.26Å; A692-R696 WeakPolarHBondContact O-CB 3.29Å; A692-R696 PolarHBondContact O-N 2.99Å; A692-L736 HydrophobicContact CB-CB 4.46Å; A692-L736 HydrophobicContact CB-CD1 4.01Å; A692-E739 HydrophobicContact CB-CG 4.37Å
693R85.1Confident86.3Confident2 Ų216.4 Ų16.41%0.0089%0.094CC..Hα-helixtrans-61.5-46.6176.5178.362.673.2119.65.3112.5N464 P466 H557 C560 R689 L690 V691 R696 M697 E1268N464-R693 PolarHBondContact OD1-NH1 3.16Å; N464-R693 PolarHBondContact OD1-NH2 2.89Å; P466-R693 VanDerWaalsContact CG-NH1 3.31Å; H557-R693 PolarHBondContact CE1-NH2 3.14Å; H557-R693 PolarHBondContact NE2-NH2 3.43Å; C560-R693 HydrophobicContact CB-CG 3.84Å; R689-R693 VanDerWaalsContact O-CB 3.24Å; R689-R693 WeakPolarHBondContact O-CB 3.3Å; R689-R693 PolarHBondContact O-N 3.21Å; L690-R693 PolarHBondContact O-N 3.06Å; V691-R693 VanDerWaalsContact C-N 3.33Å; V691-R693 PolarHBondContact O-N 3.03Å; R693-R696 WeakPolarHBondContact O-CB 3.38Å; R693-R696 PolarHBondContact O-N 3.31Å; R693-M697 WeakPolarHBondContact O-CG 3.25Å; R693-M697 PolarHBondContact O-N 3.36Å; R693-M697 VanDerWaalsContact O-N 3.14Å; R693-E1268 IonicContact CZ-OE1 2.71Å; R693-E1268 IonicContact CZ-OE2 3.18Å; R693-E1268 IonicContact NE-OE2 3.85Å; R693-E1268 IonicContact NH2-OE1 4Å; R693-E1268 PolarHBondContact NH2-OE1 3.48Å; R693-E1268 IonicContact NH2-OE2 3.12Å; R693-E1268 PolarHBondContact NH2-OE2 3.09Å
694V87.7Confident86.3Confident0 Ų018.1 Ų18.10%010%0.104CC..Hα-helixtrans-64.2-44.9178.1172.60000110.6A566 F570 L690 V691 R696 M697 D698 A701 F705A566-V694 HydrophobicContact CB-CG1 4.45Å; F570-V694 HydrophobicContact CB-CG1 4.14Å; F570-V694 HydrophobicContact CD2-CG1 4.47Å; L690-V694 HydrophobicContact CD1-CG2 4.39Å; L690-V694 WeakPolarHBondContact O-CG2 3.4Å; L690-V694 PolarHBondContact O-N 3.32Å; V691-V694 PolarHBondContact O-N 3Å; V694-R696 VanDerWaalsContact C-N 3.27Å; V694-R696 PolarHBondContact O-N 3.1Å; V694-M697 PolarHBondContact O-N 3.19Å; V694-D698 PolarHBondContact O-N 3.3Å; V694-A701 HydrophobicContact CG1-CB 3.69Å; V694-F705 HydrophobicContact CB-CE2 4.45Å; V694-F705 HydrophobicContact CG1-CE2 3.99Å
695C86.4Confident86.4Confident0 Ų017.8 Ų17.80%010%0.102CC..Hα-helixtrans-62.2-32.9176.8-68.90000112.7V691 A692 R702 F705 E739 F740V691-C695 VanDerWaalsContact O-CB 3.31Å; V691-C695 WeakPolarHBondContact O-CB 3.36Å; V691-C695 PolarHBondContact O-N 3.02Å; V691-C695 PolarHBondContact O-SG 3.3Å; A692-C695 PolarHBondContact O-N 3.26Å; C695-R702 HydrophobicContact CB-CB 4.16Å; C695-R702 HydrophobicContact CB-CG 4.08Å; C695-R702 VanDerWaalsContact O-CZ 3.26Å; C695-R702 PolarHBondContact O-NE 3.34Å; C695-R702 PolarHBondContact O-NH2 3.27Å; C695-F705 WeakPolarHBondContact SG-CD2 3.31Å; C695-E739 HydrophobicContact CB-CB 4.33Å; C695-F740 HydrophobicContact CB-CE1 4.45Å
696R79.9Confident86.2Confident6.66667 Ų6.6666718.6 Ų18.63%0.02511%0.107CC..Hα-helixtrans-65.5-50.5176.8-175176.3-17293.910.1111.7A692 R693 V694 R702 E739 K742 D1250 Q1256 E1268 A1271 S1272A692-R696 WeakPolarHBondContact O-CB 3.29Å; A692-R696 PolarHBondContact O-N 2.99Å; R693-R696 WeakPolarHBondContact O-CB 3.38Å; R693-R696 PolarHBondContact O-N 3.31Å; V694-R696 VanDerWaalsContact C-N 3.27Å; V694-R696 PolarHBondContact O-N 3.1Å; R696-R702 PolarHBondContact O-NH2 3.16Å; R696-R702 VanDerWaalsContact O-NH2 3.11Å; R696-E739 VanDerWaalsContact CA-OE2 3.29Å; R696-E739 WeakPolarHBondContact CA-OE2 3.29Å; R696-E739 HydrophobicContact CB-CG 4.45Å; R696-E739 VanDerWaalsContact CB-OE2 3.29Å; R696-E739 WeakPolarHBondContact CB-OE2 3.33Å; R696-E739 WeakPolarHBondContact CG-OE2 3.17Å; R696-E739 IonicContact CZ-OE1 2.93Å; R696-E739 IonicContact NE-OE1 2.74Å; R696-E739 IonicContact NH1-OE1 3.38Å; R696-E739 PolarHBondContact NH1-OE1 3.07Å; R696-K742 VanDerWaalsContact CZ-NZ 3.27Å; R696-D1250 IonicContact CZ-OD1 3.49Å; R696-D1250 IonicContact CZ-OD2 3.77Å; R696-D1250 IonicContact NE-OD1 3.9Å; R696-D1250 PolarHBondContact NE-OD1 3.01Å; R696-D1250 IonicContact NE-OD2 3.06Å; R696-D1250 IonicContact NH2-OD1 3.57Å; R696-D1250 PolarHBondContact NH2-OD1 3.48Å; R696-D1250 IonicContact NH2-OD2 2.67Å; R696-D1250 PolarHBondContact NH2-OD2 3.12Å; R696-Q1256 VanDerWaalsContact NH2-NE2 3.12Å; R696-E1268 VanDerWaalsContact CZ-O 3.26Å; R696-E1268 PolarHBondContact NH1-O 2.98Å; R696-A1271 PolarHBondContact NH1-O 3.17Å; R696-A1271 VanDerWaalsContact NH2-CA 3.34Å; R696-A1271 PolarHBondContact NH2-O 2.87Å; R696-S1272 VanDerWaalsContact NH1-N 3.16Å
697M78.7Confident86Confident5.66667 Ų5.6666722.3 Ų22.33%0.02813%0.131CC..Hα-helixtrans-80.3-35.3-172.5-61.4-56.3-178.100113.6P466 R563 A566 R693 V694 F1213 W1267P466-M697 HydrophobicContact CB-CE 3.69Å; P466-M697 VanDerWaalsContact CB-CE 3.44Å; P466-M697 HydrophobicContact CG-CE 4.03Å; R563-M697 WeakPolarHBondContact CB-O 3.42Å; R563-M697 WeakPolarHBondContact CG-O 3.18Å; A566-M697 HydrophobicContact CB-CB 3.52Å; A566-M697 HydrophobicContact CB-CG 4.39Å; R693-M697 WeakPolarHBondContact O-CG 3.25Å; R693-M697 PolarHBondContact O-N 3.36Å; R693-M697 VanDerWaalsContact O-N 3.14Å; V694-M697 PolarHBondContact O-N 3.19Å; M697-F1213 HydrophobicContact SD-CD1 4.04Å; M697-F1213 HydrophobicContact SD-CE1 4.04Å; M697-W1267 HydrophobicContact CE-CH2 4.21Å
698D83Confident85.8Confident13.6667 Ų13.666723.9 Ų23.97%0.07314%0.14CC..  trans-118.6110.2-179.8-178.526.2000112.4R563 A566 V694 V700 A701 R702R563-D698 HydrophobicContact CG-CB 4.42Å; R563-D698 IonicContact NE-OD1 3.06Å; A566-D698 HydrophobicContact CB-CB 4.13Å; V694-D698 PolarHBondContact O-N 3.3Å; D698-V700 VanDerWaalsContact C-N 3.25Å; D698-V700 PolarHBondContact O-N 2.93Å; D698-V700 WeakPolarHBondContact OD1-CB 3.4Å; D698-V700 PolarHBondContact OD1-N 3.31Å; D698-A701 HydrophobicContact CB-CB 4Å; D698-A701 PolarHBondContact O-N 2.85Å; D698-A701 VanDerWaalsContact OD2-CB 3.27Å; D698-A701 WeakPolarHBondContact OD2-CB 3.23Å; D698-A701 PolarHBondContact OD2-N 3.19Å; D698-R702 PolarHBondContact O-N 3.21Å; D698-R702 VanDerWaalsContact O-N 3.12Å
699P81.3Confident85.6Confident30.3333 Ų30.333328.5 Ų28.520%0.19717%0.17CC..Hα-helixtrans-66.6-25.117628.1-34.6000112.7R702 S703P699-R702 WeakPolarHBondContact O-CB 3.2Å; P699-R702 PolarHBondContact O-N 3.05Å; P699-S703 PolarHBondContact O-N 3.23Å; P699-S703 VanDerWaalsContact O-N 3.16Å
700V84.9Confident85.3Confident80.6667 Ų80.666731.7 Ų31.749%0.48919%0.188SC..Hα-helixtrans-69.4-52.2177.5-1770000109.3D698 R702 S703 T704D698-V700 VanDerWaalsContact C-N 3.25Å; D698-V700 PolarHBondContact O-N 2.93Å; D698-V700 WeakPolarHBondContact OD1-CB 3.4Å; D698-V700 PolarHBondContact OD1-N 3.31Å; V700-R702 VanDerWaalsContact C-N 3.29Å; V700-R702 PolarHBondContact O-N 2.97Å; V700-S703 PolarHBondContact O-N 3.43Å; V700-S703 VanDerWaalsContact O-N 3.15Å; V700-S703 PolarHBondContact O-OG 3.1Å; V700-T704 WeakPolarHBondContact O-CG2 3.13Å; V700-T704 PolarHBondContact O-N 3.09Å; V700-T704 VanDerWaalsContact O-N 3.1Å
701A85.5Confident85.1Confident0.666667 Ų0.66666732.6 Ų32.61%0.00619%0.192CC..Hα-helixtrans-53.4-45.4172.300000111.9F570 V694 D698 S703 T704 F705F570-A701 HydrophobicContact CB-CB 4.26Å; F570-A701 HydrophobicContact CD1-CB 4.49Å; F570-A701 HydrophobicContact CD2-CB 3.96Å; F570-A701 HydrophobicContact CE2-CB 4.47Å; F570-A701 HydrophobicContact CG-CB 4Å; V694-A701 HydrophobicContact CG1-CB 3.69Å; D698-A701 HydrophobicContact CB-CB 4Å; D698-A701 PolarHBondContact O-N 2.85Å; D698-A701 VanDerWaalsContact OD2-CB 3.27Å; D698-A701 WeakPolarHBondContact OD2-CB 3.23Å; D698-A701 PolarHBondContact OD2-N 3.19Å; A701-S703 VanDerWaalsContact C-N 3.35Å; A701-S703 PolarHBondContact O-N 3.05Å; A701-T704 WeakPolarHBondContact CA-OG1 3.33Å; A701-T704 PolarHBondContact O-N 3.08Å; A701-T704 VanDerWaalsContact O-N 3.08Å; A701-T704 PolarHBondContact O-OG1 3.27Å; A701-F705 HydrophobicContact CB-CD2 4.48Å; A701-F705 HydrophobicContact CB-CE2 4.23Å; A701-F705 WeakPolarHBondContact O-CD2 3.42Å; A701-F705 PolarHBondContact O-N 3.1Å
702R87.8Confident84.9Confident9.66667 Ų9.6666737.1 Ų37.14%0.03621%0.213CC..Hα-helixtrans-53.7-47.5176.6-170.5-168.3-54.31574.4112.7C695 R696 D698 P699 V700 T704 F705 I706 E739 F740 S743C695-R702 HydrophobicContact CB-CB 4.16Å; C695-R702 HydrophobicContact CB-CG 4.08Å; C695-R702 VanDerWaalsContact O-CZ 3.26Å; C695-R702 PolarHBondContact O-NE 3.34Å; C695-R702 PolarHBondContact O-NH2 3.27Å; R696-R702 PolarHBondContact O-NH2 3.16Å; R696-R702 VanDerWaalsContact O-NH2 3.11Å; D698-R702 PolarHBondContact O-N 3.21Å; D698-R702 VanDerWaalsContact O-N 3.12Å; P699-R702 WeakPolarHBondContact O-CB 3.2Å; P699-R702 PolarHBondContact O-N 3.05Å; V700-R702 VanDerWaalsContact C-N 3.29Å; V700-R702 PolarHBondContact O-N 2.97Å; R702-T704 VanDerWaalsContact C-N 3.3Å; R702-T704 PolarHBondContact O-N 3.1Å; R702-F705 PolarHBondContact O-N 3.03Å; R702-I706 HydrophobicContact CG-CD1 4.34Å; R702-I706 WeakPolarHBondContact O-CG1 3.39Å; R702-I706 PolarHBondContact O-N 2.87Å; R702-E739 VanDerWaalsContact CD-O 3.25Å; R702-E739 WeakPolarHBondContact CD-O 3.32Å; R702-E739 PolarHBondContact NE-O 3.18Å; R702-F740 HydrophobicContact CG-CD1 4.3Å; R702-S743 PolarHBondContact NH1-OG 2.94Å
703S85.5Confident84.9Confident59 Ų5936.7 Ų36.741%0.41321%0.208SC..Hα-helixtrans-65.8-36.2178.272.40000112.2P699 V700 A701 I706 S707P699-S703 PolarHBondContact O-N 3.23Å; P699-S703 VanDerWaalsContact O-N 3.16Å; V700-S703 PolarHBondContact O-N 3.43Å; V700-S703 VanDerWaalsContact O-N 3.15Å; V700-S703 PolarHBondContact O-OG 3.1Å; A701-S703 VanDerWaalsContact C-N 3.35Å; A701-S703 PolarHBondContact O-N 3.05Å; S703-I706 PolarHBondContact O-N 3.27Å; S703-S707 VanDerWaalsContact O-CB 3.29Å; S703-S707 WeakPolarHBondContact O-CB 3.25Å; S703-S707 PolarHBondContact O-N 3.12Å; S703-S707 PolarHBondContact O-OG 2.84Å
704T87.1Confident85Confident41.3333 Ų41.333337.2 Ų37.225%0.25421%0.211SC..Hα-helixtrans-69.2-35.2177.366.90000113.3F570 V700 A701 R702 I706 S707 N708F570-T704 WeakPolarHBondContact CE2-OG1 3.37Å; F570-T704 WeakPolarHBondContact CZ-OG1 3.21Å; V700-T704 WeakPolarHBondContact O-CG2 3.13Å; V700-T704 PolarHBondContact O-N 3.09Å; V700-T704 VanDerWaalsContact O-N 3.1Å; A701-T704 WeakPolarHBondContact CA-OG1 3.33Å; A701-T704 PolarHBondContact O-N 3.08Å; A701-T704 VanDerWaalsContact O-N 3.08Å; A701-T704 PolarHBondContact O-OG1 3.27Å; R702-T704 VanDerWaalsContact C-N 3.3Å; R702-T704 PolarHBondContact O-N 3.1Å; T704-I706 VanDerWaalsContact C-N 3.31Å; T704-I706 PolarHBondContact O-N 2.86Å; T704-S707 WeakPolarHBondContact CA-OG 3.45Å; T704-N708 VanDerWaalsContact O-CB 3.31Å; T704-N708 WeakPolarHBondContact O-CB 3.36Å; T704-N708 PolarHBondContact O-N 3.43Å
705F88.2Confident85Confident0 Ų040 Ų400%023%0.229CC..Hα-helixtrans-63.6-36.1176.1-78.1-64000113F570 W589 F593 V691 V694 C695 A701 R702 W711 L713 F740F570-F705 HydrophobicContact CD2-CE1 4.25Å; F570-F705 AromaticContact CD2-CE2 3.66Å; F570-F705 HydrophobicContact CD2-CE2 3.66Å; F570-F705 AromaticContact CD2-CZ 3.49Å; F570-F705 HydrophobicContact CD2-CZ 3.49Å; F570-F705 VanDerWaalsContact CD2-CZ 3.48Å; F570-F705 HydrophobicContact CE2-CD1 4.37Å; F570-F705 HydrophobicContact CE2-CD2 4.27Å; F570-F705 AromaticContact CE2-CE1 3.86Å; F570-F705 HydrophobicContact CE2-CE1 3.86Å; F570-F705 AromaticContact CE2-CE2 3.76Å; F570-F705 HydrophobicContact CE2-CE2 3.76Å; F570-F705 AromaticContact CE2-CZ 3.54Å; F570-F705 HydrophobicContact CE2-CZ 3.54Å; W589-F705 AromaticContact CD2-CE1 3.84Å; W589-F705 HydrophobicContact CD2-CE1 3.84Å; W589-F705 HydrophobicContact CD2-CZ 4.01Å; W589-F705 AromaticContact CE2-CZ 3.85Å; W589-F705 AromaticContact CE3-CE1 3.79Å; W589-F705 HydrophobicContact CE3-CE1 3.79Å; W589-F705 AromaticContact CE3-CZ 4Å; W589-F705 HydrophobicContact CE3-CZ 4.01Å; W589-F705 HydrophobicContact CG-CE1 4.37Å; W589-F705 HydrophobicContact CH2-CE1 4.41Å; W589-F705 AromaticContact CH2-CZ 3.8Å; W589-F705 HydrophobicContact CH2-CZ 3.8Å; W589-F705 HydrophobicContact CZ2-CE1 4.42Å; W589-F705 AromaticContact CZ2-CZ 3.74Å; W589-F705 HydrophobicContact CZ2-CZ 3.74Å; W589-F705 HydrophobicContact CZ3-CE1 4.12Å; W589-F705 AromaticContact CZ3-CZ 3.94Å; W589-F705 HydrophobicContact CZ3-CZ 3.94Å; F593-F705 AromaticContact CE2-CD1 3.94Å; F593-F705 HydrophobicContact CE2-CD1 3.94Å; F593-F705 AromaticContact CE2-CE1 3.91Å; F593-F705 HydrophobicContact CE2-CE1 3.91Å; F593-F705 AromaticContact CZ-CD1 3.73Å; F593-F705 HydrophobicContact CZ-CD1 3.73Å; F593-F705 AromaticContact CZ-CE1 3.74Å; F593-F705 HydrophobicContact CZ-CE1 3.74Å; V691-F705 HydrophobicContact CG1-CD1 4.37Å; V691-F705 HydrophobicContact CG1-CD2 4.41Å; V691-F705 HydrophobicContact CG1-CE1 4.33Å; V691-F705 HydrophobicContact CG1-CE2 4.31Å; V691-F705 HydrophobicContact CG1-CG 4.41Å; V691-F705 HydrophobicContact CG1-CZ 4.26Å; V694-F705 HydrophobicContact CB-CE2 4.45Å; V694-F705 HydrophobicContact CG1-CE2 3.99Å; C695-F705 WeakPolarHBondContact SG-CD2 3.31Å; A701-F705 HydrophobicContact CB-CD2 4.48Å; A701-F705 HydrophobicContact CB-CE2 4.23Å; A701-F705 WeakPolarHBondContact O-CD2 3.42Å; A701-F705 PolarHBondContact O-N 3.1Å; R702-F705 PolarHBondContact O-N 3.03Å; F705-W711 AromaticContact CD1-CE3 3.79Å; F705-W711 HydrophobicContact CD1-CE3 3.79Å; F705-W711 HydrophobicContact CD1-CH2 4.31Å; F705-W711 AromaticContact CD1-CZ3 3.44Å; F705-W711 HydrophobicContact CD1-CZ3 3.44Å; F705-W711 VanDerWaalsContact CD1-CZ3 3.44Å; F705-W711 HydrophobicContact CE1-CE3 4.48Å; F705-W711 HydrophobicContact CE1-CH2 4.36Å; F705-W711 AromaticContact CE1-CZ3 3.93Å; F705-W711 HydrophobicContact CE1-CZ3 3.93Å; F705-W711 HydrophobicContact CG-CZ3 4.24Å; F705-L713 HydrophobicContact CB-CD2 4.43Å; F705-F740 HydrophobicContact CB-CE1 4.4Å
706I85Confident85Confident37.3333 Ų37.333340.5 Ų40.519%0.19123%0.232CC..Hα-helixtrans-86-40.1-176.1-61.5168.3000111.3R702 S703 T704 N708 I714 F740 N746R702-I706 HydrophobicContact CG-CD1 4.34Å; R702-I706 WeakPolarHBondContact O-CG1 3.39Å; R702-I706 PolarHBondContact O-N 2.87Å; S703-I706 PolarHBondContact O-N 3.27Å; T704-I706 VanDerWaalsContact C-N 3.31Å; T704-I706 PolarHBondContact O-N 2.86Å; I706-N708 VanDerWaalsContact C-N 3.32Å; I706-N708 PolarHBondContact O-N 3.18Å; I706-I714 HydrophobicContact CG2-CD1 3.91Å; I706-F740 HydrophobicContact CD1-CB 3.7Å; I706-F740 HydrophobicContact CD1-CD1 3.67Å; I706-F740 HydrophobicContact CD1-CD2 4.43Å; I706-F740 HydrophobicContact CD1-CE1 4.43Å; I706-F740 HydrophobicContact CD1-CG 3.69Å; I706-F740 HydrophobicContact CG1-CB 4.44Å; I706-F740 HydrophobicContact CG1-CD1 3.94Å; I706-F740 HydrophobicContact CG1-CD2 4.4Å; I706-F740 HydrophobicContact CG1-CE1 4.23Å; I706-F740 HydrophobicContact CG1-CG 4.05Å; I706-N746 HydrophobicContact CD1-CB 4.31Å; I706-N746 VanDerWaalsContact CD1-CG 3.42Å; I706-N746 WeakPolarHBondContact CD1-ND2 3.42Å
707S84.6Confident85.4Confident86.6667 Ų86.666740.3 Ų40.361%0.60623%0.232SC*.Hα-helixtrans-74.3-18.4-178.857.30000113.9S703 T704 P709S703-S707 VanDerWaalsContact O-CB 3.29Å; S703-S707 WeakPolarHBondContact O-CB 3.25Å; S703-S707 PolarHBondContact O-N 3.12Å; S703-S707 PolarHBondContact O-OG 2.84Å; T704-S707 WeakPolarHBondContact CA-OG 3.45Å; S707-P709 WeakPolarHBondContact O-CD 3.36Å
708N86.2Confident85.8Confident36.6667 Ų36.666740.3 Ų40.320%0.19623%0.231CC..  trans-70.9111.6-178.2-170.7-17.6000111.8T704 I706 Q710 W711 Q712T704-N708 VanDerWaalsContact O-CB 3.31Å; T704-N708 WeakPolarHBondContact O-CB 3.36Å; T704-N708 PolarHBondContact O-N 3.43Å; I706-N708 VanDerWaalsContact C-N 3.32Å; I706-N708 PolarHBondContact O-N 3.18Å; N708-Q710 VanDerWaalsContact C-N 3.25Å; N708-Q710 PolarHBondContact O-N 3.27Å; N708-Q710 WeakPolarHBondContact OD1-CB 3.39Å; N708-Q710 PolarHBondContact OD1-N 3.15Å; N708-W711 HydrophobicContact CB-CB 4.46Å; N708-W711 HydrophobicContact CB-CD2 3.9Å; N708-W711 HydrophobicContact CB-CE3 3.57Å; N708-W711 HydrophobicContact CB-CG 4.32Å; N708-W711 HydrophobicContact CB-CZ3 4.07Å; N708-W711 WeakPolarHBondContact ND2-CZ2 3.4Å; N708-W711 PolarHBondContact O-N 3.21Å; N708-Q712 PolarHBondContact O-N 3.49Å
709P83.5Confident85.9Confident101 Ų10139.9 Ų39.966%0.65623%0.231SC*.THydrogen-bonded Turntrans-71.6-15.5-175.831.5-37.1000113.5S707 Q712S707-P709 WeakPolarHBondContact O-CD 3.36Å; P709-Q712 WeakPolarHBondContact O-CG 3.43Å
710Q83.3Confident86.1Confident139 Ų13938.6 Ų38.665%0.6522%0.222SC*.THydrogen-bonded Turntrans-77.6-37.9178.6-65.2-177.3-25.200111.8N708N708-Q710 VanDerWaalsContact C-N 3.25Å; N708-Q710 PolarHBondContact O-N 3.27Å; N708-Q710 WeakPolarHBondContact OD1-CB 3.39Å; N708-Q710 PolarHBondContact OD1-N 3.15Å
711W86Confident86.1Confident19.3333 Ų19.333334.9 Ų34.97%0.07320%0.199CC..THydrogen-bonded Turntrans-78.7-34.7-176.2-60.4-21.9000112.7F570 W589 D590 F593 F705 N708 L713 I716F570-W711 HydrophobicContact CE2-CH2 4.29Å; F570-W711 HydrophobicContact CE2-CZ3 4.42Å; F570-W711 HydrophobicContact CZ-CH2 4.32Å; W589-W711 HydrophobicContact CB-CH2 4.09Å; W589-W711 HydrophobicContact CB-CZ2 3.63Å; W589-W711 HydrophobicContact CG-CH2 4.37Å; W589-W711 HydrophobicContact CG-CZ2 4.35Å; D590-W711 PolarHBondContact OD1-NE1 3.22Å; F593-W711 HydrophobicContact CB-CB 4.33Å; F593-W711 HydrophobicContact CB-CG 4.33Å; F593-W711 HydrophobicContact CD2-CB 3.83Å; F593-W711 AromaticContact CD2-CD1 3.5Å; F593-W711 VanDerWaalsContact CD2-CD1 3.49Å; F593-W711 AromaticContact CD2-CD2 3.48Å; F593-W711 HydrophobicContact CD2-CD2 3.48Å; F593-W711 VanDerWaalsContact CD2-CD2 3.48Å; F593-W711 AromaticContact CD2-CE2 3.75Å; F593-W711 HydrophobicContact CD2-CE3 4.15Å; F593-W711 AromaticContact CD2-CG 3.33Å; F593-W711 HydrophobicContact CD2-CG 3.33Å; F593-W711 AromaticContact CD2-NE1 3.75Å; F593-W711 HydrophobicContact CE2-CB 4.36Å; F593-W711 AromaticContact CE2-CD2 3.53Å; F593-W711 HydrophobicContact CE2-CD2 3.53Å; F593-W711 AromaticContact CE2-CE2 3.9Å; F593-W711 AromaticContact CE2-CE3 3.71Å; F593-W711 HydrophobicContact CE2-CE3 3.71Å; F593-W711 AromaticContact CE2-CG 3.86Å; F593-W711 HydrophobicContact CE2-CG 3.86Å; F593-W711 HydrophobicContact CE2-CZ2 4.39Å; F593-W711 HydrophobicContact CE2-CZ3 4.22Å; F593-W711 HydrophobicContact CG-CB 4.11Å; F593-W711 HydrophobicContact CG-CG 4.04Å; F705-W711 AromaticContact CD1-CE3 3.79Å; F705-W711 HydrophobicContact CD1-CE3 3.79Å; F705-W711 HydrophobicContact CD1-CH2 4.31Å; F705-W711 AromaticContact CD1-CZ3 3.44Å; F705-W711 HydrophobicContact CD1-CZ3 3.44Å; F705-W711 VanDerWaalsContact CD1-CZ3 3.44Å; F705-W711 HydrophobicContact CE1-CE3 4.48Å; F705-W711 HydrophobicContact CE1-CH2 4.36Å; F705-W711 AromaticContact CE1-CZ3 3.93Å; F705-W711 HydrophobicContact CE1-CZ3 3.93Å; F705-W711 HydrophobicContact CG-CZ3 4.24Å; N708-W711 HydrophobicContact CB-CB 4.46Å; N708-W711 HydrophobicContact CB-CD2 3.9Å; N708-W711 HydrophobicContact CB-CE3 3.57Å; N708-W711 HydrophobicContact CB-CG 4.32Å; N708-W711 HydrophobicContact CB-CZ3 4.07Å; N708-W711 WeakPolarHBondContact ND2-CZ2 3.4Å; N708-W711 PolarHBondContact O-N 3.21Å; W711-L713 PolarHBondContact O-N 3.12Å; W711-L713 VanDerWaalsContact O-N 3.14Å; W711-I716 WeakPolarHBondContact O-CD1 3.32Å
712Q85.5Confident86Confident96 Ų9638.4 Ų38.445%0.44922%0.221SC..  trans45.446.6178.3-57.6-169.7-26.700113.3N708 P709 I714 P715 I716N708-Q712 PolarHBondContact O-N 3.49Å; P709-Q712 WeakPolarHBondContact O-CG 3.43Å; Q712-I714 VanDerWaalsContact C-N 3.34Å; Q712-I714 PolarHBondContact O-N 2.77Å; Q712-P715 HydrophobicContact CB-CG 4.35Å; Q712-P715 VanDerWaalsContact O-CD 3.26Å; Q712-P715 WeakPolarHBondContact O-CD 3.39Å; Q712-I716 WeakPolarHBondContact O-CG1 3.38Å; Q712-I716 PolarHBondContact O-N 3.16Å
713L87.1Confident85.7Confident5.66667 Ų5.6666738.3 Ų38.33%0.0322%0.222CC..Hα-helixtrans-63.4-38.9-165.7-170.850.4000113F593 V691 F705 W711 I716 C717 L736 F740F593-L713 HydrophobicContact CD1-CD1 3.77Å; F593-L713 HydrophobicContact CE1-CD1 3.57Å; F593-L713 HydrophobicContact CE1-CD2 3.79Å; F593-L713 HydrophobicContact CE1-CG 4.3Å; F593-L713 HydrophobicContact CZ-CD2 4.03Å; V691-L713 HydrophobicContact CG1-CD2 4.4Å; F705-L713 HydrophobicContact CB-CD2 4.43Å; W711-L713 PolarHBondContact O-N 3.12Å; W711-L713 VanDerWaalsContact O-N 3.14Å; L713-I716 PolarHBondContact O-N 3.18Å; L713-C717 WeakPolarHBondContact O-CB 3.32Å; L713-C717 PolarHBondContact O-N 2.92Å; L713-C717 PolarHBondContact O-SG 3.22Å; L713-L736 HydrophobicContact CD2-CD2 4.44Å; L713-F740 HydrophobicContact CD2-CE1 4.42Å; L713-F740 HydrophobicContact CD2-CE2 3.98Å; L713-F740 HydrophobicContact CD2-CZ 3.45Å; L713-F740 VanDerWaalsContact CD2-CZ 3.45Å; L713-F740 HydrophobicContact CG-CE2 4.1Å; L713-F740 HydrophobicContact CG-CZ 4.08Å
714I88Confident85.4Confident12.3333 Ų12.333339.2 Ų39.26%0.06323%0.226CC..Hα-helixtrans-60.7-55.4178.7-64168.1000111.4I706 Q712 I716 C717 M718 F740 V749 I750 H753I706-I714 HydrophobicContact CG2-CD1 3.91Å; Q712-I714 VanDerWaalsContact C-N 3.34Å; Q712-I714 PolarHBondContact O-N 2.77Å; I714-I716 VanDerWaalsContact C-N 3.28Å; I714-I716 PolarHBondContact O-N 3.1Å; I714-C717 PolarHBondContact O-N 3.08Å; I714-M718 HydrophobicContact CG2-CG 4.33Å; I714-M718 WeakPolarHBondContact O-CB 3.26Å; I714-M718 VanDerWaalsContact O-CG 3.24Å; I714-M718 WeakPolarHBondContact O-CG 3.4Å; I714-M718 PolarHBondContact O-N 3.25Å; I714-F740 HydrophobicContact CG1-CD2 4.38Å; I714-V749 HydrophobicContact CD1-CG1 4.4Å; I714-I750 HydrophobicContact CD1-CD1 4.45Å; I714-I750 HydrophobicContact CD1-CG1 3.84Å; I714-I750 HydrophobicContact CG1-CG1 4.32Å; I714-I750 HydrophobicContact CG2-CG1 4.34Å; I714-H753 HydrophobicContact CG2-CB 4.18Å
715P87.6Confident85.2Confident59.3333 Ų59.333338 Ų3839%0.38522%0.218SC..Hα-helixtrans-54.1-37.8173.5-29.632.5000115Q712 G719Q712-P715 HydrophobicContact CB-CG 4.35Å; Q712-P715 VanDerWaalsContact O-CD 3.26Å; Q712-P715 WeakPolarHBondContact O-CD 3.39Å; P715-G719 PolarHBondContact O-N 3.32Å
716I87.4Confident85.1Confident9.66667 Ų9.6666739.5 Ų39.55%0.0523%0.229CC..Hα-helixtrans-66.9-51.6178.9-68176.4000110.4F596 R597 L600 W711 Q712 L713 I714 M718 G719 F720F596-I716 HydrophobicContact CB-CG2 3.85Å; R597-I716 HydrophobicContact CB-CD1 4.21Å; L600-I716 HydrophobicContact CD1-CG2 4.21Å; L600-I716 WeakPolarHBondContact CD1-O 3.15Å; L600-I716 HydrophobicContact CD2-CG2 4.42Å; W711-I716 WeakPolarHBondContact O-CD1 3.32Å; Q712-I716 WeakPolarHBondContact O-CG1 3.38Å; Q712-I716 PolarHBondContact O-N 3.16Å; L713-I716 PolarHBondContact O-N 3.18Å; I714-I716 VanDerWaalsContact C-N 3.28Å; I714-I716 PolarHBondContact O-N 3.1Å; I716-M718 VanDerWaalsContact C-N 3.33Å; I716-M718 PolarHBondContact O-N 3.12Å; I716-G719 PolarHBondContact O-N 2.98Å; I716-G719 VanDerWaalsContact O-N 3.15Å; I716-F720 HydrophobicContact CG2-CD2 3.83Å; I716-F720 HydrophobicContact CG2-CE2 3.68Å; I716-F720 VanDerWaalsContact O-CD2 3.32Å; I716-F720 WeakPolarHBondContact O-CD2 3.35Å; I716-F720 PolarHBondContact O-N 3.17Å
717C88.2Confident85.2Confident3 Ų339.2 Ų39.22%0.0223%0.228CC..Hα-helixtrans-55.3-47.5176.6-73.20000111.8L713 I714 G719 F720 L721 I733 L736 L737L713-C717 WeakPolarHBondContact O-CB 3.32Å; L713-C717 PolarHBondContact O-N 2.92Å; L713-C717 PolarHBondContact O-SG 3.22Å; I714-C717 PolarHBondContact O-N 3.08Å; C717-G719 VanDerWaalsContact C-N 3.32Å; C717-G719 PolarHBondContact O-N 3.06Å; C717-F720 PolarHBondContact O-N 3Å; C717-L721 WeakPolarHBondContact O-CG 3.37Å; C717-L721 PolarHBondContact O-N 3.19Å; C717-L721 VanDerWaalsContact O-N 3.11Å; C717-I733 HydrophobicContact CB-CG2 3.68Å; C717-L736 VanDerWaalsContact SG-CD2 3.54Å; C717-L737 HydrophobicContact CB-CD2 4.2Å; C717-L737 HydrophobicContact CB-CG 4.5Å
718M86.9Confident85.3Confident5 Ų538.4 Ų38.43%0.02522%0.217CC..Hα-helixtrans-64.1-38.7178.8-66-66.8-147.600112.1I714 I716 F720 L721 T722 L737 I750 H753 F754 S757 L759I714-M718 HydrophobicContact CG2-CG 4.33Å; I714-M718 WeakPolarHBondContact O-CB 3.26Å; I714-M718 VanDerWaalsContact O-CG 3.24Å; I714-M718 WeakPolarHBondContact O-CG 3.4Å; I714-M718 PolarHBondContact O-N 3.25Å; I716-M718 VanDerWaalsContact C-N 3.33Å; I716-M718 PolarHBondContact O-N 3.12Å; M718-F720 PolarHBondContact O-N 3.22Å; M718-L721 PolarHBondContact O-N 3.16Å; M718-L721 HydrophobicContact SD-CD1 4.2Å; M718-T722 PolarHBondContact O-N 2.98Å; M718-L737 HydrophobicContact CE-CD1 3.89Å; M718-L737 HydrophobicContact CE-CD2 4.32Å; M718-L737 HydrophobicContact SD-CD1 4.19Å; M718-I750 HydrophobicContact CE-CG2 3.71Å; M718-I750 WeakPolarHBondContact CE-O 3.4Å; M718-H753 HydrophobicContact CE-CB 4.28Å; M718-H753 HydrophobicContact CG-CB 4.05Å; M718-H753 HydrophobicContact SD-CB 4.45Å; M718-F754 VanDerWaalsContact CE-CA 3.47Å; M718-F754 HydrophobicContact CE-CB 3.97Å; M718-F754 HydrophobicContact CE-CD2 4.05Å; M718-F754 HydrophobicContact CE-CG 4.34Å; M718-F754 HydrophobicContact SD-CB 4.4Å; M718-F754 HydrophobicContact SD-CD2 4.19Å; M718-S757 WeakPolarHBondContact CE-OG 3.28Å; M718-L759 HydrophobicContact CE-CD1 3.59Å; M718-L759 HydrophobicContact SD-CD1 4.06Å
719G84.8Confident85.3Confident5.33333 Ų5.3333336.7 Ų36.76%0.05521%0.207CC..Hα-helixtrans-62.8-4017400000113.2P715 I716 C717 L721 T722 C723P715-G719 PolarHBondContact O-N 3.32Å; I716-G719 PolarHBondContact O-N 2.98Å; I716-G719 VanDerWaalsContact O-N 3.15Å; C717-G719 VanDerWaalsContact C-N 3.32Å; C717-G719 PolarHBondContact O-N 3.06Å; G719-L721 VanDerWaalsContact C-N 3.34Å; G719-L721 PolarHBondContact O-N 3.01Å; G719-T722 PolarHBondContact O-N 3.07Å; G719-T722 PolarHBondContact O-OG1 2.98Å; G719-C723 PolarHBondContact O-N 3.38Å; G719-C723 PolarHBondContact O-SG 3.27Å; G719-C723 VanDerWaalsContact O-SG 3.36Å
720F86Confident85.6Confident2.33333 Ų2.3333332.3 Ų32.31%0.0118%0.178CC..Hα-helixtrans-65.9-34.4176-85.9-70.1000113.2F596 L600 L684 I716 C717 M718 T722 C723 V725 I733F596-F720 HydrophobicContact CB-CE2 4.07Å; F596-F720 HydrophobicContact CD1-CD2 4.43Å; F596-F720 AromaticContact CD1-CE2 3.76Å; F596-F720 HydrophobicContact CD1-CE2 3.76Å; F596-F720 HydrophobicContact CD1-CZ 4.19Å; F596-F720 HydrophobicContact CG-CE2 4.41Å; F596-F720 VanDerWaalsContact O-CE2 3.29Å; F596-F720 WeakPolarHBondContact O-CE2 3.32Å; F596-F720 WeakPolarHBondContact O-CZ 3.19Å; L600-F720 HydrophobicContact CB-CD2 4.36Å; L600-F720 HydrophobicContact CB-CE1 4.31Å; L600-F720 HydrophobicContact CB-CE2 3.8Å; L600-F720 HydrophobicContact CB-CZ 3.79Å; L600-F720 HydrophobicContact CD1-CD1 4.3Å; L600-F720 HydrophobicContact CD1-CD2 4.02Å; L600-F720 HydrophobicContact CD1-CE2 4.25Å; L600-F720 HydrophobicContact CD1-CG 4.22Å; L684-F720 HydrophobicContact CD2-CE1 4.49Å; L684-F720 HydrophobicContact CD2-CZ 4.41Å; I716-F720 HydrophobicContact CG2-CD2 3.83Å; I716-F720 HydrophobicContact CG2-CE2 3.68Å; I716-F720 VanDerWaalsContact O-CD2 3.32Å; I716-F720 WeakPolarHBondContact O-CD2 3.35Å; I716-F720 PolarHBondContact O-N 3.17Å; C717-F720 PolarHBondContact O-N 3Å; M718-F720 PolarHBondContact O-N 3.22Å; F720-T722 VanDerWaalsContact C-N 3.26Å; F720-T722 PolarHBondContact O-N 3.23Å; F720-C723 PolarHBondContact O-N 3Å; F720-C723 VanDerWaalsContact O-N 3.11Å; F720-V725 HydrophobicContact CD1-CG2 4.24Å; F720-I733 HydrophobicContact CB-CD1 3.45Å; F720-I733 VanDerWaalsContact CB-CD1 3.45Å; F720-I733 HydrophobicContact CD2-CD1 4.38Å; F720-I733 HydrophobicContact CG-CD1 4.16Å
721L85.1Confident85.8Confident4 Ų425.8 Ų25.82%0.02115%0.148CC..Hα-helixtrans-63.4-30175.7-67173000112.4C717 M718 G719 C723 K730 I733 L734 L737 L759 L777C717-L721 WeakPolarHBondContact O-CG 3.37Å; C717-L721 PolarHBondContact O-N 3.19Å; C717-L721 VanDerWaalsContact O-N 3.11Å; M718-L721 PolarHBondContact O-N 3.16Å; M718-L721 HydrophobicContact SD-CD1 4.2Å; G719-L721 VanDerWaalsContact C-N 3.34Å; G719-L721 PolarHBondContact O-N 3.01Å; L721-C723 VanDerWaalsContact C-N 3.34Å; L721-K730 HydrophobicContact CD2-CB 4.08Å; L721-K730 HydrophobicContact CD2-CG 4.33Å; L721-I733 HydrophobicContact CD1-CG2 4.19Å; L721-I733 HydrophobicContact CD2-CB 4.3Å; L721-I733 HydrophobicContact CD2-CG2 4.04Å; L721-I733 HydrophobicContact CG-CG2 3.98Å; L721-L734 HydrophobicContact CD1-CD2 3.84Å; L721-L734 HydrophobicContact CD2-CD2 4.14Å; L721-L734 HydrophobicContact CD2-CG 4.18Å; L721-L737 HydrophobicContact CD1-CD1 4.05Å; L721-L759 HydrophobicContact CB-CD1 4.1Å; L721-L759 HydrophobicContact CB-CD2 3.77Å; L721-L759 HydrophobicContact CD1-CD1 3.94Å; L721-L777 HydrophobicContact CD2-CD2 4.46Å
722T82.4Confident85.9Confident74.3333 Ų74.333325.5 Ų25.546%0.45615%0.148SC..Hα-helixtrans-77.8-15.7174.564.70000114.1M718 G719 F720 L759M718-T722 PolarHBondContact O-N 2.98Å; G719-T722 PolarHBondContact O-N 3.07Å; G719-T722 PolarHBondContact O-OG1 2.98Å; F720-T722 VanDerWaalsContact C-N 3.26Å; F720-T722 PolarHBondContact O-N 3.23Å; T722-L759 HydrophobicContact CG2-CD2 3.8Å
723C82.2Confident86.2Confident7.66667 Ų7.6666721 Ų215%0.05213%0.127CC..SBendtrans-88.1155.3-177.8-69.20000112.1M603 G719 F720 L721 V725 K730M603-C723 HydrophobicContact CB-CB 4.29Å; G719-C723 PolarHBondContact O-N 3.38Å; G719-C723 PolarHBondContact O-SG 3.27Å; G719-C723 VanDerWaalsContact O-SG 3.36Å; F720-C723 PolarHBondContact O-N 3Å; F720-C723 VanDerWaalsContact O-N 3.11Å; L721-C723 VanDerWaalsContact C-N 3.34Å; C723-V725 VanDerWaalsContact C-N 3.28Å; C723-V725 HydrophobicContact CB-CG2 3.78Å; C723-V725 PolarHBondContact O-N 3.2Å; C723-K730 VanDerWaalsContact O-CE 3.22Å; C723-K730 WeakPolarHBondContact O-CE 3.38Å; C723-K730 PolarHBondContact O-NZ 3.27Å
724P78.3Confident86.3Confident77.3333 Ų77.333320.7 Ų20.750%0.50213%0.125SC..  trans-75.878.5173.132.1-34.8000110.5M603 Q622 Y628M603-P724 HydrophobicContact CE-CG 4.09Å; M603-P724 WeakPolarHBondContact CE-O 3.39Å; Q622-P724 PolarHBondContact NE2-O 3.03Å; Y628-P724 HydrophobicContact CD1-CB 3.6Å; Y628-P724 HydrophobicContact CD2-CB 4.07Å; Y628-P724 HydrophobicContact CE1-CB 3.64Å; Y628-P724 HydrophobicContact CE2-CB 4.13Å; Y628-P724 HydrophobicContact CG-CB 3.79Å
725V83.6Confident86.2Confident15 Ų1521.6 Ų21.69%0.09113%0.128CC..  trans-111.4160.7177.8-164.60000110M603 I676 F720 C723 L729 K730M603-V725 HydrophobicContact CE-CG2 4.33Å; I676-V725 HydrophobicContact CD1-CG1 4.33Å; F720-V725 HydrophobicContact CD1-CG2 4.24Å; C723-V725 VanDerWaalsContact C-N 3.28Å; C723-V725 HydrophobicContact CB-CG2 3.78Å; C723-V725 PolarHBondContact O-N 3.2Å; V725-L729 HydrophobicContact CB-CD2 4.32Å; V725-L729 HydrophobicContact CG1-CB 3.95Å; V725-L729 HydrophobicContact CG1-CD1 3.79Å; V725-L729 HydrophobicContact CG1-CD2 3.56Å; V725-L729 HydrophobicContact CG1-CG 3.94Å; V725-K730 WeakPolarHBondContact O-CE 3.36Å
726S86.5Confident86.3Confident33.3333 Ų33.333318.7 Ų18.723%0.23311%0.11CC..  trans-54.1147.9176.764.60000113Q681 D728 L729 K730Q681-S726 VanDerWaalsContact NE2-CB 3.31Å; Q681-S726 PolarHBondContact NE2-OG 3.33Å; Q681-S726 PolarHBondContact OE1-OG 3.15Å; S726-D728 VanDerWaalsContact C-N 3.28Å; S726-D728 PolarHBondContact O-N 3.18Å; S726-L729 PolarHBondContact O-N 3.05Å; S726-L729 WeakPolarHBondContact OG-CB 3.25Å; S726-L729 PolarHBondContact OG-N 3.02Å; S726-K730 PolarHBondContact O-N 3.15Å; S726-K730 VanDerWaalsContact O-N 3.14Å
727L85.6Confident86.3Confident30 Ų3018.3 Ų18.316%0.15711%0.107CC..Hα-helixtrans-58.9-41.7-178.4-60.3177.1000111.9L729 K730 A731 D780 V784 E785 A788 P792 L793L727-L729 VanDerWaalsContact C-N 3.32Å; L727-L729 PolarHBondContact O-N 3.28Å; L727-K730 PolarHBondContact O-N 3.14Å; L727-A731 WeakPolarHBondContact O-CB 3.32Å; L727-A731 PolarHBondContact O-N 3.34Å; L727-D780 HydrophobicContact CD2-CB 4.25Å; L727-V784 HydrophobicContact CD1-CG1 3.99Å; L727-V784 HydrophobicContact CD2-CB 4.42Å; L727-V784 HydrophobicContact CD2-CG1 4.18Å; L727-V784 HydrophobicContact CG-CG1 4.39Å; L727-E785 HydrophobicContact CD1-CG 4.09Å; L727-E785 HydrophobicContact CD2-CG 4.38Å; L727-A788 HydrophobicContact CD1-CB 4.38Å; L727-P792 HydrophobicContact CB-CG 4.28Å; L727-L793 HydrophobicContact CD2-CD2 4.27Å
728D86.4Confident86.2Confident70 Ų7018.2 Ų18.237%0.37411%0.107SC..Hα-helixtrans-59.6-42178.2-65.5-36000112.8S726 A731 D732S726-D728 VanDerWaalsContact C-N 3.28Å; S726-D728 PolarHBondContact O-N 3.18Å; D728-A731 WeakPolarHBondContact O-CB 3.46Å; D728-A731 PolarHBondContact O-N 3.18Å; D728-D732 PolarHBondContact O-N 3.09Å
729L87.6Confident86Confident0.666667 Ų0.66666718.5 Ų18.50%0.00311%0.108CC..Hα-helixtrans-70.4-39.4-180-174.9123.2000110.6I676 Q681 L684 Q685 L688 V725 S726 L727 A731 D732 I733I676-L729 HydrophobicContact CD1-CD2 4.48Å; Q681-L729 HydrophobicContact CG-CD1 4.07Å; Q681-L729 HydrophobicContact CG-CD2 4.29Å; L684-L729 HydrophobicContact CB-CD1 4.16Å; L684-L729 HydrophobicContact CD2-CD1 3.63Å; L684-L729 HydrophobicContact CD2-CG 4.36Å; L684-L729 HydrophobicContact CG-CD1 4.04Å; Q685-L729 HydrophobicContact CG-CB 4.34Å; Q685-L729 HydrophobicContact CG-CD1 4.11Å; Q685-L729 HydrophobicContact CG-CG 4.48Å; L688-L729 HydrophobicContact CD1-CD1 3.32Å; L688-L729 HydrophobicContact CD1-CG 4.27Å; V725-L729 HydrophobicContact CB-CD2 4.32Å; V725-L729 HydrophobicContact CG1-CB 3.95Å; V725-L729 HydrophobicContact CG1-CD1 3.79Å; V725-L729 HydrophobicContact CG1-CD2 3.56Å; V725-L729 HydrophobicContact CG1-CG 3.94Å; S726-L729 PolarHBondContact O-N 3.05Å; S726-L729 WeakPolarHBondContact OG-CB 3.25Å; S726-L729 PolarHBondContact OG-N 3.02Å; L727-L729 VanDerWaalsContact C-N 3.32Å; L727-L729 PolarHBondContact O-N 3.28Å; L729-A731 VanDerWaalsContact C-N 3.32Å; L729-A731 PolarHBondContact O-N 3.07Å; L729-D732 PolarHBondContact O-N 3.22Å; L729-I733 HydrophobicContact CD1-CD1 4.45Å; L729-I733 HydrophobicContact CD2-CD1 3.54Å; L729-I733 VanDerWaalsContact CD2-CD1 3.46Å; L729-I733 HydrophobicContact CD2-CG1 4.26Å; L729-I733 HydrophobicContact CG-CD1 4.36Å; L729-I733 WeakPolarHBondContact O-CD1 3.42Å; L729-I733 VanDerWaalsContact O-CG1 3.27Å; L729-I733 WeakPolarHBondContact O-CG1 3.37Å; L729-I733 PolarHBondContact O-N 3.38Å; L729-I733 VanDerWaalsContact O-N 3.09Å
730K89.7Confident86.1Confident9 Ų918.3 Ų18.34%0.03911%0.105CC..Hα-helixtrans-61.2-41.3171.7-68.1-174.6178.6-173.50111.3L721 C723 V725 S726 L727 I733 L734 L777 D780 L793L721-K730 HydrophobicContact CD2-CB 4.08Å; L721-K730 HydrophobicContact CD2-CG 4.33Å; C723-K730 VanDerWaalsContact O-CE 3.22Å; C723-K730 WeakPolarHBondContact O-CE 3.38Å; C723-K730 PolarHBondContact O-NZ 3.27Å; V725-K730 WeakPolarHBondContact O-CE 3.36Å; S726-K730 PolarHBondContact O-N 3.15Å; S726-K730 VanDerWaalsContact O-N 3.14Å; L727-K730 PolarHBondContact O-N 3.14Å; K730-I733 PolarHBondContact O-N 3.16Å; K730-L734 WeakPolarHBondContact O-CG 3.29Å; K730-L734 PolarHBondContact O-N 3.24Å; K730-L777 HydrophobicContact CD-CD2 4.16Å; K730-D780 IonicContact NZ-OD1 2.67Å; K730-D780 IonicContact NZ-OD2 3.78Å; K730-D780 PolarHBondContact NZ-OD2 3.19Å; K730-L793 HydrophobicContact CB-CD1 3.65Å; K730-L793 VanDerWaalsContact CB-CD1 3.46Å
731A87.8Confident86Confident2 Ų218.2 Ų18.22%0.01711%0.105CC..Hα-helixtrans-63.6-47.8176.300000112.3L727 D728 L729 I733 L734 Y735 P792 A796L727-A731 WeakPolarHBondContact O-CB 3.32Å; L727-A731 PolarHBondContact O-N 3.34Å; D728-A731 WeakPolarHBondContact O-CB 3.46Å; D728-A731 PolarHBondContact O-N 3.18Å; L729-A731 VanDerWaalsContact C-N 3.32Å; L729-A731 PolarHBondContact O-N 3.07Å; A731-I733 VanDerWaalsContact C-N 3.26Å; A731-I733 PolarHBondContact O-N 3.16Å; A731-L734 PolarHBondContact O-N 3.17Å; A731-L734 VanDerWaalsContact O-N 3.09Å; A731-Y735 HydrophobicContact CB-CE2 4.38Å; A731-Y735 WeakPolarHBondContact O-CD2 3.26Å; A731-Y735 PolarHBondContact O-N 3.39Å; A731-P792 HydrophobicContact CB-CB 4.06Å; A731-P792 WeakPolarHBondContact CB-O 3.33Å; A731-A796 HydrophobicContact CB-CB 3.9Å; A731-A796 WeakPolarHBondContact O-CB 3.41Å
732D88.1Confident85.6Confident12.6667 Ų12.666719 Ų197%0.06811%0.108CC..Hα-helixtrans-58.8-36.5176.1-74.5-38.5000111.9Q685 L688 R689 D728 L729 Y735 L736Q685-D732 WeakPolarHBondContact CB-OD2 3.37Å; Q685-D732 VanDerWaalsContact CG-OD2 3.28Å; Q685-D732 WeakPolarHBondContact CG-OD2 3.24Å; L688-D732 HydrophobicContact CB-CB 4.36Å; L688-D732 HydrophobicContact CD1-CB 4.06Å; R689-D732 IonicContact CZ-OD1 3.59Å; R689-D732 IonicContact CZ-OD2 2.99Å; R689-D732 VanDerWaalsContact CZ-OD2 3.24Å; R689-D732 IonicContact NE-OD1 3.06Å; R689-D732 PolarHBondContact NE-OD1 3.35Å; R689-D732 IonicContact NE-OD2 3.33Å; R689-D732 PolarHBondContact NE-OD2 3.19Å; R689-D732 VanDerWaalsContact NE-OD2 3.15Å; R689-D732 IonicContact NH2-OD1 2.98Å; R689-D732 PolarHBondContact NH2-OD1 3.14Å; R689-D732 IonicContact NH2-OD2 3.56Å; R689-D732 PolarHBondContact NH2-OD2 3.01Å; D728-D732 PolarHBondContact O-N 3.09Å; L729-D732 PolarHBondContact O-N 3.22Å; D732-Y735 PolarHBondContact O-N 3.18Å; D732-L736 WeakPolarHBondContact O-CB 3.45Å; D732-L736 PolarHBondContact O-N 3.23Å
733I90.5Very high85.5Confident1.66667 Ų1.6666716.6 Ų16.61%0.00910%0.095CC..Hα-helixtrans-65.5-44.6173.5-69.5169.3000111.5L688 C717 F720 L721 L729 K730 A731 Y735 L736 L737L688-I733 HydrophobicContact CD1-CG1 3.73Å; L688-I733 HydrophobicContact CD2-CG1 4.39Å; C717-I733 HydrophobicContact CB-CG2 3.68Å; F720-I733 HydrophobicContact CB-CD1 3.45Å; F720-I733 VanDerWaalsContact CB-CD1 3.45Å; F720-I733 HydrophobicContact CD2-CD1 4.38Å; F720-I733 HydrophobicContact CG-CD1 4.16Å; L721-I733 HydrophobicContact CD1-CG2 4.19Å; L721-I733 HydrophobicContact CD2-CB 4.3Å; L721-I733 HydrophobicContact CD2-CG2 4.04Å; L721-I733 HydrophobicContact CG-CG2 3.98Å; L729-I733 HydrophobicContact CD1-CD1 4.45Å; L729-I733 HydrophobicContact CD2-CD1 3.54Å; L729-I733 VanDerWaalsContact CD2-CD1 3.46Å; L729-I733 HydrophobicContact CD2-CG1 4.26Å; L729-I733 HydrophobicContact CG-CD1 4.36Å; L729-I733 WeakPolarHBondContact O-CD1 3.42Å; L729-I733 VanDerWaalsContact O-CG1 3.27Å; L729-I733 WeakPolarHBondContact O-CG1 3.37Å; L729-I733 PolarHBondContact O-N 3.38Å; L729-I733 VanDerWaalsContact O-N 3.09Å; K730-I733 PolarHBondContact O-N 3.16Å; A731-I733 VanDerWaalsContact C-N 3.26Å; A731-I733 PolarHBondContact O-N 3.16Å; I733-Y735 VanDerWaalsContact C-N 3.32Å; I733-Y735 PolarHBondContact O-N 3.39Å; I733-L736 WeakPolarHBondContact O-CB 3.3Å; I733-L736 PolarHBondContact O-N 2.93Å; I733-L737 HydrophobicContact CG2-CD1 4.31Å; I733-L737 HydrophobicContact CG2-CG 4.39Å; I733-L737 WeakPolarHBondContact O-CG 3.39Å; I733-L737 PolarHBondContact O-N 3.23Å
734L89.2Confident85.2Confident0 Ų020.7 Ų20.70%011%0.114CC..Hα-helixtrans-63.5-39.5177.5-69179000111.5L721 K730 A731 L736 L737 T738 L793 A796 F797 L800L721-L734 HydrophobicContact CD1-CD2 3.84Å; L721-L734 HydrophobicContact CD2-CD2 4.14Å; L721-L734 HydrophobicContact CD2-CG 4.18Å; K730-L734 WeakPolarHBondContact O-CG 3.29Å; K730-L734 PolarHBondContact O-N 3.24Å; A731-L734 PolarHBondContact O-N 3.17Å; A731-L734 VanDerWaalsContact O-N 3.09Å; L734-L736 VanDerWaalsContact C-N 3.31Å; L734-L736 PolarHBondContact O-N 3.39Å; L734-L737 HydrophobicContact CD2-CD1 4.38Å; L734-L737 WeakPolarHBondContact O-CB 3.37Å; L734-L737 PolarHBondContact O-N 3.26Å; L734-L737 VanDerWaalsContact O-N 3.17Å; L734-T738 WeakPolarHBondContact O-CB 3.45Å; L734-T738 PolarHBondContact O-N 3.43Å; L734-T738 PolarHBondContact O-OG1 3.12Å; L734-L793 HydrophobicContact CD1-CD1 3.63Å; L734-A796 HydrophobicContact CB-CB 3.74Å; L734-A796 HydrophobicContact CD1-CB 4.13Å; L734-F797 HydrophobicContact CD1-CB 4.11Å; L734-L800 HydrophobicContact CD2-CD2 3.82Å
735Y87.3Confident85.3Confident30.3333 Ų30.333324.5 Ų24.512%0.11912%0.124CC..Hα-helixtrans-62.2-41.2172.7-71.7-58.3000112.2A731 D732 I733 L737 T738 E739 A796 T799 R1269A731-Y735 HydrophobicContact CB-CE2 4.38Å; A731-Y735 WeakPolarHBondContact O-CD2 3.26Å; A731-Y735 PolarHBondContact O-N 3.39Å; D732-Y735 PolarHBondContact O-N 3.18Å; I733-Y735 VanDerWaalsContact C-N 3.32Å; I733-Y735 PolarHBondContact O-N 3.39Å; Y735-L737 PolarHBondContact O-N 3.18Å; Y735-T738 VanDerWaalsContact O-CB 3.29Å; Y735-T738 WeakPolarHBondContact O-CB 3.27Å; Y735-T738 PolarHBondContact O-N 3.18Å; Y735-T738 VanDerWaalsContact O-N 3.14Å; Y735-E739 PolarHBondContact O-N 3.21Å; Y735-A796 HydrophobicContact CD1-CB 4.3Å; Y735-A796 HydrophobicContact CD2-CB 3.93Å; Y735-A796 HydrophobicContact CE1-CB 3.99Å; Y735-A796 HydrophobicContact CE2-CB 3.58Å; Y735-A796 HydrophobicContact CG-CB 4.26Å; Y735-A796 PolarHBondContact OH-N 2.99Å; Y735-T799 HydrophobicContact CD1-CG2 3.94Å; Y735-T799 HydrophobicContact CE1-CG2 4.15Å; Y735-T799 WeakPolarHBondContact CE1-OG1 3.34Å; Y735-R1269 HydrophobicContact CE1-CB 4.28Å; Y735-R1269 HydrophobicContact CE1-CG 3.89Å; Y735-R1269 WeakPolarHBondContact OH-CD 3.25Å; Y735-R1269 PolarHBondContact OH-NE 3.48Å
736L88.1Confident85.2Confident0.333333 Ų0.33333324.8 Ų24.80%0.00213%0.126CC..Hα-helixtrans-62.7-42.1174.8178.385.1000112L688 V691 A692 L713 C717 D732 I733 L734 T738 E739 F740L688-L736 HydrophobicContact CD2-CD1 4.14Å; L688-L736 HydrophobicContact CD2-CD2 3.71Å; V691-L736 HydrophobicContact CB-CD1 4.02Å; V691-L736 HydrophobicContact CG1-CD1 3.67Å; V691-L736 HydrophobicContact CG1-CD2 4.48Å; A692-L736 HydrophobicContact CB-CB 4.46Å; A692-L736 HydrophobicContact CB-CD1 4.01Å; L713-L736 HydrophobicContact CD2-CD2 4.44Å; C717-L736 VanDerWaalsContact SG-CD2 3.54Å; D732-L736 WeakPolarHBondContact O-CB 3.45Å; D732-L736 PolarHBondContact O-N 3.23Å; I733-L736 WeakPolarHBondContact O-CB 3.3Å; I733-L736 PolarHBondContact O-N 2.93Å; L734-L736 VanDerWaalsContact C-N 3.31Å; L734-L736 PolarHBondContact O-N 3.39Å; L736-T738 VanDerWaalsContact C-N 3.29Å; L736-T738 PolarHBondContact O-N 3.02Å; L736-E739 PolarHBondContact O-N 3.33Å; L736-F740 HydrophobicContact CD1-CD1 4.45Å; L736-F740 HydrophobicContact CD1-CE1 3.68Å; L736-F740 HydrophobicContact CD1-CE2 4.24Å; L736-F740 HydrophobicContact CD1-CZ 3.81Å; L736-F740 VanDerWaalsContact CD1-CZ 3.49Å; L736-F740 HydrophobicContact CD2-CD2 4.26Å; L736-F740 HydrophobicContact CD2-CE2 3.92Å; L736-F740 HydrophobicContact CD2-CZ 3.85Å; L736-F740 HydrophobicContact CG-CE1 4.16Å; L736-F740 HydrophobicContact CG-CE2 3.84Å; L736-F740 HydrophobicContact CG-CZ 3.64Å; L736-F740 WeakPolarHBondContact O-CD2 3.42Å; L736-F740 WeakPolarHBondContact O-CG 3.44Å; L736-F740 PolarHBondContact O-N 3.19Å; L736-F740 VanDerWaalsContact O-N 3.11Å
737L89Confident85Confident0 Ų023.3 Ų23.30%012%0.115CC..Hα-helixtrans-62.7-36.5173.2-69.1175.3000111.8C717 M718 L721 I733 L734 Y735 E739 F740 C741 I750 L800C717-L737 HydrophobicContact CB-CD2 4.2Å; C717-L737 HydrophobicContact CB-CG 4.5Å; M718-L737 HydrophobicContact CE-CD1 3.89Å; M718-L737 HydrophobicContact CE-CD2 4.32Å; M718-L737 HydrophobicContact SD-CD1 4.19Å; L721-L737 HydrophobicContact CD1-CD1 4.05Å; I733-L737 HydrophobicContact CG2-CD1 4.31Å; I733-L737 HydrophobicContact CG2-CG 4.39Å; I733-L737 WeakPolarHBondContact O-CG 3.39Å; I733-L737 PolarHBondContact O-N 3.23Å; L734-L737 HydrophobicContact CD2-CD1 4.38Å; L734-L737 WeakPolarHBondContact O-CB 3.37Å; L734-L737 PolarHBondContact O-N 3.26Å; L734-L737 VanDerWaalsContact O-N 3.17Å; Y735-L737 PolarHBondContact O-N 3.18Å; L737-E739 VanDerWaalsContact C-N 3.35Å; L737-E739 PolarHBondContact O-N 3.43Å; L737-F740 HydrophobicContact CD2-CD2 4.16Å; L737-F740 HydrophobicContact CD2-CE2 4.45Å; L737-F740 WeakPolarHBondContact O-CB 3.43Å; L737-F740 PolarHBondContact O-N 3.14Å; L737-C741 PolarHBondContact O-N 2.99Å; L737-C741 PolarHBondContact O-SG 3.33Å; L737-I750 HydrophobicContact CD2-CG2 4.44Å; L737-L800 HydrophobicContact CB-CD1 4.05Å
738T85.2Confident84.8Confident1.33333 Ų1.3333323.9 Ų23.91%0.00812%0.12CC..Hα-helixtrans-61.9-44.1175.1-55.20000111.2L734 Y735 L736 F740 C741 K742 T799 L800 V803 F1253L734-T738 WeakPolarHBondContact O-CB 3.45Å; L734-T738 PolarHBondContact O-N 3.43Å; L734-T738 PolarHBondContact O-OG1 3.12Å; Y735-T738 VanDerWaalsContact O-CB 3.29Å; Y735-T738 WeakPolarHBondContact O-CB 3.27Å; Y735-T738 PolarHBondContact O-N 3.18Å; Y735-T738 VanDerWaalsContact O-N 3.14Å; L736-T738 VanDerWaalsContact C-N 3.29Å; L736-T738 PolarHBondContact O-N 3.02Å; T738-F740 VanDerWaalsContact C-N 3.29Å; T738-F740 PolarHBondContact O-N 3.05Å; T738-C741 WeakPolarHBondContact O-CB 3.26Å; T738-C741 PolarHBondContact O-N 3.17Å; T738-C741 VanDerWaalsContact O-N 3.17Å; T738-K742 PolarHBondContact O-N 2.83Å; T738-T799 HydrophobicContact CG2-CG2 3.79Å; T738-T799 VanDerWaalsContact CG2-O 3.28Å; T738-T799 WeakPolarHBondContact CG2-O 3.33Å; T738-L800 VanDerWaalsContact OG1-CA 3.31Å; T738-L800 WeakPolarHBondContact OG1-CA 3.35Å; T738-L800 WeakPolarHBondContact OG1-CB 3.35Å; T738-L800 PolarHBondContact OG1-N 3.26Å; T738-V803 HydrophobicContact CG2-CB 4.15Å; T738-V803 HydrophobicContact CG2-CG1 4.31Å; T738-V803 HydrophobicContact CG2-CG2 3.72Å; T738-F1253 HydrophobicContact CG2-CD1 4.27Å; T738-F1253 HydrophobicContact CG2-CE1 3.44Å; T738-F1253 VanDerWaalsContact CG2-CE1 3.44Å; T738-F1253 HydrophobicContact CG2-CZ 4.17Å
739E83.2Confident84.8Confident11.6667 Ų11.666723.7 Ų23.76%0.05512%0.122CC..Hα-helixtrans-63.3-32.9175.6-67.7-62.915700112.2A692 C695 R696 R702 Y735 L736 L737 K742A692-E739 HydrophobicContact CB-CG 4.37Å; C695-E739 HydrophobicContact CB-CB 4.33Å; R696-E739 VanDerWaalsContact CA-OE2 3.29Å; R696-E739 WeakPolarHBondContact CA-OE2 3.29Å; R696-E739 HydrophobicContact CB-CG 4.45Å; R696-E739 VanDerWaalsContact CB-OE2 3.29Å; R696-E739 WeakPolarHBondContact CB-OE2 3.33Å; R696-E739 WeakPolarHBondContact CG-OE2 3.17Å; R696-E739 IonicContact CZ-OE1 2.93Å; R696-E739 IonicContact NE-OE1 2.74Å; R696-E739 IonicContact NH1-OE1 3.38Å; R696-E739 PolarHBondContact NH1-OE1 3.07Å; R702-E739 VanDerWaalsContact CD-O 3.25Å; R702-E739 WeakPolarHBondContact CD-O 3.32Å; R702-E739 PolarHBondContact NE-O 3.18Å; Y735-E739 PolarHBondContact O-N 3.21Å; L736-E739 PolarHBondContact O-N 3.33Å; L737-E739 VanDerWaalsContact C-N 3.35Å; L737-E739 PolarHBondContact O-N 3.43Å; E739-K742 VanDerWaalsContact CD-NZ 3.32Å; E739-K742 WeakPolarHBondContact O-CB 3.42Å; E739-K742 PolarHBondContact O-N 3.3Å; E739-K742 IonicContact OE1-NZ 3.17Å; E739-K742 PolarHBondContact OE1-NZ 2.86Å; E739-K742 VanDerWaalsContact OE1-NZ 3.12Å; E739-K742 VanDerWaalsContact OE2-CD 3.26Å; E739-K742 WeakPolarHBondContact OE2-CD 3.46Å; E739-K742 VanDerWaalsContact OE2-CE 3.23Å; E739-K742 WeakPolarHBondContact OE2-CE 3.42Å; E739-K742 IonicContact OE2-NZ 3.22Å; E739-K742 PolarHBondContact OE2-NZ 3.33Å
740F87.2Confident84.6Confident0 Ų023.7 Ų23.70%012%0.122CC..Hα-helixtrans-69.4-38.4172.6-62.4-24.5000113.4C695 R702 F705 I706 L713 I714 L736 L737 T738 K742 S743 N746 I750C695-F740 HydrophobicContact CB-CE1 4.45Å; R702-F740 HydrophobicContact CG-CD1 4.3Å; F705-F740 HydrophobicContact CB-CE1 4.4Å; I706-F740 HydrophobicContact CD1-CB 3.7Å; I706-F740 HydrophobicContact CD1-CD1 3.67Å; I706-F740 HydrophobicContact CD1-CD2 4.43Å; I706-F740 HydrophobicContact CD1-CE1 4.43Å; I706-F740 HydrophobicContact CD1-CG 3.69Å; I706-F740 HydrophobicContact CG1-CB 4.44Å; I706-F740 HydrophobicContact CG1-CD1 3.94Å; I706-F740 HydrophobicContact CG1-CD2 4.4Å; I706-F740 HydrophobicContact CG1-CE1 4.23Å; I706-F740 HydrophobicContact CG1-CG 4.05Å; L713-F740 HydrophobicContact CD2-CE1 4.42Å; L713-F740 HydrophobicContact CD2-CE2 3.98Å; L713-F740 HydrophobicContact CD2-CZ 3.45Å; L713-F740 VanDerWaalsContact CD2-CZ 3.45Å; L713-F740 HydrophobicContact CG-CE2 4.1Å; L713-F740 HydrophobicContact CG-CZ 4.08Å; I714-F740 HydrophobicContact CG1-CD2 4.38Å; L736-F740 HydrophobicContact CD1-CD1 4.45Å; L736-F740 HydrophobicContact CD1-CE1 3.68Å; L736-F740 HydrophobicContact CD1-CE2 4.24Å; L736-F740 HydrophobicContact CD1-CZ 3.81Å; L736-F740 VanDerWaalsContact CD1-CZ 3.49Å; L736-F740 HydrophobicContact CD2-CD2 4.26Å; L736-F740 HydrophobicContact CD2-CE2 3.92Å; L736-F740 HydrophobicContact CD2-CZ 3.85Å; L736-F740 HydrophobicContact CG-CE1 4.16Å; L736-F740 HydrophobicContact CG-CE2 3.84Å; L736-F740 HydrophobicContact CG-CZ 3.64Å; L736-F740 WeakPolarHBondContact O-CD2 3.42Å; L736-F740 WeakPolarHBondContact O-CG 3.44Å; L736-F740 PolarHBondContact O-N 3.19Å; L736-F740 VanDerWaalsContact O-N 3.11Å; L737-F740 HydrophobicContact CD2-CD2 4.16Å; L737-F740 HydrophobicContact CD2-CE2 4.45Å; L737-F740 WeakPolarHBondContact O-CB 3.43Å; L737-F740 PolarHBondContact O-N 3.14Å; T738-F740 VanDerWaalsContact C-N 3.29Å; T738-F740 PolarHBondContact O-N 3.05Å; F740-K742 PolarHBondContact O-N 3.2Å; F740-S743 PolarHBondContact O-N 3.11Å; F740-N746 PolarHBondContact O-ND2 3.18Å; F740-I750 HydrophobicContact CB-CD1 3.77Å
741C83.9Confident84.4Confident0 Ų024.2 Ų24.20%012%0.123CC..Hα-helixtrans-66.8-12.2177.8-68.90000113.7L737 T738 S743 I747 I750 V803 M804 K807L737-C741 PolarHBondContact O-N 2.99Å; L737-C741 PolarHBondContact O-SG 3.33Å; T738-C741 WeakPolarHBondContact O-CB 3.26Å; T738-C741 PolarHBondContact O-N 3.17Å; T738-C741 VanDerWaalsContact O-N 3.17Å; C741-S743 VanDerWaalsContact C-N 3.31Å; C741-S743 PolarHBondContact O-N 3.31Å; C741-I747 HydrophobicContact CB-CG1 4.12Å; C741-I747 WeakPolarHBondContact O-CD1 3.3Å; C741-I747 WeakPolarHBondContact O-CG1 3.34Å; C741-I750 WeakPolarHBondContact SG-CD1 3.24Å; C741-V803 HydrophobicContact CB-CG1 3.61Å; C741-M804 HydrophobicContact CB-CG 3.95Å; C741-M804 WeakPolarHBondContact SG-CG 3.18Å; C741-K807 PolarHBondContact O-NZ 2.96Å
742K76.3Confident84.1Confident20.6667 Ų20.666730.7 Ų30.79%0.0915%0.153CC..THydrogen-bonded Turntrans-60.9-37172.1-70.7-175.4176.4171.80112.3R696 T738 E739 F740 Q744 K807 F1253 A1271 L1274R696-K742 VanDerWaalsContact CZ-NZ 3.27Å; T738-K742 PolarHBondContact O-N 2.83Å; E739-K742 VanDerWaalsContact CD-NZ 3.32Å; E739-K742 WeakPolarHBondContact O-CB 3.42Å; E739-K742 PolarHBondContact O-N 3.3Å; E739-K742 IonicContact OE1-NZ 3.17Å; E739-K742 PolarHBondContact OE1-NZ 2.86Å; E739-K742 VanDerWaalsContact OE1-NZ 3.12Å; E739-K742 VanDerWaalsContact OE2-CD 3.26Å; E739-K742 WeakPolarHBondContact OE2-CD 3.46Å; E739-K742 VanDerWaalsContact OE2-CE 3.23Å; E739-K742 WeakPolarHBondContact OE2-CE 3.42Å; E739-K742 IonicContact OE2-NZ 3.22Å; E739-K742 PolarHBondContact OE2-NZ 3.33Å; F740-K742 PolarHBondContact O-N 3.2Å; K742-Q744 PolarHBondContact O-N 3.21Å; K742-K807 PolarHBondContact O-NZ 3.23Å; K742-F1253 VanDerWaalsContact CE-CE2 3.47Å; K742-F1253 VanDerWaalsContact CE-CZ 3.41Å; K742-A1271 PolarHBondContact NZ-O 2.97Å; K742-L1274 HydrophobicContact CG-CG 4.38Å
743S79.8Confident83.8Confident25.3333 Ų25.333333 Ų3318%0.17716%0.164CC..SBendtrans-82116.2168.6-157.10000109.7R702 F740 C741 Q745 N746R702-S743 PolarHBondContact NH1-OG 2.94Å; F740-S743 PolarHBondContact O-N 3.11Å; C741-S743 VanDerWaalsContact C-N 3.31Å; C741-S743 PolarHBondContact O-N 3.31Å; S743-Q745 VanDerWaalsContact C-N 3.27Å; S743-Q745 PolarHBondContact O-N 3.16Å; S743-Q745 VanDerWaalsContact O-N 3.1Å; S743-N746 VanDerWaalsContact CB-ND2 3.34Å; S743-N746 WeakPolarHBondContact CB-ND2 3.36Å; S743-N746 PolarHBondContact O-N 3.45Å; S743-N746 VanDerWaalsContact O-N 3.1Å; S743-N746 PolarHBondContact O-ND2 3.06Å; S743-N746 PolarHBondContact OG-ND2 2.88Å
744Q76.8Confident83.3Confident94.3333 Ų94.333333.3 Ų33.344%0.44117%0.165SC..G310 helixtrans-60.3-28.9-169.7-144.3178.71.500113.6K742 N746 I747 K807 Y811K742-Q744 PolarHBondContact O-N 3.21Å; Q744-N746 VanDerWaalsContact C-N 3.27Å; Q744-N746 PolarHBondContact O-N 3.19Å; Q744-I747 HydrophobicContact CG-CD1 4.44Å; Q744-I747 PolarHBondContact O-N 3.07Å; Q744-K807 HydrophobicContact CG-CD 4.21Å; Q744-Y811 HydrophobicContact CG-CE2 4.4Å
745Q80Confident82.8Confident155.667 Ų155.66736.3 Ų36.373%0.72718%0.183SC*.G310 helixtrans-64.1-25.8-178.9-61177.93.100113.1S743S743-Q745 VanDerWaalsContact C-N 3.27Å; S743-Q745 PolarHBondContact O-N 3.16Å; S743-Q745 VanDerWaalsContact O-N 3.1Å
746N80.7Confident82.3Confident22.3333 Ų22.333338.7 Ų38.712%0.11920%0.204CC..G310 helixtrans-84.9-21.2-175.3-57-40.4000113.4I706 F740 S743 Q744 V749 I750I706-N746 HydrophobicContact CD1-CB 4.31Å; I706-N746 VanDerWaalsContact CD1-CG 3.42Å; I706-N746 WeakPolarHBondContact CD1-ND2 3.42Å; F740-N746 PolarHBondContact O-ND2 3.18Å; S743-N746 VanDerWaalsContact CB-ND2 3.34Å; S743-N746 WeakPolarHBondContact CB-ND2 3.36Å; S743-N746 PolarHBondContact O-N 3.45Å; S743-N746 VanDerWaalsContact O-N 3.1Å; S743-N746 PolarHBondContact O-ND2 3.06Å; S743-N746 PolarHBondContact OG-ND2 2.88Å; Q744-N746 VanDerWaalsContact C-N 3.27Å; Q744-N746 PolarHBondContact O-N 3.19Å; N746-V749 PolarHBondContact O-N 3.22Å; N746-I750 HydrophobicContact CB-CD1 4.02Å; N746-I750 WeakPolarHBondContact O-CG1 3.42Å; N746-I750 PolarHBondContact O-N 3.12Å
747I82.7Confident81.6Confident1.33333 Ų1.3333340.2 Ų40.21%0.00722%0.215CC..Hα-helixtrans-57.8-48.1-170.9-64.4174.6000112.8C741 Q744 V749 I750 W751 M804 K807 L808C741-I747 HydrophobicContact CB-CG1 4.12Å; C741-I747 WeakPolarHBondContact O-CD1 3.3Å; C741-I747 WeakPolarHBondContact O-CG1 3.34Å; Q744-I747 HydrophobicContact CG-CD1 4.44Å; Q744-I747 PolarHBondContact O-N 3.07Å; I747-V749 VanDerWaalsContact C-N 3.31Å; I747-V749 PolarHBondContact O-N 2.98Å; I747-I750 PolarHBondContact O-N 3.05Å; I747-W751 VanDerWaalsContact O-CB 3.31Å; I747-W751 WeakPolarHBondContact O-CB 3.4Å; I747-W751 PolarHBondContact O-N 3.28Å; I747-M804 HydrophobicContact CG2-CE 4.48Å; I747-M804 HydrophobicContact CG2-CG 3.9Å; I747-K807 HydrophobicContact CD1-CB 3.68Å; I747-K807 HydrophobicContact CD1-CD 3.26Å; I747-K807 HydrophobicContact CD1-CG 4.1Å; I747-L808 HydrophobicContact CG2-CD1 4.28Å; I747-L808 HydrophobicContact CG2-CD2 3.55Å; I747-L808 VanDerWaalsContact CG2-CD2 3.42Å; I747-L808 HydrophobicContact CG2-CG 3.55Å; I747-L808 VanDerWaalsContact CG2-CG 3.48Å
748P82.2Confident80.8Confident42.3333 Ų42.333344.1 Ų44.128%0.27523%0.233SC..Hα-helixtrans-63.3-36.2179.9-7.313000112.9W751 Q752 Y811P748-W751 PolarHBondContact O-N 3.17Å; P748-Q752 WeakPolarHBondContact O-CB 3.44Å; P748-Q752 PolarHBondContact O-N 3.08Å; P748-Y811 HydrophobicContact CG-CD1 4.08Å; P748-Y811 HydrophobicContact CG-CE1 3.89Å; P748-Y811 HydrophobicContact CG-CE2 4.35Å; P748-Y811 HydrophobicContact CG-CG 4.39Å
749V84.6Confident80.1Confident66.3333 Ų66.333344.3 Ų44.340%0.40223%0.234SC..Hα-helixtrans-68-46.9179.1179.90000110.6I714 N746 I747 W751 Q752 H753I714-V749 HydrophobicContact CD1-CG1 4.4Å; N746-V749 PolarHBondContact O-N 3.22Å; I747-V749 VanDerWaalsContact C-N 3.31Å; I747-V749 PolarHBondContact O-N 2.98Å; V749-W751 VanDerWaalsContact C-N 3.32Å; V749-W751 PolarHBondContact O-N 3.1Å; V749-Q752 PolarHBondContact O-N 3.22Å; V749-H753 PolarHBondContact O-CD2 3.25Å; V749-H753 VanDerWaalsContact O-CD2 3.24Å; V749-H753 PolarHBondContact O-N 3.25Å; V749-H753 VanDerWaalsContact O-N 3.09Å
750I85.1Confident79.4Confident0 Ų043.9 Ų43.90%023%0.232CC..Hα-helixtrans-62.3-43.1176.9-66.2168.7000110I714 M718 L737 F740 C741 N746 I747 H753 F754 M804I714-I750 HydrophobicContact CD1-CD1 4.45Å; I714-I750 HydrophobicContact CD1-CG1 3.84Å; I714-I750 HydrophobicContact CG1-CG1 4.32Å; I714-I750 HydrophobicContact CG2-CG1 4.34Å; M718-I750 HydrophobicContact CE-CG2 3.71Å; M718-I750 WeakPolarHBondContact CE-O 3.4Å; L737-I750 HydrophobicContact CD2-CG2 4.44Å; F740-I750 HydrophobicContact CB-CD1 3.77Å; C741-I750 WeakPolarHBondContact SG-CD1 3.24Å; N746-I750 HydrophobicContact CB-CD1 4.02Å; N746-I750 WeakPolarHBondContact O-CG1 3.42Å; N746-I750 PolarHBondContact O-N 3.12Å; I747-I750 PolarHBondContact O-N 3.05Å; I750-H753 PolarHBondContact O-N 3.19Å; I750-F754 VanDerWaalsContact O-CB 3.32Å; I750-F754 WeakPolarHBondContact O-CB 3.45Å; I750-F754 PolarHBondContact O-N 3.25Å; I750-M804 HydrophobicContact CB-CE 4.33Å; I750-M804 HydrophobicContact CG2-CE 3.85Å; I750-M804 HydrophobicContact CG2-SD 4.22Å
751W83.7Confident78.1Confident19.6667 Ų19.666745.2 Ų45.27%0.07424%0.24CC..Hα-helixtrans-62.5-44.8177.4-177.1-113.9000112.9I747 P748 V749 H753 F754 V755 M804 L808 P846 F847 I850I747-W751 VanDerWaalsContact O-CB 3.31Å; I747-W751 WeakPolarHBondContact O-CB 3.4Å; I747-W751 PolarHBondContact O-N 3.28Å; P748-W751 PolarHBondContact O-N 3.17Å; V749-W751 VanDerWaalsContact C-N 3.32Å; V749-W751 PolarHBondContact O-N 3.1Å; W751-H753 VanDerWaalsContact C-N 3.3Å; W751-H753 PolarHBondContact O-N 3.22Å; W751-F754 HydrophobicContact CE3-CB 4.5Å; W751-F754 HydrophobicContact CE3-CD1 4.3Å; W751-F754 AromaticContact CZ3-CD1 3.99Å; W751-F754 HydrophobicContact CZ3-CD1 4.05Å; W751-F754 HydrophobicContact CZ3-CE1 4.45Å; W751-F754 WeakPolarHBondContact O-CB 3.29Å; W751-F754 PolarHBondContact O-N 2.97Å; W751-F754 VanDerWaalsContact O-N 3.12Å; W751-V755 HydrophobicContact CD2-CG2 4.18Å; W751-V755 HydrophobicContact CZ2-CG2 4.03Å; W751-V755 WeakPolarHBondContact O-CG2 3.4Å; W751-V755 PolarHBondContact O-N 3.21Å; W751-M804 HydrophobicContact CB-CE 4.08Å; W751-M804 HydrophobicContact CE3-CE 3.52Å; W751-M804 HydrophobicContact CE3-SD 3.96Å; W751-M804 HydrophobicContact CZ3-CE 3.49Å; W751-M804 VanDerWaalsContact CZ3-CE 3.44Å; W751-L808 HydrophobicContact CB-CD1 4.01Å; W751-L808 HydrophobicContact CB-CD2 3.95Å; W751-L808 HydrophobicContact CD2-CD1 3.49Å; W751-L808 VanDerWaalsContact CD2-CD1 3.47Å; W751-L808 HydrophobicContact CD2-CD2 4.48Å; W751-L808 HydrophobicContact CE3-CD1 3.61Å; W751-L808 HydrophobicContact CG-CD1 3.69Å; W751-L808 HydrophobicContact CG-CD2 3.95Å; W751-L808 HydrophobicContact CG-CG 4.47Å; W751-L808 HydrophobicContact CZ3-CD1 4.24Å; W751-P846 HydrophobicContact CH2-CB 4.42Å; W751-P846 HydrophobicContact CZ2-CB 4.24Å; W751-P846 HydrophobicContact CZ2-CG 4.2Å; W751-F847 HydrophobicContact CD2-CE1 4.46Å; W751-F847 AromaticContact CE2-CE1 3.72Å; W751-F847 AromaticContact CE2-CZ 3.89Å; W751-F847 HydrophobicContact CH2-CD1 4.1Å; W751-F847 AromaticContact CH2-CE1 3.78Å; W751-F847 HydrophobicContact CH2-CE1 3.78Å; W751-F847 AromaticContact CZ2-CD1 3.91Å; W751-F847 HydrophobicContact CZ2-CD1 3.91Å; W751-F847 AromaticContact CZ2-CE1 3.31Å; W751-F847 HydrophobicContact CZ2-CE1 3.31Å; W751-F847 AromaticContact CZ2-CZ 3.84Å; W751-F847 HydrophobicContact CZ2-CZ 3.92Å; W751-F847 HydrophobicContact CZ3-CE1 4.46Å; W751-F847 AromaticContact NE1-CZ 3.95Å; W751-I850 HydrophobicContact CH2-CD1 3.55Å; W751-I850 VanDerWaalsContact CH2-CD1 3.49Å; W751-I850 HydrophobicContact CZ3-CD1 4.1Å
752Q82.4Confident77.1Confident138.333 Ų138.33348.1 Ų48.165%0.64625%0.253SS*.Hα-helixtrans-59.3-42.9175.9-176-179.5-3.300111.3P748 V749 F754 S756P748-Q752 WeakPolarHBondContact O-CB 3.44Å; P748-Q752 PolarHBondContact O-N 3.08Å; V749-Q752 PolarHBondContact O-N 3.22Å; Q752-F754 VanDerWaalsContact C-N 3.33Å; Q752-S756 VanDerWaalsContact O-CB 3.31Å; Q752-S756 WeakPolarHBondContact O-CB 3.34Å; Q752-S756 PolarHBondContact O-N 3.24Å; Q752-S756 PolarHBondContact O-OG 2.79Å
753H81.2Confident76.1Confident61.6667 Ų61.666748.2 Ų48.229%0.28526%0.256SS..Hα-helixtrans-66-37.6174.6-79.9-64.8000112.9I714 M718 V749 I750 W751 S756 S757I714-H753 HydrophobicContact CG2-CB 4.18Å; M718-H753 HydrophobicContact CE-CB 4.28Å; M718-H753 HydrophobicContact CG-CB 4.05Å; M718-H753 HydrophobicContact SD-CB 4.45Å; V749-H753 PolarHBondContact O-CD2 3.25Å; V749-H753 VanDerWaalsContact O-CD2 3.24Å; V749-H753 PolarHBondContact O-N 3.25Å; V749-H753 VanDerWaalsContact O-N 3.09Å; I750-H753 PolarHBondContact O-N 3.19Å; W751-H753 VanDerWaalsContact C-N 3.3Å; W751-H753 PolarHBondContact O-N 3.22Å; H753-S756 VanDerWaalsContact CA-OG 3.3Å; H753-S756 WeakPolarHBondContact CA-OG 3.22Å; H753-S756 PolarHBondContact O-N 3.22Å; H753-S756 PolarHBondContact O-OG 3.13Å; H753-S757 WeakPolarHBondContact O-CB 3.4Å; H753-S757 PolarHBondContact O-N 3.3Å; H753-S757 VanDerWaalsContact O-N 3.11Å; H753-S757 PolarHBondContact O-OG 3.07Å; H753-S757 VanDerWaalsContact O-OG 3.07Å
754F80.7Confident74.9Confident8 Ų849.3 Ų49.34%0.03526%0.261CS..Hα-helixtrans-65.3-42.2178.2-166.6-92.3000112.3M718 I750 W751 Q752 S757 L759 L760 L777 F797 L800M718-F754 VanDerWaalsContact CE-CA 3.47Å; M718-F754 HydrophobicContact CE-CB 3.97Å; M718-F754 HydrophobicContact CE-CD2 4.05Å; M718-F754 HydrophobicContact CE-CG 4.34Å; M718-F754 HydrophobicContact SD-CB 4.4Å; M718-F754 HydrophobicContact SD-CD2 4.19Å; I750-F754 VanDerWaalsContact O-CB 3.32Å; I750-F754 WeakPolarHBondContact O-CB 3.45Å; I750-F754 PolarHBondContact O-N 3.25Å; W751-F754 HydrophobicContact CE3-CB 4.5Å; W751-F754 HydrophobicContact CE3-CD1 4.3Å; W751-F754 AromaticContact CZ3-CD1 3.99Å; W751-F754 HydrophobicContact CZ3-CD1 4.05Å; W751-F754 HydrophobicContact CZ3-CE1 4.45Å; W751-F754 WeakPolarHBondContact O-CB 3.29Å; W751-F754 PolarHBondContact O-N 2.97Å; W751-F754 VanDerWaalsContact O-N 3.12Å; Q752-F754 VanDerWaalsContact C-N 3.33Å; F754-S757 PolarHBondContact O-N 3.01Å; F754-S757 PolarHBondContact O-OG 2.84Å; F754-S757 VanDerWaalsContact O-OG 3.13Å; F754-L759 HydrophobicContact CD2-CD1 3.81Å; F754-L759 HydrophobicContact CE2-CB 4.46Å; F754-L759 HydrophobicContact CE2-CD1 3.78Å; F754-L759 HydrophobicContact CG-CD1 4.38Å; F754-L759 HydrophobicContact CZ-CB 4.41Å; F754-L759 HydrophobicContact CZ-CD1 4.39Å; F754-L760 HydrophobicContact CE1-CD1 3.61Å; F754-L760 HydrophobicContact CE1-CG 3.94Å; F754-L760 HydrophobicContact CZ-CD1 3.91Å; F754-L760 HydrophobicContact CZ-CG 4.05Å; F754-L777 HydrophobicContact CE2-CD1 4.45Å; F754-F797 HydrophobicContact CZ-CE2 4.2Å; F754-L800 HydrophobicContact CE2-CD2 4.39Å
755V78.5Confident73.6Confident62.3333 Ų62.333349.4 Ų49.438%0.37826%0.261SS..Hα-helixtrans-68.9-43.8174.4175.70000111W751 S757 E758W751-V755 HydrophobicContact CD2-CG2 4.18Å; W751-V755 HydrophobicContact CZ2-CG2 4.03Å; W751-V755 WeakPolarHBondContact O-CG2 3.4Å; W751-V755 PolarHBondContact O-N 3.21Å; V755-S757 VanDerWaalsContact C-N 3.31Å; V755-S757 PolarHBondContact O-N 3.13Å; V755-E758 PolarHBondContact O-N 3.27Å; V755-E758 VanDerWaalsContact O-N 3.11Å
756S76.7Confident72.3Confident80.6667 Ų80.666746.3 Ų46.356%0.56424%0.243SC*.Hα-helixtrans-67.4-22.1-179.5660000114.3Q752 H753 E758Q752-S756 VanDerWaalsContact O-CB 3.31Å; Q752-S756 WeakPolarHBondContact O-CB 3.34Å; Q752-S756 PolarHBondContact O-N 3.24Å; Q752-S756 PolarHBondContact O-OG 2.79Å; H753-S756 VanDerWaalsContact CA-OG 3.3Å; H753-S756 WeakPolarHBondContact CA-OG 3.22Å; H753-S756 PolarHBondContact O-N 3.22Å; H753-S756 PolarHBondContact O-OG 3.13Å; S756-E758 VanDerWaalsContact C-N 3.26Å
757S73Confident70.7Confident31.6667 Ų31.666751.6 Ų51.622%0.22127%0.267CS..THydrogen-bonded Turntrans-84.5-2.5177.9-27.50000113.3M718 H753 F754 V755 L759M718-S757 WeakPolarHBondContact CE-OG 3.28Å; H753-S757 WeakPolarHBondContact O-CB 3.4Å; H753-S757 PolarHBondContact O-N 3.3Å; H753-S757 VanDerWaalsContact O-N 3.11Å; H753-S757 PolarHBondContact O-OG 3.07Å; H753-S757 VanDerWaalsContact O-OG 3.07Å; F754-S757 PolarHBondContact O-N 3.01Å; F754-S757 PolarHBondContact O-OG 2.84Å; F754-S757 VanDerWaalsContact O-OG 3.13Å; V755-S757 VanDerWaalsContact C-N 3.31Å; V755-S757 PolarHBondContact O-N 3.13Å; S757-L759 PolarHBondContact O-N 3.15Å; S757-L759 VanDerWaalsContact O-N 3.08Å; S757-L759 VanDerWaalsContact OG-CD1 3.31Å; S757-L759 WeakPolarHBondContact OG-CD1 3.41Å; S757-L759 WeakPolarHBondContact OG-CG 3.41Å
758E72.8Confident69.4Low83.3333 Ų83.333357.4 Ų57.439%0.38931%0.305SS..THydrogen-bonded Turntrans49.729.3-179.5-59.2-167.4142.900114.6V755 S756 L760 V764 R766V755-E758 PolarHBondContact O-N 3.27Å; V755-E758 VanDerWaalsContact O-N 3.11Å; S756-E758 VanDerWaalsContact C-N 3.26Å; E758-L760 PolarHBondContact O-N 3.14Å; E758-L760 VanDerWaalsContact O-N 3.14Å; E758-V764 HydrophobicContact CG-CG2 4.43Å; E758-R766 IonicContact OE1-CZ 2.81Å; E758-R766 IonicContact OE1-NH2 3.42Å; E758-R766 PolarHBondContact OE1-NH2 2.94Å; E758-R766 IonicContact OE2-CZ 2.92Å; E758-R766 IonicContact OE2-NH2 2.93Å; E758-R766 PolarHBondContact OE2-NH2 3Å
759L69.7Low67.8Low5.66667 Ų5.6666762.9 Ų62.93%0.0333%0.332CS..SBendtrans-61.1-24.5-174.5-70.2169.4000113.7M718 L721 T722 F754 S757 G776 L777M718-L759 HydrophobicContact CE-CD1 3.59Å; M718-L759 HydrophobicContact SD-CD1 4.06Å; L721-L759 HydrophobicContact CB-CD1 4.1Å; L721-L759 HydrophobicContact CB-CD2 3.77Å; L721-L759 HydrophobicContact CD1-CD1 3.94Å; T722-L759 HydrophobicContact CG2-CD2 3.8Å; F754-L759 HydrophobicContact CD2-CD1 3.81Å; F754-L759 HydrophobicContact CE2-CB 4.46Å; F754-L759 HydrophobicContact CE2-CD1 3.78Å; F754-L759 HydrophobicContact CG-CD1 4.38Å; F754-L759 HydrophobicContact CZ-CB 4.41Å; F754-L759 HydrophobicContact CZ-CD1 4.39Å; S757-L759 PolarHBondContact O-N 3.15Å; S757-L759 VanDerWaalsContact O-N 3.08Å; S757-L759 VanDerWaalsContact OG-CD1 3.31Å; S757-L759 WeakPolarHBondContact OG-CD1 3.41Å; S757-L759 WeakPolarHBondContact OG-CG 3.41Å; L759-G776 CarbonylContact O-C 3.45Å; L759-G776 WeakPolarHBondContact O-CA 3.36Å; L759-L777 HydrophobicContact CB-CD1 3.95Å; L759-L777 HydrophobicContact CB-CG 4.21Å; L759-L777 HydrophobicContact CD1-CD1 4.19Å; L759-L777 HydrophobicContact CD2-CD1 4.34Å; L759-L777 HydrophobicContact CD2-CG 4.29Å; L759-L777 HydrophobicContact CG-CD1 4.39Å; L759-L777 PolarHBondContact O-N 3.02Å
760L70.2Confident66Low1.66667 Ų1.6666765.6 Ų65.61%0.00934%0.34CS..SBendtrans-12187.7176.2-60.1-179.8000109.3F754 E758 F762 T763 L777 N778 F797 I850F754-L760 HydrophobicContact CE1-CD1 3.61Å; F754-L760 HydrophobicContact CE1-CG 3.94Å; F754-L760 HydrophobicContact CZ-CD1 3.91Å; F754-L760 HydrophobicContact CZ-CG 4.05Å; E758-L760 PolarHBondContact O-N 3.14Å; E758-L760 VanDerWaalsContact O-N 3.14Å; L760-F762 HydrophobicContact CB-CD1 4.38Å; L760-F762 HydrophobicContact CB-CD2 4.48Å; L760-F762 HydrophobicContact CB-CE1 3.95Å; L760-F762 HydrophobicContact CB-CE2 4.17Å; L760-F762 HydrophobicContact CB-CZ 3.83Å; L760-F762 HydrophobicContact CD1-CE2 4.27Å; L760-F762 HydrophobicContact CD1-CZ 3.81Å; L760-F762 HydrophobicContact CD2-CE1 3.83Å; L760-F762 HydrophobicContact CD2-CZ 3.86Å; L760-F762 HydrophobicContact CG-CE1 4.32Å; L760-F762 HydrophobicContact CG-CZ 4.05Å; L760-F762 PolarHBondContact O-N 3.31Å; L760-T763 HydrophobicContact CB-CG2 3.95Å; L760-T763 HydrophobicContact CD1-CG2 4.35Å; L760-T763 WeakPolarHBondContact O-CB 3.43Å; L760-T763 PolarHBondContact O-N 3.1Å; L760-T763 PolarHBondContact O-OG1 2.99Å; L760-L777 HydrophobicContact CD2-CB 4.19Å; L760-L777 HydrophobicContact CD2-CD2 4.27Å; L760-N778 HydrophobicContact CD2-CB 4.45Å; L760-F797 HydrophobicContact CD1-CE2 3.97Å; L760-F797 HydrophobicContact CD1-CZ 3.98Å; L760-F797 HydrophobicContact CD2-CE2 4.38Å; L760-I850 HydrophobicContact CD1-CD1 4.14Å; L760-I850 HydrophobicContact CD1-CG1 4Å
761P58.3Low64.2Low27.3333 Ų27.333371 Ų7118%0.17738%0.375CS..G310 helixtrans-58.3-26.1-174.6-9.211.9000113.8T763 V764 H775 N778P761-T763 PolarHBondContact O-N 3.23Å; P761-V764 PolarHBondContact O-N 3.21Å; P761-V764 VanDerWaalsContact O-N 3.12Å; P761-H775 WeakPolarHBondContact CD-O 3.27Å; P761-H775 WeakPolarHBondContact CG-O 3.28Å; P761-N778 VanDerWaalsContact CD-OD1 3.24Å; P761-N778 WeakPolarHBondContact CD-OD1 3.31Å
762F63.1Low62.6Low62 Ų6278 Ų7827%0.27241%0.409SS..G310 helixtrans-67.9-10.9176.660.7-106.3000114.2L760 N778 I850 F853L760-F762 HydrophobicContact CB-CD1 4.38Å; L760-F762 HydrophobicContact CB-CD2 4.48Å; L760-F762 HydrophobicContact CB-CE1 3.95Å; L760-F762 HydrophobicContact CB-CE2 4.17Å; L760-F762 HydrophobicContact CB-CZ 3.83Å; L760-F762 HydrophobicContact CD1-CE2 4.27Å; L760-F762 HydrophobicContact CD1-CZ 3.81Å; L760-F762 HydrophobicContact CD2-CE1 3.83Å; L760-F762 HydrophobicContact CD2-CZ 3.86Å; L760-F762 HydrophobicContact CG-CE1 4.32Å; L760-F762 HydrophobicContact CG-CZ 4.05Å; L760-F762 PolarHBondContact O-N 3.31Å; F762-N778 HydrophobicContact CD1-CB 4.08Å; F762-N778 HydrophobicContact CE1-CB 3.95Å; F762-I850 HydrophobicContact CE2-CG1 4.05Å; F762-F853 HydrophobicContact CD1-CD2 4.24Å; F762-F853 HydrophobicContact CD1-CE2 4.42Å; F762-F853 HydrophobicContact CD1-CG 4.45Å; F762-F853 HydrophobicContact CD2-CB 4.46Å; F762-F853 HydrophobicContact CE1-CB 4.28Å; F762-F853 AromaticContact CE1-CD1 3.95Å; F762-F853 HydrophobicContact CE1-CD1 4.09Å; F762-F853 AromaticContact CE1-CD2 3.65Å; F762-F853 HydrophobicContact CE1-CD2 3.65Å; F762-F853 VanDerWaalsContact CE1-CD2 3.47Å; F762-F853 HydrophobicContact CE1-CE1 4.32Å; F762-F853 AromaticContact CE1-CE2 3.75Å; F762-F853 HydrophobicContact CE1-CE2 3.95Å; F762-F853 AromaticContact CE1-CG 3.74Å; F762-F853 HydrophobicContact CE1-CG 3.74Å; F762-F853 HydrophobicContact CE1-CZ 4.28Å; F762-F853 HydrophobicContact CE2-CB 3.88Å; F762-F853 HydrophobicContact CE2-CG 4.21Å; F762-F853 HydrophobicContact CZ-CB 3.69Å; F762-F853 AromaticContact CZ-CD1 3.73Å; F762-F853 HydrophobicContact CZ-CD1 3.73Å; F762-F853 AromaticContact CZ-CD2 3.92Å; F762-F853 HydrophobicContact CZ-CD2 3.92Å; F762-F853 HydrophobicContact CZ-CE1 4.32Å; F762-F853 HydrophobicContact CZ-CE2 4.35Å; F762-F853 AromaticContact CZ-CG 3.5Å; F762-F853 HydrophobicContact CZ-CG 3.5Å
763T56.4Low61.1Low22.3333 Ų22.333373.8 Ų73.814%0.13739%0.394CS..G310 helixtrans-84-16.6172.662.60000112.9L760 P761 P846 I850L760-T763 HydrophobicContact CB-CG2 3.95Å; L760-T763 HydrophobicContact CD1-CG2 4.35Å; L760-T763 WeakPolarHBondContact O-CB 3.43Å; L760-T763 PolarHBondContact O-N 3.1Å; L760-T763 PolarHBondContact O-OG1 2.99Å; P761-T763 PolarHBondContact O-N 3.23Å; T763-P846 HydrophobicContact CG2-CB 4.38Å; T763-I850 HydrophobicContact CG2-CD1 4.22Å; T763-I850 HydrophobicContact CG2-CG1 4Å
764V55.2Low59.7Low48.6667 Ų48.666776 Ų7630%0.29541%0.407SS..SBendtrans-107.3108.7-176.4-175.20000109.4E758 P761 R766E758-V764 HydrophobicContact CG-CG2 4.43Å; P761-V764 PolarHBondContact O-N 3.21Å; P761-V764 VanDerWaalsContact O-N 3.12Å; V764-R766 HydrophobicContact CG1-CG 4.24Å; V764-R766 PolarHBondContact O-N 3.2Å
765Q49.3Very low58.6Low95.3333 Ų95.333380.7 Ų80.745%0.44543%0.429SS..  trans-68.9112.7171.5-79.2-171.5-16.700110.7S842 T844Q765-S842 PolarHBondContact NE2-O 3.05Å; Q765-S842 VanDerWaalsContact OE1-C 3.24Å; Q765-S842 PolarHBondContact OE1-O 3.15Å; Q765-T844 HydrophobicContact CG-CG2 3.87Å; Q765-T844 WeakPolarHBondContact CG-OG1 3.43Å; Q765-T844 VanDerWaalsContact NE2-CG2 3.34Å; Q765-T844 VanDerWaalsContact NE2-N 3.1Å; Q765-T844 PolarHBondContact NE2-OG1 3.38Å
766R51.4Low58.3Low92.3333 Ų92.333378.5 Ų78.535%0.34842%0.419SS..  trans-103.8152.9169.6-63-172.4-176.4162.94.7110.4E758 V764 Q770 P771 S773E758-R766 IonicContact OE1-CZ 2.81Å; E758-R766 IonicContact OE1-NH2 3.42Å; E758-R766 PolarHBondContact OE1-NH2 2.94Å; E758-R766 IonicContact OE2-CZ 2.92Å; E758-R766 IonicContact OE2-NH2 2.93Å; E758-R766 PolarHBondContact OE2-NH2 3Å; V764-R766 HydrophobicContact CG1-CG 4.24Å; V764-R766 PolarHBondContact O-N 3.2Å; R766-Q770 HydrophobicContact CB-CB 4.46Å; R766-P771 PolarHBondContact NH1-O 3.49Å; R766-S773 PolarHBondContact NH1-OG 3.25Å; R766-S773 PolarHBondContact NH2-OG 3.33Å
767H48.4Very low58.4Low133 Ų13374.8 Ų74.862%0.61639%0.393SS*.  trans-56.1144.6176.8-84.2-76000111.2N769 Q770H767-N769 PolarHBondContact O-N 3.02Å; H767-Q770 PolarHBondContact O-N 3.23Å
768P54.8Low58.7Low123 Ų12374.5 Ų74.580%0.79939%0.389SS*.THydrogen-bonded Turntrans-60.8-10.6-175.423-33.9000115
769N48.3Very low59Low156.667 Ų156.66771.6 Ų71.684%0.83838%0.377SS*.THydrogen-bonded Turntrans-99.21.2-179.7-67.1-4.8000114.1H767H767-N769 PolarHBondContact O-N 3.02Å
770Q47.8Very low59.7Low123 Ų12372.1 Ų72.158%0.57538%0.379SS*.SBendtrans-96.1132.6172.5-96.2179.5-13.700110.2R766 H767 Q772R766-Q770 HydrophobicContact CB-CB 4.46Å; H767-Q770 PolarHBondContact O-N 3.23Å; Q770-Q772 PolarHBondContact O-N 3.35Å
771P46.9Very low60.4Low114 Ų11472 Ų7274%0.7438%0.379SS*.PPolyproline II helixtrans-60.2132.2174.224.8-31.6000109.4R766 S773R766-P771 PolarHBondContact NH1-O 3.49Å; P771-S773 VanDerWaalsContact C-N 3.32Å; P771-S773 PolarHBondContact O-N 3.31Å
772Q49.5Very low61.5Low167 Ų16773.1 Ų73.178%0.7838%0.383SS*.PPolyproline II helixtrans-59.9115.5170.8-68.5177.8-18.900107.9Q770 I774Q770-Q772 PolarHBondContact O-N 3.35Å; Q772-I774 VanDerWaalsContact C-N 3.26Å; Q772-I774 HydrophobicContact CB-CG1 4.32Å; Q772-I774 WeakPolarHBondContact O-CG1 3.25Å; Q772-I774 PolarHBondContact O-N 3.17Å
773S51.1Low62.4Low49.3333 Ų49.333374.3 Ų74.335%0.34539%0.39SS..  trans-66.597.6164.650.80000106.1R766 P771 H775R766-S773 PolarHBondContact NH1-OG 3.25Å; R766-S773 PolarHBondContact NH2-OG 3.33Å; P771-S773 VanDerWaalsContact C-N 3.32Å; P771-S773 PolarHBondContact O-N 3.31Å; S773-H775 PolarHBondContact O-N 3.23Å
774I52.5Low63.7Low109.333 Ų109.33375.3 Ų75.356%0.56140%0.396SS*.  trans-62.917.5-175.9-57.3170.1000109.5Q772 N778 T779Q772-I774 VanDerWaalsContact C-N 3.26Å; Q772-I774 HydrophobicContact CB-CG1 4.32Å; Q772-I774 WeakPolarHBondContact O-CG1 3.25Å; Q772-I774 PolarHBondContact O-N 3.17Å; I774-N778 HydrophobicContact CG2-CB 4.37Å; I774-N778 WeakPolarHBondContact CG2-ND2 3.45Å; I774-T779 HydrophobicContact CB-CG2 4.35Å; I774-T779 HydrophobicContact CG2-CG2 3.96Å; I774-T779 WeakPolarHBondContact O-CG2 3.41Å
775H57.9Low65.3Low105.667 Ų105.66773 Ų7349%0.48938%0.382SS..  trans-123.9120-168.8-59.717.2000109.7L627 P761 S773L627-H775 PolarHBondContact O-CD2 3.13Å; L627-H775 PolarHBondContact O-CE1 3.33Å; L627-H775 PolarHBondContact O-NE2 3.05Å; L627-H775 VanDerWaalsContact O-NE2 3.08Å; P761-H775 WeakPolarHBondContact CD-O 3.27Å; P761-H775 WeakPolarHBondContact CG-O 3.28Å; S773-H775 PolarHBondContact O-N 3.23Å
776G71.4Confident67.1Low16.3333 Ų16.333370.3 Ų70.317%0.16837%0.373CS..SBendtrans-176.1-173.8176.200000111.8L759 N778 T779 D780L759-G776 CarbonylContact O-C 3.45Å; L759-G776 WeakPolarHBondContact O-CA 3.36Å; G776-N778 WeakPolarHBondContact CA-OD1 3.33Å; G776-N778 PolarHBondContact O-N 3.13Å; G776-N778 VanDerWaalsContact O-N 3.1Å; G776-T779 PolarHBondContact N-OG1 3.26Å; G776-T779 PolarHBondContact O-N 3.07Å; G776-T779 VanDerWaalsContact O-N 3.13Å; G776-T779 PolarHBondContact O-OG1 3.06Å; G776-D780 PolarHBondContact O-N 3.49Å
777L77.6Confident68.7Low2.33333 Ų2.3333372.9 Ų72.91%0.01238%0.383CS..Hα-helixtrans-60.3-27.7-179.9-95.4148.5000112.1L721 K730 F754 L759 L760 T779 D780 M781 L793 F797L721-L777 HydrophobicContact CD2-CD2 4.46Å; K730-L777 HydrophobicContact CD-CD2 4.16Å; F754-L777 HydrophobicContact CE2-CD1 4.45Å; L759-L777 HydrophobicContact CB-CD1 3.95Å; L759-L777 HydrophobicContact CB-CG 4.21Å; L759-L777 HydrophobicContact CD1-CD1 4.19Å; L759-L777 HydrophobicContact CD2-CD1 4.34Å; L759-L777 HydrophobicContact CD2-CG 4.29Å; L759-L777 HydrophobicContact CG-CD1 4.39Å; L759-L777 PolarHBondContact O-N 3.02Å; L760-L777 HydrophobicContact CD2-CB 4.19Å; L760-L777 HydrophobicContact CD2-CD2 4.27Å; L777-T779 PolarHBondContact O-N 3.14Å; L777-D780 PolarHBondContact O-N 3.29Å; L777-M781 HydrophobicContact CD2-SD 4Å; L777-M781 HydrophobicContact CG-SD 3.99Å; L777-M781 VanDerWaalsContact O-CG 3.25Å; L777-M781 WeakPolarHBondContact O-CG 3.31Å; L777-M781 PolarHBondContact O-N 3.25Å; L777-L793 HydrophobicContact CD1-CD1 3.99Å; L777-L793 HydrophobicContact CD1-CD2 3.77Å; L777-L793 HydrophobicContact CD1-CG 4.04Å; L777-L793 HydrophobicContact CD2-CD1 4.34Å; L777-L793 HydrophobicContact CD2-CD2 4.31Å; L777-L793 HydrophobicContact CG-CD2 4.41Å; L777-F797 HydrophobicContact CD2-CD2 3.7Å; L777-F797 HydrophobicContact CD2-CE2 4.22Å; L777-F797 HydrophobicContact CD2-CG 4.3Å
778N80Confident70.4Confident25.6667 Ų25.666769 Ų6914%0.13737%0.373CS..Hα-helixtrans-63.2-39.4176.797.2-39000113L760 P761 F762 I774 G776 D780 M781 D782 F853L760-N778 HydrophobicContact CD2-CB 4.45Å; P761-N778 VanDerWaalsContact CD-OD1 3.24Å; P761-N778 WeakPolarHBondContact CD-OD1 3.31Å; F762-N778 HydrophobicContact CD1-CB 4.08Å; F762-N778 HydrophobicContact CE1-CB 3.95Å; I774-N778 HydrophobicContact CG2-CB 4.37Å; I774-N778 WeakPolarHBondContact CG2-ND2 3.45Å; G776-N778 WeakPolarHBondContact CA-OD1 3.33Å; G776-N778 PolarHBondContact O-N 3.13Å; G776-N778 VanDerWaalsContact O-N 3.1Å; N778-D780 VanDerWaalsContact C-N 3.32Å; N778-D780 PolarHBondContact O-N 3.23Å; N778-M781 PolarHBondContact O-N 3.39Å; N778-D782 VanDerWaalsContact O-CB 3.31Å; N778-D782 WeakPolarHBondContact O-CB 3.38Å; N778-D782 PolarHBondContact O-N 2.98Å; N778-F853 HydrophobicContact CB-CE2 4.05Å; N778-F853 HydrophobicContact CB-CZ 3.98Å; N778-F853 WeakPolarHBondContact OD1-CE2 3.31Å; N778-F853 WeakPolarHBondContact OD1-CZ 3.35Å
779T79.2Confident72Confident23 Ų2367.5 Ų67.514%0.14136%0.355CS..Hα-helixtrans-70.5-35.4176.848.60000111.7I774 G776 L777 M781 D782 E783 V784I774-T779 HydrophobicContact CB-CG2 4.35Å; I774-T779 HydrophobicContact CG2-CG2 3.96Å; I774-T779 WeakPolarHBondContact O-CG2 3.41Å; G776-T779 PolarHBondContact N-OG1 3.26Å; G776-T779 PolarHBondContact O-N 3.07Å; G776-T779 VanDerWaalsContact O-N 3.13Å; G776-T779 PolarHBondContact O-OG1 3.06Å; L777-T779 PolarHBondContact O-N 3.14Å; T779-M781 VanDerWaalsContact C-N 3.33Å; T779-M781 PolarHBondContact O-N 3.21Å; T779-D782 PolarHBondContact O-N 3.11Å; T779-E783 WeakPolarHBondContact O-CA 3.19Å; T779-E783 VanDerWaalsContact O-CB 3.24Å; T779-E783 WeakPolarHBondContact O-CB 3.36Å; T779-E783 PolarHBondContact O-N 3.13Å; T779-V784 PolarHBondContact O-N 2.76Å
780D83.8Confident73.8Confident15.3333 Ų15.333363.1 Ų63.18%0.08233%0.33CS..Iπ-helixtrans-62.5-43.4174.5-66.8-17.1000110.8L727 K730 G776 L777 N778 V784 E785 L793L727-D780 HydrophobicContact CD2-CB 4.25Å; K730-D780 IonicContact NZ-OD1 2.67Å; K730-D780 IonicContact NZ-OD2 3.78Å; K730-D780 PolarHBondContact NZ-OD2 3.19Å; G776-D780 PolarHBondContact O-N 3.49Å; L777-D780 PolarHBondContact O-N 3.29Å; N778-D780 VanDerWaalsContact C-N 3.32Å; N778-D780 PolarHBondContact O-N 3.23Å; D780-V784 WeakPolarHBondContact O-CA 3.4Å; D780-V784 WeakPolarHBondContact O-CB 3.39Å; D780-V784 PolarHBondContact O-N 3.29Å; D780-V784 VanDerWaalsContact O-N 3.09Å; D780-E785 PolarHBondContact O-N 2.94Å; D780-L793 HydrophobicContact CB-CD2 3.59Å; D780-L793 VanDerWaalsContact CB-CD2 3.46Å
781M85.3Confident75.8Confident0.666667 Ų0.66666757.2 Ų57.20%0.00330%0.302CS..Iπ-helixtrans-74.4-29.9-179.3-67.7169.26000114.9L777 N778 T779 E785 L793 T794 F797 F853 I858 R865L777-M781 HydrophobicContact CD2-SD 4Å; L777-M781 HydrophobicContact CG-SD 3.99Å; L777-M781 VanDerWaalsContact O-CG 3.25Å; L777-M781 WeakPolarHBondContact O-CG 3.31Å; L777-M781 PolarHBondContact O-N 3.25Å; N778-M781 PolarHBondContact O-N 3.39Å; T779-M781 VanDerWaalsContact C-N 3.33Å; T779-M781 PolarHBondContact O-N 3.21Å; M781-E785 WeakPolarHBondContact CA-OE2 3.33Å; M781-L793 HydrophobicContact CG-CD2 3.96Å; M781-L793 HydrophobicContact CG-CG 4.15Å; M781-T794 HydrophobicContact CE-CG2 4.26Å; M781-T794 WeakPolarHBondContact CE-OG1 3.31Å; M781-F797 HydrophobicContact CE-CB 4.33Å; M781-F797 HydrophobicContact CE-CD1 3.7Å; M781-F797 HydrophobicContact CE-CE1 4.33Å; M781-F797 HydrophobicContact CE-CG 4.18Å; M781-F797 HydrophobicContact SD-CB 4.23Å; M781-F797 HydrophobicContact SD-CD1 4.19Å; M781-F797 HydrophobicContact SD-CG 4.14Å; M781-F853 HydrophobicContact CE-CE1 3.87Å; M781-F853 HydrophobicContact CE-CZ 4.29Å; M781-F853 HydrophobicContact SD-CE1 4.35Å; M781-I858 HydrophobicContact CE-CD1 3.5Å; M781-I858 VanDerWaalsContact CE-CD1 3.47Å; M781-I858 HydrophobicContact CE-CG1 4.24Å; M781-R865 PolarHBondContact O-NH1 3.1Å; M781-R865 VanDerWaalsContact O-NH1 3.1Å; M781-R865 PolarHBondContact O-NH2 3.37Å
782D82.2Confident77.6Confident49.6667 Ų49.666752.5 Ų52.527%0.26627%0.272SS..Iπ-helixtrans-98.4-22.2-177.6-88.3-14.9000113.7N778 T779 P786 R861 R865N778-D782 VanDerWaalsContact O-CB 3.31Å; N778-D782 WeakPolarHBondContact O-CB 3.38Å; N778-D782 PolarHBondContact O-N 2.98Å; T779-D782 PolarHBondContact O-N 3.11Å; D782-P786 WeakPolarHBondContact O-CG 3.42Å; D782-R861 IonicContact OD1-NH1 3.19Å; D782-R861 PolarHBondContact OD1-NH1 3Å; D782-R861 IonicContact OD2-CZ 2.75Å; D782-R861 IonicContact OD2-NH1 3.3Å; D782-R861 PolarHBondContact OD2-NH1 3.31Å; D782-R865 IonicContact OD1-CZ 3.99Å; D782-R865 IonicContact OD1-NH2 2.86Å; D782-R865 PolarHBondContact OD1-NH2 3.34Å
783E82.2Confident79.5Confident88 Ų8844.6 Ų44.641%0.41123%0.234SC..Iπ-helixtrans-119.4-35.9-178.5-70.4-164.2-163.400114.7L627 T779 R787L627-E783 WeakPolarHBondContact CD2-OE2 3.21Å; T779-E783 WeakPolarHBondContact O-CA 3.19Å; T779-E783 VanDerWaalsContact O-CB 3.24Å; T779-E783 WeakPolarHBondContact O-CB 3.36Å; T779-E783 PolarHBondContact O-N 3.13Å; E783-R787 VanDerWaalsContact O-CD 3.27Å; E783-R787 WeakPolarHBondContact O-CD 3.36Å; E783-R787 VanDerWaalsContact O-CG 3.26Å; E783-R787 WeakPolarHBondContact O-CG 3.4Å; E783-R787 PolarHBondContact O-NH1 2.68Å; E783-R787 IonicContact OE2-CZ 2.87Å; E783-R787 VanDerWaalsContact OE2-CZ 3.32Å; E783-R787 IonicContact OE2-NH1 3.9Å; E783-R787 PolarHBondContact OE2-NH1 3.2Å; E783-R787 IonicContact OE2-NH2 3.46Å; E783-R787 PolarHBondContact OE2-NH2 3.28Å
784V83.7Confident81.3Confident42.6667 Ų42.666742.2 Ų42.226%0.25922%0.218SC..Iπ-helixtrans-89.6-49.4-173.1-169.80000111.1Y624 L627 L727 T779 D780 R787 A788Y624-V784 HydrophobicContact CD2-CG1 3.94Å; Y624-V784 HydrophobicContact CE2-CG1 4.01Å; L627-V784 HydrophobicContact CD1-CG2 3.51Å; L727-V784 HydrophobicContact CD1-CG1 3.99Å; L727-V784 HydrophobicContact CD2-CB 4.42Å; L727-V784 HydrophobicContact CD2-CG1 4.18Å; L727-V784 HydrophobicContact CG-CG1 4.39Å; T779-V784 PolarHBondContact O-N 2.76Å; D780-V784 WeakPolarHBondContact O-CA 3.4Å; D780-V784 WeakPolarHBondContact O-CB 3.39Å; D780-V784 PolarHBondContact O-N 3.29Å; D780-V784 VanDerWaalsContact O-N 3.09Å; V784-R787 PolarHBondContact O-N 3.09Å; V784-A788 PolarHBondContact O-N 2.94Å
785E88.7Confident82.9Confident0 Ų037.2 Ų37.20%019%0.193CC..Hα-helixtrans-58.6-46.9176.7-70.5-172.613000113.2L727 D780 M781 R787 A788 E789 E790 Y791 L793 T794L727-E785 HydrophobicContact CD1-CG 4.09Å; L727-E785 HydrophobicContact CD2-CG 4.38Å; D780-E785 PolarHBondContact O-N 2.94Å; M781-E785 WeakPolarHBondContact CA-OE2 3.33Å; E785-R787 PolarHBondContact O-N 3.05Å; E785-R787 VanDerWaalsContact O-N 3.14Å; E785-A788 CarbonylContact O-C 3.39Å; E785-A788 PolarHBondContact O-N 3.31Å; E785-E789 PolarHBondContact O-N 3.01Å; E785-E790 WeakPolarHBondContact CB-O 3.24Å; E785-Y791 HydrophobicContact CB-CD1 3.69Å; E785-Y791 HydrophobicContact CB-CE1 3.99Å; E785-Y791 HydrophobicContact CB-CG 4.49Å; E785-Y791 VanDerWaalsContact OE1-CA 3.25Å; E785-Y791 WeakPolarHBondContact OE1-CA 3.31Å; E785-L793 HydrophobicContact CG-CB 4.43Å; E785-L793 VanDerWaalsContact OE1-CA 3.24Å; E785-L793 WeakPolarHBondContact OE1-CA 3.37Å; E785-L793 WeakPolarHBondContact OE1-CB 3.34Å; E785-L793 PolarHBondContact OE1-N 3.02Å; E785-T794 PolarHBondContact OE1-N 3.19Å; E785-T794 VanDerWaalsContact OE2-CB 3.28Å; E785-T794 WeakPolarHBondContact OE2-CB 3.45Å; E785-T794 PolarHBondContact OE2-N 3.11Å; E785-T794 PolarHBondContact OE2-OG1 3.2Å
786P86.3Confident84.2Confident39 Ų3932.2 Ų32.225%0.25317%0.169SC..Hα-helixtrans-64.7-20.9179.7-21.734.6000114.2D782 Y791D782-P786 WeakPolarHBondContact O-CG 3.42Å; P786-Y791 WeakPolarHBondContact CA-OH 3.2Å; P786-Y791 HydrophobicContact CB-CE1 4.43Å; P786-Y791 HydrophobicContact CG-CE1 4.1Å
787R85.1Confident85.1Confident147.667 Ų147.66731.4 Ų31.456%0.55716%0.161SC*.Hα-helixtrans-81.2-28.3173.3-70.9177.7-177.4152.63.2112.7Y624 E783 V784 E785 E789Y624-R787 PolarHBondContact OH-NE 3.16Å; E783-R787 VanDerWaalsContact O-CD 3.27Å; E783-R787 WeakPolarHBondContact O-CD 3.36Å; E783-R787 VanDerWaalsContact O-CG 3.26Å; E783-R787 WeakPolarHBondContact O-CG 3.4Å; E783-R787 PolarHBondContact O-NH1 2.68Å; E783-R787 IonicContact OE2-CZ 2.87Å; E783-R787 VanDerWaalsContact OE2-CZ 3.32Å; E783-R787 IonicContact OE2-NH1 3.9Å; E783-R787 PolarHBondContact OE2-NH1 3.2Å; E783-R787 IonicContact OE2-NH2 3.46Å; E783-R787 PolarHBondContact OE2-NH2 3.28Å; V784-R787 PolarHBondContact O-N 3.09Å; E785-R787 PolarHBondContact O-N 3.05Å; E785-R787 VanDerWaalsContact O-N 3.14Å; R787-E789 VanDerWaalsContact C-N 3.31Å
788A84.8Confident85.5Confident49.6667 Ų49.666731.3 Ų31.341%0.4116%0.161SC..Hα-helixtrans-82.2-15.9174.100000112.7L727 V784 E785 E790L727-A788 HydrophobicContact CD1-CB 4.38Å; V784-A788 PolarHBondContact O-N 2.94Å; E785-A788 CarbonylContact O-C 3.39Å; E785-A788 PolarHBondContact O-N 3.31Å; A788-E790 PolarHBondContact O-N 3.16Å
789E88.2Confident85.7Confident92.3333 Ų92.333330.2 Ų30.243%0.43116%0.155SC..THydrogen-bonded Turntrans59.619.5-173.9-53.6-177.4167.400113.7E785 R787 A866 Y867 R868E785-E789 PolarHBondContact O-N 3.01Å; R787-E789 VanDerWaalsContact C-N 3.31Å; E789-A866 HydrophobicContact CG-CB 4.26Å; E789-Y867 WeakPolarHBondContact O-CA 3.41Å; E789-R868 HydrophobicContact CB-CB 4.28Å; E789-R868 WeakPolarHBondContact O-CB 3.18Å; E789-R868 PolarHBondContact O-N 3.09Å
790E85.9Confident86Confident63.6667 Ų63.666729.1 Ų29.130%0.29815%0.148SC..  trans-132.7139.4178.7-66.6178.8-176.300108.7E785 A788 P792 R868E785-E790 WeakPolarHBondContact CB-O 3.24Å; A788-E790 PolarHBondContact O-N 3.16Å; E790-P792 VanDerWaalsContact O-CD 3.31Å; E790-P792 WeakPolarHBondContact O-CD 3.24Å; E790-R868 HydrophobicContact CG-CB 4.14Å; E790-R868 WeakPolarHBondContact OE1-CD 3.14Å; E790-R868 IonicContact OE1-CZ 3.07Å; E790-R868 IonicContact OE1-NE 3.22Å; E790-R868 IonicContact OE1-NH1 3.54Å; E790-R868 PolarHBondContact OE1-NH1 3.17Å
791Y89.2Confident86.1Confident0 Ų028.4 Ų28.40%014%0.144CC..  trans-122.950.2-170.5-58.3-87.5000114.3E785 P786 L793 N795 R865 A866 Y867 E872 I876E785-Y791 HydrophobicContact CB-CD1 3.69Å; E785-Y791 HydrophobicContact CB-CE1 3.99Å; E785-Y791 HydrophobicContact CB-CG 4.49Å; E785-Y791 VanDerWaalsContact OE1-CA 3.25Å; E785-Y791 WeakPolarHBondContact OE1-CA 3.31Å; P786-Y791 WeakPolarHBondContact CA-OH 3.2Å; P786-Y791 HydrophobicContact CB-CE1 4.43Å; P786-Y791 HydrophobicContact CG-CE1 4.1Å; Y791-L793 VanDerWaalsContact C-N 3.27Å; Y791-L793 PolarHBondContact O-N 3.32Å; Y791-N795 WeakPolarHBondContact O-CB 3.32Å; Y791-N795 PolarHBondContact O-N 3.35Å; Y791-N795 VanDerWaalsContact O-N 3.07Å; Y791-N795 PolarHBondContact O-ND2 3.36Å; Y791-R865 WeakPolarHBondContact OH-CB 3.29Å; Y791-A866 VanDerWaalsContact CE2-O 3.25Å; Y791-A866 WeakPolarHBondContact CE2-O 3.15Å; Y791-A866 PolarHBondContact OH-O 3.34Å; Y791-Y867 AromaticContact CD2-CD1 3.51Å; Y791-Y867 HydrophobicContact CD2-CD1 3.51Å; Y791-Y867 VanDerWaalsContact CD2-CD1 3.47Å; Y791-Y867 AromaticContact CD2-CE1 3.41Å; Y791-Y867 HydrophobicContact CD2-CE1 3.41Å; Y791-Y867 VanDerWaalsContact CD2-CE1 3.42Å; Y791-Y867 HydrophobicContact CD2-CG 4.48Å; Y791-Y867 AromaticContact CE2-CD1 3.35Å; Y791-Y867 HydrophobicContact CE2-CD1 3.35Å; Y791-Y867 VanDerWaalsContact CE2-CD1 3.42Å; Y791-Y867 AromaticContact CE2-CE1 3.34Å; Y791-Y867 HydrophobicContact CE2-CE1 3.34Å; Y791-Y867 HydrophobicContact CE2-CG 4.08Å; Y791-Y867 AromaticContact CE2-CZ 3.99Å; Y791-Y867 HydrophobicContact CG-CE1 4.33Å; Y791-E872 VanDerWaalsContact C-OE1 3.29Å; Y791-E872 VanDerWaalsContact CA-OE1 3.32Å; Y791-E872 WeakPolarHBondContact CA-OE1 3.31Å; Y791-E872 HydrophobicContact CD2-CG 4.48Å; Y791-E872 PolarHBondContact N-OE1 3.04Å; Y791-E872 PolarHBondContact N-OE2 3.06Å; Y791-I876 HydrophobicContact CD1-CD1 4.4Å; Y791-I876 HydrophobicContact CD2-CD1 4.18Å; Y791-I876 HydrophobicContact CG-CD1 3.84Å
792P85.9Confident85.9Confident15 Ų1529.3 Ų29.310%0.09715%0.15CC..Hα-helixtrans-66.9-34.6-178.129.1-35.1000113L727 A731 E790 A796L727-P792 HydrophobicContact CB-CG 4.28Å; A731-P792 HydrophobicContact CB-CB 4.06Å; A731-P792 WeakPolarHBondContact CB-O 3.33Å; E790-P792 VanDerWaalsContact O-CD 3.31Å; E790-P792 WeakPolarHBondContact O-CD 3.24Å; P792-A796 VanDerWaalsContact O-CB 3.31Å; P792-A796 WeakPolarHBondContact O-CB 3.3Å; P792-A796 PolarHBondContact O-N 2.97Å; P792-A796 VanDerWaalsContact O-N 3.1Å
793L88.5Confident85.6Confident0.333333 Ų0.33333327.5 Ų27.50%0.00214%0.141CC..Hα-helixtrans-75.4-43.5-178.1-176.769.3000111L727 K730 L734 L777 D780 M781 E785 Y791 N795 A796 F797L727-L793 HydrophobicContact CD2-CD2 4.27Å; K730-L793 HydrophobicContact CB-CD1 3.65Å; K730-L793 VanDerWaalsContact CB-CD1 3.46Å; L734-L793 HydrophobicContact CD1-CD1 3.63Å; L777-L793 HydrophobicContact CD1-CD1 3.99Å; L777-L793 HydrophobicContact CD1-CD2 3.77Å; L777-L793 HydrophobicContact CD1-CG 4.04Å; L777-L793 HydrophobicContact CD2-CD1 4.34Å; L777-L793 HydrophobicContact CD2-CD2 4.31Å; L777-L793 HydrophobicContact CG-CD2 4.41Å; D780-L793 HydrophobicContact CB-CD2 3.59Å; D780-L793 VanDerWaalsContact CB-CD2 3.46Å; M781-L793 HydrophobicContact CG-CD2 3.96Å; M781-L793 HydrophobicContact CG-CG 4.15Å; E785-L793 HydrophobicContact CG-CB 4.43Å; E785-L793 VanDerWaalsContact OE1-CA 3.24Å; E785-L793 WeakPolarHBondContact OE1-CA 3.37Å; E785-L793 WeakPolarHBondContact OE1-CB 3.34Å; E785-L793 PolarHBondContact OE1-N 3.02Å; Y791-L793 VanDerWaalsContact C-N 3.27Å; Y791-L793 PolarHBondContact O-N 3.32Å; L793-N795 VanDerWaalsContact C-N 3.34Å; L793-N795 PolarHBondContact O-N 3.19Å; L793-A796 PolarHBondContact O-N 3.07Å; L793-F797 VanDerWaalsContact O-CB 3.28Å; L793-F797 WeakPolarHBondContact O-CB 3.44Å; L793-F797 PolarHBondContact O-N 3.06Å
794T88.4Confident85.5Confident0 Ų023.4 Ų23.40%012%0.122CC..Hα-helixtrans-58.8-46173.5-74.10000110.9M781 E785 A796 F797 L798 I858 I876M781-T794 HydrophobicContact CE-CG2 4.26Å; M781-T794 WeakPolarHBondContact CE-OG1 3.31Å; E785-T794 PolarHBondContact OE1-N 3.19Å; E785-T794 VanDerWaalsContact OE2-CB 3.28Å; E785-T794 WeakPolarHBondContact OE2-CB 3.45Å; E785-T794 PolarHBondContact OE2-N 3.11Å; E785-T794 PolarHBondContact OE2-OG1 3.2Å; T794-A796 PolarHBondContact O-N 2.74Å; T794-F797 PolarHBondContact O-N 3.08Å; T794-L798 HydrophobicContact CG2-CD1 3.91Å; T794-L798 HydrophobicContact CG2-CG 4.36Å; T794-L798 WeakPolarHBondContact O-CB 3.43Å; T794-L798 VanDerWaalsContact O-CG 3.29Å; T794-L798 WeakPolarHBondContact O-CG 3.36Å; T794-L798 PolarHBondContact O-N 3.09Å; T794-I858 HydrophobicContact CG2-CD1 4.42Å; T794-I858 HydrophobicContact CG2-CG2 3.9Å; T794-I876 HydrophobicContact CG2-CD1 4.26Å; T794-I876 HydrophobicContact CG2-CG1 4.4Å; T794-I876 HydrophobicContact CG2-CG2 4.39Å
795N87Confident85.4Confident5 Ų521.5 Ų21.53%0.02711%0.11CC..Hα-helixtrans-61.3-47.1177.4-78.7-42.5000111.9Y791 L793 F797 L798 T799 E872 I876Y791-N795 WeakPolarHBondContact O-CB 3.32Å; Y791-N795 PolarHBondContact O-N 3.35Å; Y791-N795 VanDerWaalsContact O-N 3.07Å; Y791-N795 PolarHBondContact O-ND2 3.36Å; L793-N795 VanDerWaalsContact C-N 3.34Å; L793-N795 PolarHBondContact O-N 3.19Å; N795-F797 VanDerWaalsContact C-N 3.33Å; N795-F797 PolarHBondContact O-N 2.9Å; N795-L798 PolarHBondContact O-N 3.35Å; N795-T799 WeakPolarHBondContact O-CB 3.38Å; N795-T799 WeakPolarHBondContact O-CG2 3.47Å; N795-T799 PolarHBondContact O-N 3.13Å; N795-T799 PolarHBondContact O-OG1 3.36Å; N795-T799 VanDerWaalsContact O-OG1 3.07Å; N795-E872 WeakPolarHBondContact ND2-CG 3.35Å; N795-E872 PolarHBondContact ND2-OE1 3.31Å; N795-E872 VanDerWaalsContact ND2-OE1 3.16Å; N795-I876 VanDerWaalsContact OD1-CG1 3.27Å; N795-I876 WeakPolarHBondContact OD1-CG1 3.3Å
796A85.6Confident84.7Confident0 Ų022.6 Ų22.60%012%0.117CC..Hα-helixtrans-65.1-37.2178.700000112.6A731 L734 Y735 P792 L793 T794 T799 L800A731-A796 HydrophobicContact CB-CB 3.9Å; A731-A796 WeakPolarHBondContact O-CB 3.41Å; L734-A796 HydrophobicContact CB-CB 3.74Å; L734-A796 HydrophobicContact CD1-CB 4.13Å; Y735-A796 HydrophobicContact CD1-CB 4.3Å; Y735-A796 HydrophobicContact CD2-CB 3.93Å; Y735-A796 HydrophobicContact CE1-CB 3.99Å; Y735-A796 HydrophobicContact CE2-CB 3.58Å; Y735-A796 HydrophobicContact CG-CB 4.26Å; Y735-A796 PolarHBondContact OH-N 2.99Å; P792-A796 VanDerWaalsContact O-CB 3.31Å; P792-A796 WeakPolarHBondContact O-CB 3.3Å; P792-A796 PolarHBondContact O-N 2.97Å; P792-A796 VanDerWaalsContact O-N 3.1Å; L793-A796 PolarHBondContact O-N 3.07Å; T794-A796 PolarHBondContact O-N 2.74Å; A796-T799 PolarHBondContact O-N 3.06Å; A796-T799 PolarHBondContact O-OG1 3.4Å; A796-L800 WeakPolarHBondContact O-CB 3.38Å; A796-L800 PolarHBondContact O-N 2.89Å; A796-L800 VanDerWaalsContact O-N 3.09Å
797F89Confident84.1Confident0.333333 Ų0.33333322 Ų220%0.00111%0.11CC..Hα-helixtrans-63.6-48173.9176.1-103.8000111.9L734 F754 L760 L777 M781 L793 T794 N795 T799 L800 I801 I850 F853 I854 I858L734-F797 HydrophobicContact CD1-CB 4.11Å; F754-F797 HydrophobicContact CZ-CE2 4.2Å; L760-F797 HydrophobicContact CD1-CE2 3.97Å; L760-F797 HydrophobicContact CD1-CZ 3.98Å; L760-F797 HydrophobicContact CD2-CE2 4.38Å; L777-F797 HydrophobicContact CD2-CD2 3.7Å; L777-F797 HydrophobicContact CD2-CE2 4.22Å; L777-F797 HydrophobicContact CD2-CG 4.3Å; M781-F797 HydrophobicContact CE-CB 4.33Å; M781-F797 HydrophobicContact CE-CD1 3.7Å; M781-F797 HydrophobicContact CE-CE1 4.33Å; M781-F797 HydrophobicContact CE-CG 4.18Å; M781-F797 HydrophobicContact SD-CB 4.23Å; M781-F797 HydrophobicContact SD-CD1 4.19Å; M781-F797 HydrophobicContact SD-CG 4.14Å; L793-F797 VanDerWaalsContact O-CB 3.28Å; L793-F797 WeakPolarHBondContact O-CB 3.44Å; L793-F797 PolarHBondContact O-N 3.06Å; T794-F797 PolarHBondContact O-N 3.08Å; N795-F797 VanDerWaalsContact C-N 3.33Å; N795-F797 PolarHBondContact O-N 2.9Å; F797-T799 VanDerWaalsContact C-N 3.32Å; F797-T799 PolarHBondContact O-N 3.18Å; F797-L800 WeakPolarHBondContact O-CB 3.22Å; F797-L800 PolarHBondContact O-N 3.01Å; F797-L800 VanDerWaalsContact O-N 3.16Å; F797-I801 HydrophobicContact CD1-CG1 4.32Å; F797-I801 HydrophobicContact CD2-CG1 4.16Å; F797-I801 HydrophobicContact CE1-CG1 3.89Å; F797-I801 HydrophobicContact CE2-CD1 3.84Å; F797-I801 HydrophobicContact CE2-CG1 3.7Å; F797-I801 HydrophobicContact CG-CG1 4.42Å; F797-I801 HydrophobicContact CZ-CD1 3.95Å; F797-I801 HydrophobicContact CZ-CG1 3.57Å; F797-I801 WeakPolarHBondContact O-CG1 3.22Å; F797-I801 PolarHBondContact O-N 3.41Å; F797-I850 HydrophobicContact CZ-CG2 4.41Å; F797-F853 HydrophobicContact CE1-CD1 4.43Å; F797-F853 HydrophobicContact CE1-CE1 4.41Å; F797-I854 HydrophobicContact CE1-CD1 4.32Å; F797-I854 HydrophobicContact CE1-CG1 4.22Å; F797-I858 HydrophobicContact CD1-CD1 4.41Å; F797-I858 HydrophobicContact CE1-CD1 4.48Å
798L87Confident83.5Confident0 Ų015.1 Ų15.10%08%0.084CC..Hα-helixtrans-60-43.5177.3-69.7171.7000111.1T794 N795 L800 I801 T802 I854 I858 I876T794-L798 HydrophobicContact CG2-CD1 3.91Å; T794-L798 HydrophobicContact CG2-CG 4.36Å; T794-L798 WeakPolarHBondContact O-CB 3.43Å; T794-L798 VanDerWaalsContact O-CG 3.29Å; T794-L798 WeakPolarHBondContact O-CG 3.36Å; T794-L798 PolarHBondContact O-N 3.09Å; N795-L798 PolarHBondContact O-N 3.35Å; L798-L800 VanDerWaalsContact C-N 3.32Å; L798-L800 PolarHBondContact O-N 3.23Å; L798-I801 PolarHBondContact O-N 3.11Å; L798-T802 WeakPolarHBondContact O-CB 3.37Å; L798-T802 WeakPolarHBondContact O-CG2 3.44Å; L798-T802 PolarHBondContact O-N 3.03Å; L798-T802 PolarHBondContact O-OG1 3.24Å; L798-I854 HydrophobicContact CD2-CD1 4.36Å; L798-I854 HydrophobicContact CD2-CG1 4.27Å; L798-I854 HydrophobicContact CD2-CG2 3.89Å; L798-I858 HydrophobicContact CD1-CG2 4.3Å; L798-I858 HydrophobicContact CD2-CD1 4.17Å; L798-I876 HydrophobicContact CD1-CG2 4.04Å
799T83.3Confident82.8Confident1 Ų113.4 Ų13.41%0.0067%0.068CC..Hα-helixtrans-59.3-41.7175.5-28.20000112.9Y735 T738 N795 A796 F797 I801 T802 V803 F1253 S1272 Y1273Y735-T799 HydrophobicContact CD1-CG2 3.94Å; Y735-T799 HydrophobicContact CE1-CG2 4.15Å; Y735-T799 WeakPolarHBondContact CE1-OG1 3.34Å; T738-T799 HydrophobicContact CG2-CG2 3.79Å; T738-T799 VanDerWaalsContact CG2-O 3.28Å; T738-T799 WeakPolarHBondContact CG2-O 3.33Å; N795-T799 WeakPolarHBondContact O-CB 3.38Å; N795-T799 WeakPolarHBondContact O-CG2 3.47Å; N795-T799 PolarHBondContact O-N 3.13Å; N795-T799 PolarHBondContact O-OG1 3.36Å; N795-T799 VanDerWaalsContact O-OG1 3.07Å; A796-T799 PolarHBondContact O-N 3.06Å; A796-T799 PolarHBondContact O-OG1 3.4Å; F797-T799 VanDerWaalsContact C-N 3.32Å; F797-T799 PolarHBondContact O-N 3.18Å; T799-I801 PolarHBondContact O-N 3.45Å; T799-T802 WeakPolarHBondContact CA-OG1 3.49Å; T799-T802 PolarHBondContact O-N 2.95Å; T799-T802 PolarHBondContact O-OG1 2.84Å; T799-V803 PolarHBondContact O-N 3.38Å; T799-F1253 HydrophobicContact CG2-CD1 4.12Å; T799-S1272 WeakPolarHBondContact CG2-OG 3.19Å; T799-Y1273 HydrophobicContact CG2-CD1 4.29Å; T799-Y1273 HydrophobicContact CG2-CE1 3.96Å
800L85.3Confident81.6Confident0 Ų012.4 Ų12.40%07%0.066CC..Hα-helixtrans-64.3-46.7175.8-179.864.9000111.6L734 L737 T738 F754 A796 F797 L798 V803 M804L734-L800 HydrophobicContact CD2-CD2 3.82Å; L737-L800 HydrophobicContact CB-CD1 4.05Å; T738-L800 VanDerWaalsContact OG1-CA 3.31Å; T738-L800 WeakPolarHBondContact OG1-CA 3.35Å; T738-L800 WeakPolarHBondContact OG1-CB 3.35Å; T738-L800 PolarHBondContact OG1-N 3.26Å; F754-L800 HydrophobicContact CE2-CD2 4.39Å; A796-L800 WeakPolarHBondContact O-CB 3.38Å; A796-L800 PolarHBondContact O-N 2.89Å; A796-L800 VanDerWaalsContact O-N 3.09Å; F797-L800 WeakPolarHBondContact O-CB 3.22Å; F797-L800 PolarHBondContact O-N 3.01Å; F797-L800 VanDerWaalsContact O-N 3.16Å; L798-L800 VanDerWaalsContact C-N 3.32Å; L798-L800 PolarHBondContact O-N 3.23Å; L800-V803 PolarHBondContact O-N 2.97Å; L800-M804 HydrophobicContact CD1-CG 4.03Å; L800-M804 HydrophobicContact CD1-SD 3.44Å; L800-M804 WeakPolarHBondContact CD1-SD 3.27Å; L800-M804 HydrophobicContact CD2-SD 4.09Å; L800-M804 HydrophobicContact CG-CG 4.33Å; L800-M804 HydrophobicContact CG-SD 3.58Å; L800-M804 VanDerWaalsContact CG-SD 3.58Å; L800-M804 WeakPolarHBondContact O-CB 3.35Å; L800-M804 WeakPolarHBondContact O-CG 3.48Å; L800-M804 PolarHBondContact O-N 2.97Å
801I85.7Confident80.4Confident1.5 Ų1.513.8 Ų13.81%0.0087%0.069CC..Hα-helixtrans-66.9-39-178.2-62.4-56.9000111.5F797 L798 T799 V803 M804 L805 I850 I854 L883F797-I801 HydrophobicContact CD1-CG1 4.32Å; F797-I801 HydrophobicContact CD2-CG1 4.16Å; F797-I801 HydrophobicContact CE1-CG1 3.89Å; F797-I801 HydrophobicContact CE2-CD1 3.84Å; F797-I801 HydrophobicContact CE2-CG1 3.7Å; F797-I801 HydrophobicContact CG-CG1 4.42Å; F797-I801 HydrophobicContact CZ-CD1 3.95Å; F797-I801 HydrophobicContact CZ-CG1 3.57Å; F797-I801 WeakPolarHBondContact O-CG1 3.22Å; F797-I801 PolarHBondContact O-N 3.41Å; L798-I801 PolarHBondContact O-N 3.11Å; T799-I801 PolarHBondContact O-N 3.45Å; I801-V803 VanDerWaalsContact C-N 3.3Å; I801-V803 PolarHBondContact O-N 3.14Å; I801-M804 HydrophobicContact CD1-CE 3.88Å; I801-M804 PolarHBondContact O-N 3.18Å; I801-L805 HydrophobicContact CG2-CB 3.92Å; I801-L805 HydrophobicContact CG2-CD2 3.91Å; I801-L805 HydrophobicContact CG2-CG 4.39Å; I801-L805 WeakPolarHBondContact O-CB 3.4Å; I801-L805 PolarHBondContact O-N 2.97Å; I801-I850 HydrophobicContact CD1-CG2 4.3Å; I801-I850 HydrophobicContact CG1-CG2 4.43Å; I801-I850 HydrophobicContact CG2-CG2 4.25Å; I801-I854 HydrophobicContact CB-CD1 4.42Å; I801-I854 HydrophobicContact CG1-CD1 4.48Å; I801-I854 HydrophobicContact CG2-CD1 3.83Å; I801-L883 HydrophobicContact CB-CD1 4.1Å; I801-L883 HydrophobicContact CG2-CD1 4.07Å; I801-L883 HydrophobicContact CG2-CD2 4.05Å
802T81.3Confident78.6Confident20.25 Ų20.2518.4 Ų18.412%0.12410%0.099CC..Hα-helixtrans-59.4-35.6176.2-37.80000112.4L798 T799 P806 I882 L883 Y1273 T1276L798-T802 WeakPolarHBondContact O-CB 3.37Å; L798-T802 WeakPolarHBondContact O-CG2 3.44Å; L798-T802 PolarHBondContact O-N 3.03Å; L798-T802 PolarHBondContact O-OG1 3.24Å; T799-T802 WeakPolarHBondContact CA-OG1 3.49Å; T799-T802 PolarHBondContact O-N 2.95Å; T799-T802 PolarHBondContact O-OG1 2.84Å; T802-P806 VanDerWaalsContact O-CD 3.29Å; T802-P806 WeakPolarHBondContact O-CD 3.37Å; T802-P806 WeakPolarHBondContact O-CG 3.4Å; T802-I882 HydrophobicContact CG2-CG2 4.21Å; T802-L883 HydrophobicContact CG2-CB 4.16Å; T802-L883 HydrophobicContact CG2-CD1 4.24Å; T802-L883 HydrophobicContact CG2-CG 4.38Å; T802-Y1273 HydrophobicContact CG2-CD1 3.45Å; T802-Y1273 VanDerWaalsContact CG2-CD1 3.45Å; T802-Y1273 HydrophobicContact CG2-CE1 3.83Å; T802-Y1273 HydrophobicContact CG2-CG 4.41Å; T802-T1276 HydrophobicContact CG2-CG2 3.91Å; T802-T1276 WeakPolarHBondContact O-CG2 3.14Å
803V76.6Confident76.8Confident11.75 Ų11.7521.1 Ų21.17%0.07111%0.112CC..Hα-helixtrans-79.6-40.5176.5169.10000112.6T738 C741 T799 L800 I801 K807 F1253 S1272 L1274 W1281T738-V803 HydrophobicContact CG2-CB 4.15Å; T738-V803 HydrophobicContact CG2-CG1 4.31Å; T738-V803 HydrophobicContact CG2-CG2 3.72Å; C741-V803 HydrophobicContact CB-CG1 3.61Å; T799-V803 PolarHBondContact O-N 3.38Å; L800-V803 PolarHBondContact O-N 2.97Å; I801-V803 VanDerWaalsContact C-N 3.3Å; I801-V803 PolarHBondContact O-N 3.14Å; V803-K807 WeakPolarHBondContact O-CD 3.41Å; V803-F1253 HydrophobicContact CG2-CE1 3.5Å; V803-F1253 VanDerWaalsContact CG2-CE1 3.5Å; V803-F1253 HydrophobicContact CG2-CZ 3.61Å; V803-S1272 WeakPolarHBondContact CG2-O 3.48Å; V803-L1274 HydrophobicContact CB-CD1 3.97Å; V803-L1274 HydrophobicContact CG1-CD1 3.44Å; V803-L1274 VanDerWaalsContact CG1-CD1 3.44Å; V803-L1274 HydrophobicContact CG1-CG 4.48Å; V803-L1274 HydrophobicContact CG2-CD1 3.99Å; V803-L1274 HydrophobicContact CG2-CG 4.33Å; V803-W1281 HydrophobicContact CG1-CE3 3.74Å; V803-W1281 HydrophobicContact CG1-CZ3 3.92Å
804M81.2Confident74.3Confident1.5 Ų1.526.4 Ų26.41%0.00715%0.147CC..Hα-helixtrans-85.5-42.5-168.6-149.4-179.762.800113.3C741 I747 I750 W751 L800 I801 K807 L808C741-M804 HydrophobicContact CB-CG 3.95Å; C741-M804 WeakPolarHBondContact SG-CG 3.18Å; I747-M804 HydrophobicContact CG2-CE 4.48Å; I747-M804 HydrophobicContact CG2-CG 3.9Å; I750-M804 HydrophobicContact CB-CE 4.33Å; I750-M804 HydrophobicContact CG2-CE 3.85Å; I750-M804 HydrophobicContact CG2-SD 4.22Å; W751-M804 HydrophobicContact CB-CE 4.08Å; W751-M804 HydrophobicContact CE3-CE 3.52Å; W751-M804 HydrophobicContact CE3-SD 3.96Å; W751-M804 HydrophobicContact CZ3-CE 3.49Å; W751-M804 VanDerWaalsContact CZ3-CE 3.44Å; L800-M804 HydrophobicContact CD1-CG 4.03Å; L800-M804 HydrophobicContact CD1-SD 3.44Å; L800-M804 WeakPolarHBondContact CD1-SD 3.27Å; L800-M804 HydrophobicContact CD2-SD 4.09Å; L800-M804 HydrophobicContact CG-CG 4.33Å; L800-M804 HydrophobicContact CG-SD 3.58Å; L800-M804 VanDerWaalsContact CG-SD 3.58Å; L800-M804 WeakPolarHBondContact O-CB 3.35Å; L800-M804 WeakPolarHBondContact O-CG 3.48Å; L800-M804 PolarHBondContact O-N 2.97Å; I801-M804 HydrophobicContact CD1-CE 3.88Å; I801-M804 PolarHBondContact O-N 3.18Å; M804-K807 PolarHBondContact O-N 3.06Å; M804-L808 HydrophobicContact CB-CD1 4.16Å; M804-L808 HydrophobicContact CE-CD1 4.11Å; M804-L808 HydrophobicContact CG-CD1 3.71Å; M804-L808 HydrophobicContact CG-CG 4.14Å; M804-L808 WeakPolarHBondContact O-CB 3.38Å; M804-L808 WeakPolarHBondContact O-CG 3.38Å; M804-L808 PolarHBondContact O-N 3.19Å; M804-L808 HydrophobicContact SD-CD1 4.16Å
805L80.7Confident71.7Confident3.25 Ų3.2531.9 Ų31.92%0.01718%0.175CC..Hα-helixtrans-66.5-47-168.1-175.363.5000114I801 K807 L808 I809 F847 L883 L887I801-L805 HydrophobicContact CG2-CB 3.92Å; I801-L805 HydrophobicContact CG2-CD2 3.91Å; I801-L805 HydrophobicContact CG2-CG 4.39Å; I801-L805 WeakPolarHBondContact O-CB 3.4Å; I801-L805 PolarHBondContact O-N 2.97Å; L805-K807 VanDerWaalsContact C-N 3.27Å; L805-K807 PolarHBondContact O-N 3.02Å; L805-L808 PolarHBondContact O-N 3.17Å; L805-I809 HydrophobicContact CD1-CD1 4.33Å; L805-I809 HydrophobicContact CD1-CG1 4.41Å; L805-I809 HydrophobicContact CG-CD1 4.19Å; L805-I809 WeakPolarHBondContact O-CD1 3.27Å; L805-I809 VanDerWaalsContact O-CG1 3.31Å; L805-I809 WeakPolarHBondContact O-CG1 3.27Å; L805-I809 PolarHBondContact O-N 3.04Å; L805-I809 VanDerWaalsContact O-N 3.12Å; L805-F847 HydrophobicContact CD1-CB 4.04Å; L805-F847 HydrophobicContact CD1-CD1 3.29Å; L805-F847 HydrophobicContact CD1-CE1 4.01Å; L805-F847 HydrophobicContact CD1-CG 3.92Å; L805-L883 HydrophobicContact CD2-CD1 4.42Å; L805-L887 HydrophobicContact CD2-CD1 3.83Å; L805-L887 HydrophobicContact CD2-CD2 3.92Å; L805-L887 HydrophobicContact CD2-CG 4.37Å; L805-L887 HydrophobicContact CG-CD2 3.99Å
806P73.1Confident69Low21.5 Ų21.536.6 Ų36.614%0.1421%0.206CC..Hα-helixtrans-54.5-42.2177.1-28.938.3000113T802 I809 L887 D890T802-P806 VanDerWaalsContact O-CD 3.29Å; T802-P806 WeakPolarHBondContact O-CD 3.37Å; T802-P806 WeakPolarHBondContact O-CG 3.4Å; P806-I809 PolarHBondContact O-N 2.97Å; P806-L887 HydrophobicContact CG-CD2 4.38Å; P806-D890 WeakPolarHBondContact CB-OD2 3.28Å
807K73.9Confident66.2Low27.5 Ų27.541.3 Ų41.312%0.1224%0.238CC..Hα-helixtrans-75.1-34.2-177.8-64.3-170176.6-177.20112.8C741 K742 Q744 I747 V803 M804 L805 I809 N810 Y811 L1274 E1280 W1281 T1282C741-K807 PolarHBondContact O-NZ 2.96Å; K742-K807 PolarHBondContact O-NZ 3.23Å; Q744-K807 HydrophobicContact CG-CD 4.21Å; I747-K807 HydrophobicContact CD1-CB 3.68Å; I747-K807 HydrophobicContact CD1-CD 3.26Å; I747-K807 HydrophobicContact CD1-CG 4.1Å; V803-K807 WeakPolarHBondContact O-CD 3.41Å; M804-K807 PolarHBondContact O-N 3.06Å; L805-K807 VanDerWaalsContact C-N 3.27Å; L805-K807 PolarHBondContact O-N 3.02Å; K807-I809 VanDerWaalsContact C-N 3.33Å; K807-I809 PolarHBondContact O-N 3.32Å; K807-N810 PolarHBondContact O-N 3.28Å; K807-Y811 WeakPolarHBondContact O-CD2 3.2Å; K807-L1274 HydrophobicContact CD-CD1 4.31Å; K807-E1280 PolarHBondContact NZ-O 3.38Å; K807-W1281 HydrophobicContact CD-CE3 3.84Å; K807-W1281 HydrophobicContact CD-CH2 3.36Å; K807-W1281 HydrophobicContact CD-CZ2 4.19Å; K807-W1281 HydrophobicContact CD-CZ3 3.17Å; K807-W1281 VanDerWaalsContact CE-CH2 3.44Å; K807-W1281 VanDerWaalsContact CE-O 3.23Å; K807-W1281 WeakPolarHBondContact CE-O 3.42Å; K807-W1281 HydrophobicContact CG-CZ3 3.98Å; K807-T1282 HydrophobicContact CG-CG2 4.21Å
808L73.4Confident63.4Low2.25 Ų2.2548.6 Ų48.61%0.01228%0.278CS..Hα-helixtrans-68.2-34.9177.8-92.1167.3000112.8I747 W751 M804 L805 N810 Y811 I813 F847I747-L808 HydrophobicContact CG2-CD1 4.28Å; I747-L808 HydrophobicContact CG2-CD2 3.55Å; I747-L808 VanDerWaalsContact CG2-CD2 3.42Å; I747-L808 HydrophobicContact CG2-CG 3.55Å; I747-L808 VanDerWaalsContact CG2-CG 3.48Å; W751-L808 HydrophobicContact CB-CD1 4.01Å; W751-L808 HydrophobicContact CB-CD2 3.95Å; W751-L808 HydrophobicContact CD2-CD1 3.49Å; W751-L808 VanDerWaalsContact CD2-CD1 3.47Å; W751-L808 HydrophobicContact CD2-CD2 4.48Å; W751-L808 HydrophobicContact CE3-CD1 3.61Å; W751-L808 HydrophobicContact CG-CD1 3.69Å; W751-L808 HydrophobicContact CG-CD2 3.95Å; W751-L808 HydrophobicContact CG-CG 4.47Å; W751-L808 HydrophobicContact CZ3-CD1 4.24Å; M804-L808 HydrophobicContact CB-CD1 4.16Å; M804-L808 HydrophobicContact CE-CD1 4.11Å; M804-L808 HydrophobicContact CG-CD1 3.71Å; M804-L808 HydrophobicContact CG-CG 4.14Å; M804-L808 WeakPolarHBondContact O-CB 3.38Å; M804-L808 WeakPolarHBondContact O-CG 3.38Å; M804-L808 PolarHBondContact O-N 3.19Å; M804-L808 HydrophobicContact SD-CD1 4.16Å; L805-L808 PolarHBondContact O-N 3.17Å; L808-N810 VanDerWaalsContact C-N 3.29Å; L808-N810 PolarHBondContact O-N 3Å; L808-Y811 PolarHBondContact O-N 3.24Å; L808-Y811 VanDerWaalsContact O-N 3.09Å; L808-I813 HydrophobicContact CD2-CD1 3.9Å; L808-I813 HydrophobicContact CD2-CG1 3.92Å; L808-F847 HydrophobicContact CB-CE1 4.02Å; L808-F847 HydrophobicContact CB-CZ 4.02Å; L808-F847 HydrophobicContact CD1-CE1 4.06Å; L808-F847 HydrophobicContact CD1-CZ 4.29Å; L808-F847 HydrophobicContact CD2-CE1 3.88Å; L808-F847 HydrophobicContact CD2-CZ 3.48Å; L808-F847 VanDerWaalsContact CD2-CZ 3.48Å; L808-F847 HydrophobicContact CG-CE1 4.44Å; L808-F847 HydrophobicContact CG-CZ 4.37Å
809I70Confident60.7Low14.25 Ų14.2555 Ų557%0.07332%0.316CS..Hα-helixtrans-61.6-31.7179.2-65.5161.4000111.5L805 P806 K807 L887 R894 P996 P1004L805-I809 HydrophobicContact CD1-CD1 4.33Å; L805-I809 HydrophobicContact CD1-CG1 4.41Å; L805-I809 HydrophobicContact CG-CD1 4.19Å; L805-I809 WeakPolarHBondContact O-CD1 3.27Å; L805-I809 VanDerWaalsContact O-CG1 3.31Å; L805-I809 WeakPolarHBondContact O-CG1 3.27Å; L805-I809 PolarHBondContact O-N 3.04Å; L805-I809 VanDerWaalsContact O-N 3.12Å; P806-I809 PolarHBondContact O-N 2.97Å; K807-I809 VanDerWaalsContact C-N 3.33Å; K807-I809 PolarHBondContact O-N 3.32Å; I809-L887 HydrophobicContact CD1-CD2 3.75Å; I809-R894 VanDerWaalsContact CG2-NH1 3.33Å; I809-P996 HydrophobicContact CG2-CG 4.06Å; I809-P1004 HydrophobicContact CD1-CG 3.63Å; I809-P1004 HydrophobicContact CG1-CG 4.43Å
810N62.9Low58Low71.5 Ų71.562.8 Ų62.838%0.38236%0.357SS..THydrogen-bonded Turntrans-84.7-8.5178.9-65.1-24.3000113.6K807 L808 R894K807-N810 PolarHBondContact O-N 3.28Å; L808-N810 VanDerWaalsContact C-N 3.29Å; L808-N810 PolarHBondContact O-N 3Å; N810-R894 PolarHBondContact OD1-NH1 2.96Å
811Y61.6Low55.2Low92.5 Ų92.574.1 Ų74.136%0.36340%0.4SS..SBendtrans-87.4127.7177.7-111.6-87.6000110.6Q744 P748 K807 L808 I813Q744-Y811 HydrophobicContact CG-CE2 4.4Å; P748-Y811 HydrophobicContact CG-CD1 4.08Å; P748-Y811 HydrophobicContact CG-CE1 3.89Å; P748-Y811 HydrophobicContact CG-CE2 4.35Å; P748-Y811 HydrophobicContact CG-CG 4.39Å; K807-Y811 WeakPolarHBondContact O-CD2 3.2Å; L808-Y811 PolarHBondContact O-N 3.24Å; L808-Y811 VanDerWaalsContact O-N 3.09Å; Y811-I813 VanDerWaalsContact C-N 3.28Å; Y811-I813 PolarHBondContact O-N 3.13Å
812P50.4Low52.4Low97 Ų9780 Ų8063%0.6344%0.441SS*.  trans-70.790.1168.529.6-32000108P814P812-P814 VanDerWaalsContact O-CD 3.24Å; P812-P814 WeakPolarHBondContact O-CD 3.38Å; P812-P814 VanDerWaalsContact O-N 3.09Å
813I47.2Very low49.9Very low72.5 Ų72.582.2 Ų82.237%0.37247%0.468SS..  trans-69.4116.8175.3-57.4167.9000107L808 Y811 I815 F847L808-I813 HydrophobicContact CD2-CD1 3.9Å; L808-I813 HydrophobicContact CD2-CG1 3.92Å; Y811-I813 VanDerWaalsContact C-N 3.28Å; Y811-I813 PolarHBondContact O-N 3.13Å; I813-I815 PolarHBondContact O-N 3Å; I813-F847 HydrophobicContact CD1-CE2 4.06Å; I813-F847 HydrophobicContact CD1-CZ 3.77Å; I813-F847 VanDerWaalsContact CD1-CZ 3.46Å
814P36.7Very low47.7Very low111.5 Ų111.589.6 Ų89.672%0.72451%0.507SS*.  trans-68.8104170.514.6-9.2000107.4P812 P816P812-P814 VanDerWaalsContact O-CD 3.24Å; P812-P814 WeakPolarHBondContact O-CD 3.38Å; P812-P814 VanDerWaalsContact O-N 3.09Å; P814-P816 VanDerWaalsContact O-CD 3.31Å; P814-P816 WeakPolarHBondContact O-CD 3.41Å; P814-P816 VanDerWaalsContact O-N 3.13Å
815I34.9Very low45.2Very low114.75 Ų114.7595.7 Ų95.759%0.58854%0.544SS*.  trans-59.1118.9171.7-57.9167.4000106.4I813 S817I813-I815 PolarHBondContact O-N 3Å; I815-S817 PolarHBondContact O-N 3.12Å; I815-S817 PolarHBondContact O-OG 3Å
816P28.4Very low42.7Very low104.75 Ų104.75104.7 Ų104.768%0.6858%0.583SS**  trans-64109.9-173.93-1.5000110.2P814 N818P814-P816 VanDerWaalsContact O-CD 3.31Å; P814-P816 WeakPolarHBondContact O-CD 3.41Å; P814-P816 VanDerWaalsContact O-N 3.13Å; P816-N818 PolarHBondContact O-N 3.11Å; P816-N818 VanDerWaalsContact O-N 3.14Å
817S28.4Very low40.5Very low98.5 Ų98.5112.6 Ų112.669%0.68962%0.618SS**  trans-74.96.3-176.812.80000114I815 V819 L820I815-S817 PolarHBondContact O-N 3.12Å; I815-S817 PolarHBondContact O-OG 3Å; S817-V819 VanDerWaalsContact C-N 3.29Å; S817-V819 PolarHBondContact O-N 3.29Å; S817-V819 VanDerWaalsContact O-N 3.14Å; S817-L820 PolarHBondContact O-N 2.84Å
818N28.7Very low38.2Very low153.75 Ų153.75120.5 Ų120.582%0.82266%0.658SS**THydrogen-bonded Turntrans-82.215.5-170.1-86.3-2.4000116P816P816-N818 PolarHBondContact O-N 3.11Å; P816-N818 VanDerWaalsContact O-N 3.14Å
819V30.5Very low36Very low133 Ų133123.5 Ų123.581%0.80669%0.689SS**THydrogen-bonded Turntrans-100.8-0.6174.2-173.30000113.1S817 R821S817-V819 VanDerWaalsContact C-N 3.29Å; S817-V819 PolarHBondContact O-N 3.29Å; S817-V819 VanDerWaalsContact O-N 3.14Å; V819-R821 PolarHBondContact O-N 3.36Å
820L27.7Very low33.9Very low164.75 Ų164.75129 Ų12986%0.86372%0.723SS**SBendtrans-102.424.2179.1-69176.2000114.9S817S817-L820 PolarHBondContact O-N 2.84Å
821R25.5Very low32.2Very low238.25 Ų238.25135.6 Ų135.690%0.89975%0.749SS**  trans-131.184.8176-138.2-177.2-128.4-131.21.5112V819V819-R821 PolarHBondContact O-N 3.36Å
822S26.9Very low30.5Very low125.75 Ų125.75134.3 Ų134.388%0.87977%0.765SS**  trans-142.696.3163.6174.30000110.4
823G28.7Very low29.4Very low66.5 Ų66.5137.8 Ų137.869%0.68678%0.777SS**  trans-162.681.3169.900000110.1T825G823-T825 VanDerWaalsContact C-N 3.27Å; G823-T825 PolarHBondContact O-N 3.43Å
824D29.9Very low28.4Very low166.25 Ų166.25140.9 Ų140.989%0.88980%0.8SS**  trans-44.3109.1163.1-75.5-30.9000112.1K826D824-K826 PolarHBondContact O-N 2.98Å; D824-K826 VanDerWaalsContact O-N 3.13Å
825T29.9Very low27.8Very low130.5 Ų130.5141.3 Ų141.380%0.80181%0.805SS**  trans-135102.2159470000112.3G823G823-T825 VanDerWaalsContact C-N 3.27Å; G823-T825 PolarHBondContact O-N 3.43Å
826K27.6Very low27.6Very low192 Ų192144 Ų14484%0.83582%0.819SS**  trans-64.3129.3146.6-73.8168.4-178.9178.60111.3D824D824-K826 PolarHBondContact O-N 2.98Å; D824-K826 VanDerWaalsContact O-N 3.13Å
827E28.2Very low27.6Very low187.25 Ų187.25141.9 Ų141.988%0.87582%0.816SS**  trans137.1113.1140.9-78.3170.3-160.900114.7
828M24.5Very low27.5Very low193.75 Ų193.75145.3 Ų145.395%0.95482%0.821SS**  trans57.1116.6140-156.385.6162.400117.6
829G27.3Very low27.6Very low64.75 Ų64.75144.3 Ų144.367%0.66882%0.816SS**  trans129.188.814900000117.3F831G829-F831 PolarHBondContact O-N 3.41Å
830T26.7Very low27.5Very low128.5 Ų128.5145.4 Ų145.479%0.78882%0.815SS**  trans0.9123.3149.132.60000117.9
831F26.8Very low27.6Very low210.25 Ų210.25141.6 Ų141.692%0.92280%0.8SS**  trans161.8122.9138.4-84.1-77.6000111.9G829G829-F831 PolarHBondContact O-N 3.41Å
832G25.1Very low28.1Very low66.5 Ų66.5133.2 Ų133.269%0.68678%0.778SS**  trans68.3114.6158.400000117.8
833L26.7Very low28.9Very low169.25 Ų169.25134.5 Ų134.589%0.88677%0.77SS**  trans50.4103137.8-59167.8000117.1
834T27Very low30.1Very low139.25 Ų139.25133.7 Ų133.785%0.85475%0.752SS**  -177.4105.6103390000109.4
835S25Very low31.9Very low119.25 Ų119.25127.7 Ų127.783%0.83472%0.72SS**  trans-133.897159.6176.30000109.4G837S835-G837 VanDerWaalsContact C-N 3.35Å; S835-G837 PolarHBondContact O-N 3.39Å
836I29.4Very low33.9Very low171.5 Ų171.5123.1 Ų123.188%0.87969%0.693SS**  trans-103.7112158.1-72.3163.7000106.3
837G28.1Very low36.4Very low60.5 Ų60.5114.9 Ų114.962%0.62466%0.657SS**  trans162.488.4159.900000112.8S835 N839S835-G837 VanDerWaalsContact C-N 3.35Å; S835-G837 PolarHBondContact O-N 3.39Å; G837-N839 VanDerWaalsContact C-N 3.34Å; G837-N839 PolarHBondContact O-N 3.44Å
838H28.1Very low38.9Very low169 Ų169107.6 Ų107.678%0.78262%0.624SS**  trans-133.9112.4156.2-113.8-75.2000110.9I840H838-I840 PolarHBondContact O-N 2.9Å
839N29.5Very low41.5Very low134.25 Ų134.2599.5 Ų99.572%0.71859%0.586SS**  trans48.886.7152.6-59.2-15.9000116.3G837 P841G837-N839 VanDerWaalsContact C-N 3.34Å; G837-N839 PolarHBondContact O-N 3.44Å; N839-P841 WeakPolarHBondContact O-CD 3.42Å
840I29.4Very low44.2Very low156.25 Ų156.2596.4 Ų96.480%0.80155%0.554SS**  trans-84.2110.8155-57.4166.3000106.9H838 S842H838-I840 PolarHBondContact O-N 2.9Å; I840-S842 PolarHBondContact O-N 3.33Å
841P29.9Very low46.9Very low83.75 Ų83.7590.5 Ų90.554%0.54452%0.518SS..  trans-70.8131.5178.826.9-29.1000110.5N839 Q843N839-P841 WeakPolarHBondContact O-CD 3.42Å; P841-Q843 HydrophobicContact CB-CG 4.23Å; P841-Q843 HydrophobicContact CG-CG 3.99Å; P841-Q843 WeakPolarHBondContact O-CG 3.41Å; P841-Q843 PolarHBondContact O-N 3.19Å
842S36.4Very low49.7Very low61.5 Ų61.582.7 Ų82.743%0.4349%0.49SS..  trans-74.890.7-175.150.30000112.7Q765 I840 T844 N1097Q765-S842 PolarHBondContact NE2-O 3.05Å; Q765-S842 VanDerWaalsContact OE1-C 3.24Å; Q765-S842 PolarHBondContact OE1-O 3.15Å; I840-S842 PolarHBondContact O-N 3.33Å; S842-T844 PolarHBondContact O-N 2.98Å; S842-N1097 VanDerWaalsContact CB-ND2 3.34Å; S842-N1097 WeakPolarHBondContact CB-ND2 3.35Å
843Q43Very low52.6Low153 Ų15380.2 Ų80.272%0.71546%0.46SS*.  trans-55.5107.2-175.3-68.4-178.1-0.500113.1P841 N845P841-Q843 HydrophobicContact CB-CG 4.23Å; P841-Q843 HydrophobicContact CG-CG 3.99Å; P841-Q843 WeakPolarHBondContact O-CG 3.41Å; P841-Q843 PolarHBondContact O-N 3.19Å; Q843-N845 PolarHBondContact O-N 3.45Å
844T52.8Low55.5Low51 Ų5172.1 Ų72.131%0.31342%0.418SS..  trans-72.6130.5165.542.90000109.8Q765 S842 P846Q765-T844 HydrophobicContact CG-CG2 3.87Å; Q765-T844 WeakPolarHBondContact CG-OG1 3.43Å; Q765-T844 VanDerWaalsContact NE2-CG2 3.34Å; Q765-T844 VanDerWaalsContact NE2-N 3.1Å; Q765-T844 PolarHBondContact NE2-OG1 3.38Å; S842-T844 PolarHBondContact O-N 2.98Å; T844-P846 WeakPolarHBondContact O-CD 3.08Å; T844-P846 VanDerWaalsContact O-N 3.1Å
845N67.8Low58.4Low39 Ų3965.7 Ų65.721%0.20938%0.378CS..  trans-61.9120.1179.1-175.3-9.2000110.6Q843 F847 L848 S849 T1002Q843-N845 PolarHBondContact O-N 3.45Å; N845-F847 PolarHBondContact O-N 3.08Å; N845-F847 VanDerWaalsContact O-N 3.16Å; N845-F847 WeakPolarHBondContact OD1-CB 3.32Å; N845-F847 WeakPolarHBondContact OD1-CD2 3.24Å; N845-F847 PolarHBondContact OD1-N 2.99Å; N845-L848 HydrophobicContact CB-CB 4.37Å; N845-L848 PolarHBondContact O-N 3.28Å; N845-L848 VanDerWaalsContact O-N 3.12Å; N845-S849 PolarHBondContact O-N 3.01Å; N845-S849 PolarHBondContact O-OG 3.2Å; N845-T1002 WeakPolarHBondContact ND2-CA 3.49Å; N845-T1002 VanDerWaalsContact ND2-CB 3.33Å; N845-T1002 WeakPolarHBondContact ND2-CB 3.29Å; N845-T1002 PolarHBondContact ND2-O 3.37Å
846P73.5Confident61.4Low35.5 Ų35.563.3 Ų63.323%0.23136%0.356CS..Hα-helixtrans-59.5-31.4-176.523.7-35.1000112.9W751 T763 T844 S849 I850W751-P846 HydrophobicContact CH2-CB 4.42Å; W751-P846 HydrophobicContact CZ2-CB 4.24Å; W751-P846 HydrophobicContact CZ2-CG 4.2Å; T763-P846 HydrophobicContact CG2-CB 4.38Å; T844-P846 WeakPolarHBondContact O-CD 3.08Å; T844-P846 VanDerWaalsContact O-N 3.1Å; P846-S849 PolarHBondContact O-N 3.28Å; P846-I850 WeakPolarHBondContact O-CG1 3.44Å; P846-I850 PolarHBondContact O-N 2.93Å
847F78.9Confident64Low18.75 Ų18.7556.3 Ų56.38%0.08232%0.321CS..Hα-helixtrans-63.5-43.8177.8-57.1-51.4000112.1W751 L805 L808 I813 N845 S849 I850 T851W751-F847 HydrophobicContact CD2-CE1 4.46Å; W751-F847 AromaticContact CE2-CE1 3.72Å; W751-F847 AromaticContact CE2-CZ 3.89Å; W751-F847 HydrophobicContact CH2-CD1 4.1Å; W751-F847 AromaticContact CH2-CE1 3.78Å; W751-F847 HydrophobicContact CH2-CE1 3.78Å; W751-F847 AromaticContact CZ2-CD1 3.91Å; W751-F847 HydrophobicContact CZ2-CD1 3.91Å; W751-F847 AromaticContact CZ2-CE1 3.31Å; W751-F847 HydrophobicContact CZ2-CE1 3.31Å; W751-F847 AromaticContact CZ2-CZ 3.84Å; W751-F847 HydrophobicContact CZ2-CZ 3.92Å; W751-F847 HydrophobicContact CZ3-CE1 4.46Å; W751-F847 AromaticContact NE1-CZ 3.95Å; L805-F847 HydrophobicContact CD1-CB 4.04Å; L805-F847 HydrophobicContact CD1-CD1 3.29Å; L805-F847 HydrophobicContact CD1-CE1 4.01Å; L805-F847 HydrophobicContact CD1-CG 3.92Å; L808-F847 HydrophobicContact CB-CE1 4.02Å; L808-F847 HydrophobicContact CB-CZ 4.02Å; L808-F847 HydrophobicContact CD1-CE1 4.06Å; L808-F847 HydrophobicContact CD1-CZ 4.29Å; L808-F847 HydrophobicContact CD2-CE1 3.88Å; L808-F847 HydrophobicContact CD2-CZ 3.48Å; L808-F847 VanDerWaalsContact CD2-CZ 3.48Å; L808-F847 HydrophobicContact CG-CE1 4.44Å; L808-F847 HydrophobicContact CG-CZ 4.37Å; I813-F847 HydrophobicContact CD1-CE2 4.06Å; I813-F847 HydrophobicContact CD1-CZ 3.77Å; I813-F847 VanDerWaalsContact CD1-CZ 3.46Å; N845-F847 PolarHBondContact O-N 3.08Å; N845-F847 VanDerWaalsContact O-N 3.16Å; N845-F847 WeakPolarHBondContact OD1-CB 3.32Å; N845-F847 WeakPolarHBondContact OD1-CD2 3.24Å; N845-F847 PolarHBondContact OD1-N 2.99Å; F847-S849 VanDerWaalsContact C-N 3.32Å; F847-S849 PolarHBondContact O-N 3.23Å; F847-I850 PolarHBondContact O-N 2.99Å; F847-T851 PolarHBondContact O-N 3.22Å; F847-T851 PolarHBondContact O-OG1 3.32Å; F847-T851 VanDerWaalsContact O-OG1 3.11Å
848L80Confident66.9Low33.5 Ų33.553.5 Ų53.518%0.17529%0.292CS..Hα-helixtrans-64.7-39.4177.1-178.157.9000111.3N845 I850 T851 S852 H1007 P1099N845-L848 HydrophobicContact CB-CB 4.37Å; N845-L848 PolarHBondContact O-N 3.28Å; N845-L848 VanDerWaalsContact O-N 3.12Å; L848-I850 VanDerWaalsContact C-N 3.34Å; L848-I850 PolarHBondContact O-N 3.23Å; L848-T851 PolarHBondContact O-N 3.21Å; L848-S852 VanDerWaalsContact O-CB 3.28Å; L848-S852 WeakPolarHBondContact O-CB 3.34Å; L848-S852 PolarHBondContact O-N 3.12Å; L848-S852 PolarHBondContact O-OG 3.5Å; L848-H1007 HydrophobicContact CD1-CB 4.05Å; L848-H1007 WeakPolarHBondContact CD1-CD2 3.3Å; L848-H1007 VanDerWaalsContact CD1-CG 3.5Å; L848-P1099 HydrophobicContact CD2-CG 4.44Å
849S79.6Confident69.9Low23.5 Ų23.545.4 Ų45.416%0.16426%0.255CS..Hα-helixtrans-63.3-40.9176.3-57.70000111.8N845 P846 F847 S852 F853N845-S849 PolarHBondContact O-N 3.01Å; N845-S849 PolarHBondContact O-OG 3.2Å; P846-S849 PolarHBondContact O-N 3.28Å; F847-S849 VanDerWaalsContact C-N 3.32Å; F847-S849 PolarHBondContact O-N 3.23Å; S849-S852 PolarHBondContact O-N 3.09Å; S849-S852 PolarHBondContact O-OG 2.95Å; S849-F853 WeakPolarHBondContact O-CB 3.3Å; S849-F853 PolarHBondContact O-N 3.29Å
850I83.7Confident72.8Confident1.25 Ų1.2540.5 Ų40.51%0.00623%0.228CC..Hα-helixtrans-67.3-46.2176.2-69.6168.6000111.3W751 L760 F762 T763 F797 I801 P846 F847 L848 S852 F853 I854W751-I850 HydrophobicContact CH2-CD1 3.55Å; W751-I850 VanDerWaalsContact CH2-CD1 3.49Å; W751-I850 HydrophobicContact CZ3-CD1 4.1Å; L760-I850 HydrophobicContact CD1-CD1 4.14Å; L760-I850 HydrophobicContact CD1-CG1 4Å; F762-I850 HydrophobicContact CE2-CG1 4.05Å; T763-I850 HydrophobicContact CG2-CD1 4.22Å; T763-I850 HydrophobicContact CG2-CG1 4Å; F797-I850 HydrophobicContact CZ-CG2 4.41Å; I801-I850 HydrophobicContact CD1-CG2 4.3Å; I801-I850 HydrophobicContact CG1-CG2 4.43Å; I801-I850 HydrophobicContact CG2-CG2 4.25Å; P846-I850 WeakPolarHBondContact O-CG1 3.44Å; P846-I850 PolarHBondContact O-N 2.93Å; F847-I850 PolarHBondContact O-N 2.99Å; L848-I850 VanDerWaalsContact C-N 3.34Å; L848-I850 PolarHBondContact O-N 3.23Å; I850-S852 VanDerWaalsContact C-N 3.3Å; I850-S852 PolarHBondContact O-N 3.13Å; I850-F853 WeakPolarHBondContact O-CB 3.32Å; I850-F853 PolarHBondContact O-N 3.05Å; I850-F853 VanDerWaalsContact O-N 3.15Å; I850-I854 HydrophobicContact CG2-CD1 3.74Å; I850-I854 HydrophobicContact CG2-CG1 4.37Å; I850-I854 WeakPolarHBondContact O-CG1 3.27Å; I850-I854 PolarHBondContact O-N 3.29Å
851T84.5Confident75.6Confident3.25 Ų3.2539.4 Ų39.42%0.0221%0.214CC..Hα-helixtrans-61.7-41.6176.6-57.80000110.8F847 L848 F853 I854 T855 P1004 L1008F847-T851 PolarHBondContact O-N 3.22Å; F847-T851 PolarHBondContact O-OG1 3.32Å; F847-T851 VanDerWaalsContact O-OG1 3.11Å; L848-T851 PolarHBondContact O-N 3.21Å; T851-F853 VanDerWaalsContact C-N 3.32Å; T851-F853 PolarHBondContact O-N 2.91Å; T851-I854 PolarHBondContact O-N 3.13Å; T851-T855 HydrophobicContact CG2-CG2 4.38Å; T851-T855 WeakPolarHBondContact O-CB 3.45Å; T851-T855 VanDerWaalsContact O-CG2 3.3Å; T851-T855 WeakPolarHBondContact O-CG2 3.35Å; T851-T855 PolarHBondContact O-N 3.02Å; T851-T855 PolarHBondContact O-OG1 3.03Å; T851-P1004 HydrophobicContact CG2-CB 4.01Å; T851-P1004 WeakPolarHBondContact OG1-CB 3.45Å; T851-L1008 HydrophobicContact CG2-CD1 3.99Å; T851-L1008 HydrophobicContact CG2-CD2 4.03Å; T851-L1008 HydrophobicContact CG2-CG 3.94Å
852S84.7Confident78.4Confident47.75 Ų47.7535.5 Ų35.533%0.33419%0.188SC..Hα-helixtrans-62.8-37.4175.2167.30000112.8L848 S849 I850 T855 N856L848-S852 VanDerWaalsContact O-CB 3.28Å; L848-S852 WeakPolarHBondContact O-CB 3.34Å; L848-S852 PolarHBondContact O-N 3.12Å; L848-S852 PolarHBondContact O-OG 3.5Å; S849-S852 PolarHBondContact O-N 3.09Å; S849-S852 PolarHBondContact O-OG 2.95Å; I850-S852 VanDerWaalsContact C-N 3.3Å; I850-S852 PolarHBondContact O-N 3.13Å; S852-T855 WeakPolarHBondContact CA-OG1 3.35Å; S852-T855 PolarHBondContact O-OG1 3.26Å; S852-T855 VanDerWaalsContact O-OG1 3.07Å; S852-N856 VanDerWaalsContact O-CB 3.26Å; S852-N856 WeakPolarHBondContact O-CB 3.38Å; S852-N856 VanDerWaalsContact O-CG 3.3Å; S852-N856 PolarHBondContact O-N 3.06Å; S852-N856 PolarHBondContact O-ND2 3.13Å; S852-N856 VanDerWaalsContact O-ND2 3.11Å; S852-N856 PolarHBondContact OG-ND2 3.11Å; S852-N856 VanDerWaalsContact OG-ND2 3.08Å
853F86Confident80.8Confident13.25 Ų13.2534.5 Ų34.56%0.05818%0.18CC..Hα-helixtrans-63.7-54.6172.4177.7-104.2000110.3F762 N778 M781 F797 S849 I850 T851 T855 N856 T857 I858F762-F853 HydrophobicContact CD1-CD2 4.24Å; F762-F853 HydrophobicContact CD1-CE2 4.42Å; F762-F853 HydrophobicContact CD1-CG 4.45Å; F762-F853 HydrophobicContact CD2-CB 4.46Å; F762-F853 HydrophobicContact CE1-CB 4.28Å; F762-F853 AromaticContact CE1-CD1 3.95Å; F762-F853 HydrophobicContact CE1-CD1 4.09Å; F762-F853 AromaticContact CE1-CD2 3.65Å; F762-F853 HydrophobicContact CE1-CD2 3.65Å; F762-F853 VanDerWaalsContact CE1-CD2 3.47Å; F762-F853 HydrophobicContact CE1-CE1 4.32Å; F762-F853 AromaticContact CE1-CE2 3.75Å; F762-F853 HydrophobicContact CE1-CE2 3.95Å; F762-F853 AromaticContact CE1-CG 3.74Å; F762-F853 HydrophobicContact CE1-CG 3.74Å; F762-F853 HydrophobicContact CE1-CZ 4.28Å; F762-F853 HydrophobicContact CE2-CB 3.88Å; F762-F853 HydrophobicContact CE2-CG 4.21Å; F762-F853 HydrophobicContact CZ-CB 3.69Å; F762-F853 AromaticContact CZ-CD1 3.73Å; F762-F853 HydrophobicContact CZ-CD1 3.73Å; F762-F853 AromaticContact CZ-CD2 3.92Å; F762-F853 HydrophobicContact CZ-CD2 3.92Å; F762-F853 HydrophobicContact CZ-CE1 4.32Å; F762-F853 HydrophobicContact CZ-CE2 4.35Å; F762-F853 AromaticContact CZ-CG 3.5Å; F762-F853 HydrophobicContact CZ-CG 3.5Å; N778-F853 HydrophobicContact CB-CE2 4.05Å; N778-F853 HydrophobicContact CB-CZ 3.98Å; N778-F853 WeakPolarHBondContact OD1-CE2 3.31Å; N778-F853 WeakPolarHBondContact OD1-CZ 3.35Å; M781-F853 HydrophobicContact CE-CE1 3.87Å; M781-F853 HydrophobicContact CE-CZ 4.29Å; M781-F853 HydrophobicContact SD-CE1 4.35Å; F797-F853 HydrophobicContact CE1-CD1 4.43Å; F797-F853 HydrophobicContact CE1-CE1 4.41Å; S849-F853 WeakPolarHBondContact O-CB 3.3Å; S849-F853 PolarHBondContact O-N 3.29Å; I850-F853 WeakPolarHBondContact O-CB 3.32Å; I850-F853 PolarHBondContact O-N 3.05Å; I850-F853 VanDerWaalsContact O-N 3.15Å; T851-F853 VanDerWaalsContact C-N 3.32Å; T851-F853 PolarHBondContact O-N 2.91Å; F853-T855 VanDerWaalsContact C-N 3.3Å; F853-T855 PolarHBondContact O-N 2.97Å; F853-N856 PolarHBondContact O-N 3.31Å; F853-T857 HydrophobicContact CD2-CG2 3.69Å; F853-T857 WeakPolarHBondContact CD2-OG1 3.41Å; F853-T857 HydrophobicContact CE2-CG2 3.91Å; F853-T857 WeakPolarHBondContact CE2-OG1 3.28Å; F853-T857 WeakPolarHBondContact CG-OG1 3.33Å; F853-T857 WeakPolarHBondContact CZ-OG1 3.37Å; F853-T857 PolarHBondContact O-N 3.37Å; F853-T857 PolarHBondContact O-OG1 3.25Å; F853-I858 HydrophobicContact CD1-CD1 4.13Å; F853-I858 HydrophobicContact CD1-CG1 4.45Å; F853-I858 HydrophobicContact CE1-CD1 3.76Å; F853-I858 HydrophobicContact CE1-CG1 4.09Å; F853-I858 HydrophobicContact CZ-CD1 4.44Å; F853-I858 HydrophobicContact CZ-CG1 4.45Å; F853-I858 PolarHBondContact O-N 3.08Å
854I88.5Confident82.8Confident0 Ų035.2 Ų35.20%019%0.185CC..Iπ-helixtrans-57.7-41.2-179.6-64.3168.3000111.5F797 L798 I801 I850 T851 I858 F859 L883 F884F797-I854 HydrophobicContact CE1-CD1 4.32Å; F797-I854 HydrophobicContact CE1-CG1 4.22Å; L798-I854 HydrophobicContact CD2-CD1 4.36Å; L798-I854 HydrophobicContact CD2-CG1 4.27Å; L798-I854 HydrophobicContact CD2-CG2 3.89Å; I801-I854 HydrophobicContact CB-CD1 4.42Å; I801-I854 HydrophobicContact CG1-CD1 4.48Å; I801-I854 HydrophobicContact CG2-CD1 3.83Å; I850-I854 HydrophobicContact CG2-CD1 3.74Å; I850-I854 HydrophobicContact CG2-CG1 4.37Å; I850-I854 WeakPolarHBondContact O-CG1 3.27Å; I850-I854 PolarHBondContact O-N 3.29Å; T851-I854 PolarHBondContact O-N 3.13Å; I854-I858 HydrophobicContact CG1-CD1 4.19Å; I854-I858 WeakPolarHBondContact O-CB 3.39Å; I854-F859 VanDerWaalsContact O-CB 3.3Å; I854-F859 WeakPolarHBondContact O-CB 3.39Å; I854-F859 PolarHBondContact O-N 3.15Å; I854-L883 HydrophobicContact CD1-CD1 4.11Å; I854-L883 HydrophobicContact CD1-CD2 3.59Å; I854-L883 HydrophobicContact CG2-CD2 4.16Å; I854-F884 HydrophobicContact CG2-CE1 3.87Å; I854-F884 HydrophobicContact CG2-CZ 3.98Å
855T88.2Confident84.5Confident3.25 Ų3.2534.4 Ų34.42%0.0218%0.176CC..Iπ-helixtrans-67.8-53.8176.136.30000111.7T851 S852 F853 L860 F884 L1008 L1018T851-T855 HydrophobicContact CG2-CG2 4.38Å; T851-T855 WeakPolarHBondContact O-CB 3.45Å; T851-T855 VanDerWaalsContact O-CG2 3.3Å; T851-T855 WeakPolarHBondContact O-CG2 3.35Å; T851-T855 PolarHBondContact O-N 3.02Å; T851-T855 PolarHBondContact O-OG1 3.03Å; S852-T855 WeakPolarHBondContact CA-OG1 3.35Å; S852-T855 PolarHBondContact O-OG1 3.26Å; S852-T855 VanDerWaalsContact O-OG1 3.07Å; F853-T855 VanDerWaalsContact C-N 3.3Å; F853-T855 PolarHBondContact O-N 2.97Å; T855-L860 WeakPolarHBondContact O-CB 3.31Å; T855-L860 WeakPolarHBondContact O-CG 3.39Å; T855-L860 PolarHBondContact O-N 3.05Å; T855-F884 HydrophobicContact CG2-CE1 3.76Å; T855-F884 HydrophobicContact CG2-CE2 4.47Å; T855-F884 HydrophobicContact CG2-CZ 3.64Å; T855-L1008 HydrophobicContact CG2-CD2 3.47Å; T855-L1008 VanDerWaalsContact CG2-CD2 3.45Å; T855-L1018 HydrophobicContact CG2-CD1 3.84Å; T855-L1018 HydrophobicContact CG2-CD2 4.36Å
856N87.1Confident85.4Confident69.75 Ų69.7534.9 Ų34.937%0.37319%0.186SC..Iπ-helixtrans-86.6-33.1-166.3-64.3-44.4000114.9S852 F853S852-N856 VanDerWaalsContact O-CB 3.26Å; S852-N856 WeakPolarHBondContact O-CB 3.38Å; S852-N856 VanDerWaalsContact O-CG 3.3Å; S852-N856 PolarHBondContact O-N 3.06Å; S852-N856 PolarHBondContact O-ND2 3.13Å; S852-N856 VanDerWaalsContact O-ND2 3.11Å; S852-N856 PolarHBondContact OG-ND2 3.11Å; S852-N856 VanDerWaalsContact OG-ND2 3.08Å; F853-N856 PolarHBondContact O-N 3.31Å
857T84.9Confident86.1Confident23.5 Ų23.534.9 Ų34.914%0.14418%0.182CC..Iπ-helixtrans-101-35.8-175.965.90000112.8F853 R861 R865F853-T857 HydrophobicContact CD2-CG2 3.69Å; F853-T857 WeakPolarHBondContact CD2-OG1 3.41Å; F853-T857 HydrophobicContact CE2-CG2 3.91Å; F853-T857 WeakPolarHBondContact CE2-OG1 3.28Å; F853-T857 WeakPolarHBondContact CG-OG1 3.33Å; F853-T857 WeakPolarHBondContact CZ-OG1 3.37Å; F853-T857 PolarHBondContact O-N 3.37Å; F853-T857 PolarHBondContact O-OG1 3.25Å; T857-R861 VanDerWaalsContact O-CB 3.27Å; T857-R861 WeakPolarHBondContact O-CB 3.4Å; T857-R861 VanDerWaalsContact O-CD 3.25Å; T857-R861 WeakPolarHBondContact O-CD 3.4Å; T857-R861 VanDerWaalsContact O-CG 3.25Å; T857-R861 WeakPolarHBondContact O-CG 3.21Å; T857-R865 PolarHBondContact O-NH2 3.2Å
858I88.5Confident86.4Confident1.75 Ų1.7542.5 Ų42.51%0.00921%0.21CC..Iπ-helixtrans-91.9-70.1179.8-54.7176.6000109.7M781 T794 F797 L798 F853 I854 L860 R861 H862 I876M781-I858 HydrophobicContact CE-CD1 3.5Å; M781-I858 VanDerWaalsContact CE-CD1 3.47Å; M781-I858 HydrophobicContact CE-CG1 4.24Å; T794-I858 HydrophobicContact CG2-CD1 4.42Å; T794-I858 HydrophobicContact CG2-CG2 3.9Å; F797-I858 HydrophobicContact CD1-CD1 4.41Å; F797-I858 HydrophobicContact CE1-CD1 4.48Å; L798-I858 HydrophobicContact CD1-CG2 4.3Å; L798-I858 HydrophobicContact CD2-CD1 4.17Å; F853-I858 HydrophobicContact CD1-CD1 4.13Å; F853-I858 HydrophobicContact CD1-CG1 4.45Å; F853-I858 HydrophobicContact CE1-CD1 3.76Å; F853-I858 HydrophobicContact CE1-CG1 4.09Å; F853-I858 HydrophobicContact CZ-CD1 4.44Å; F853-I858 HydrophobicContact CZ-CG1 4.45Å; F853-I858 PolarHBondContact O-N 3.08Å; I854-I858 HydrophobicContact CG1-CD1 4.19Å; I854-I858 WeakPolarHBondContact O-CB 3.39Å; I858-L860 PolarHBondContact O-N 2.9Å; I858-R861 PolarHBondContact O-N 3.01Å; I858-H862 WeakPolarHBondContact O-CB 3.35Å; I858-H862 PolarHBondContact O-N 2.95Å; I858-I876 HydrophobicContact CG2-CG2 3.78Å
859F91Very high86.6Confident0 Ų044.8 Ų44.80%022%0.222CC..Iπ-helixtrans-65.6-46.3-169.8-175.3-108.2000112.9I854 R861 H862 C880 L881 F884 L1018 M1021 V1022 L1025I854-F859 VanDerWaalsContact O-CB 3.3Å; I854-F859 WeakPolarHBondContact O-CB 3.39Å; I854-F859 PolarHBondContact O-N 3.15Å; F859-R861 VanDerWaalsContact C-N 3.28Å; F859-R861 PolarHBondContact O-N 3.24Å; F859-H862 PolarHBondContact O-N 3.27Å; F859-H862 PolarHBondContact O-ND1 2.97Å; F859-C880 HydrophobicContact CB-CB 4.21Å; F859-C880 HydrophobicContact CD2-CB 3.51Å; F859-C880 VanDerWaalsContact CD2-CB 3.44Å; F859-C880 HydrophobicContact CE2-CB 4.23Å; F859-C880 HydrophobicContact CG-CB 4.16Å; F859-L881 HydrophobicContact CE2-CD1 4.47Å; F859-L881 HydrophobicContact CE2-CD2 3.99Å; F859-L881 HydrophobicContact CE2-CG 3.95Å; F859-L881 HydrophobicContact CZ-CD2 3.74Å; F859-L881 HydrophobicContact CZ-CG 4.2Å; F859-F884 HydrophobicContact CB-CE2 4.11Å; F859-F884 HydrophobicContact CB-CZ 4.07Å; F859-F884 AromaticContact CD1-CE2 3.77Å; F859-F884 HydrophobicContact CD1-CE2 3.77Å; F859-F884 HydrophobicContact CD1-CZ 4.43Å; F859-F884 HydrophobicContact CD2-CE2 4.16Å; F859-F884 HydrophobicContact CE1-CE2 4.18Å; F859-F884 HydrophobicContact CE2-CE2 4.5Å; F859-F884 AromaticContact CG-CE2 3.74Å; F859-F884 HydrophobicContact CG-CE2 3.74Å; F859-F884 HydrophobicContact CG-CZ 4.22Å; F859-F884 HydrophobicContact CZ-CE2 4.47Å; F859-L1018 HydrophobicContact CD1-CD1 3.97Å; F859-L1018 HydrophobicContact CD1-CG 4.44Å; F859-L1018 HydrophobicContact CE1-CD1 4.02Å; F859-L1018 HydrophobicContact CE1-CG 4.37Å; F859-M1021 HydrophobicContact CD1-CG 4.16Å; F859-M1021 HydrophobicContact CE1-CB 3.92Å; F859-M1021 HydrophobicContact CE1-CG 3.54Å; F859-M1021 VanDerWaalsContact CE1-CG 3.49Å; F859-M1021 HydrophobicContact CZ-CB 4.45Å; F859-M1021 HydrophobicContact CZ-CG 3.82Å; F859-V1022 HydrophobicContact CE1-CG2 4.26Å; F859-V1022 HydrophobicContact CZ-CG2 4.22Å; F859-L1025 HydrophobicContact CE2-CD1 3.77Å; F859-L1025 HydrophobicContact CZ-CD1 3.7Å
860L90Very high86.7Confident32 Ų3248.1 Ų48.117%0.16824%0.243CC..THydrogen-bonded Turntrans-70.6-21.1179.4-72.6-180000113.9T855 I858 S1017 M1021T855-L860 WeakPolarHBondContact O-CB 3.31Å; T855-L860 WeakPolarHBondContact O-CG 3.39Å; T855-L860 PolarHBondContact O-N 3.05Å; I858-L860 PolarHBondContact O-N 2.9Å; L860-S1017 VanDerWaalsContact CD1-OG 3.26Å; L860-S1017 WeakPolarHBondContact CD1-OG 3.33Å; L860-S1017 WeakPolarHBondContact CD2-O 3.44Å; L860-M1021 HydrophobicContact CD2-CB 3.96Å; L860-M1021 HydrophobicContact CD2-CE 4.39Å; L860-M1021 HydrophobicContact CD2-CG 4.37Å; L860-M1021 WeakPolarHBondContact O-CE 3.34Å
861R89.1Confident86.6Confident132.5 Ų132.550.5 Ų50.550%0.526%0.258SS..THydrogen-bonded Turntrans-99.4-10.8179.5-56.5-173.6179.5-179-3.7113.9D782 T857 I858 F859 T863 M864 R865D782-R861 IonicContact OD1-NH1 3.19Å; D782-R861 PolarHBondContact OD1-NH1 3Å; D782-R861 IonicContact OD2-CZ 2.75Å; D782-R861 IonicContact OD2-NH1 3.3Å; D782-R861 PolarHBondContact OD2-NH1 3.31Å; T857-R861 VanDerWaalsContact O-CB 3.27Å; T857-R861 WeakPolarHBondContact O-CB 3.4Å; T857-R861 VanDerWaalsContact O-CD 3.25Å; T857-R861 WeakPolarHBondContact O-CD 3.4Å; T857-R861 VanDerWaalsContact O-CG 3.25Å; T857-R861 WeakPolarHBondContact O-CG 3.21Å; I858-R861 PolarHBondContact O-N 3.01Å; F859-R861 VanDerWaalsContact C-N 3.28Å; F859-R861 PolarHBondContact O-N 3.24Å; R861-T863 PolarHBondContact O-N 2.81Å; R861-T863 VanDerWaalsContact O-N 3.1Å; R861-M864 PolarHBondContact O-N 3.23Å; R861-R865 PolarHBondContact O-N 2.91Å; R861-R865 VanDerWaalsContact O-N 3.14Å
862H87.7Confident86.6Confident0.75 Ų0.7551.4 Ų51.40%0.00326%0.262CS..THydrogen-bonded Turntrans-58.5-27.5-175.588.7-78.1000112.9I858 F859 M864 Y867 I876I858-H862 WeakPolarHBondContact O-CB 3.35Å; I858-H862 PolarHBondContact O-N 2.95Å; F859-H862 PolarHBondContact O-N 3.27Å; F859-H862 PolarHBondContact O-ND1 2.97Å; H862-M864 VanDerWaalsContact C-N 3.34Å; H862-Y867 WeakPolarHBondContact CA-OH 3.33Å; H862-Y867 VanDerWaalsContact O-CE2 3.25Å; H862-Y867 WeakPolarHBondContact O-CE2 3.34Å; H862-Y867 PolarHBondContact O-OH 3.32Å; H862-I876 HydrophobicContact CB-CG2 4.27Å
863T86.2Confident86.8Confident42.25 Ų42.2552.1 Ų52.126%0.25926%0.257SS..THydrogen-bonded Turntrans-77.7-19.8177.456.90000114R861 M1021R861-T863 PolarHBondContact O-N 2.81Å; R861-T863 VanDerWaalsContact O-N 3.1Å; T863-M1021 HydrophobicContact CG2-CE 3.96Å; T863-M1021 HydrophobicContact CG2-SD 3.54Å; T863-M1021 VanDerWaalsContact CG2-SD 3.56Å; T863-M1021 WeakPolarHBondContact CG2-SD 3.46Å; T863-M1021 WeakPolarHBondContact OG1-CE 3.25Å
864M85.6Confident86.8Confident167.25 Ų167.2551.8 Ų51.882%0.82426%0.256SS*.THydrogen-bonded Turntrans-97-12-178.6-61.7-120.8155.600113R861 H862R861-M864 PolarHBondContact O-N 3.23Å; H862-M864 VanDerWaalsContact C-N 3.34Å
865R88Confident86.6Confident32.75 Ų32.7552.8 Ų52.812%0.12426%0.261CS..SBendtrans-78147.5178.5-76-178-172.3-147.2-2.2111.1M781 D782 Y791 T857 R861 Y867M781-R865 PolarHBondContact O-NH1 3.1Å; M781-R865 VanDerWaalsContact O-NH1 3.1Å; M781-R865 PolarHBondContact O-NH2 3.37Å; D782-R865 IonicContact OD1-CZ 3.99Å; D782-R865 IonicContact OD1-NH2 2.86Å; D782-R865 PolarHBondContact OD1-NH2 3.34Å; Y791-R865 WeakPolarHBondContact OH-CB 3.29Å; T857-R865 PolarHBondContact O-NH2 3.2Å; R861-R865 PolarHBondContact O-N 2.91Å; R861-R865 VanDerWaalsContact O-N 3.14Å; R865-Y867 HydrophobicContact CB-CE2 3.96Å; R865-Y867 VanDerWaalsContact O-CD2 3.27Å; R865-Y867 WeakPolarHBondContact O-CD2 3.15Å; R865-Y867 VanDerWaalsContact O-CE2 3.25Å; R865-Y867 WeakPolarHBondContact O-CE2 3.33Å
866A88Confident86.6Confident50.25 Ų50.2552.7 Ų52.742%0.41526%0.261SS..  trans-85.6145.7172.500000110.6E789 Y791E789-A866 HydrophobicContact CG-CB 4.26Å; Y791-A866 VanDerWaalsContact CE2-O 3.25Å; Y791-A866 WeakPolarHBondContact CE2-O 3.15Å; Y791-A866 PolarHBondContact OH-O 3.34Å
867Y88.7Confident86.6Confident36.5 Ų36.549.4 Ų49.414%0.14324%0.243CC..  trans-135.4128.6-177-62.6-92.7000110.4E789 Y791 H862 R865 N869 E872 R873 I876E789-Y867 WeakPolarHBondContact O-CA 3.41Å; Y791-Y867 AromaticContact CD2-CD1 3.51Å; Y791-Y867 HydrophobicContact CD2-CD1 3.51Å; Y791-Y867 VanDerWaalsContact CD2-CD1 3.47Å; Y791-Y867 AromaticContact CD2-CE1 3.41Å; Y791-Y867 HydrophobicContact CD2-CE1 3.41Å; Y791-Y867 VanDerWaalsContact CD2-CE1 3.42Å; Y791-Y867 HydrophobicContact CD2-CG 4.48Å; Y791-Y867 AromaticContact CE2-CD1 3.35Å; Y791-Y867 HydrophobicContact CE2-CD1 3.35Å; Y791-Y867 VanDerWaalsContact CE2-CD1 3.42Å; Y791-Y867 AromaticContact CE2-CE1 3.34Å; Y791-Y867 HydrophobicContact CE2-CE1 3.34Å; Y791-Y867 HydrophobicContact CE2-CG 4.08Å; Y791-Y867 AromaticContact CE2-CZ 3.99Å; Y791-Y867 HydrophobicContact CG-CE1 4.33Å; H862-Y867 WeakPolarHBondContact CA-OH 3.33Å; H862-Y867 VanDerWaalsContact O-CE2 3.25Å; H862-Y867 WeakPolarHBondContact O-CE2 3.34Å; H862-Y867 PolarHBondContact O-OH 3.32Å; R865-Y867 HydrophobicContact CB-CE2 3.96Å; R865-Y867 VanDerWaalsContact O-CD2 3.27Å; R865-Y867 WeakPolarHBondContact O-CD2 3.15Å; R865-Y867 VanDerWaalsContact O-CE2 3.25Å; R865-Y867 WeakPolarHBondContact O-CE2 3.33Å; Y867-N869 VanDerWaalsContact C-N 3.34Å; Y867-E872 HydrophobicContact CD1-CB 4.18Å; Y867-E872 HydrophobicContact CD1-CG 4.38Å; Y867-E872 HydrophobicContact CE1-CG 4.42Å; Y867-R873 HydrophobicContact CD1-CB 4.18Å; Y867-R873 HydrophobicContact CD2-CB 3.9Å; Y867-R873 HydrophobicContact CD2-CG 4.37Å; Y867-R873 HydrophobicContact CE1-CB 4.03Å; Y867-R873 HydrophobicContact CE2-CB 3.74Å; Y867-R873 HydrophobicContact CE2-CG 3.83Å; Y867-R873 HydrophobicContact CG-CB 4.13Å; Y867-I876 HydrophobicContact CE1-CD1 3.79Å
868R84.8Confident86.6Confident177 Ų17748.3 Ų48.367%0.66824%0.236SC*.SBendtrans-65.8-41.4171.9-169.4-174.8-173.6168.83.9111.4E789 E790E789-R868 HydrophobicContact CB-CB 4.28Å; E789-R868 WeakPolarHBondContact O-CB 3.18Å; E789-R868 PolarHBondContact O-N 3.09Å; E790-R868 HydrophobicContact CG-CB 4.14Å; E790-R868 WeakPolarHBondContact OE1-CD 3.14Å; E790-R868 IonicContact OE1-CZ 3.07Å; E790-R868 IonicContact OE1-NE 3.22Å; E790-R868 IonicContact OE1-NH1 3.54Å; E790-R868 PolarHBondContact OE1-NH1 3.17Å
869N82.9Confident86.3Confident81.75 Ų81.7548.7 Ų48.744%0.43724%0.239SC..SBendtrans-107.6113171.5-157.9-8.2000109.7Y867 V871 E872Y867-N869 VanDerWaalsContact C-N 3.34Å; N869-V871 PolarHBondContact O-N 3.13Å; N869-V871 WeakPolarHBondContact OD1-CB 3.41Å; N869-V871 WeakPolarHBondContact OD1-CG2 3.37Å; N869-V871 PolarHBondContact OD1-N 3.05Å; N869-E872 HydrophobicContact CB-CB 4.4Å; N869-E872 WeakPolarHBondContact O-CB 3.37Å; N869-E872 PolarHBondContact O-N 3.01Å
870P82.7Confident86.2Confident93.5 Ų93.548.7 Ų48.761%0.60724%0.239SC*.THydrogen-bonded Turntrans-64-16.5-178.126.9-35.7000113.9E872P870-E872 VanDerWaalsContact C-N 3.34Å
871V82.2Confident86.1Confident51.5 Ų51.547.2 Ų47.231%0.31223%0.231SC..THydrogen-bonded Turntrans-69.9-34.1175-179.10000111.6N869 R873 W874 D875 P1043 S1045N869-V871 PolarHBondContact O-N 3.13Å; N869-V871 WeakPolarHBondContact OD1-CB 3.41Å; N869-V871 WeakPolarHBondContact OD1-CG2 3.37Å; N869-V871 PolarHBondContact OD1-N 3.05Å; V871-R873 PolarHBondContact O-N 3.11Å; V871-R873 VanDerWaalsContact O-N 3.16Å; V871-W874 WeakPolarHBondContact O-CA 3.42Å; V871-W874 WeakPolarHBondContact O-CB 3.21Å; V871-W874 PolarHBondContact O-N 3.19Å; V871-D875 PolarHBondContact O-N 3.32Å; V871-D875 VanDerWaalsContact O-OD2 3.09Å; V871-P1043 HydrophobicContact CB-CB 4.43Å; V871-P1043 HydrophobicContact CG1-CB 3.91Å; V871-P1043 HydrophobicContact CG1-CG 4.44Å; V871-P1043 HydrophobicContact CG2-CB 4.08Å; V871-P1043 HydrophobicContact CG2-CG 4.4Å; V871-S1045 VanDerWaalsContact CG1-OG 3.3Å; V871-S1045 WeakPolarHBondContact CG1-OG 3.4Å; V871-S1045 PolarHBondContact O-OG 3.02Å
872E84.4Confident85.8Confident22 Ų2241.9 Ų41.910%0.10321%0.213CC..Hα-helixtrans-62.8-30.4-176.8-174173.6-144.200112.3Y791 N795 Y867 N869 P870 W874 D875 I876Y791-E872 VanDerWaalsContact C-OE1 3.29Å; Y791-E872 VanDerWaalsContact CA-OE1 3.32Å; Y791-E872 WeakPolarHBondContact CA-OE1 3.31Å; Y791-E872 HydrophobicContact CD2-CG 4.48Å; Y791-E872 PolarHBondContact N-OE1 3.04Å; Y791-E872 PolarHBondContact N-OE2 3.06Å; N795-E872 WeakPolarHBondContact ND2-CG 3.35Å; N795-E872 PolarHBondContact ND2-OE1 3.31Å; N795-E872 VanDerWaalsContact ND2-OE1 3.16Å; Y867-E872 HydrophobicContact CD1-CB 4.18Å; Y867-E872 HydrophobicContact CD1-CG 4.38Å; Y867-E872 HydrophobicContact CE1-CG 4.42Å; N869-E872 HydrophobicContact CB-CB 4.4Å; N869-E872 WeakPolarHBondContact O-CB 3.37Å; N869-E872 PolarHBondContact O-N 3.01Å; P870-E872 VanDerWaalsContact C-N 3.34Å; E872-W874 PolarHBondContact O-N 3.44Å; E872-D875 WeakPolarHBondContact CA-OD2 3.48Å; E872-D875 WeakPolarHBondContact O-CB 3.29Å; E872-D875 PolarHBondContact O-N 3.17Å; E872-D875 VanDerWaalsContact O-N 3.1Å; E872-I876 PolarHBondContact O-N 3.21Å; E872-I876 VanDerWaalsContact O-N 3.1Å
873R88.1Confident85.6Confident62 Ų6242.1 Ų42.123%0.23421%0.214CC..Hα-helixtrans-53.6-42.1171.6179.3-177.2163.6178.7-5.4111.9Y867 V871 A877Y867-R873 HydrophobicContact CD1-CB 4.18Å; Y867-R873 HydrophobicContact CD2-CB 3.9Å; Y867-R873 HydrophobicContact CD2-CG 4.37Å; Y867-R873 HydrophobicContact CE1-CB 4.03Å; Y867-R873 HydrophobicContact CE2-CB 3.74Å; Y867-R873 HydrophobicContact CE2-CG 3.83Å; Y867-R873 HydrophobicContact CG-CB 4.13Å; V871-R873 PolarHBondContact O-N 3.11Å; V871-R873 VanDerWaalsContact O-N 3.16Å; R873-A877 WeakPolarHBondContact O-CB 3.41Å; R873-A877 PolarHBondContact O-N 2.88Å
874W86.9Confident85.7Confident7.75 Ų7.7540.1 Ų40.13%0.02920%0.201CC..Hα-helixtrans-77.5-28.6179.8-69.6105.6000112.3V871 E872 A877 A878 L1025 V1028 R1032 S1045 M1046 A1049V871-W874 WeakPolarHBondContact O-CA 3.42Å; V871-W874 WeakPolarHBondContact O-CB 3.21Å; V871-W874 PolarHBondContact O-N 3.19Å; E872-W874 PolarHBondContact O-N 3.44Å; W874-A877 PolarHBondContact O-N 3.13Å; W874-A878 VanDerWaalsContact O-CB 3.24Å; W874-A878 WeakPolarHBondContact O-CB 3.41Å; W874-A878 PolarHBondContact O-N 2.94Å; W874-L1025 HydrophobicContact CE3-CD1 4.12Å; W874-L1025 HydrophobicContact CH2-CD1 3.83Å; W874-L1025 HydrophobicContact CH2-CD2 4.22Å; W874-L1025 HydrophobicContact CH2-CG 4.27Å; W874-L1025 HydrophobicContact CZ3-CB 4.48Å; W874-L1025 HydrophobicContact CZ3-CD1 3.45Å; W874-L1025 VanDerWaalsContact CZ3-CD1 3.45Å; W874-L1025 HydrophobicContact CZ3-CD2 4.04Å; W874-L1025 HydrophobicContact CZ3-CG 3.69Å; W874-V1028 HydrophobicContact CH2-CB 4.41Å; W874-V1028 HydrophobicContact CH2-CG1 4.18Å; W874-V1028 HydrophobicContact CZ2-CG1 4.02Å; W874-R1032 VanDerWaalsContact CZ2-NH1 3.35Å; W874-S1045 VanDerWaalsContact CB-OG 3.28Å; W874-S1045 WeakPolarHBondContact CB-OG 3.26Å; W874-M1046 HydrophobicContact CB-CB 4.31Å; W874-M1046 HydrophobicContact CD2-CB 3.65Å; W874-M1046 HydrophobicContact CD2-CG 3.63Å; W874-M1046 HydrophobicContact CD2-SD 4.39Å; W874-M1046 HydrophobicContact CE3-CB 3.93Å; W874-M1046 HydrophobicContact CE3-CG 3.68Å; W874-M1046 HydrophobicContact CG-CB 3.84Å; W874-M1046 HydrophobicContact CG-CG 4.32Å; W874-M1046 HydrophobicContact CH2-CG 3.75Å; W874-M1046 HydrophobicContact CH2-SD 4.16Å; W874-M1046 HydrophobicContact CZ2-CB 4.46Å; W874-M1046 HydrophobicContact CZ2-CG 3.71Å; W874-M1046 HydrophobicContact CZ2-SD 3.67Å; W874-M1046 VanDerWaalsContact CZ2-SD 3.56Å; W874-M1046 HydrophobicContact CZ3-CB 4.46Å; W874-M1046 HydrophobicContact CZ3-CG 3.73Å; W874-A1049 HydrophobicContact CE3-CB 3.92Å; W874-A1049 HydrophobicContact CZ3-CB 4.32Å
875D83.3Confident85.6Confident20 Ų2032.3 Ų32.311%0.10716%0.163CC..Hα-helixtrans-63.7-44.5173.5-68.8-51.7000111.5V871 E872 A878 S879 S1045 P1254 L1255V871-D875 PolarHBondContact O-N 3.32Å; V871-D875 VanDerWaalsContact O-OD2 3.09Å; E872-D875 WeakPolarHBondContact CA-OD2 3.48Å; E872-D875 WeakPolarHBondContact O-CB 3.29Å; E872-D875 PolarHBondContact O-N 3.17Å; E872-D875 VanDerWaalsContact O-N 3.1Å; D875-A878 PolarHBondContact O-N 3.07Å; D875-S879 WeakPolarHBondContact O-CB 3.33Å; D875-S879 PolarHBondContact O-N 3.09Å; D875-S879 PolarHBondContact O-OG 3.24Å; D875-S1045 WeakPolarHBondContact OD1-CB 3.34Å; D875-P1254 HydrophobicContact CB-CB 4.35Å; D875-L1255 HydrophobicContact CB-CD1 4.05Å; D875-L1255 HydrophobicContact CB-CG 4.04Å; D875-L1255 WeakPolarHBondContact OD1-CD1 3.46Å
876I87.5Confident85.2Confident2.25 Ų2.2531.4 Ų31.41%0.01216%0.164CC..Hα-helixtrans-63.2-46.8175.1-62.9176.6000110.4Y791 T794 N795 L798 I858 H862 Y867 E872 A878 S879 C880Y791-I876 HydrophobicContact CD1-CD1 4.4Å; Y791-I876 HydrophobicContact CD2-CD1 4.18Å; Y791-I876 HydrophobicContact CG-CD1 3.84Å; T794-I876 HydrophobicContact CG2-CD1 4.26Å; T794-I876 HydrophobicContact CG2-CG1 4.4Å; T794-I876 HydrophobicContact CG2-CG2 4.39Å; N795-I876 VanDerWaalsContact OD1-CG1 3.27Å; N795-I876 WeakPolarHBondContact OD1-CG1 3.3Å; L798-I876 HydrophobicContact CD1-CG2 4.04Å; I858-I876 HydrophobicContact CG2-CG2 3.78Å; H862-I876 HydrophobicContact CB-CG2 4.27Å; Y867-I876 HydrophobicContact CE1-CD1 3.79Å; E872-I876 PolarHBondContact O-N 3.21Å; E872-I876 VanDerWaalsContact O-N 3.1Å; I876-A878 PolarHBondContact O-N 3.13Å; I876-S879 PolarHBondContact O-N 3.28Å; I876-C880 PolarHBondContact O-N 3.09Å; I876-C880 PolarHBondContact O-SG 3.22Å; I876-C880 VanDerWaalsContact O-SG 3.37Å
877A88.9Confident85Confident0 Ų029.1 Ų29.10%014%0.144CC..Hα-helixtrans-61.7-44.9179.700000111.9R873 W874 C880 L881 L1025 A1049R873-A877 WeakPolarHBondContact O-CB 3.41Å; R873-A877 PolarHBondContact O-N 2.88Å; W874-A877 PolarHBondContact O-N 3.13Å; A877-C880 PolarHBondContact O-N 3.25Å; A877-L881 WeakPolarHBondContact O-CB 3.25Å; A877-L881 VanDerWaalsContact O-CG 3.32Å; A877-L881 WeakPolarHBondContact O-CG 3.44Å; A877-L881 PolarHBondContact O-N 2.87Å; A877-L1025 HydrophobicContact CB-CD1 4.3Å; A877-L1025 HydrophobicContact CB-CD2 3.9Å; A877-A1049 HydrophobicContact CB-CB 4.41Å
878A84.1Confident84.8Confident1.25 Ų1.2527.3 Ų27.31%0.0114%0.138CC..Hα-helixtrans-60.6-47.5176.300000111.4W874 D875 I876 C880 L881 I882 R1048 A1049 P1254W874-A878 VanDerWaalsContact O-CB 3.24Å; W874-A878 WeakPolarHBondContact O-CB 3.41Å; W874-A878 PolarHBondContact O-N 2.94Å; D875-A878 PolarHBondContact O-N 3.07Å; I876-A878 PolarHBondContact O-N 3.13Å; A878-C880 VanDerWaalsContact C-N 3.33Å; A878-C880 PolarHBondContact O-N 3.12Å; A878-L881 PolarHBondContact O-N 3.12Å; A878-I882 VanDerWaalsContact O-CB 3.26Å; A878-I882 WeakPolarHBondContact O-CB 3.25Å; A878-I882 WeakPolarHBondContact O-CD1 3.44Å; A878-I882 VanDerWaalsContact O-CG1 3.23Å; A878-I882 WeakPolarHBondContact O-CG1 3.33Å; A878-I882 PolarHBondContact O-N 2.99Å; A878-R1048 HydrophobicContact CB-CB 4.03Å; A878-A1049 HydrophobicContact CB-CB 3.99Å; A878-P1254 HydrophobicContact CB-CG 4.46Å
879S82.8Confident84.7Confident8.75 Ų8.7520.3 Ų20.36%0.06111%0.112CC..Hα-helixtrans-60.6-41.8-179.7-55.50000112.1D875 I876 L883 P1254 Y1273D875-S879 WeakPolarHBondContact O-CB 3.33Å; D875-S879 PolarHBondContact O-N 3.09Å; D875-S879 PolarHBondContact O-OG 3.24Å; I876-S879 PolarHBondContact O-N 3.28Å; S879-L883 WeakPolarHBondContact O-CB 3.36Å; S879-L883 PolarHBondContact O-N 3.02Å; S879-L883 VanDerWaalsContact O-N 3.14Å; S879-P1254 WeakPolarHBondContact OG-CB 3.41Å; S879-P1254 VanDerWaalsContact OG-CG 3.27Å; S879-P1254 WeakPolarHBondContact OG-CG 3.41Å; S879-Y1273 VanDerWaalsContact CB-OH 3.3Å; S879-Y1273 WeakPolarHBondContact CB-OH 3.3Å; S879-Y1273 PolarHBondContact OG-OH 2.96Å
880C88.6Confident84.5Confident0 Ų017.5 Ų17.50%010%0.097CC..Hα-helixtrans-66.6-46.1175.5-66.30000112.4F859 I876 A877 A878 L883 F884F859-C880 HydrophobicContact CB-CB 4.21Å; F859-C880 HydrophobicContact CD2-CB 3.51Å; F859-C880 VanDerWaalsContact CD2-CB 3.44Å; F859-C880 HydrophobicContact CE2-CB 4.23Å; F859-C880 HydrophobicContact CG-CB 4.16Å; I876-C880 PolarHBondContact O-N 3.09Å; I876-C880 PolarHBondContact O-SG 3.22Å; I876-C880 VanDerWaalsContact O-SG 3.37Å; A877-C880 PolarHBondContact O-N 3.25Å; A878-C880 VanDerWaalsContact C-N 3.33Å; A878-C880 PolarHBondContact O-N 3.12Å; C880-L883 WeakPolarHBondContact O-CB 3.18Å; C880-L883 PolarHBondContact O-N 3.25Å; C880-F884 HydrophobicContact CB-CE2 4.13Å; C880-F884 HydrophobicContact CB-CZ 4.21Å; C880-F884 WeakPolarHBondContact O-CD1 3.22Å; C880-F884 WeakPolarHBondContact O-CD2 3.2Å; C880-F884 WeakPolarHBondContact O-CG 3.38Å; C880-F884 PolarHBondContact O-N 3.07Å
881L87.4Confident84.6Confident2 Ų213.1 Ų13.11%0.017%0.068CC..Hα-helixtrans-67.1-38.5-178.6-71.8174.1000112.4F859 A877 A878 L883 F884 D885 V1022 L1025 A1049 A1052F859-L881 HydrophobicContact CE2-CD1 4.47Å; F859-L881 HydrophobicContact CE2-CD2 3.99Å; F859-L881 HydrophobicContact CE2-CG 3.95Å; F859-L881 HydrophobicContact CZ-CD2 3.74Å; F859-L881 HydrophobicContact CZ-CG 4.2Å; A877-L881 WeakPolarHBondContact O-CB 3.25Å; A877-L881 VanDerWaalsContact O-CG 3.32Å; A877-L881 WeakPolarHBondContact O-CG 3.44Å; A877-L881 PolarHBondContact O-N 2.87Å; A878-L881 PolarHBondContact O-N 3.12Å; L881-L883 VanDerWaalsContact C-N 3.32Å; L881-L883 PolarHBondContact O-N 2.78Å; L881-F884 HydrophobicContact CD2-CD2 4.36Å; L881-F884 PolarHBondContact O-N 3.09Å; L881-D885 VanDerWaalsContact O-CB 3.28Å; L881-D885 WeakPolarHBondContact O-CB 3.38Å; L881-D885 PolarHBondContact O-N 3.31Å; L881-V1022 HydrophobicContact CD2-CG2 3.9Å; L881-L1025 HydrophobicContact CD1-CD1 4.33Å; L881-L1025 HydrophobicContact CD1-CD2 3.62Å; L881-A1049 HydrophobicContact CD1-CB 4.23Å; L881-A1049 VanDerWaalsContact CD1-O 3.3Å; L881-A1049 WeakPolarHBondContact CD1-O 3.27Å; L881-A1052 HydrophobicContact CB-CB 3.72Å
882I82.4Confident84.6Confident21.25 Ų21.2510.9 Ų10.911%0.1096%0.055CC..Hα-helixtrans-60.4-44.9173.5-71.8166000110.4T802 A878 F884 G886 R1048 A1052 P1254 Y1273 F1278 M1284T802-I882 HydrophobicContact CG2-CG2 4.21Å; A878-I882 VanDerWaalsContact O-CB 3.26Å; A878-I882 WeakPolarHBondContact O-CB 3.25Å; A878-I882 WeakPolarHBondContact O-CD1 3.44Å; A878-I882 VanDerWaalsContact O-CG1 3.23Å; A878-I882 WeakPolarHBondContact O-CG1 3.33Å; A878-I882 PolarHBondContact O-N 2.99Å; I882-F884 PolarHBondContact O-N 2.99Å; I882-G886 PolarHBondContact O-N 3.09Å; I882-R1048 VanDerWaalsContact CD1-NH2 3.29Å; I882-A1052 HydrophobicContact CG1-CB 4.03Å; I882-P1254 HydrophobicContact CD1-CG 4.49Å; I882-Y1273 HydrophobicContact CD1-CE2 4.44Å; I882-F1278 HydrophobicContact CB-CZ 4.39Å; I882-F1278 HydrophobicContact CG1-CZ 4.29Å; I882-F1278 HydrophobicContact CG2-CE1 3.56Å; I882-F1278 HydrophobicContact CG2-CE2 4.18Å; I882-F1278 HydrophobicContact CG2-CZ 3.63Å; I882-M1284 HydrophobicContact CG2-CE 4.34Å
883L84.3Confident84.3Confident4.25 Ų4.2511.6 Ų11.62%0.0226%0.059CC..Hα-helixtrans-60.6-46.9174.9178.686.7000111.5I801 T802 L805 I854 S879 C880 L881 G886 L887I801-L883 HydrophobicContact CB-CD1 4.1Å; I801-L883 HydrophobicContact CG2-CD1 4.07Å; I801-L883 HydrophobicContact CG2-CD2 4.05Å; T802-L883 HydrophobicContact CG2-CB 4.16Å; T802-L883 HydrophobicContact CG2-CD1 4.24Å; T802-L883 HydrophobicContact CG2-CG 4.38Å; L805-L883 HydrophobicContact CD2-CD1 4.42Å; I854-L883 HydrophobicContact CD1-CD1 4.11Å; I854-L883 HydrophobicContact CD1-CD2 3.59Å; I854-L883 HydrophobicContact CG2-CD2 4.16Å; S879-L883 WeakPolarHBondContact O-CB 3.36Å; S879-L883 PolarHBondContact O-N 3.02Å; S879-L883 VanDerWaalsContact O-N 3.14Å; C880-L883 WeakPolarHBondContact O-CB 3.18Å; C880-L883 PolarHBondContact O-N 3.25Å; L881-L883 VanDerWaalsContact C-N 3.32Å; L881-L883 PolarHBondContact O-N 2.78Å; L883-G886 PolarHBondContact O-N 3.05Å; L883-L887 HydrophobicContact CD1-CD1 4.04Å; L883-L887 HydrophobicContact CD1-CG 4.13Å; L883-L887 HydrophobicContact CD2-CD1 3.54Å; L883-L887 HydrophobicContact CD2-CG 4.29Å; L883-L887 HydrophobicContact CG-CD1 4.08Å; L883-L887 HydrophobicContact CG-CG 4.39Å; L883-L887 VanDerWaalsContact O-CG 3.3Å; L883-L887 WeakPolarHBondContact O-CG 3.33Å; L883-L887 PolarHBondContact O-N 2.98Å
884F88.5Confident83.9Confident0.5 Ų0.59.7 Ų9.70%0.0025%0.052CC..Hα-helixtrans-65.1-43.9-178.8-60.1-23.2000112.3I854 T855 F859 C880 L881 I882 G886 L887 V888 L1008 L1018 L1056I854-F884 HydrophobicContact CG2-CE1 3.87Å; I854-F884 HydrophobicContact CG2-CZ 3.98Å; T855-F884 HydrophobicContact CG2-CE1 3.76Å; T855-F884 HydrophobicContact CG2-CE2 4.47Å; T855-F884 HydrophobicContact CG2-CZ 3.64Å; F859-F884 HydrophobicContact CB-CE2 4.11Å; F859-F884 HydrophobicContact CB-CZ 4.07Å; F859-F884 AromaticContact CD1-CE2 3.77Å; F859-F884 HydrophobicContact CD1-CE2 3.77Å; F859-F884 HydrophobicContact CD1-CZ 4.43Å; F859-F884 HydrophobicContact CD2-CE2 4.16Å; F859-F884 HydrophobicContact CE1-CE2 4.18Å; F859-F884 HydrophobicContact CE2-CE2 4.5Å; F859-F884 AromaticContact CG-CE2 3.74Å; F859-F884 HydrophobicContact CG-CE2 3.74Å; F859-F884 HydrophobicContact CG-CZ 4.22Å; F859-F884 HydrophobicContact CZ-CE2 4.47Å; C880-F884 HydrophobicContact CB-CE2 4.13Å; C880-F884 HydrophobicContact CB-CZ 4.21Å; C880-F884 WeakPolarHBondContact O-CD1 3.22Å; C880-F884 WeakPolarHBondContact O-CD2 3.2Å; C880-F884 WeakPolarHBondContact O-CG 3.38Å; C880-F884 PolarHBondContact O-N 3.07Å; L881-F884 HydrophobicContact CD2-CD2 4.36Å; L881-F884 PolarHBondContact O-N 3.09Å; I882-F884 PolarHBondContact O-N 2.99Å; F884-G886 VanDerWaalsContact C-N 3.33Å; F884-G886 PolarHBondContact O-N 3.1Å; F884-L887 PolarHBondContact O-N 3.22Å; F884-V888 WeakPolarHBondContact O-CB 3.42Å; F884-V888 VanDerWaalsContact O-CG2 3.3Å; F884-V888 WeakPolarHBondContact O-CG2 3.26Å; F884-V888 PolarHBondContact O-N 3.16Å; F884-L1008 HydrophobicContact CB-CD1 4.16Å; F884-L1008 HydrophobicContact CD1-CD1 3.67Å; F884-L1008 HydrophobicContact CD1-CD2 3.96Å; F884-L1008 HydrophobicContact CD1-CG 4.42Å; F884-L1008 HydrophobicContact CE1-CD1 4.45Å; F884-L1008 HydrophobicContact CE1-CD2 4.17Å; F884-L1008 HydrophobicContact CG-CD1 4.17Å; F884-L1008 HydrophobicContact CG-CD2 4.33Å; F884-L1018 HydrophobicContact CD2-CD1 4.37Å; F884-L1018 HydrophobicContact CE2-CD1 3.99Å; F884-L1018 HydrophobicContact CZ-CD1 4.45Å; F884-L1056 HydrophobicContact CB-CD1 3.84Å; F884-L1056 HydrophobicContact CB-CD2 4.44Å
885D82.5Confident83.6Confident4 Ų49.3 Ų9.32%0.0215%0.051CC..Hα-helixtrans-60.4-43.1176.2-16936.8000111.1L881 V888 H889 S1055 L1056 R1059L881-D885 VanDerWaalsContact O-CB 3.28Å; L881-D885 WeakPolarHBondContact O-CB 3.38Å; L881-D885 PolarHBondContact O-N 3.31Å; D885-V888 PolarHBondContact O-N 2.96Å; D885-H889 VanDerWaalsContact O-CB 3.25Å; D885-H889 WeakPolarHBondContact O-CB 3.32Å; D885-H889 PolarHBondContact O-N 3.31Å; D885-H889 VanDerWaalsContact O-N 3.07Å; D885-S1055 WeakPolarHBondContact OD2-CB 3.34Å; D885-S1055 PolarHBondContact OD2-OG 3.05Å; D885-L1056 HydrophobicContact CB-CB 4.35Å; D885-L1056 VanDerWaalsContact OD1-CA 3.28Å; D885-L1056 WeakPolarHBondContact OD1-CA 3.32Å; D885-L1056 PolarHBondContact OD1-N 3.33Å; D885-R1059 VanDerWaalsContact CG-NE 3.32Å; D885-R1059 VanDerWaalsContact CG-NH2 3.33Å; D885-R1059 PolarHBondContact O-NH1 3.32Å; D885-R1059 WeakPolarHBondContact OD1-CD 3.43Å; D885-R1059 IonicContact OD1-CZ 3.48Å; D885-R1059 IonicContact OD1-NE 2.88Å; D885-R1059 PolarHBondContact OD1-NE 3.13Å; D885-R1059 IonicContact OD1-NH1 2.67Å; D885-R1059 PolarHBondContact OD1-NH1 2.89Å; D885-R1059 IonicContact OD1-NH2 3.29Å; D885-R1059 PolarHBondContact OD1-NH2 3.46Å; D885-R1059 IonicContact OD2-CZ 2.77Å; D885-R1059 IonicContact OD2-NE 3.23Å; D885-R1059 PolarHBondContact OD2-NE 3.38Å; D885-R1059 IonicContact OD2-NH1 2.76Å; D885-R1059 PolarHBondContact OD2-NH1 3.41Å; D885-R1059 IonicContact OD2-NH2 3.09Å; D885-R1059 PolarHBondContact OD2-NH2 3.08Å
886G79.3Confident83.2Confident13.5 Ų13.59.4 Ų9.414%0.1395%0.051CC..Hα-helixtrans-62.4-48.517500000113.6I882 L883 F884 V888 H889 D890I882-G886 PolarHBondContact O-N 3.09Å; L883-G886 PolarHBondContact O-N 3.05Å; F884-G886 VanDerWaalsContact C-N 3.33Å; F884-G886 PolarHBondContact O-N 3.1Å; G886-V888 PolarHBondContact O-N 2.91Å; G886-H889 VanDerWaalsContact O-CB 3.22Å; G886-H889 WeakPolarHBondContact O-CB 3.3Å; G886-H889 PolarHBondContact O-N 3.22Å; G886-H889 VanDerWaalsContact O-N 3.15Å; G886-D890 PolarHBondContact O-N 3.16Å
887L84.2Confident82.6Confident0.75 Ų0.7512.9 Ų12.90%0.0047%0.07CC..Hα-helixtrans-65.1-40.1179.8-68.4177000112.8L805 P806 I809 L883 F884 H889 D890 F891 P1004 G1005 L1008L805-L887 HydrophobicContact CD2-CD1 3.83Å; L805-L887 HydrophobicContact CD2-CD2 3.92Å; L805-L887 HydrophobicContact CD2-CG 4.37Å; L805-L887 HydrophobicContact CG-CD2 3.99Å; P806-L887 HydrophobicContact CG-CD2 4.38Å; I809-L887 HydrophobicContact CD1-CD2 3.75Å; L883-L887 HydrophobicContact CD1-CD1 4.04Å; L883-L887 HydrophobicContact CD1-CG 4.13Å; L883-L887 HydrophobicContact CD2-CD1 3.54Å; L883-L887 HydrophobicContact CD2-CG 4.29Å; L883-L887 HydrophobicContact CG-CD1 4.08Å; L883-L887 HydrophobicContact CG-CG 4.39Å; L883-L887 VanDerWaalsContact O-CG 3.3Å; L883-L887 WeakPolarHBondContact O-CG 3.33Å; L883-L887 PolarHBondContact O-N 2.98Å; F884-L887 PolarHBondContact O-N 3.22Å; L887-H889 VanDerWaalsContact C-N 3.34Å; L887-D890 PolarHBondContact O-N 3.26Å; L887-F891 WeakPolarHBondContact O-CB 3.4Å; L887-F891 PolarHBondContact O-N 3.04Å; L887-F891 VanDerWaalsContact O-N 3.13Å; L887-P1004 HydrophobicContact CD1-CB 4.31Å; L887-P1004 HydrophobicContact CD1-CG 4.36Å; L887-P1004 HydrophobicContact CD2-CG 4.21Å; L887-G1005 WeakPolarHBondContact O-CA 3.38Å; L887-L1008 HydrophobicContact CB-CD1 4.1Å; L887-L1008 HydrophobicContact CD1-CD1 3.93Å
888V85.8Confident82Confident0 Ų013 Ų130%07%0.071CC..Hα-helixtrans-66.5-39.8175.8170.90000110.2F884 D885 G886 F891 L892 L1008 L1056 L1060F884-V888 WeakPolarHBondContact O-CB 3.42Å; F884-V888 VanDerWaalsContact O-CG2 3.3Å; F884-V888 WeakPolarHBondContact O-CG2 3.26Å; F884-V888 PolarHBondContact O-N 3.16Å; D885-V888 PolarHBondContact O-N 2.96Å; G886-V888 PolarHBondContact O-N 2.91Å; V888-F891 PolarHBondContact O-N 3.24Å; V888-L892 HydrophobicContact CG1-CD1 3.83Å; V888-L892 HydrophobicContact CG1-CG 4.25Å; V888-L892 WeakPolarHBondContact O-CB 3.37Å; V888-L892 VanDerWaalsContact O-CG 3.26Å; V888-L892 WeakPolarHBondContact O-CG 3.33Å; V888-L892 PolarHBondContact O-N 3.32Å; V888-L1008 HydrophobicContact CG2-CB 3.86Å; V888-L1008 HydrophobicContact CG2-CD1 4.48Å; V888-L1056 HydrophobicContact CB-CD1 4.07Å; V888-L1056 HydrophobicContact CG1-CD1 4.23Å; V888-L1056 HydrophobicContact CG2-CD1 4Å; V888-L1060 HydrophobicContact CG1-CD2 3.99Å
889H81.1Confident81.5Confident29.75 Ų29.7513.5 Ų13.514%0.1387%0.074CC..Hα-helixtrans-60.1-49.6175.2-175.948.4000112.8D885 G886 L887 F891 L892 N893 R1059D885-H889 VanDerWaalsContact O-CB 3.25Å; D885-H889 WeakPolarHBondContact O-CB 3.32Å; D885-H889 PolarHBondContact O-N 3.31Å; D885-H889 VanDerWaalsContact O-N 3.07Å; G886-H889 VanDerWaalsContact O-CB 3.22Å; G886-H889 WeakPolarHBondContact O-CB 3.3Å; G886-H889 PolarHBondContact O-N 3.22Å; G886-H889 VanDerWaalsContact O-N 3.15Å; L887-H889 VanDerWaalsContact C-N 3.34Å; H889-F891 VanDerWaalsContact C-N 3.3Å; H889-F891 PolarHBondContact O-N 3.14Å; H889-L892 PolarHBondContact O-N 3.08Å; H889-L892 VanDerWaalsContact O-N 3.12Å; H889-N893 PolarHBondContact CD2-ND2 3.09Å; H889-N893 VanDerWaalsContact CD2-ND2 3.32Å; H889-N893 PolarHBondContact CE1-ND2 3.13Å; H889-N893 VanDerWaalsContact CE1-ND2 3.27Å; H889-N893 PolarHBondContact CE1-OD1 3.26Å; H889-N893 PolarHBondContact ND1-ND2 3.5Å; H889-N893 PolarHBondContact ND1-OD1 3.34Å; H889-N893 PolarHBondContact NE2-ND2 3.06Å; H889-N893 VanDerWaalsContact NE2-ND2 3.12Å; H889-N893 WeakPolarHBondContact O-CB 3.43Å; H889-N893 VanDerWaalsContact O-CG 3.26Å; H889-N893 PolarHBondContact O-N 3.15Å; H889-N893 PolarHBondContact O-ND2 3.28Å; H889-N893 PolarHBondContact O-OD1 2.86Å; H889-R1059 VanDerWaalsContact CB-NH1 3.32Å; H889-R1059 PolarHBondContact CD2-NH1 3.29Å; H889-R1059 PolarHBondContact CE1-NH1 3.05Å; H889-R1059 VanDerWaalsContact CG-NH1 3.31Å; H889-R1059 PolarHBondContact ND1-NE 3.33Å; H889-R1059 PolarHBondContact ND1-NH1 3.04Å
890D78.9Confident81Confident22.75 Ų22.7514.4 Ų14.412%0.1228%0.081CC..Hα-helixtrans-61.2-40179.8-73.8-16.1000111.6P806 G886 L887 N893 R894 Y1277P806-D890 WeakPolarHBondContact CB-OD2 3.28Å; G886-D890 PolarHBondContact O-N 3.16Å; L887-D890 PolarHBondContact O-N 3.26Å; D890-N893 PolarHBondContact O-N 3.15Å; D890-R894 WeakPolarHBondContact O-CB 3.45Å; D890-R894 WeakPolarHBondContact O-CG 3.27Å; D890-R894 PolarHBondContact O-N 3.14Å; D890-R894 VanDerWaalsContact O-N 3.17Å; D890-R894 PolarHBondContact O-NE 3.28Å; D890-Y1277 WeakPolarHBondContact OD1-CD2 3.3Å
891F84.4Confident80.1Confident0.25 Ų0.2515.9 Ų15.90%0.0019%0.089CC..Hα-helixtrans-63.6-47174.3167.1-105.5000112L887 V888 H889 N893 R894 L895 W999 P1000 D1003 Y1006 A1009 L1067 F1070L887-F891 WeakPolarHBondContact O-CB 3.4Å; L887-F891 PolarHBondContact O-N 3.04Å; L887-F891 VanDerWaalsContact O-N 3.13Å; V888-F891 PolarHBondContact O-N 3.24Å; H889-F891 VanDerWaalsContact C-N 3.3Å; H889-F891 PolarHBondContact O-N 3.14Å; F891-N893 VanDerWaalsContact C-N 3.33Å; F891-N893 PolarHBondContact O-N 3.12Å; F891-R894 PolarHBondContact O-N 3.23Å; F891-L895 HydrophobicContact CE1-CD1 4.06Å; F891-L895 HydrophobicContact CE1-CD2 4.41Å; F891-L895 HydrophobicContact CE2-CD1 4.18Å; F891-L895 HydrophobicContact CZ-CD1 3.53Å; F891-L895 HydrophobicContact CZ-CD2 4.31Å; F891-L895 WeakPolarHBondContact O-CB 3.36Å; F891-L895 PolarHBondContact O-N 3.15Å; F891-W999 HydrophobicContact CD2-CZ2 4.4Å; F891-W999 AromaticContact CD2-NE1 3.93Å; F891-W999 AromaticContact CE2-CZ2 3.73Å; F891-W999 HydrophobicContact CE2-CZ2 3.73Å; F891-W999 AromaticContact CE2-NE1 3.96Å; F891-P1000 HydrophobicContact CE2-CB 4.42Å; F891-D1003 HydrophobicContact CD2-CB 4.34Å; F891-D1003 WeakPolarHBondContact CD2-OD2 3.3Å; F891-Y1006 HydrophobicContact CE1-CD2 4.45Å; F891-Y1006 AromaticContact CE2-CD2 3.98Å; F891-Y1006 HydrophobicContact CE2-CD2 4.09Å; F891-Y1006 HydrophobicContact CE2-CG 4.36Å; F891-Y1006 AromaticContact CZ-CD2 3.72Å; F891-Y1006 HydrophobicContact CZ-CD2 3.72Å; F891-Y1006 HydrophobicContact CZ-CG 4.35Å; F891-A1009 HydrophobicContact CD1-CB 4.42Å; F891-A1009 HydrophobicContact CE1-CB 4.39Å; F891-L1067 HydrophobicContact CE1-CD1 3.57Å; F891-L1067 HydrophobicContact CE1-CD2 3.77Å; F891-L1067 HydrophobicContact CZ-CD1 4.28Å; F891-F1070 HydrophobicContact CE2-CE1 4.43Å; F891-F1070 HydrophobicContact CZ-CD1 4.35Å; F891-F1070 HydrophobicContact CZ-CE1 4.2Å
892L83.2Confident79.3Confident5 Ų516 Ų163%0.0269%0.09CC..Hα-helixtrans-63.8-39.2178.7-72.4174.3000112.1V888 H889 R894 L895 N896 R1059 S1063 L1067V888-L892 HydrophobicContact CG1-CD1 3.83Å; V888-L892 HydrophobicContact CG1-CG 4.25Å; V888-L892 WeakPolarHBondContact O-CB 3.37Å; V888-L892 VanDerWaalsContact O-CG 3.26Å; V888-L892 WeakPolarHBondContact O-CG 3.33Å; V888-L892 PolarHBondContact O-N 3.32Å; H889-L892 PolarHBondContact O-N 3.08Å; H889-L892 VanDerWaalsContact O-N 3.12Å; L892-R894 PolarHBondContact O-N 2.92Å; L892-L895 HydrophobicContact CD2-CD2 4.47Å; L892-L895 PolarHBondContact O-N 2.99Å; L892-N896 WeakPolarHBondContact O-CB 3.33Å; L892-N896 VanDerWaalsContact O-CG 3.27Å; L892-N896 PolarHBondContact O-N 3.22Å; L892-N896 PolarHBondContact O-ND2 3.1Å; L892-R1059 HydrophobicContact CD1-CB 4.44Å; L892-R1059 HydrophobicContact CD1-CG 3.73Å; L892-S1063 VanDerWaalsContact CD1-OG 3.25Å; L892-S1063 WeakPolarHBondContact CD1-OG 3.3Å; L892-S1063 VanDerWaalsContact CD2-OG 3.3Å; L892-S1063 WeakPolarHBondContact CD2-OG 3.35Å; L892-L1067 HydrophobicContact CD2-CD1 4.07Å; L892-L1067 HydrophobicContact CD2-CD2 3.69Å; L892-L1067 HydrophobicContact CD2-CG 3.86Å
893N77.9Confident78.7Confident36.75 Ų36.7518.2 Ų18.220%0.19711%0.105CC..Hα-helixtrans-62.6-44.8174.7-70.8-13.3000111.3H889 D890 F891 L895 N896 N897 N1289H889-N893 PolarHBondContact CD2-ND2 3.09Å; H889-N893 VanDerWaalsContact CD2-ND2 3.32Å; H889-N893 PolarHBondContact CE1-ND2 3.13Å; H889-N893 VanDerWaalsContact CE1-ND2 3.27Å; H889-N893 PolarHBondContact CE1-OD1 3.26Å; H889-N893 PolarHBondContact ND1-ND2 3.5Å; H889-N893 PolarHBondContact ND1-OD1 3.34Å; H889-N893 PolarHBondContact NE2-ND2 3.06Å; H889-N893 VanDerWaalsContact NE2-ND2 3.12Å; H889-N893 WeakPolarHBondContact O-CB 3.43Å; H889-N893 VanDerWaalsContact O-CG 3.26Å; H889-N893 PolarHBondContact O-N 3.15Å; H889-N893 PolarHBondContact O-ND2 3.28Å; H889-N893 PolarHBondContact O-OD1 2.86Å; D890-N893 PolarHBondContact O-N 3.15Å; F891-N893 VanDerWaalsContact C-N 3.33Å; F891-N893 PolarHBondContact O-N 3.12Å; N893-L895 VanDerWaalsContact C-N 3.32Å; N893-L895 PolarHBondContact O-N 3.11Å; N893-N896 PolarHBondContact O-N 3.19Å; N893-N897 WeakPolarHBondContact O-CB 3.34Å; N893-N897 VanDerWaalsContact O-CG 3.23Å; N893-N897 PolarHBondContact O-N 3.26Å; N893-N897 VanDerWaalsContact O-N 3.14Å; N893-N897 PolarHBondContact O-ND2 2.98Å; N893-N1289 PolarHBondContact O-ND2 3.31Å
894R78.9Confident77.9Confident22.25 Ų22.2521.1 Ų21.18%0.08412%0.122CC..Hα-helixtrans-62-42.2174.8-76.3-175-75.3-114.2-2.6111.7I809 N810 D890 F891 L892 N897 A898 L995 D1003I809-R894 VanDerWaalsContact CG2-NH1 3.33Å; N810-R894 PolarHBondContact OD1-NH1 2.96Å; D890-R894 WeakPolarHBondContact O-CB 3.45Å; D890-R894 WeakPolarHBondContact O-CG 3.27Å; D890-R894 PolarHBondContact O-N 3.14Å; D890-R894 VanDerWaalsContact O-N 3.17Å; D890-R894 PolarHBondContact O-NE 3.28Å; F891-R894 PolarHBondContact O-N 3.23Å; L892-R894 PolarHBondContact O-N 2.92Å; R894-N897 WeakPolarHBondContact O-CB 3.17Å; R894-N897 PolarHBondContact O-N 3.11Å; R894-A898 VanDerWaalsContact O-CB 3.29Å; R894-A898 WeakPolarHBondContact O-CB 3.24Å; R894-A898 PolarHBondContact O-N 3.24Å; R894-L995 HydrophobicContact CB-CD2 4.2Å; R894-D1003 IonicContact CZ-OD1 3.44Å; R894-D1003 IonicContact CZ-OD2 3.18Å; R894-D1003 VanDerWaalsContact CZ-OD2 3.27Å; R894-D1003 IonicContact NE-OD2 3.02Å; R894-D1003 PolarHBondContact NE-OD2 3Å; R894-D1003 IonicContact NH1-OD1 2.68Å; R894-D1003 IonicContact NH1-OD2 3.34Å; R894-D1003 PolarHBondContact NH1-OD2 2.83Å; R894-D1003 VanDerWaalsContact NH2-CG 3.31Å; R894-D1003 IonicContact NH2-OD1 3.05Å; R894-D1003 PolarHBondContact NH2-OD1 3.15Å; R894-D1003 IonicContact NH2-OD2 3.64Å; R894-D1003 PolarHBondContact NH2-OD2 3.1Å
895L80.8Confident76.7Confident0.25 Ų0.2523.1 Ų23.10%0.00113%0.132CC..Hα-helixtrans-62-49.6176.9-176.381.5000111F891 L892 N893 N897 A898 T899 W949 W999 I1066 L1067 F1070F891-L895 HydrophobicContact CE1-CD1 4.06Å; F891-L895 HydrophobicContact CE1-CD2 4.41Å; F891-L895 HydrophobicContact CE2-CD1 4.18Å; F891-L895 HydrophobicContact CZ-CD1 3.53Å; F891-L895 HydrophobicContact CZ-CD2 4.31Å; F891-L895 WeakPolarHBondContact O-CB 3.36Å; F891-L895 PolarHBondContact O-N 3.15Å; L892-L895 HydrophobicContact CD2-CD2 4.47Å; L892-L895 PolarHBondContact O-N 2.99Å; N893-L895 VanDerWaalsContact C-N 3.32Å; N893-L895 PolarHBondContact O-N 3.11Å; L895-N897 PolarHBondContact O-N 3.19Å; L895-A898 PolarHBondContact O-N 3.18Å; L895-A898 VanDerWaalsContact O-N 3.11Å; L895-T899 HydrophobicContact CD1-CG2 4.34Å; L895-T899 HydrophobicContact CD2-CG2 3.83Å; L895-T899 HydrophobicContact CG-CG2 4.38Å; L895-T899 WeakPolarHBondContact O-CG2 3.25Å; L895-T899 PolarHBondContact O-N 3.05Å; L895-W949 HydrophobicContact CD1-CZ3 4.49Å; L895-W999 HydrophobicContact CB-CZ2 4.37Å; L895-W999 HydrophobicContact CD1-CH2 4.01Å; L895-W999 HydrophobicContact CD1-CZ2 4.28Å; L895-W999 HydrophobicContact CG-CH2 4.43Å; L895-W999 HydrophobicContact CG-CZ2 4.49Å; L895-I1066 HydrophobicContact CD2-CG2 3.72Å; L895-I1066 HydrophobicContact CG-CG2 4.11Å; L895-L1067 HydrophobicContact CD2-CD1 4.38Å; L895-F1070 HydrophobicContact CD1-CB 4.39Å; L895-F1070 HydrophobicContact CD1-CD1 3.72Å; L895-F1070 HydrophobicContact CD1-CD2 4.11Å; L895-F1070 HydrophobicContact CD1-CE1 3.93Å; L895-F1070 HydrophobicContact CD1-CE2 4.26Å; L895-F1070 HydrophobicContact CD1-CG 3.81Å; L895-F1070 HydrophobicContact CD1-CZ 4.25Å; L895-F1070 HydrophobicContact CD2-CB 4.48Å; L895-F1070 HydrophobicContact CD2-CD1 4.3Å; L895-F1070 HydrophobicContact CD2-CG 4.48Å
896N76.2Confident75.9Confident21.25 Ų21.2524.1 Ų24.111%0.11414%0.137CC..Hα-helixtrans-63.2-36.5179.3-72.8-24.2000112.9L892 N893 A898 T899 A900 I1066 N1289 N1292 N1294L892-N896 WeakPolarHBondContact O-CB 3.33Å; L892-N896 VanDerWaalsContact O-CG 3.27Å; L892-N896 PolarHBondContact O-N 3.22Å; L892-N896 PolarHBondContact O-ND2 3.1Å; N893-N896 PolarHBondContact O-N 3.19Å; N896-A898 VanDerWaalsContact C-N 3.35Å; N896-T899 WeakPolarHBondContact CA-OG1 3.38Å; N896-T899 PolarHBondContact O-N 3.35Å; N896-T899 PolarHBondContact O-OG1 3.26Å; N896-T899 VanDerWaalsContact O-OG1 3.08Å; N896-A900 WeakPolarHBondContact O-CB 3.37Å; N896-A900 PolarHBondContact O-N 3.19Å; N896-A900 VanDerWaalsContact O-N 3.07Å; N896-I1066 VanDerWaalsContact OD1-CD1 3.24Å; N896-I1066 WeakPolarHBondContact OD1-CD1 3.26Å; N896-N1289 VanDerWaalsContact C-ND2 3.31Å; N896-N1292 PolarHBondContact ND2-OD1 3.04Å; N896-N1294 VanDerWaalsContact CG-ND2 3.32Å; N896-N1294 PolarHBondContact OD1-ND2 3.02Å
897N74.3Confident75Confident76.5 Ų76.527.3 Ų27.341%0.40916%0.157SC..Hα-helixtrans-65.1-44.6174.1-77-26.8000111N893 R894 L895 T899 A900 I901 L993 H1288 N1289N893-N897 WeakPolarHBondContact O-CB 3.34Å; N893-N897 VanDerWaalsContact O-CG 3.23Å; N893-N897 PolarHBondContact O-N 3.26Å; N893-N897 VanDerWaalsContact O-N 3.14Å; N893-N897 PolarHBondContact O-ND2 2.98Å; R894-N897 WeakPolarHBondContact O-CB 3.17Å; R894-N897 PolarHBondContact O-N 3.11Å; L895-N897 PolarHBondContact O-N 3.19Å; N897-T899 PolarHBondContact O-N 3.21Å; N897-A900 PolarHBondContact O-N 3.04Å; N897-I901 WeakPolarHBondContact O-CB 3.39Å; N897-I901 WeakPolarHBondContact O-CD1 3.22Å; N897-I901 VanDerWaalsContact O-CG1 3.24Å; N897-I901 WeakPolarHBondContact O-CG1 3.29Å; N897-I901 PolarHBondContact O-N 3.36Å; N897-I901 VanDerWaalsContact O-N 3.16Å; N897-L993 HydrophobicContact CB-CD2 3.71Å; N897-H1288 VanDerWaalsContact CG-O 3.25Å; N897-H1288 PolarHBondContact ND2-O 3.23Å; N897-H1288 WeakPolarHBondContact OD1-CB 3.38Å; N897-H1288 PolarHBondContact OD1-O 2.97Å; N897-N1289 WeakPolarHBondContact CA-ND2 3.26Å; N897-N1289 VanDerWaalsContact CG-CG 3.45Å; N897-N1289 PolarHBondContact N-ND2 3.28Å; N897-N1289 PolarHBondContact ND2-ND2 3.15Å; N897-N1289 PolarHBondContact OD1-ND2 3.03Å; N897-N1289 PolarHBondContact OD1-OD1 3.34Å
898A75.7Confident73.8Confident2.25 Ų2.2530.9 Ų30.92%0.01918%0.183CC..Hα-helixtrans-65.1-39.5177.300000112.3R894 L895 N896 I901 I902 L953 L993 L995R894-A898 VanDerWaalsContact O-CB 3.29Å; R894-A898 WeakPolarHBondContact O-CB 3.24Å; R894-A898 PolarHBondContact O-N 3.24Å; L895-A898 PolarHBondContact O-N 3.18Å; L895-A898 VanDerWaalsContact O-N 3.11Å; N896-A898 VanDerWaalsContact C-N 3.35Å; A898-I901 PolarHBondContact O-N 3.43Å; A898-I902 WeakPolarHBondContact O-CB 3.29Å; A898-I902 VanDerWaalsContact O-CG1 3.31Å; A898-I902 WeakPolarHBondContact O-CG1 3.42Å; A898-I902 PolarHBondContact O-N 3.18Å; A898-I902 VanDerWaalsContact O-N 3.07Å; A898-L953 HydrophobicContact CB-CD1 3.91Å; A898-L993 HydrophobicContact CB-CD1 4.26Å; A898-L993 HydrophobicContact CB-CD2 3.93Å; A898-L995 HydrophobicContact CB-CD1 4.41Å
899T73.7Confident72Confident11.25 Ų11.2533.3 Ų33.37%0.06920%0.199CC..Hα-helixtrans-65.1-43.917666.60000111.5L895 N896 N897 I901 I902 T903 W949 I1066L895-T899 HydrophobicContact CD1-CG2 4.34Å; L895-T899 HydrophobicContact CD2-CG2 3.83Å; L895-T899 HydrophobicContact CG-CG2 4.38Å; L895-T899 WeakPolarHBondContact O-CG2 3.25Å; L895-T899 PolarHBondContact O-N 3.05Å; N896-T899 WeakPolarHBondContact CA-OG1 3.38Å; N896-T899 PolarHBondContact O-N 3.35Å; N896-T899 PolarHBondContact O-OG1 3.26Å; N896-T899 VanDerWaalsContact O-OG1 3.08Å; N897-T899 PolarHBondContact O-N 3.21Å; T899-I901 PolarHBondContact O-N 3Å; T899-I902 PolarHBondContact O-N 3.06Å; T899-T903 VanDerWaalsContact O-CB 3.29Å; T899-T903 WeakPolarHBondContact O-CB 3.4Å; T899-T903 VanDerWaalsContact O-CG2 3.26Å; T899-T903 WeakPolarHBondContact O-CG2 3.3Å; T899-T903 PolarHBondContact O-N 3.25Å; T899-T903 PolarHBondContact O-OG1 3.04Å; T899-W949 HydrophobicContact CG2-CD2 4.34Å; T899-W949 HydrophobicContact CG2-CE3 3.63Å; T899-W949 HydrophobicContact CG2-CH2 3.61Å; T899-W949 HydrophobicContact CG2-CZ2 4.3Å; T899-W949 HydrophobicContact CG2-CZ3 3.23Å; T899-I1066 HydrophobicContact CG2-CD1 4.33Å; T899-I1066 HydrophobicContact CG2-CG2 4.06Å
900A71.8Confident70.3Confident27 Ų2738.2 Ų38.222%0.22322%0.222CC..Hα-helixtrans-62-45.3178.100000112.2N896 N897 I902 T903 T904N896-A900 WeakPolarHBondContact O-CB 3.37Å; N896-A900 PolarHBondContact O-N 3.19Å; N896-A900 VanDerWaalsContact O-N 3.07Å; N897-A900 PolarHBondContact O-N 3.04Å; A900-I902 VanDerWaalsContact C-N 3.34Å; A900-I902 PolarHBondContact O-N 3.26Å; A900-T903 WeakPolarHBondContact CA-OG1 3.29Å; A900-T903 PolarHBondContact O-N 2.76Å; A900-T903 PolarHBondContact O-OG1 3.17Å; A900-T904 VanDerWaalsContact O-CG2 3.29Å; A900-T904 WeakPolarHBondContact O-CG2 3.43Å; A900-T904 PolarHBondContact O-N 3.04Å; A900-T904 VanDerWaalsContact O-N 3.11Å; A900-T904 PolarHBondContact O-OG1 3.24Å
901I69.9Low68.6Low31.5 Ų31.545.4 Ų45.416%0.16226%0.255CS..Hα-helixtrans-63.2-43177.4-66.7168.4000111N897 A898 T899 T904 M905 I989 Q992 L993 M1613N897-I901 WeakPolarHBondContact O-CB 3.39Å; N897-I901 WeakPolarHBondContact O-CD1 3.22Å; N897-I901 VanDerWaalsContact O-CG1 3.24Å; N897-I901 WeakPolarHBondContact O-CG1 3.29Å; N897-I901 PolarHBondContact O-N 3.36Å; N897-I901 VanDerWaalsContact O-N 3.16Å; A898-I901 PolarHBondContact O-N 3.43Å; T899-I901 PolarHBondContact O-N 3Å; I901-T904 WeakPolarHBondContact CA-OG1 3.42Å; I901-T904 PolarHBondContact O-N 3.21Å; I901-T904 PolarHBondContact O-OG1 3.13Å; I901-M905 HydrophobicContact CG2-CE 3.98Å; I901-M905 HydrophobicContact CG2-SD 4.2Å; I901-M905 VanDerWaalsContact O-CG 3.3Å; I901-M905 WeakPolarHBondContact O-CG 3.38Å; I901-M905 PolarHBondContact O-N 3.08Å; I901-M905 VanDerWaalsContact O-N 3.08Å; I901-I989 HydrophobicContact CG2-CG2 4.01Å; I901-Q992 WeakPolarHBondContact CD1-O 3.42Å; I901-L993 HydrophobicContact CB-CD2 4.17Å; I901-L993 HydrophobicContact CD1-CD1 4.02Å; I901-L993 HydrophobicContact CD1-CD2 4Å; I901-L993 HydrophobicContact CD1-CG 3.82Å; I901-L993 HydrophobicContact CG2-CD2 4.1Å; I901-M1613 VanDerWaalsContact CA-CE 3.49Å; I901-M1613 HydrophobicContact CB-CE 4.18Å; I901-M1613 HydrophobicContact CG1-CE 3.79Å; I901-M1613 HydrophobicContact CG1-SD 4.37Å
902I70.6Confident66.6Low5.25 Ų5.2554.2 Ų54.23%0.02729%0.293CS..Hα-helixtrans-72.6-39.5-178.3-74.4168.4000112.2A898 T899 A900 T904 M905 M906 W949 Y952 L953A898-I902 WeakPolarHBondContact O-CB 3.29Å; A898-I902 VanDerWaalsContact O-CG1 3.31Å; A898-I902 WeakPolarHBondContact O-CG1 3.42Å; A898-I902 PolarHBondContact O-N 3.18Å; A898-I902 VanDerWaalsContact O-N 3.07Å; T899-I902 PolarHBondContact O-N 3.06Å; A900-I902 VanDerWaalsContact C-N 3.34Å; A900-I902 PolarHBondContact O-N 3.26Å; I902-T904 VanDerWaalsContact C-N 3.29Å; I902-T904 PolarHBondContact O-N 3.27Å; I902-M905 PolarHBondContact O-N 3.18Å; I902-M905 VanDerWaalsContact O-N 3.12Å; I902-M906 HydrophobicContact CG2-CE 3.76Å; I902-M906 HydrophobicContact CG2-CG 4.33Å; I902-M906 HydrophobicContact CG2-SD 4.11Å; I902-M906 WeakPolarHBondContact O-CB 3.36Å; I902-M906 VanDerWaalsContact O-CG 3.29Å; I902-M906 WeakPolarHBondContact O-CG 3.24Å; I902-M906 PolarHBondContact O-N 2.92Å; I902-W949 HydrophobicContact CG2-CB 4.35Å; I902-Y952 HydrophobicContact CB-CD1 4.49Å; I902-Y952 HydrophobicContact CD1-CD1 4.49Å; I902-Y952 HydrophobicContact CG1-CD1 4.4Å; I902-Y952 HydrophobicContact CG1-CE1 4.46Å; I902-Y952 HydrophobicContact CG2-CD1 3.61Å; I902-Y952 HydrophobicContact CG2-CE1 4.14Å; I902-Y952 HydrophobicContact CG2-CG 4.4Å; I902-L953 HydrophobicContact CD1-CB 3.41Å; I902-L953 VanDerWaalsContact CD1-CB 3.45Å; I902-L953 HydrophobicContact CD1-CD1 3.68Å; I902-L953 VanDerWaalsContact CD1-CD1 3.41Å; I902-L953 HydrophobicContact CD1-CG 3.31Å
903T70.3Confident64.3Low67.75 Ų67.7558.7 Ų58.742%0.41632%0.317SS..Hα-helixtrans-63.6-37.2177-33.10000111.3T899 A900 M906 S907 W949T899-T903 VanDerWaalsContact O-CB 3.29Å; T899-T903 WeakPolarHBondContact O-CB 3.4Å; T899-T903 VanDerWaalsContact O-CG2 3.26Å; T899-T903 WeakPolarHBondContact O-CG2 3.3Å; T899-T903 PolarHBondContact O-N 3.25Å; T899-T903 PolarHBondContact O-OG1 3.04Å; A900-T903 WeakPolarHBondContact CA-OG1 3.29Å; A900-T903 PolarHBondContact O-N 2.76Å; A900-T903 PolarHBondContact O-OG1 3.17Å; T903-M906 PolarHBondContact O-N 3.08Å; T903-S907 PolarHBondContact O-N 2.94Å; T903-S907 VanDerWaalsContact O-N 3.08Å; T903-S907 PolarHBondContact O-OG 3.1Å; T903-W949 HydrophobicContact CG2-CB 3.95Å; T903-W949 HydrophobicContact CG2-CG 4.39Å
904T67.6Low62.6Low65 Ų6561.7 Ų61.740%0.39934%0.337SS..Hα-helixtrans-70.6-35.117453.60000112.9A900 I901 I902 M906 S907 S908 M1613A900-T904 VanDerWaalsContact O-CG2 3.29Å; A900-T904 WeakPolarHBondContact O-CG2 3.43Å; A900-T904 PolarHBondContact O-N 3.04Å; A900-T904 VanDerWaalsContact O-N 3.11Å; A900-T904 PolarHBondContact O-OG1 3.24Å; I901-T904 WeakPolarHBondContact CA-OG1 3.42Å; I901-T904 PolarHBondContact O-N 3.21Å; I901-T904 PolarHBondContact O-OG1 3.13Å; I902-T904 VanDerWaalsContact C-N 3.29Å; I902-T904 PolarHBondContact O-N 3.27Å; T904-M906 PolarHBondContact O-N 3.19Å; T904-S907 WeakPolarHBondContact CA-OG 3.28Å; T904-S907 PolarHBondContact O-N 3.02Å; T904-S907 PolarHBondContact O-OG 3.14Å; T904-S908 PolarHBondContact O-N 3.17Å; T904-S908 VanDerWaalsContact O-N 3.13Å; T904-S908 PolarHBondContact O-OG 3.4Å; T904-S908 VanDerWaalsContact O-OG 3.14Å; T904-M1613 HydrophobicContact CG2-CB 4.07Å; T904-M1613 HydrophobicContact CG2-CE 3.74Å; T904-M1613 HydrophobicContact CG2-CG 4.11Å; T904-M1613 WeakPolarHBondContact OG1-CE 3.38Å
905M64.2Low60.8Low41.75 Ų41.7567.4 Ų67.421%0.20637%0.369CS..Hα-helixtrans-66.2-43.5172.1-74-158.7173.200112.4I901 I902 S907 S908 S909 I989 Q992I901-M905 HydrophobicContact CG2-CE 3.98Å; I901-M905 HydrophobicContact CG2-SD 4.2Å; I901-M905 VanDerWaalsContact O-CG 3.3Å; I901-M905 WeakPolarHBondContact O-CG 3.38Å; I901-M905 PolarHBondContact O-N 3.08Å; I901-M905 VanDerWaalsContact O-N 3.08Å; I902-M905 PolarHBondContact O-N 3.18Å; I902-M905 VanDerWaalsContact O-N 3.12Å; M905-S907 VanDerWaalsContact C-N 3.3Å; M905-S907 PolarHBondContact O-N 3.27Å; M905-S908 WeakPolarHBondContact CA-OG 3.38Å; M905-S908 PolarHBondContact O-N 3.32Å; M905-S908 VanDerWaalsContact O-N 3.12Å; M905-S908 PolarHBondContact O-OG 3.08Å; M905-S909 WeakPolarHBondContact O-CB 3.4Å; M905-S909 PolarHBondContact O-N 3.18Å; M905-S909 VanDerWaalsContact O-N 3.13Å; M905-S909 PolarHBondContact O-OG 3.18Å; M905-S909 VanDerWaalsContact O-OG 3.08Å; M905-I989 HydrophobicContact CE-CB 4.4Å; M905-I989 HydrophobicContact CE-CD1 3.51Å; M905-I989 HydrophobicContact CE-CG1 3.64Å; M905-I989 HydrophobicContact CE-CG2 4.31Å; M905-I989 HydrophobicContact SD-CD1 4.39Å; M905-I989 HydrophobicContact SD-CG1 3.89Å; M905-I989 HydrophobicContact SD-CG2 4.36Å; M905-Q992 VanDerWaalsContact CE-OE1 3.28Å
906M64.2Low59Low26 Ų2672.5 Ų72.513%0.12840%0.396CS..Hα-helixtrans-61.6-41.8177.3-74.5179.7163.900112.2I902 T903 T904 S908 S909 H910 V947 W949 Y952I902-M906 HydrophobicContact CG2-CE 3.76Å; I902-M906 HydrophobicContact CG2-CG 4.33Å; I902-M906 HydrophobicContact CG2-SD 4.11Å; I902-M906 WeakPolarHBondContact O-CB 3.36Å; I902-M906 VanDerWaalsContact O-CG 3.29Å; I902-M906 WeakPolarHBondContact O-CG 3.24Å; I902-M906 PolarHBondContact O-N 2.92Å; T903-M906 PolarHBondContact O-N 3.08Å; T904-M906 PolarHBondContact O-N 3.19Å; M906-S908 VanDerWaalsContact C-N 3.28Å; M906-S908 PolarHBondContact O-N 3.07Å; M906-S909 PolarHBondContact O-N 3.24Å; M906-S909 PolarHBondContact O-OG 3.35Å; M906-S909 VanDerWaalsContact O-OG 3.1Å; M906-H910 PolarHBondContact O-CD2 3.49Å; M906-H910 PolarHBondContact O-N 2.93Å; M906-V947 HydrophobicContact CB-CG1 4.43Å; M906-V947 HydrophobicContact CE-CB 4.43Å; M906-V947 HydrophobicContact CE-CG1 4.15Å; M906-V947 WeakPolarHBondContact CE-O 3.24Å; M906-V947 HydrophobicContact CG-CG1 4.41Å; M906-V947 HydrophobicContact SD-CG1 3.27Å; M906-V947 WeakPolarHBondContact SD-CG1 3.24Å; M906-W949 HydrophobicContact CE-CB 4.44Å; M906-W949 VanDerWaalsContact SD-CA 3.59Å; M906-W949 HydrophobicContact SD-CB 4.17Å; M906-Y952 VanDerWaalsContact CE-CB 3.4Å; M906-Y952 HydrophobicContact CE-CD1 3.81Å; M906-Y952 HydrophobicContact CE-CD2 3.87Å; M906-Y952 HydrophobicContact CE-CE1 4.44Å; M906-Y952 HydrophobicContact CE-CG 3.33Å
907S61.8Low57Low79.75 Ų79.7574.8 Ų74.856%0.55841%0.408SS*.Hα-helixtrans-68.6-30.7178.561.60000113.1T903 T904 M905T903-S907 PolarHBondContact O-N 2.94Å; T903-S907 VanDerWaalsContact O-N 3.08Å; T903-S907 PolarHBondContact O-OG 3.1Å; T904-S907 WeakPolarHBondContact CA-OG 3.28Å; T904-S907 PolarHBondContact O-N 3.02Å; T904-S907 PolarHBondContact O-OG 3.14Å; M905-S907 VanDerWaalsContact C-N 3.3Å; M905-S907 PolarHBondContact O-N 3.27Å
908S57.6Low55.2Low77 Ų7776 Ų7654%0.53842%0.415SS..Hα-helixtrans-79.3-29.7177.263.60000113.9T904 M905 M906 H910T904-S908 PolarHBondContact O-N 3.17Å; T904-S908 VanDerWaalsContact O-N 3.13Å; T904-S908 PolarHBondContact O-OG 3.4Å; T904-S908 VanDerWaalsContact O-OG 3.14Å; M905-S908 WeakPolarHBondContact CA-OG 3.38Å; M905-S908 PolarHBondContact O-N 3.32Å; M905-S908 VanDerWaalsContact O-N 3.12Å; M905-S908 PolarHBondContact O-OG 3.08Å; M906-S908 VanDerWaalsContact C-N 3.28Å; M906-S908 PolarHBondContact O-N 3.07Å; S908-H910 VanDerWaalsContact C-N 3.33Å; S908-H910 PolarHBondContact O-N 3.09Å
909S48.6Very low53.5Low49.75 Ų49.7578.9 Ų78.935%0.34844%0.438SS..Hα-helixtrans-73.3-24.3-179.361.90000114M905 M906 E911 K912 N913M905-S909 WeakPolarHBondContact O-CB 3.4Å; M905-S909 PolarHBondContact O-N 3.18Å; M905-S909 VanDerWaalsContact O-N 3.13Å; M905-S909 PolarHBondContact O-OG 3.18Å; M905-S909 VanDerWaalsContact O-OG 3.08Å; M906-S909 PolarHBondContact O-N 3.24Å; M906-S909 PolarHBondContact O-OG 3.35Å; M906-S909 VanDerWaalsContact O-OG 3.1Å; S909-E911 PolarHBondContact O-N 3.19Å; S909-E911 VanDerWaalsContact O-N 3.16Å; S909-K912 PolarHBondContact O-N 2.98Å; S909-N913 PolarHBondContact O-N 2.88Å
910H45.8Very low51.7Low133.5 Ų133.584.1 Ų84.162%0.61847%0.465SS*.THydrogen-bonded Turntrans-66-18.1-175.5-104.4-66.5000114.7M906 S908 K912M906-H910 PolarHBondContact O-CD2 3.49Å; M906-H910 PolarHBondContact O-N 2.93Å; S908-H910 VanDerWaalsContact C-N 3.33Å; S908-H910 PolarHBondContact O-N 3.09Å; H910-K912 PolarHBondContact O-N 2.9Å
911E43.3Very low49.9Very low173.75 Ų173.7589.1 Ų89.181%0.81248%0.482SS*.THydrogen-bonded Turntrans-86.3-15.2-176-79-168.1157.100115.6S909S909-E911 PolarHBondContact O-N 3.19Å; S909-E911 VanDerWaalsContact O-N 3.16Å
912K41.3Very low48Very low184.5 Ų184.592.1 Ų92.180%0.80250%0.502SS*.THydrogen-bonded Turntrans-137.9-8.5-172-71.5-171.2179.9175.20119S909 H910S909-K912 PolarHBondContact O-N 2.98Å; H910-K912 PolarHBondContact O-N 2.9Å
913N35.8Very low46.1Very low99.5 Ų99.597.3 Ų97.353%0.53253%0.534SS..  trans-14050.8-171.2-80-36.1000114.3S909 D915 N916 L917S909-N913 PolarHBondContact O-N 2.88Å; N913-D915 VanDerWaalsContact C-N 3.3Å; N913-D915 PolarHBondContact O-N 3.13Å; N913-N916 HydrophobicContact CB-CB 4.29Å; N913-N916 PolarHBondContact O-N 3.35Å; N913-N916 PolarHBondContact OD1-ND2 2.83Å; N913-L917 PolarHBondContact O-N 3.13Å
914V42.2Very low44.1Very low99.5 Ų99.5100.5 Ų100.560%0.60355%0.553SS**Hα-helixtrans-61.3-30.8176.3177.40000111.9N916 L917 D918V914-N916 PolarHBondContact O-N 3.38Å; V914-N916 VanDerWaalsContact O-N 3.15Å; V914-L917 PolarHBondContact O-N 3.33Å; V914-D918 PolarHBondContact O-N 2.71Å
915D42.1Very low42.2Very low143 Ų143102.5 Ų102.577%0.76557%0.57SS**Hα-helixtrans-79.2-20.1-175.4-58.5-23.3000114.7N913 A919N913-D915 VanDerWaalsContact C-N 3.3Å; N913-D915 PolarHBondContact O-N 3.13Å; D915-A919 PolarHBondContact O-N 3.26Å
916N41Very low40.5Very low107.75 Ų107.75106.3 Ų106.358%0.57660%0.595SS**Hα-helixtrans-94.8-17.9-176-79.4-27.3000114.1N913 V914 A919 L920N913-N916 HydrophobicContact CB-CB 4.29Å; N913-N916 PolarHBondContact O-N 3.35Å; N913-N916 PolarHBondContact OD1-ND2 2.83Å; V914-N916 PolarHBondContact O-N 3.38Å; V914-N916 VanDerWaalsContact O-N 3.15Å; N916-A919 WeakPolarHBondContact O-CB 3.39Å; N916-A919 PolarHBondContact O-N 3.47Å; N916-L920 PolarHBondContact O-N 3.17Å
917L34.3Very low38.8Very low69.25 Ų69.25110.6 Ų110.636%0.36363%0.628SS.*Hα-helixtrans-80.5-32.4179.5-123.5156.8000111.4N913 V914 A919 L920 F921N913-L917 PolarHBondContact O-N 3.13Å; V914-L917 PolarHBondContact O-N 3.33Å; L917-A919 VanDerWaalsContact C-N 3.3Å; L917-A919 PolarHBondContact O-N 3Å; L917-L920 PolarHBondContact O-N 3.02Å; L917-F921 HydrophobicContact CD2-CD2 3.65Å; L917-F921 VanDerWaalsContact CD2-CD2 3.48Å; L917-F921 HydrophobicContact CD2-CE2 3.56Å; L917-F921 VanDerWaalsContact CD2-CE2 3.46Å; L917-F921 WeakPolarHBondContact O-CD2 3.29Å; L917-F921 PolarHBondContact O-N 3.08Å
918D38.4Very low37.2Very low101.75 Ų101.75113.1 Ų113.154%0.54464%0.64SS.*Hα-helixtrans-61.6-32.7170.8-81.9-10.4000111.6V914 L920 F921 T922V914-D918 PolarHBondContact O-N 2.71Å; D918-L920 VanDerWaalsContact C-N 3.28Å; D918-L920 PolarHBondContact O-N 3.15Å; D918-L920 VanDerWaalsContact O-N 3.13Å; D918-F921 CarbonylContact O-C 3.54Å; D918-F921 WeakPolarHBondContact O-CA 3.35Å; D918-F921 PolarHBondContact O-N 3.36Å; D918-T922 VanDerWaalsContact C-OG1 3.28Å; D918-T922 HydrophobicContact CB-CG2 4.16Å; D918-T922 WeakPolarHBondContact O-CA 3.39Å; D918-T922 VanDerWaalsContact O-CB 3.25Å; D918-T922 WeakPolarHBondContact O-CB 3.41Å; D918-T922 VanDerWaalsContact O-CG2 3.23Å; D918-T922 WeakPolarHBondContact O-CG2 3.37Å; D918-T922 PolarHBondContact O-N 3.34Å; D918-T922 PolarHBondContact O-OG1 3.27Å
919A39.5Very low35.8Very low62.5 Ų62.5112.9 Ų112.952%0.51765%0.65SS.*Hα-helixtrans-64.1-26.8175.600000113.7D915 N916 L917 F921 T922 T923D915-A919 PolarHBondContact O-N 3.26Å; N916-A919 WeakPolarHBondContact O-CB 3.39Å; N916-A919 PolarHBondContact O-N 3.47Å; L917-A919 VanDerWaalsContact C-N 3.3Å; L917-A919 PolarHBondContact O-N 3Å; A919-F921 PolarHBondContact O-N 2.9Å; A919-T922 PolarHBondContact O-N 3.43Å; A919-T922 VanDerWaalsContact O-N 3.17Å; A919-T923 HydrophobicContact CB-CG2 3.87Å; A919-T923 WeakPolarHBondContact O-CB 3.28Å; A919-T923 WeakPolarHBondContact O-CG2 3.37Å; A919-T923 PolarHBondContact O-N 3.49Å; A919-T923 PolarHBondContact O-OG1 3.38Å
920L34.5Very low34.9Very low120.75 Ų120.75117.2 Ų117.263%0.63267%0.674SS**Hα-helixtrans-80.4-23.1174.2-83.2164.1000113N916 L917 D918N916-L920 PolarHBondContact O-N 3.17Å; L917-L920 PolarHBondContact O-N 3.02Å; D918-L920 VanDerWaalsContact C-N 3.28Å; D918-L920 PolarHBondContact O-N 3.15Å; D918-L920 VanDerWaalsContact O-N 3.13Å
921F34.6Very low34.1Very low132 Ų132116.9 Ų116.958%0.57968%0.682SS**Hα-helixtrans-106.3-12.6-179.7-70.8-68.9000114.7L917 D918 A919 T923L917-F921 HydrophobicContact CD2-CD2 3.65Å; L917-F921 VanDerWaalsContact CD2-CD2 3.48Å; L917-F921 HydrophobicContact CD2-CE2 3.56Å; L917-F921 VanDerWaalsContact CD2-CE2 3.46Å; L917-F921 WeakPolarHBondContact O-CD2 3.29Å; L917-F921 PolarHBondContact O-N 3.08Å; D918-F921 CarbonylContact O-C 3.54Å; D918-F921 WeakPolarHBondContact O-CA 3.35Å; D918-F921 PolarHBondContact O-N 3.36Å; A919-F921 PolarHBondContact O-N 2.9Å; F921-T923 VanDerWaalsContact C-N 3.29Å; F921-T923 PolarHBondContact O-N 3.13Å
922T31.4Very low33.3Very low94.5 Ų94.5114.4 Ų114.458%0.5868%0.683SS**  trans-10158.4-179.557.60000112.3D918 A919 V924D918-T922 VanDerWaalsContact C-OG1 3.28Å; D918-T922 HydrophobicContact CB-CG2 4.16Å; D918-T922 WeakPolarHBondContact O-CA 3.39Å; D918-T922 VanDerWaalsContact O-CB 3.25Å; D918-T922 WeakPolarHBondContact O-CB 3.41Å; D918-T922 VanDerWaalsContact O-CG2 3.23Å; D918-T922 WeakPolarHBondContact O-CG2 3.37Å; D918-T922 PolarHBondContact O-N 3.34Å; D918-T922 PolarHBondContact O-OG1 3.27Å; A919-T922 PolarHBondContact O-N 3.43Å; A919-T922 VanDerWaalsContact O-N 3.17Å; T922-V924 PolarHBondContact O-N 3.24Å; T922-V924 VanDerWaalsContact O-N 3.1Å
923T30.2Very low32.7Very low113.75 Ų113.75109.3 Ų109.370%0.69868%0.683SS**  trans-70.8104.9167.352.70000110.9A919 F921 S925A919-T923 HydrophobicContact CB-CG2 3.87Å; A919-T923 WeakPolarHBondContact O-CB 3.28Å; A919-T923 WeakPolarHBondContact O-CG2 3.37Å; A919-T923 PolarHBondContact O-N 3.49Å; A919-T923 PolarHBondContact O-OG1 3.38Å; F921-T923 VanDerWaalsContact C-N 3.29Å; F921-T923 PolarHBondContact O-N 3.13Å; T923-S925 VanDerWaalsContact C-N 3.34Å; T923-S925 PolarHBondContact O-N 3.28Å; T923-S925 PolarHBondContact O-OG 3.24Å
924V28.3Very low32.3Very low134.25 Ų134.25111.9 Ų111.981%0.81470%0.697SS**  trans-45.390.7166-1770000111.1T922 T926T922-V924 PolarHBondContact O-N 3.24Å; T922-V924 VanDerWaalsContact O-N 3.1Å; V924-T926 VanDerWaalsContact C-N 3.32Å; V924-T926 PolarHBondContact O-N 3.25Å
925S27.5Very low31.7Very low108.25 Ų108.25114.4 Ų114.476%0.75771%0.707SS**  trans-82.6106.716531.70000108T923 S927T923-S925 VanDerWaalsContact C-N 3.34Å; T923-S925 PolarHBondContact O-N 3.28Å; T923-S925 PolarHBondContact O-OG 3.24Å; S925-S927 PolarHBondContact O-N 3.08Å; S925-S927 VanDerWaalsContact O-N 3.09Å
926T28.4Very low31.2Very low120.5 Ų120.5117 Ų11774%0.73971%0.711SS**  trans-33.3114.5172.6510000111.6V924 T928V924-T926 VanDerWaalsContact C-N 3.32Å; V924-T926 PolarHBondContact O-N 3.25Å; T926-T928 VanDerWaalsContact C-N 3.27Å; T926-T928 PolarHBondContact O-N 3.34Å
927S27.4Very low30.6Very low117 Ų117120.6 Ų120.682%0.81873%0.725SS**  trans-79101.8163.257.30000110.2S925 G929S925-S927 PolarHBondContact O-N 3.08Å; S925-S927 VanDerWaalsContact O-N 3.09Å; S927-G929 PolarHBondContact O-N 2.96Å
928T28.9Very low30.3Very low132 Ų132125.1 Ų125.181%0.8175%0.749SS**  trans-91.7101.6166.556.20000109.3T926 V930T926-T928 VanDerWaalsContact C-N 3.27Å; T926-T928 PolarHBondContact O-N 3.34Å; T928-V930 PolarHBondContact O-N 3.09Å
929G28.2Very low30.1Very low72.25 Ų72.25124.9 Ų124.975%0.74575%0.754SS**  trans-77.4123.1179.700000112.3S927S927-G929 PolarHBondContact O-N 2.96Å
930V29.6Very low29.5Very low141.75 Ų141.75129.1 Ų129.186%0.85977%0.767SS**  trans-116.9122.3160.9-166.10000109.7T928T928-V930 PolarHBondContact O-N 3.09Å
931V29.3Very low29.2Very low127 Ų127129.6 Ų129.677%0.7778%0.775SS**  trans-123.8131.8145.4172.20000112.1
932S27Very low29Very low120.25 Ų120.25130.3 Ų130.384%0.84179%0.79SS**  trans27.8124.5153.9-550000119.8
933G29.3Very low29Very low78.5 Ų78.5130 Ų13081%0.80979%0.792SS**  trans-174.895.5160.700000112.3N935G933-N935 PolarHBondContact O-N 3.18Å
934D27.3Very low29Very low153.25 Ų153.25128.3 Ų128.382%0.8280%0.797SS**  trans-47.8135.5175.3-73.5-47.8000115.6
935N29.3Very low29.4Very low151.75 Ų151.75130.4 Ų130.481%0.81180%0.798SS**  trans121.1126.4130.5-84.4-35.2000116.7G933G933-N935 PolarHBondContact O-N 3.18Å
936K30.7Very low30.4Very low197.5 Ų197.5130.2 Ų130.286%0.85980%0.796SS**  trans-123.3133.3150.1-84.5164-179.3175.80112.4N938K936-N938 PolarHBondContact O-N 3.33Å
937Q28.5Very low31.7Very low183.75 Ų183.75128.7 Ų128.786%0.85979%0.787SS**  trans-60.9130.6157-74.4160.12.100113.7
938N27.2Very low33.7Very low163 Ų163126.8 Ų126.887%0.87277%0.767SS**  trans-126.2117158.5-106.3-5.5000108.8K936K936-N938 PolarHBondContact O-N 3.33Å
939P35.1Very low36Very low98.75 Ų98.75123 Ų12364%0.64174%0.738SS**  trans-92.4162.6-17334.8-26.2000110
940N26.8Very low38.3Very low150 Ų150119.7 Ų119.780%0.80270%0.704SS**  trans100.184.2165.8-52.8-19.4000117.5
941V28.9Very low40.5Very low132.5 Ų132.5113.4 Ų113.480%0.80367%0.667SS**  trans-159.892.9140.5-178.40000109.7S943V941-S943 VanDerWaalsContact C-N 3.29Å; V941-S943 PolarHBondContact O-N 3.11Å; V941-S943 VanDerWaalsContact O-N 3.09Å
942V30Very low42.5Very low146 Ų146110.7 Ų110.789%0.88564%0.643SS**  trans-92.297.4155-179.20000106.3G944V942-G944 PolarHBondContact O-N 3.04Å
943S30.5Very low44.8Very low89 Ų89105.1 Ų105.162%0.62260%0.604SS**  trans-71.1120.7169.649.90000108.7V941 Q945V941-S943 VanDerWaalsContact C-N 3.29Å; V941-S943 PolarHBondContact O-N 3.11Å; V941-S943 VanDerWaalsContact O-N 3.09Å; S943-Q945 PolarHBondContact O-N 3.3Å
944G30.4Very low46.9Very low77.25 Ų77.25101.5 Ų101.580%0.79657%0.566SS**  trans-60.9115.2176.300000111V942 S946V942-G944 PolarHBondContact O-N 3.04Å; G944-S946 PolarHBondContact O-N 3.06Å; G944-S946 VanDerWaalsContact O-N 3.15Å
945Q36.3Very low49Very low178.25 Ų178.2597.4 Ų97.483%0.83354%0.544SS*.  trans-78.6120.7173-72178.6-11.600107.9S943 V947S943-Q945 PolarHBondContact O-N 3.3Å; Q945-V947 PolarHBondContact O-N 3.15Å; Q945-V947 VanDerWaalsContact O-N 3.12Å
946S49.3Very low50.8Low104.5 Ų104.590.8 Ų90.873%0.73151%0.509SS*.  trans-60.1123.3174.652.90000109.8G944 D948G944-S946 PolarHBondContact O-N 3.06Å; G944-S946 VanDerWaalsContact O-N 3.15Å; S946-D948 PolarHBondContact O-N 3.33Å
947V55.2Low52.6Low88.25 Ų88.2582.9 Ų82.954%0.53548%0.476SS..  trans-75.8114-177.9-179.40000109.9M906 Q945 W949M906-V947 HydrophobicContact CB-CG1 4.43Å; M906-V947 HydrophobicContact CE-CB 4.43Å; M906-V947 HydrophobicContact CE-CG1 4.15Å; M906-V947 WeakPolarHBondContact CE-O 3.24Å; M906-V947 HydrophobicContact CG-CG1 4.41Å; M906-V947 HydrophobicContact SD-CG1 3.27Å; M906-V947 WeakPolarHBondContact SD-CG1 3.24Å; Q945-V947 PolarHBondContact O-N 3.15Å; Q945-V947 VanDerWaalsContact O-N 3.12Å; V947-W949 VanDerWaalsContact C-N 3.34Å; V947-W949 PolarHBondContact O-N 3.27Å
948D69.1Low54.4Low76.5 Ų76.577.9 Ų77.941%0.40945%0.452SS..  trans-75.585.2-179.2-87.80.4000112.3S946 A950 S951 Y952 R1073S946-D948 PolarHBondContact O-N 3.33Å; D948-A950 VanDerWaalsContact C-N 3.26Å; D948-A950 PolarHBondContact O-N 3.04Å; D948-A950 VanDerWaalsContact O-N 3.16Å; D948-S951 WeakPolarHBondContact CB-OG 3.45Å; D948-S951 WeakPolarHBondContact O-CB 3.3Å; D948-S951 PolarHBondContact O-N 3.36Å; D948-S951 VanDerWaalsContact O-N 3.12Å; D948-S951 PolarHBondContact OD2-OG 3.18Å; D948-S951 VanDerWaalsContact OD2-OG 3.13Å; D948-Y952 PolarHBondContact O-N 3.12Å; D948-Y952 VanDerWaalsContact O-N 3.14Å; D948-R1073 VanDerWaalsContact CG-NH2 3.28Å; D948-R1073 IonicContact OD1-NH2 3.46Å; D948-R1073 PolarHBondContact OD1-NH2 3.08Å; D948-R1073 IonicContact OD2-CZ 3.41Å; D948-R1073 IonicContact OD2-NE 2.7Å; D948-R1073 PolarHBondContact OD2-NE 2.93Å; D948-R1073 IonicContact OD2-NH1 3.31Å; D948-R1073 PolarHBondContact OD2-NH1 2.85Å; D948-R1073 IonicContact OD2-NH2 3.53Å; D948-R1073 PolarHBondContact OD2-NH2 3.26Å
949W78.4Confident56.1Low52 Ų5274.5 Ų74.520%0.19743%0.431CS..Hα-helixtrans-51.7-39.3179.665.4-95.2000113.3L895 T899 I902 T903 M906 V947 S951 Y952 L953 I1066 T1069 F1070L895-W949 HydrophobicContact CD1-CZ3 4.49Å; T899-W949 HydrophobicContact CG2-CD2 4.34Å; T899-W949 HydrophobicContact CG2-CE3 3.63Å; T899-W949 HydrophobicContact CG2-CH2 3.61Å; T899-W949 HydrophobicContact CG2-CZ2 4.3Å; T899-W949 HydrophobicContact CG2-CZ3 3.23Å; I902-W949 HydrophobicContact CG2-CB 4.35Å; T903-W949 HydrophobicContact CG2-CB 3.95Å; T903-W949 HydrophobicContact CG2-CG 4.39Å; M906-W949 HydrophobicContact CE-CB 4.44Å; M906-W949 VanDerWaalsContact SD-CA 3.59Å; M906-W949 HydrophobicContact SD-CB 4.17Å; V947-W949 VanDerWaalsContact C-N 3.34Å; V947-W949 PolarHBondContact O-N 3.27Å; W949-S951 PolarHBondContact O-N 2.9Å; W949-Y952 PolarHBondContact O-N 3.18Å; W949-L953 HydrophobicContact CE3-CD1 4.34Å; W949-L953 HydrophobicContact CZ3-CD1 4.23Å; W949-L953 VanDerWaalsContact O-CB 3.3Å; W949-L953 WeakPolarHBondContact O-CB 3.33Å; W949-L953 PolarHBondContact O-N 3.23Å; W949-I1066 HydrophobicContact CH2-CG2 3.68Å; W949-I1066 HydrophobicContact CZ2-CG1 4.33Å; W949-I1066 HydrophobicContact CZ2-CG2 3.93Å; W949-T1069 HydrophobicContact CZ2-CG2 4.18Å; W949-F1070 HydrophobicContact CH2-CB 4.16Å; W949-F1070 HydrophobicContact CH2-CD2 4.36Å; W949-F1070 HydrophobicContact CZ3-CD2 4.32Å
950A77Confident57.3Low4 Ų471.1 Ų71.13%0.03341%0.406CS..Hα-helixtrans-67.1-36.3-178.500000112.5D948 L953 L954 T1069 F1070 R1073D948-A950 VanDerWaalsContact C-N 3.26Å; D948-A950 PolarHBondContact O-N 3.04Å; D948-A950 VanDerWaalsContact O-N 3.16Å; A950-L953 PolarHBondContact O-N 3.23Å; A950-L954 WeakPolarHBondContact O-CB 3.32Å; A950-L954 WeakPolarHBondContact O-CD1 3.37Å; A950-L954 VanDerWaalsContact O-CG 3.29Å; A950-L954 WeakPolarHBondContact O-CG 3.34Å; A950-L954 PolarHBondContact O-N 3.18Å; A950-T1069 HydrophobicContact CB-CG2 4.41Å; A950-F1070 HydrophobicContact CB-CD2 4.42Å; A950-R1073 HydrophobicContact CB-CB 4.03Å; A950-R1073 HydrophobicContact CB-CG 4.17Å
951S74.4Confident58.6Low10.25 Ų10.2565.5 Ų65.57%0.07238%0.384CS..Hα-helixtrans-67.5-43.8177-54.10000111.1D948 W949 L954 N955 R1073D948-S951 WeakPolarHBondContact CB-OG 3.45Å; D948-S951 WeakPolarHBondContact O-CB 3.3Å; D948-S951 PolarHBondContact O-N 3.36Å; D948-S951 VanDerWaalsContact O-N 3.12Å; D948-S951 PolarHBondContact OD2-OG 3.18Å; D948-S951 VanDerWaalsContact OD2-OG 3.13Å; W949-S951 PolarHBondContact O-N 2.9Å; S951-L954 PolarHBondContact O-N 3.07Å; S951-N955 WeakPolarHBondContact O-CB 3.42Å; S951-N955 PolarHBondContact O-N 3.04Å; S951-N955 PolarHBondContact O-ND2 3Å; S951-N955 PolarHBondContact O-OD1 3.43Å; S951-R1073 WeakPolarHBondContact OG-CD 3.39Å; S951-R1073 PolarHBondContact OG-NE 3.11Å; S951-R1073 PolarHBondContact OG-NH1 3.04Å; S951-R1073 PolarHBondContact OG-NH2 3.09Å
952Y71.1Confident59.8Low70 Ų7065.9 Ų65.928%0.27538%0.375SS..Hα-helixtrans-64.8-44.2177.5-174.1-91000111.3I902 M906 D948 W949 L954 N955 V956 L986I902-Y952 HydrophobicContact CB-CD1 4.49Å; I902-Y952 HydrophobicContact CD1-CD1 4.49Å; I902-Y952 HydrophobicContact CG1-CD1 4.4Å; I902-Y952 HydrophobicContact CG1-CE1 4.46Å; I902-Y952 HydrophobicContact CG2-CD1 3.61Å; I902-Y952 HydrophobicContact CG2-CE1 4.14Å; I902-Y952 HydrophobicContact CG2-CG 4.4Å; M906-Y952 VanDerWaalsContact CE-CB 3.4Å; M906-Y952 HydrophobicContact CE-CD1 3.81Å; M906-Y952 HydrophobicContact CE-CD2 3.87Å; M906-Y952 HydrophobicContact CE-CE1 4.44Å; M906-Y952 HydrophobicContact CE-CG 3.33Å; D948-Y952 PolarHBondContact O-N 3.12Å; D948-Y952 VanDerWaalsContact O-N 3.14Å; W949-Y952 PolarHBondContact O-N 3.18Å; Y952-L954 VanDerWaalsContact C-N 3.32Å; Y952-L954 PolarHBondContact O-N 3.27Å; Y952-N955 PolarHBondContact O-N 3.26Å; Y952-N955 VanDerWaalsContact O-N 3.16Å; Y952-V956 HydrophobicContact CD1-CG2 3.97Å; Y952-V956 HydrophobicContact CE1-CG2 3.72Å; Y952-V956 WeakPolarHBondContact O-CG2 3.39Å; Y952-V956 PolarHBondContact O-N 2.94Å; Y952-L986 WeakPolarHBondContact OH-CD1 3.48Å
953L76Confident60.6Low3 Ų363.2 Ų63.22%0.01635%0.353CS..Hα-helixtrans-54.4-51.4173.9-166.9161.1000110.8A898 I902 W949 A950 N955 V956 L957 W999 F1070A898-L953 HydrophobicContact CB-CD1 3.91Å; I902-L953 HydrophobicContact CD1-CB 3.41Å; I902-L953 VanDerWaalsContact CD1-CB 3.45Å; I902-L953 HydrophobicContact CD1-CD1 3.68Å; I902-L953 VanDerWaalsContact CD1-CD1 3.41Å; I902-L953 HydrophobicContact CD1-CG 3.31Å; W949-L953 HydrophobicContact CE3-CD1 4.34Å; W949-L953 HydrophobicContact CZ3-CD1 4.23Å; W949-L953 VanDerWaalsContact O-CB 3.3Å; W949-L953 WeakPolarHBondContact O-CB 3.33Å; W949-L953 PolarHBondContact O-N 3.23Å; A950-L953 PolarHBondContact O-N 3.23Å; L953-N955 VanDerWaalsContact C-N 3.33Å; L953-N955 PolarHBondContact O-N 2.88Å; L953-V956 PolarHBondContact O-N 3.13Å; L953-L957 HydrophobicContact CD2-CD1 3.37Å; L953-L957 VanDerWaalsContact CD2-CD1 3.46Å; L953-L957 HydrophobicContact CD2-CG 4.09Å; L953-L957 HydrophobicContact CG-CD1 4.46Å; L953-L957 VanDerWaalsContact O-CG 3.27Å; L953-L957 WeakPolarHBondContact O-CG 3.43Å; L953-L957 PolarHBondContact O-N 2.96Å; L953-W999 HydrophobicContact CD2-CE3 4.49Å; L953-W999 HydrophobicContact CD2-CH2 4.14Å; L953-W999 HydrophobicContact CD2-CZ3 3.62Å; L953-F1070 HydrophobicContact CD1-CE2 4.48Å; L953-F1070 HydrophobicContact CD2-CE2 4.05Å; L953-F1070 HydrophobicContact CD2-CZ 4.38Å
954L74.4Confident61.4Low3 Ų364.3 Ų64.32%0.01635%0.348CS..Hα-helixtrans-62.6-42.2178.3-71.2166.2000112A950 S951 Y952 V956 L957 F958 F1070 R1073 I1074 N1077A950-L954 WeakPolarHBondContact O-CB 3.32Å; A950-L954 WeakPolarHBondContact O-CD1 3.37Å; A950-L954 VanDerWaalsContact O-CG 3.29Å; A950-L954 WeakPolarHBondContact O-CG 3.34Å; A950-L954 PolarHBondContact O-N 3.18Å; S951-L954 PolarHBondContact O-N 3.07Å; Y952-L954 VanDerWaalsContact C-N 3.32Å; Y952-L954 PolarHBondContact O-N 3.27Å; L954-V956 VanDerWaalsContact C-N 3.34Å; L954-V956 PolarHBondContact O-N 2.96Å; L954-L957 CarbonylContact O-C 3.59Å; L954-L957 WeakPolarHBondContact O-CB 3.29Å; L954-L957 PolarHBondContact O-N 3.19Å; L954-F958 HydrophobicContact CB-CD2 4.34Å; L954-F958 HydrophobicContact CB-CE2 4.18Å; L954-F958 WeakPolarHBondContact O-CB 3.42Å; L954-F958 WeakPolarHBondContact O-CD2 3.38Å; L954-F958 WeakPolarHBondContact O-CG 3.35Å; L954-F958 PolarHBondContact O-N 2.99Å; L954-F1070 HydrophobicContact CD2-CE2 4.24Å; L954-F1070 HydrophobicContact CG-CE2 4.4Å; L954-R1073 HydrophobicContact CD1-CB 4.1Å; L954-R1073 HydrophobicContact CD1-CG 3.76Å; L954-I1074 HydrophobicContact CD1-CB 4.49Å; L954-I1074 HydrophobicContact CD1-CG1 3.93Å; L954-I1074 HydrophobicContact CD2-CD1 4.46Å; L954-I1074 HydrophobicContact CD2-CG1 3.75Å; L954-I1074 HydrophobicContact CG-CG1 4.45Å; L954-N1077 HydrophobicContact CD1-CB 4.48Å
955N69.6Low61.9Low66 Ų6667.5 Ų67.535%0.35334%0.343SS..Hα-helixtrans-62.3-43.3178.1-73.8-13.1000112.2S951 Y952 L953 L957 F958 Q959S951-N955 WeakPolarHBondContact O-CB 3.42Å; S951-N955 PolarHBondContact O-N 3.04Å; S951-N955 PolarHBondContact O-ND2 3Å; S951-N955 PolarHBondContact O-OD1 3.43Å; Y952-N955 PolarHBondContact O-N 3.26Å; Y952-N955 VanDerWaalsContact O-N 3.16Å; L953-N955 VanDerWaalsContact C-N 3.33Å; L953-N955 PolarHBondContact O-N 2.88Å; N955-L957 VanDerWaalsContact C-N 3.34Å; N955-F958 PolarHBondContact O-N 2.96Å; N955-Q959 WeakPolarHBondContact O-CG 3.41Å; N955-Q959 PolarHBondContact O-N 3.18Å
956V68.3Low62Low14 Ų1466.6 Ų66.69%0.08534%0.339CS..Hα-helixtrans-60.8-46.8174.7170.80000110.2Y952 L953 L954 F958 Q959 I960 L986 I989 I990 L993Y952-V956 HydrophobicContact CD1-CG2 3.97Å; Y952-V956 HydrophobicContact CE1-CG2 3.72Å; Y952-V956 WeakPolarHBondContact O-CG2 3.39Å; Y952-V956 PolarHBondContact O-N 2.94Å; L953-V956 PolarHBondContact O-N 3.13Å; L954-V956 VanDerWaalsContact C-N 3.34Å; L954-V956 PolarHBondContact O-N 2.96Å; V956-F958 VanDerWaalsContact C-N 3.34Å; V956-F958 PolarHBondContact O-N 3.11Å; V956-Q959 PolarHBondContact O-N 3.17Å; V956-Q959 VanDerWaalsContact O-N 3.11Å; V956-I960 HydrophobicContact CG1-CD1 3.84Å; V956-I960 HydrophobicContact CG1-CG1 4.39Å; V956-I960 VanDerWaalsContact O-CG1 3.28Å; V956-I960 WeakPolarHBondContact O-CG1 3.31Å; V956-I960 PolarHBondContact O-N 3.08Å; V956-L986 HydrophobicContact CG1-CD2 3.5Å; V956-L986 HydrophobicContact CG2-CD2 4.24Å; V956-I989 HydrophobicContact CG1-CG2 3.92Å; V956-I990 HydrophobicContact CB-CD1 4.43Å; V956-I990 HydrophobicContact CG1-CD1 3.32Å; V956-L993 HydrophobicContact CG1-CD1 4.37Å
957L68.4Low61.2Low30.75 Ų30.7569.9 Ų69.916%0.16134%0.342CS..Hα-helixtrans-62.1-40.6176.5-70.1173.8000113.1L953 L954 N955 Q959 I960 G961 I990 L995 W999L953-L957 HydrophobicContact CD2-CD1 3.37Å; L953-L957 VanDerWaalsContact CD2-CD1 3.46Å; L953-L957 HydrophobicContact CD2-CG 4.09Å; L953-L957 HydrophobicContact CG-CD1 4.46Å; L953-L957 VanDerWaalsContact O-CG 3.27Å; L953-L957 WeakPolarHBondContact O-CG 3.43Å; L953-L957 PolarHBondContact O-N 2.96Å; L954-L957 CarbonylContact O-C 3.59Å; L954-L957 WeakPolarHBondContact O-CB 3.29Å; L954-L957 PolarHBondContact O-N 3.19Å; N955-L957 VanDerWaalsContact C-N 3.34Å; L957-Q959 VanDerWaalsContact C-N 3.3Å; L957-Q959 PolarHBondContact O-N 3.08Å; L957-I960 PolarHBondContact O-N 3.09Å; L957-G961 PolarHBondContact O-N 3.11Å; L957-G961 VanDerWaalsContact O-N 3.08Å; L957-I990 HydrophobicContact CD2-CG2 4.34Å; L957-L995 HydrophobicContact CD2-CD1 3.84Å; L957-W999 HydrophobicContact CD1-CE3 3.43Å; L957-W999 VanDerWaalsContact CD1-CE3 3.46Å; L957-W999 HydrophobicContact CD1-CZ3 3.56Å; L957-W999 VanDerWaalsContact CD1-CZ3 3.45Å; L957-W999 HydrophobicContact CD2-CE3 4.28Å; L957-W999 HydrophobicContact CG-CE3 4.46Å
958F66.7Low60Low79.5 Ų79.573.3 Ų73.335%0.34935%0.352SS..Hα-helixtrans-65.6-33.2176-81.6-62.5000112.2L954 N955 V956 K962 L1095L954-F958 HydrophobicContact CB-CD2 4.34Å; L954-F958 HydrophobicContact CB-CE2 4.18Å; L954-F958 WeakPolarHBondContact O-CB 3.42Å; L954-F958 WeakPolarHBondContact O-CD2 3.38Å; L954-F958 WeakPolarHBondContact O-CG 3.35Å; L954-F958 PolarHBondContact O-N 2.99Å; N955-F958 PolarHBondContact O-N 2.96Å; V956-F958 VanDerWaalsContact C-N 3.34Å; V956-F958 PolarHBondContact O-N 3.11Å; F958-K962 WeakPolarHBondContact O-CG 3.49Å; F958-K962 PolarHBondContact O-N 3.08Å; F958-K962 VanDerWaalsContact O-N 3.15Å; F958-L1095 HydrophobicContact CD1-CD2 4.13Å; F958-L1095 HydrophobicContact CE1-CD1 3.99Å; F958-L1095 HydrophobicContact CE1-CD2 4.02Å; F958-L1095 HydrophobicContact CE1-CG 4.38Å
959Q61.7Low58.4Low91.75 Ų91.7575.5 Ų75.543%0.42937%0.371SS..Hα-helixtrans-70.1-46.9174.5-93.8176.3-3.300111.6N955 V956 L957 G961 K962 E963 L986N955-Q959 WeakPolarHBondContact O-CG 3.41Å; N955-Q959 PolarHBondContact O-N 3.18Å; V956-Q959 PolarHBondContact O-N 3.17Å; V956-Q959 VanDerWaalsContact O-N 3.11Å; L957-Q959 VanDerWaalsContact C-N 3.3Å; L957-Q959 PolarHBondContact O-N 3.08Å; Q959-G961 VanDerWaalsContact C-N 3.26Å; Q959-G961 PolarHBondContact O-N 3.2Å; Q959-K962 WeakPolarHBondContact O-CB 3.41Å; Q959-K962 PolarHBondContact O-N 3.21Å; Q959-E963 PolarHBondContact O-N 3.36Å; Q959-L986 HydrophobicContact CB-CD1 4.13Å; Q959-L986 VanDerWaalsContact OE1-CD1 3.25Å
960I60Low56.2Low26 Ų2680.8 Ų80.813%0.13340%0.401CS..Hα-helixtrans-55.8-41.9174.6-65.1167.1000110.6V956 L957 K962 E963 Q964 L986 I990V956-I960 HydrophobicContact CG1-CD1 3.84Å; V956-I960 HydrophobicContact CG1-CG1 4.39Å; V956-I960 VanDerWaalsContact O-CG1 3.28Å; V956-I960 WeakPolarHBondContact O-CG1 3.31Å; V956-I960 PolarHBondContact O-N 3.08Å; L957-I960 PolarHBondContact O-N 3.09Å; I960-K962 VanDerWaalsContact C-N 3.31Å; I960-K962 PolarHBondContact O-N 3.31Å; I960-E963 PolarHBondContact O-N 3.28Å; I960-Q964 WeakPolarHBondContact O-CG 3.44Å; I960-Q964 PolarHBondContact O-N 3.33Å; I960-L986 HydrophobicContact CG1-CD2 4.32Å; I960-I990 HydrophobicContact CB-CG1 4.42Å; I960-I990 HydrophobicContact CD1-CB 4.48Å; I960-I990 HydrophobicContact CD1-CD1 4.31Å; I960-I990 HydrophobicContact CD1-CG1 3.83Å; I960-I990 HydrophobicContact CD1-CG2 4.09Å; I960-I990 HydrophobicContact CG1-CD1 4.14Å; I960-I990 HydrophobicContact CG1-CG1 3.76Å; I960-I990 HydrophobicContact CG2-CD1 4.33Å; I960-I990 HydrophobicContact CG2-CG1 4.29Å
961G55.3Low54.1Low33 Ų3389.4 Ų89.434%0.3444%0.44SS..Hα-helixtrans-64.4-29.2177.500000114.6L957 Q959 Q965L957-G961 PolarHBondContact O-N 3.11Å; L957-G961 VanDerWaalsContact O-N 3.08Å; Q959-G961 VanDerWaalsContact C-N 3.26Å; Q959-G961 PolarHBondContact O-N 3.2Å; G961-Q965 WeakPolarHBondContact O-CG 3.45Å
962K53.6Low51.9Low140.25 Ų140.2592.1 Ų92.161%0.6147%0.469SS*.Hα-helixtrans-78-42177.5-78.4-177.7178.4178.90112.7F958 Q959 I960 Q964 Q965 Q966F958-K962 WeakPolarHBondContact O-CG 3.49Å; F958-K962 PolarHBondContact O-N 3.08Å; F958-K962 VanDerWaalsContact O-N 3.15Å; Q959-K962 WeakPolarHBondContact O-CB 3.41Å; Q959-K962 PolarHBondContact O-N 3.21Å; I960-K962 VanDerWaalsContact C-N 3.31Å; I960-K962 PolarHBondContact O-N 3.31Å; K962-Q964 VanDerWaalsContact C-N 3.33Å; K962-Q964 PolarHBondContact O-N 3.29Å; K962-Q965 PolarHBondContact O-N 3.09Å; K962-Q965 VanDerWaalsContact O-N 3.1Å; K962-Q966 PolarHBondContact O-N 3.31Å
963E47.7Very low50Low89.5 Ų89.597.9 Ų97.942%0.41850%0.499SS..Hα-helixtrans-66-35.8-178-70.5-175.6-179.900112Q959 I960 Q965 Q966 L986Q959-E963 PolarHBondContact O-N 3.36Å; I960-E963 PolarHBondContact O-N 3.28Å; E963-Q965 PolarHBondContact O-N 3.08Å; E963-Q966 PolarHBondContact O-N 3.11Å; E963-L986 VanDerWaalsContact OE2-CD2 3.27Å; E963-L986 WeakPolarHBondContact OE2-CD2 3.38Å
964Q45.5Very low47.7Very low111.5 Ų111.5106.1 Ų106.152%0.52154%0.537SS..Hα-helixtrans-65.4-20.3174.7-69.4-176.5-100113.7I960 K962I960-Q964 WeakPolarHBondContact O-CG 3.44Å; I960-Q964 PolarHBondContact O-N 3.33Å; K962-Q964 VanDerWaalsContact C-N 3.33Å; K962-Q964 PolarHBondContact O-N 3.29Å
965Q41Very low45.5Very low145.25 Ų145.25114 Ų11468%0.67958%0.578SS**Hα-helixtrans-93.1-21.6178.9-69.1-175.7-0.700114.1G961 K962 E963 Q967G961-Q965 WeakPolarHBondContact O-CG 3.45Å; K962-Q965 PolarHBondContact O-N 3.09Å; K962-Q965 VanDerWaalsContact O-N 3.1Å; E963-Q965 PolarHBondContact O-N 3.08Å; Q965-Q967 VanDerWaalsContact C-N 3.35Å; Q965-Q967 PolarHBondContact O-N 3.48Å
966Q39.9Very low43.5Very low160.25 Ų160.25119.7 Ų119.775%0.74960%0.602SS**Hα-helixtrans-96.113.1-175.1-73.8-173.9-0.200114.3K962 E963 Q968K962-Q966 PolarHBondContact O-N 3.31Å; E963-Q966 PolarHBondContact O-N 3.11Å; Q966-Q968 PolarHBondContact O-N 3.27Å
967Q32.9Very low41.6Very low174 Ų174122.7 Ų122.781%0.81363%0.629SS**  trans-87.968.5169.8-66-174.94.800111.6Q965Q965-Q967 VanDerWaalsContact C-N 3.35Å; Q965-Q967 PolarHBondContact O-N 3.48Å
968Q29.7Very low39.7Very low159.5 Ų159.5127.6 Ų127.675%0.74566%0.66SS**  trans-106.3128.9158.8-74-170.9-000108.7Q966 I970Q966-Q968 PolarHBondContact O-N 3.27Å; Q968-I970 PolarHBondContact O-N 3.22Å
969P33.9Very low37.9Very low122.5 Ų122.5131 Ų13180%0.79568%0.681SS**  trans-80.9102.7-17231.9-32.1000110.2H971P969-H971 PolarHBondContact O-N 3.2Å
970I34.1Very low36.4Very low161.75 Ų161.75131.2 Ų131.283%0.82969%0.69SS**  trans-94.5108.7169-58.7177.4000107.8Q968 G972Q968-I970 PolarHBondContact O-N 3.22Å; I970-G972 PolarHBondContact O-N 3.23Å
971H30.9Very low35.3Very low185.5 Ų185.5135.3 Ų135.386%0.85972%0.722SS**  trans-60.5132.7172.6-82.7-70.8000111.9P969P969-H971 PolarHBondContact O-N 3.2Å
972G29.8Very low34.5Very low66.25 Ų66.25137.7 Ų137.768%0.68373%0.733SS**  trans96.298.5148.600000117.4I970I970-G972 PolarHBondContact O-N 3.23Å
973H30.2Very low33.8Very low191.75 Ų191.75136.1 Ų136.189%0.88873%0.73SS**  163.2125.9115.6-101.8-66.8000113.3L975H973-L975 PolarHBondContact O-N 3.24Å; H973-L975 VanDerWaalsContact O-N 3.17Å
974H27.9Very low33.7Very low175.5 Ų175.5135.6 Ų135.681%0.81374%0.736SS**  trans-47120.5167.4-75.5-98.3000113.2
975L29.3Very low34Very low170.5 Ų170.5133.2 Ų133.289%0.89373%0.732SS**  trans-139.8125.7139.7-86.2171.9000108.9H973 A977H973-L975 PolarHBondContact O-N 3.24Å; H973-L975 VanDerWaalsContact O-N 3.17Å; L975-A977 PolarHBondContact O-N 3.08Å
976H26.8Very low34.4Very low183.75 Ų183.75127.6 Ų127.685%0.85171%0.706SS**  trans-63.3100.9-179-114.1-97.2000110.3
977A28.5Very low34.9Very low78.25 Ų78.25125.9 Ų125.965%0.64770%0.698SS**  trans-122.1108.116100000107.4L975 L979L975-A977 PolarHBondContact O-N 3.08Å; A977-L979 VanDerWaalsContact C-N 3.33Å; A977-L979 HydrophobicContact CB-CD1 4.46Å; A977-L979 PolarHBondContact O-N 3.25Å
978T27.4Very low35.9Very low133.25 Ų133.25120.5 Ų120.582%0.81768%0.678SS**  trans-65.69717446.50000109.2
979L29Very low37.1Very low150 Ų150114.1 Ų114.179%0.78565%0.648SS**  trans-88.6139.6167-10393.9000109.6A977 I983A977-L979 VanDerWaalsContact C-N 3.33Å; A977-L979 HydrophobicContact CB-CD1 4.46Å; A977-L979 PolarHBondContact O-N 3.25Å; L979-I983 HydrophobicContact CD2-CD1 4.46Å
980P31.6Very low38Very low96.25 Ų96.25110.8 Ų110.863%0.62562%0.623SS**  trans-79.9146.9-166.2410.2000112.5S982P980-S982 VanDerWaalsContact C-N 3.29Å; P980-S982 PolarHBondContact O-N 3.06Å
981S36.3Very low39.1Very low113.5 Ų113.5106.7 Ų106.779%0.79461%0.609SS**THydrogen-bonded Turntrans-49.132.5175.756.80000117.9S984S981-S984 PolarHBondContact O-OG 3.4Å
982S38.7Very low40.3Very low82 Ų82101.8 Ų101.857%0.57359%0.586SS**THydrogen-bonded Turntrans-90.3-9.7178.957.10000114.5P980 S984 S985P980-S982 VanDerWaalsContact C-N 3.29Å; P980-S982 PolarHBondContact O-N 3.06Å; S982-S984 VanDerWaalsContact C-N 3.35Å; S982-S984 PolarHBondContact O-N 2.89Å; S982-S985 PolarHBondContact O-OG 3.18Å; S982-S985 VanDerWaalsContact O-OG 3.07Å
983I38.1Very low41.8Very low106.75 Ų106.7599.8 Ų99.855%0.54756%0.56SS.*Hα-helixtrans-74.9-31.3-175.7-60.6173000111.8L979 S985 L986 E987L979-I983 HydrophobicContact CD2-CD1 4.46Å; I983-S985 VanDerWaalsContact C-N 3.29Å; I983-S985 PolarHBondContact O-N 3.25Å; I983-L986 PolarHBondContact O-N 3.1Å; I983-L986 VanDerWaalsContact O-N 3.17Å; I983-E987 PolarHBondContact O-N 2.72Å
984S46.6Very low43.3Very low80 Ų8096.5 Ų96.556%0.55955%0.545SS*.Hα-helixtrans-66.1-26.9-176.457.50000114.1S981 S982 T988S981-S984 PolarHBondContact O-OG 3.4Å; S982-S984 VanDerWaalsContact C-N 3.35Å; S982-S984 PolarHBondContact O-N 2.89Å; S984-T988 WeakPolarHBondContact O-CG2 3.38Å; S984-T988 PolarHBondContact O-N 3Å; S984-T988 PolarHBondContact O-OG1 3.31Å
985S52.2Low45.2Very low60.25 Ų60.2589.9 Ų89.942%0.42152%0.515SS..Hα-helixtrans-71.8-34.7177.453.20000112.2S982 I983 T988 I989S982-S985 PolarHBondContact O-OG 3.18Å; S982-S985 VanDerWaalsContact O-OG 3.07Å; I983-S985 VanDerWaalsContact C-N 3.29Å; I983-S985 PolarHBondContact O-N 3.25Å; S985-T988 VanDerWaalsContact C-OG1 3.27Å; S985-T988 WeakPolarHBondContact CA-OG1 3.38Å; S985-T988 PolarHBondContact O-N 3.27Å; S985-T988 PolarHBondContact O-OG1 3Å; S985-I989 WeakPolarHBondContact O-CD1 3.37Å; S985-I989 WeakPolarHBondContact O-CG1 3.33Å; S985-I989 PolarHBondContact O-N 3.04Å; S985-I989 VanDerWaalsContact O-N 3.1Å
986L48.1Very low46.9Very low27.75 Ų27.7583.2 Ų83.215%0.14548%0.481CS..Hα-helixtrans-74.8-38.1-172.9-155.7141.3000112.1Y952 V956 Q959 I960 E963 I983 T988 I989 I990Y952-L986 WeakPolarHBondContact OH-CD1 3.48Å; V956-L986 HydrophobicContact CG1-CD2 3.5Å; V956-L986 HydrophobicContact CG2-CD2 4.24Å; Q959-L986 HydrophobicContact CB-CD1 4.13Å; Q959-L986 VanDerWaalsContact OE1-CD1 3.25Å; I960-L986 HydrophobicContact CG1-CD2 4.32Å; E963-L986 VanDerWaalsContact OE2-CD2 3.27Å; E963-L986 WeakPolarHBondContact OE2-CD2 3.38Å; I983-L986 PolarHBondContact O-N 3.1Å; I983-L986 VanDerWaalsContact O-N 3.17Å; L986-T988 VanDerWaalsContact C-N 3.32Å; L986-T988 PolarHBondContact O-N 3.32Å; L986-I989 WeakPolarHBondContact O-CB 3.33Å; L986-I989 PolarHBondContact O-N 3.03Å; L986-I989 VanDerWaalsContact O-N 3.12Å; L986-I990 HydrophobicContact CD2-CD1 3.6Å; L986-I990 VanDerWaalsContact CD2-CD1 3.45Å; L986-I990 HydrophobicContact CD2-CG1 4.17Å; L986-I990 WeakPolarHBondContact O-CG1 3.4Å; L986-I990 PolarHBondContact O-N 3.14Å; L986-I990 VanDerWaalsContact O-N 3.09Å
987E51.2Low48.5Very low124 Ų12479.3 Ų79.358%0.57947%0.47SS*.Hα-helixtrans-60.3-41171.1-72.9-171.9146.500111.9I983 I989 I990 S991I983-E987 PolarHBondContact O-N 2.72Å; E987-I989 VanDerWaalsContact C-N 3.33Å; E987-I989 PolarHBondContact O-N 2.86Å; E987-I990 PolarHBondContact O-N 3.07Å; E987-S991 WeakPolarHBondContact O-CB 3.28Å; E987-S991 PolarHBondContact O-N 3.15Å; E987-S991 PolarHBondContact O-OG 3.37Å
988T54.7Low50.1Low61.5 Ų61.577.6 Ų77.638%0.37746%0.461SS..Hα-helixtrans-64.1-38.5175.860.10000112S984 S985 L986 S991 Q992S984-T988 WeakPolarHBondContact O-CG2 3.38Å; S984-T988 PolarHBondContact O-N 3Å; S984-T988 PolarHBondContact O-OG1 3.31Å; S985-T988 VanDerWaalsContact C-OG1 3.27Å; S985-T988 WeakPolarHBondContact CA-OG1 3.38Å; S985-T988 PolarHBondContact O-N 3.27Å; S985-T988 PolarHBondContact O-OG1 3Å; L986-T988 VanDerWaalsContact C-N 3.32Å; L986-T988 PolarHBondContact O-N 3.32Å; T988-S991 WeakPolarHBondContact CA-OG 3.35Å; T988-S991 PolarHBondContact O-N 3.28Å; T988-S991 PolarHBondContact O-OG 3.1Å; T988-Q992 VanDerWaalsContact O-CG 3.24Å; T988-Q992 WeakPolarHBondContact O-CG 3.31Å; T988-Q992 PolarHBondContact O-N 3.25Å; T988-Q992 VanDerWaalsContact O-N 3.13Å
989I53Low52.3Low24.25 Ų24.2571.8 Ų71.812%0.12442%0.424CS..Hα-helixtrans-66.7-42.2177.7-66.6163.9000111.2I901 M905 V956 S985 L986 E987 S991 Q992 L993I901-I989 HydrophobicContact CG2-CG2 4.01Å; M905-I989 HydrophobicContact CE-CB 4.4Å; M905-I989 HydrophobicContact CE-CD1 3.51Å; M905-I989 HydrophobicContact CE-CG1 3.64Å; M905-I989 HydrophobicContact CE-CG2 4.31Å; M905-I989 HydrophobicContact SD-CD1 4.39Å; M905-I989 HydrophobicContact SD-CG1 3.89Å; M905-I989 HydrophobicContact SD-CG2 4.36Å; V956-I989 HydrophobicContact CG1-CG2 3.92Å; S985-I989 WeakPolarHBondContact O-CD1 3.37Å; S985-I989 WeakPolarHBondContact O-CG1 3.33Å; S985-I989 PolarHBondContact O-N 3.04Å; S985-I989 VanDerWaalsContact O-N 3.1Å; L986-I989 WeakPolarHBondContact O-CB 3.33Å; L986-I989 PolarHBondContact O-N 3.03Å; L986-I989 VanDerWaalsContact O-N 3.12Å; E987-I989 VanDerWaalsContact C-N 3.33Å; E987-I989 PolarHBondContact O-N 2.86Å; I989-S991 VanDerWaalsContact C-N 3.31Å; I989-S991 PolarHBondContact O-N 3.26Å; I989-Q992 WeakPolarHBondContact O-CB 3.38Å; I989-Q992 PolarHBondContact O-N 3.13Å; I989-L993 HydrophobicContact CG2-CD1 3.84Å; I989-L993 PolarHBondContact O-N 3.05Å; I989-L993 VanDerWaalsContact O-N 3.1Å
990I54.3Low54.4Low54.75 Ų54.7564.8 Ų64.828%0.28139%0.388SS..Hα-helixtrans-63.8-41.3176-68170.7000110.6V956 L957 I960 L986 E987 Q992 L993 L995V956-I990 HydrophobicContact CB-CD1 4.43Å; V956-I990 HydrophobicContact CG1-CD1 3.32Å; L957-I990 HydrophobicContact CD2-CG2 4.34Å; I960-I990 HydrophobicContact CB-CG1 4.42Å; I960-I990 HydrophobicContact CD1-CB 4.48Å; I960-I990 HydrophobicContact CD1-CD1 4.31Å; I960-I990 HydrophobicContact CD1-CG1 3.83Å; I960-I990 HydrophobicContact CD1-CG2 4.09Å; I960-I990 HydrophobicContact CG1-CD1 4.14Å; I960-I990 HydrophobicContact CG1-CG1 3.76Å; I960-I990 HydrophobicContact CG2-CD1 4.33Å; I960-I990 HydrophobicContact CG2-CG1 4.29Å; L986-I990 HydrophobicContact CD2-CD1 3.6Å; L986-I990 VanDerWaalsContact CD2-CD1 3.45Å; L986-I990 HydrophobicContact CD2-CG1 4.17Å; L986-I990 WeakPolarHBondContact O-CG1 3.4Å; L986-I990 PolarHBondContact O-N 3.14Å; L986-I990 VanDerWaalsContact O-N 3.09Å; E987-I990 PolarHBondContact O-N 3.07Å; I990-Q992 VanDerWaalsContact C-N 3.29Å; I990-Q992 PolarHBondContact O-N 3.23Å; I990-L993 WeakPolarHBondContact O-CB 3.32Å; I990-L993 PolarHBondContact O-N 2.97Å; I990-L993 VanDerWaalsContact O-N 3.11Å; I990-L995 HydrophobicContact CG2-CD1 4.07Å
991S57.6Low56.5Low74 Ų7464.1 Ų64.152%0.51737%0.373SS..Hα-helixtrans-64.6-29.217876.30000113.1E987 T988 I989 L993 H994 R1619E987-S991 WeakPolarHBondContact O-CB 3.28Å; E987-S991 PolarHBondContact O-N 3.15Å; E987-S991 PolarHBondContact O-OG 3.37Å; T988-S991 WeakPolarHBondContact CA-OG 3.35Å; T988-S991 PolarHBondContact O-N 3.28Å; T988-S991 PolarHBondContact O-OG 3.1Å; I989-S991 VanDerWaalsContact C-N 3.31Å; I989-S991 PolarHBondContact O-N 3.26Å; S991-L993 VanDerWaalsContact C-N 3.28Å; S991-L993 PolarHBondContact O-N 3.2Å; S991-H994 PolarHBondContact O-CD2 2.68Å; S991-H994 VanDerWaalsContact O-CD2 3.3Å; S991-H994 PolarHBondContact O-N 2.9Å; S991-H994 PolarHBondContact O-NE2 3.12Å; S991-R1619 PolarHBondContact OG-NH1 3.4Å
992Q56.2Low58.2Low84.25 Ų84.2560.3 Ų60.339%0.39435%0.345SS..Hα-helixtrans-81-30.6-179-74.6177.8-6.500113.6I901 M905 T988 I989 I990 H994 I1616I901-Q992 WeakPolarHBondContact CD1-O 3.42Å; M905-Q992 VanDerWaalsContact CE-OE1 3.28Å; T988-Q992 VanDerWaalsContact O-CG 3.24Å; T988-Q992 WeakPolarHBondContact O-CG 3.31Å; T988-Q992 PolarHBondContact O-N 3.25Å; T988-Q992 VanDerWaalsContact O-N 3.13Å; I989-Q992 WeakPolarHBondContact O-CB 3.38Å; I989-Q992 PolarHBondContact O-N 3.13Å; I990-Q992 VanDerWaalsContact C-N 3.29Å; I990-Q992 PolarHBondContact O-N 3.23Å; Q992-H994 VanDerWaalsContact C-N 3.26Å; Q992-H994 PolarHBondContact O-N 3.06Å; Q992-I1616 HydrophobicContact CG-CG2 3.95Å
993L60.2Low60Low22.75 Ų22.7556.4 Ų56.412%0.11932%0.318CS..Hα-helixtrans-76.1-22.4-177.1-78.2169.6000113.4N897 A898 I901 V956 I989 I990 S991 L995N897-L993 HydrophobicContact CB-CD2 3.71Å; A898-L993 HydrophobicContact CB-CD1 4.26Å; A898-L993 HydrophobicContact CB-CD2 3.93Å; I901-L993 HydrophobicContact CB-CD2 4.17Å; I901-L993 HydrophobicContact CD1-CD1 4.02Å; I901-L993 HydrophobicContact CD1-CD2 4Å; I901-L993 HydrophobicContact CD1-CG 3.82Å; I901-L993 HydrophobicContact CG2-CD2 4.1Å; V956-L993 HydrophobicContact CG1-CD1 4.37Å; I989-L993 HydrophobicContact CG2-CD1 3.84Å; I989-L993 PolarHBondContact O-N 3.05Å; I989-L993 VanDerWaalsContact O-N 3.1Å; I990-L993 WeakPolarHBondContact O-CB 3.32Å; I990-L993 PolarHBondContact O-N 2.97Å; I990-L993 VanDerWaalsContact O-N 3.11Å; S991-L993 VanDerWaalsContact C-N 3.28Å; S991-L993 PolarHBondContact O-N 3.2Å; L993-L995 HydrophobicContact CB-CD1 3.99Å; L993-L995 HydrophobicContact CB-CG 4.04Å; L993-L995 HydrophobicContact CD1-CD1 4.22Å; L993-L995 HydrophobicContact CD2-CD1 4.4Å; L993-L995 HydrophobicContact CG-CD1 4.47Å; L993-L995 WeakPolarHBondContact O-CG 3.24Å; L993-L995 PolarHBondContact O-N 3.07Å
994H62.1Low62.1Low123.5 Ų123.551.4 Ų51.457%0.57229%0.293SS*.  trans44.338-178.5-119.4-76.5000113.8S991 Q992S991-H994 PolarHBondContact O-CD2 2.68Å; S991-H994 VanDerWaalsContact O-CD2 3.3Å; S991-H994 PolarHBondContact O-N 2.9Å; S991-H994 PolarHBondContact O-NE2 3.12Å; Q992-H994 VanDerWaalsContact C-N 3.26Å; Q992-H994 PolarHBondContact O-N 3.06Å
995L68.4Low63.9Low35.75 Ų35.7547.6 Ų47.619%0.18727%0.266CS..PPolyproline II helixtrans-80.4141.9179.4-68.9165.7000110.4R894 A898 L957 I990 L993 W999R894-L995 HydrophobicContact CB-CD2 4.2Å; A898-L995 HydrophobicContact CB-CD1 4.41Å; L957-L995 HydrophobicContact CD2-CD1 3.84Å; I990-L995 HydrophobicContact CG2-CD1 4.07Å; L993-L995 HydrophobicContact CB-CD1 3.99Å; L993-L995 HydrophobicContact CB-CG 4.04Å; L993-L995 HydrophobicContact CD1-CD1 4.22Å; L993-L995 HydrophobicContact CD2-CD1 4.4Å; L993-L995 HydrophobicContact CG-CD1 4.47Å; L993-L995 WeakPolarHBondContact O-CG 3.24Å; L993-L995 PolarHBondContact O-N 3.07Å; L995-W999 HydrophobicContact CB-CB 4.35Å; L995-W999 HydrophobicContact CB-CG 4.34Å; L995-W999 HydrophobicContact CD1-CD2 4.38Å; L995-W999 HydrophobicContact CD1-CE3 4.24Å; L995-W999 HydrophobicContact CD2-CD2 4.05Å; L995-W999 HydrophobicContact CD2-CE3 4.45Å; L995-W999 HydrophobicContact CD2-CG 4.21Å
996P64.7Low65.5Low29.75 Ų29.7545.7 Ų45.719%0.19325%0.25CC..PPolyproline II helixtrans-61.6148.7175.71.50.3000111.7I809 G998 W999I809-P996 HydrophobicContact CG2-CG 4.06Å; P996-G998 PolarHBondContact O-N 3.05Å; P996-W999 HydrophobicContact CG-CB 4.14Å; P996-W999 HydrophobicContact CG-CG 4.36Å; P996-W999 VanDerWaalsContact O-CB 3.27Å; P996-W999 WeakPolarHBondContact O-CB 3.33Å; P996-W999 PolarHBondContact O-N 3.26Å; P996-W999 VanDerWaalsContact O-N 3.13Å
997V60.4Low67.2Low102.25 Ų102.2545.6 Ų45.662%0.6225%0.248SC*.THydrogen-bonded Turntrans-60.7130.7177.4-177.10000109.7W999 T1002V997-W999 VanDerWaalsContact C-N 3.33Å; V997-W999 PolarHBondContact O-N 2.99Å; V997-T1002 WeakPolarHBondContact O-CG2 3.33Å; V997-T1002 PolarHBondContact O-OG1 3.34Å
998G62Low68.9Low44 Ų4439.8 Ų39.845%0.45422%0.221SC..THydrogen-bonded Turntrans78.111.4-17700000115.5P996 Y1001 T1002P996-G998 PolarHBondContact O-N 3.05Å; G998-Y1001 PolarHBondContact O-N 3.26Å; G998-Y1001 VanDerWaalsContact O-N 3.13Å; G998-T1002 PolarHBondContact O-N 3.1Å; G998-T1002 PolarHBondContact O-OG1 3.04Å
999W73.4Confident70.5Confident11.5 Ų11.536.8 Ų36.84%0.04420%0.203CC..THydrogen-bonded Turntrans-58.3141.7172.3-170.293.7000110.8F891 L895 L953 L957 L995 P996 V997 T1002 D1003 F1070F891-W999 HydrophobicContact CD2-CZ2 4.4Å; F891-W999 AromaticContact CD2-NE1 3.93Å; F891-W999 AromaticContact CE2-CZ2 3.73Å; F891-W999 HydrophobicContact CE2-CZ2 3.73Å; F891-W999 AromaticContact CE2-NE1 3.96Å; L895-W999 HydrophobicContact CB-CZ2 4.37Å; L895-W999 HydrophobicContact CD1-CH2 4.01Å; L895-W999 HydrophobicContact CD1-CZ2 4.28Å; L895-W999 HydrophobicContact CG-CH2 4.43Å; L895-W999 HydrophobicContact CG-CZ2 4.49Å; L953-W999 HydrophobicContact CD2-CE3 4.49Å; L953-W999 HydrophobicContact CD2-CH2 4.14Å; L953-W999 HydrophobicContact CD2-CZ3 3.62Å; L957-W999 HydrophobicContact CD1-CE3 3.43Å; L957-W999 VanDerWaalsContact CD1-CE3 3.46Å; L957-W999 HydrophobicContact CD1-CZ3 3.56Å; L957-W999 VanDerWaalsContact CD1-CZ3 3.45Å; L957-W999 HydrophobicContact CD2-CE3 4.28Å; L957-W999 HydrophobicContact CG-CE3 4.46Å; L995-W999 HydrophobicContact CB-CB 4.35Å; L995-W999 HydrophobicContact CB-CG 4.34Å; L995-W999 HydrophobicContact CD1-CD2 4.38Å; L995-W999 HydrophobicContact CD1-CE3 4.24Å; L995-W999 HydrophobicContact CD2-CD2 4.05Å; L995-W999 HydrophobicContact CD2-CE3 4.45Å; L995-W999 HydrophobicContact CD2-CG 4.21Å; P996-W999 HydrophobicContact CG-CB 4.14Å; P996-W999 HydrophobicContact CG-CG 4.36Å; P996-W999 VanDerWaalsContact O-CB 3.27Å; P996-W999 WeakPolarHBondContact O-CB 3.33Å; P996-W999 PolarHBondContact O-N 3.26Å; P996-W999 VanDerWaalsContact O-N 3.13Å; V997-W999 VanDerWaalsContact C-N 3.33Å; V997-W999 PolarHBondContact O-N 2.99Å; W999-T1002 PolarHBondContact N-OG1 3.22Å; W999-D1003 PolarHBondContact NE1-OD2 3.15Å; W999-F1070 HydrophobicContact CE3-CZ 4.45Å; W999-F1070 AromaticContact CH2-CE1 3.63Å; W999-F1070 HydrophobicContact CH2-CE1 3.72Å; W999-F1070 AromaticContact CH2-CE2 3.89Å; W999-F1070 HydrophobicContact CH2-CE2 3.89Å; W999-F1070 AromaticContact CH2-CZ 3.18Å; W999-F1070 HydrophobicContact CH2-CZ 3.18Å; W999-F1070 HydrophobicContact CZ2-CE1 4.19Å; W999-F1070 HydrophobicContact CZ2-CZ 4.12Å; W999-F1070 HydrophobicContact CZ3-CE1 4.26Å; W999-F1070 AromaticContact CZ3-CE2 3.95Å; W999-F1070 HydrophobicContact CZ3-CE2 4Å; W999-F1070 AromaticContact CZ3-CZ 3.36Å; W999-F1070 HydrophobicContact CZ3-CZ 3.36Å; W999-F1070 VanDerWaalsContact CZ3-CZ 3.45Å
1000P73.7Confident72Confident2.75 Ų2.7536.1 Ų36.12%0.01820%0.2CC..THydrogen-bonded Turncis-86.6-12.65.133.8-35.9000115F891 T1002 D1003 Y1006 F1070 I1074F891-P1000 HydrophobicContact CE2-CB 4.42Å; P1000-T1002 VanDerWaalsContact C-N 3.27Å; P1000-T1002 PolarHBondContact O-N 3.12Å; P1000-D1003 WeakPolarHBondContact O-CB 3.41Å; P1000-D1003 PolarHBondContact O-N 2.98Å; P1000-D1003 VanDerWaalsContact O-N 3.08Å; P1000-Y1006 HydrophobicContact CB-CD2 4.18Å; P1000-Y1006 HydrophobicContact CB-CE2 4.46Å; P1000-Y1006 HydrophobicContact CB-CG 4.22Å; P1000-F1070 HydrophobicContact CB-CE1 4.03Å; P1000-F1070 HydrophobicContact CB-CZ 4.06Å; P1000-F1070 HydrophobicContact CG-CE1 4.16Å; P1000-F1070 HydrophobicContact CG-CZ 3.92Å; P1000-I1074 HydrophobicContact CG-CD1 3.73Å
1001Y74.6Confident73.6Confident80.4 Ų80.435.8 Ų35.832%0.31520%0.197SC..THydrogen-bonded Turntrans-67.5-21.6-170.2-57.6-75000114.5G998 Y1006 H1007 I1074 V1098G998-Y1001 PolarHBondContact O-N 3.26Å; G998-Y1001 VanDerWaalsContact O-N 3.13Å; Y1001-Y1006 HydrophobicContact CD1-CE1 4.38Å; Y1001-H1007 PolarHBondContact O-NE2 3.01Å; Y1001-I1074 HydrophobicContact CE1-CG2 3.99Å; Y1001-I1074 VanDerWaalsContact OH-CG2 3.26Å; Y1001-I1074 WeakPolarHBondContact OH-CG2 3.46Å; Y1001-V1098 HydrophobicContact CD1-CG1 4.41Å
1002T71.8Confident75Confident34.4 Ų34.432.4 Ų32.421%0.21117%0.173CC..THydrogen-bonded Turntrans-85.2-9.5176.452.10000113.7N845 V997 G998 W999 P1000N845-T1002 WeakPolarHBondContact ND2-CA 3.49Å; N845-T1002 VanDerWaalsContact ND2-CB 3.33Å; N845-T1002 WeakPolarHBondContact ND2-CB 3.29Å; N845-T1002 PolarHBondContact ND2-O 3.37Å; V997-T1002 WeakPolarHBondContact O-CG2 3.33Å; V997-T1002 PolarHBondContact O-OG1 3.34Å; G998-T1002 PolarHBondContact O-N 3.1Å; G998-T1002 PolarHBondContact O-OG1 3.04Å; W999-T1002 PolarHBondContact N-OG1 3.22Å; P1000-T1002 VanDerWaalsContact C-N 3.27Å; P1000-T1002 PolarHBondContact O-N 3.12Å
1003D77.5Confident76.5Confident0.6 Ų0.628.4 Ų28.40%0.00316%0.155CC..  trans-88.1117-175.8-163.7-30.2000111.3F891 R894 W999 P1000 G1005 Y1006 H1007F891-D1003 HydrophobicContact CD2-CB 4.34Å; F891-D1003 WeakPolarHBondContact CD2-OD2 3.3Å; R894-D1003 IonicContact CZ-OD1 3.44Å; R894-D1003 IonicContact CZ-OD2 3.18Å; R894-D1003 VanDerWaalsContact CZ-OD2 3.27Å; R894-D1003 IonicContact NE-OD2 3.02Å; R894-D1003 PolarHBondContact NE-OD2 3Å; R894-D1003 IonicContact NH1-OD1 2.68Å; R894-D1003 IonicContact NH1-OD2 3.34Å; R894-D1003 PolarHBondContact NH1-OD2 2.83Å; R894-D1003 VanDerWaalsContact NH2-CG 3.31Å; R894-D1003 IonicContact NH2-OD1 3.05Å; R894-D1003 PolarHBondContact NH2-OD1 3.15Å; R894-D1003 IonicContact NH2-OD2 3.64Å; R894-D1003 PolarHBondContact NH2-OD2 3.1Å; W999-D1003 PolarHBondContact NE1-OD2 3.15Å; P1000-D1003 WeakPolarHBondContact O-CB 3.41Å; P1000-D1003 PolarHBondContact O-N 2.98Å; P1000-D1003 VanDerWaalsContact O-N 3.08Å; D1003-G1005 PolarHBondContact O-N 3.23Å; D1003-G1005 PolarHBondContact OD1-N 2.93Å; D1003-Y1006 WeakPolarHBondContact O-CB 3.38Å; D1003-Y1006 PolarHBondContact O-N 3.25Å; D1003-Y1006 VanDerWaalsContact O-N 3.14Å; D1003-H1007 PolarHBondContact O-CD2 3.1Å; D1003-H1007 VanDerWaalsContact O-CD2 3.29Å
1004P81.1Confident77.7Confident1.8 Ų1.829 Ų291%0.01216%0.159CC..Hα-helixtrans-63.2-27.4178.826.9-35.2000113.1I809 T851 L887 Y1006 H1007 L1008I809-P1004 HydrophobicContact CD1-CG 3.63Å; I809-P1004 HydrophobicContact CG1-CG 4.43Å; T851-P1004 HydrophobicContact CG2-CB 4.01Å; T851-P1004 WeakPolarHBondContact OG1-CB 3.45Å; L887-P1004 HydrophobicContact CD1-CB 4.31Å; L887-P1004 HydrophobicContact CD1-CG 4.36Å; L887-P1004 HydrophobicContact CD2-CG 4.21Å; P1004-Y1006 VanDerWaalsContact C-N 3.31Å; P1004-Y1006 PolarHBondContact O-N 3.08Å; P1004-H1007 PolarHBondContact O-N 3.12Å; P1004-L1008 WeakPolarHBondContact O-CG 3.43Å; P1004-L1008 PolarHBondContact O-N 3.28Å; P1004-L1008 VanDerWaalsContact O-N 3.09Å
1005G84.5Confident78.8Confident0 Ų026.5 Ų26.50%015%0.15CC..Hα-helixtrans-64.9-34.2176.200000112.6L887 D1003 L1008 A1009L887-G1005 WeakPolarHBondContact O-CA 3.38Å; D1003-G1005 PolarHBondContact O-N 3.23Å; D1003-G1005 PolarHBondContact OD1-N 2.93Å; G1005-L1008 PolarHBondContact O-N 3.2Å; G1005-A1009 VanDerWaalsContact O-CB 3.25Å; G1005-A1009 WeakPolarHBondContact O-CB 3.29Å; G1005-A1009 PolarHBondContact O-N 2.99Å
1006Y85.4Confident79.7Confident19.4 Ų19.425.7 Ų25.78%0.07615%0.147CC..Hα-helixtrans-63.7-44.6173.4171.7-103.3000111.8F891 P1000 Y1001 D1003 P1004 L1008 A1009 T1010 F1070 V1071 I1074F891-Y1006 HydrophobicContact CE1-CD2 4.45Å; F891-Y1006 AromaticContact CE2-CD2 3.98Å; F891-Y1006 HydrophobicContact CE2-CD2 4.09Å; F891-Y1006 HydrophobicContact CE2-CG 4.36Å; F891-Y1006 AromaticContact CZ-CD2 3.72Å; F891-Y1006 HydrophobicContact CZ-CD2 3.72Å; F891-Y1006 HydrophobicContact CZ-CG 4.35Å; P1000-Y1006 HydrophobicContact CB-CD2 4.18Å; P1000-Y1006 HydrophobicContact CB-CE2 4.46Å; P1000-Y1006 HydrophobicContact CB-CG 4.22Å; Y1001-Y1006 HydrophobicContact CD1-CE1 4.38Å; D1003-Y1006 WeakPolarHBondContact O-CB 3.38Å; D1003-Y1006 PolarHBondContact O-N 3.25Å; D1003-Y1006 VanDerWaalsContact O-N 3.14Å; P1004-Y1006 VanDerWaalsContact C-N 3.31Å; P1004-Y1006 PolarHBondContact O-N 3.08Å; Y1006-L1008 PolarHBondContact O-N 3.45Å; Y1006-A1009 PolarHBondContact O-N 3.29Å; Y1006-T1010 HydrophobicContact CD1-CG2 4.45Å; Y1006-T1010 HydrophobicContact CD2-CG2 4Å; Y1006-T1010 HydrophobicContact CE1-CG2 4.08Å; Y1006-T1010 HydrophobicContact CE2-CG2 3.59Å; Y1006-T1010 HydrophobicContact CG-CG2 4.4Å; Y1006-T1010 WeakPolarHBondContact O-CB 3.29Å; Y1006-T1010 VanDerWaalsContact O-CG2 3.28Å; Y1006-T1010 WeakPolarHBondContact O-CG2 3.31Å; Y1006-T1010 PolarHBondContact O-N 3.06Å; Y1006-T1010 PolarHBondContact O-OG1 3.28Å; Y1006-F1070 HydrophobicContact CD2-CE1 4.37Å; Y1006-F1070 HydrophobicContact CE2-CD1 4.43Å; Y1006-F1070 HydrophobicContact CE2-CE1 4.28Å; Y1006-V1071 HydrophobicContact CE2-CG2 4.04Å; Y1006-I1074 HydrophobicContact CE2-CD1 3.69Å
1007H84.1Confident80.9Confident25.4 Ų25.427.3 Ų27.312%0.11816%0.16CC..Hα-helixtrans-65.9-39.8178.8-70.7-83.2000112.2L848 Y1001 D1003 P1004 T1010 Q1011L848-H1007 HydrophobicContact CD1-CB 4.05Å; L848-H1007 WeakPolarHBondContact CD1-CD2 3.3Å; L848-H1007 VanDerWaalsContact CD1-CG 3.5Å; Y1001-H1007 PolarHBondContact O-NE2 3.01Å; D1003-H1007 PolarHBondContact O-CD2 3.1Å; D1003-H1007 VanDerWaalsContact O-CD2 3.29Å; P1004-H1007 PolarHBondContact O-N 3.12Å; H1007-T1010 WeakPolarHBondContact CA-OG1 3.37Å; H1007-T1010 PolarHBondContact O-OG1 3.04Å; H1007-T1010 VanDerWaalsContact O-OG1 3.13Å; H1007-Q1011 WeakPolarHBondContact O-CB 3.39Å; H1007-Q1011 VanDerWaalsContact O-CG 3.28Å; H1007-Q1011 WeakPolarHBondContact O-CG 3.32Å; H1007-Q1011 PolarHBondContact O-N 3.02Å; H1007-Q1011 VanDerWaalsContact O-N 3.12Å
1008L87.4Confident82.3Confident2 Ų222.5 Ų22.51%0.0113%0.13CC..Hα-helixtrans-65.1-48.3174.2-70.2172.1000111.5T851 T855 F884 L887 V888 P1004 G1005 Y1006 T1010 Q1011 L1012 L1018T851-L1008 HydrophobicContact CG2-CD1 3.99Å; T851-L1008 HydrophobicContact CG2-CD2 4.03Å; T851-L1008 HydrophobicContact CG2-CG 3.94Å; T855-L1008 HydrophobicContact CG2-CD2 3.47Å; T855-L1008 VanDerWaalsContact CG2-CD2 3.45Å; F884-L1008 HydrophobicContact CB-CD1 4.16Å; F884-L1008 HydrophobicContact CD1-CD1 3.67Å; F884-L1008 HydrophobicContact CD1-CD2 3.96Å; F884-L1008 HydrophobicContact CD1-CG 4.42Å; F884-L1008 HydrophobicContact CE1-CD1 4.45Å; F884-L1008 HydrophobicContact CE1-CD2 4.17Å; F884-L1008 HydrophobicContact CG-CD1 4.17Å; F884-L1008 HydrophobicContact CG-CD2 4.33Å; L887-L1008 HydrophobicContact CB-CD1 4.1Å; L887-L1008 HydrophobicContact CD1-CD1 3.93Å; V888-L1008 HydrophobicContact CG2-CB 3.86Å; V888-L1008 HydrophobicContact CG2-CD1 4.48Å; P1004-L1008 WeakPolarHBondContact O-CG 3.43Å; P1004-L1008 PolarHBondContact O-N 3.28Å; P1004-L1008 VanDerWaalsContact O-N 3.09Å; G1005-L1008 PolarHBondContact O-N 3.2Å; Y1006-L1008 PolarHBondContact O-N 3.45Å; L1008-T1010 PolarHBondContact O-N 3.19Å; L1008-Q1011 PolarHBondContact O-N 3.45Å; L1008-L1012 WeakPolarHBondContact O-CB 3.35Å; L1008-L1012 WeakPolarHBondContact O-CD1 3.25Å; L1008-L1012 VanDerWaalsContact O-CG 3.27Å; L1008-L1012 WeakPolarHBondContact O-CG 3.29Å; L1008-L1012 PolarHBondContact O-N 3.16Å; L1008-L1018 HydrophobicContact CD2-CD1 4.09Å; L1008-L1018 HydrophobicContact CD2-CD2 3.81Å
1009A87.6Confident83.7Confident0.2 Ų0.220.7 Ų20.70%0.00211%0.11CC..Hα-helixtrans-61.6-43.7179.600000111.9F891 G1005 Y1006 Q1011 L1012 L1013 L1060 L1067F891-A1009 HydrophobicContact CD1-CB 4.42Å; F891-A1009 HydrophobicContact CE1-CB 4.39Å; G1005-A1009 VanDerWaalsContact O-CB 3.25Å; G1005-A1009 WeakPolarHBondContact O-CB 3.29Å; G1005-A1009 PolarHBondContact O-N 2.99Å; Y1006-A1009 PolarHBondContact O-N 3.29Å; A1009-Q1011 PolarHBondContact O-N 3.06Å; A1009-L1012 CarbonylContact O-C 3.49Å; A1009-L1012 PolarHBondContact O-N 3.13Å; A1009-L1012 VanDerWaalsContact O-N 3.16Å; A1009-L1013 WeakPolarHBondContact O-CB 3.46Å; A1009-L1013 WeakPolarHBondContact O-CD1 3.2Å; A1009-L1013 VanDerWaalsContact O-CG 3.23Å; A1009-L1013 WeakPolarHBondContact O-CG 3.37Å; A1009-L1013 PolarHBondContact O-N 3.17Å; A1009-L1060 HydrophobicContact CB-CD2 4.28Å; A1009-L1067 HydrophobicContact CB-CD1 4.12Å; A1009-L1067 HydrophobicContact CB-CD2 4.19Å
1010T85.7Confident84.5Confident8.6 Ų8.624.9 Ų24.95%0.05313%0.126CC..Hα-helixtrans-65.3-37.4176.750.70000113Y1006 H1007 L1008 L1012 L1013 V1071Y1006-T1010 HydrophobicContact CD1-CG2 4.45Å; Y1006-T1010 HydrophobicContact CD2-CG2 4Å; Y1006-T1010 HydrophobicContact CE1-CG2 4.08Å; Y1006-T1010 HydrophobicContact CE2-CG2 3.59Å; Y1006-T1010 HydrophobicContact CG-CG2 4.4Å; Y1006-T1010 WeakPolarHBondContact O-CB 3.29Å; Y1006-T1010 VanDerWaalsContact O-CG2 3.28Å; Y1006-T1010 WeakPolarHBondContact O-CG2 3.31Å; Y1006-T1010 PolarHBondContact O-N 3.06Å; Y1006-T1010 PolarHBondContact O-OG1 3.28Å; H1007-T1010 WeakPolarHBondContact CA-OG1 3.37Å; H1007-T1010 PolarHBondContact O-OG1 3.04Å; H1007-T1010 VanDerWaalsContact O-OG1 3.13Å; L1008-T1010 PolarHBondContact O-N 3.19Å; T1010-L1012 VanDerWaalsContact C-N 3.34Å; T1010-L1013 PolarHBondContact O-N 3.19Å; T1010-V1071 HydrophobicContact CG2-CG1 4.1Å; T1010-V1071 HydrophobicContact CG2-CG2 3.74Å
1011Q86.5Confident85.4Confident48.2 Ų48.226.4 Ų26.423%0.22513%0.133CC..Hα-helixtrans-65.4-37.3171.9-74.4179.27.400112H1007 L1008 A1009 L1013 T1014 S1016 L1018H1007-Q1011 WeakPolarHBondContact O-CB 3.39Å; H1007-Q1011 VanDerWaalsContact O-CG 3.28Å; H1007-Q1011 WeakPolarHBondContact O-CG 3.32Å; H1007-Q1011 PolarHBondContact O-N 3.02Å; H1007-Q1011 VanDerWaalsContact O-N 3.12Å; L1008-Q1011 PolarHBondContact O-N 3.45Å; A1009-Q1011 PolarHBondContact O-N 3.06Å; Q1011-L1013 VanDerWaalsContact C-N 3.31Å; Q1011-L1013 PolarHBondContact O-N 2.86Å; Q1011-T1014 PolarHBondContact O-N 3.09Å; Q1011-T1014 VanDerWaalsContact O-O 3.08Å; Q1011-T1014 PolarHBondContact O-OG1 3.12Å; Q1011-S1016 VanDerWaalsContact O-CB 3.25Å; Q1011-S1016 WeakPolarHBondContact O-CB 3.37Å; Q1011-S1016 PolarHBondContact O-OG 3.29Å; Q1011-L1018 HydrophobicContact CB-CD2 4.29Å
1012L88.8Confident86.2Confident3.4 Ų3.422.7 Ų22.72%0.01812%0.119CC..Hα-helixtrans-74.1-22.3177.8-71.3161.7000113.4L1008 A1009 T1010 T1014 L1018 F1019 V1022 L1056 L1060 L1113L1008-L1012 WeakPolarHBondContact O-CB 3.35Å; L1008-L1012 WeakPolarHBondContact O-CD1 3.25Å; L1008-L1012 VanDerWaalsContact O-CG 3.27Å; L1008-L1012 WeakPolarHBondContact O-CG 3.29Å; L1008-L1012 PolarHBondContact O-N 3.16Å; A1009-L1012 CarbonylContact O-C 3.49Å; A1009-L1012 PolarHBondContact O-N 3.13Å; A1009-L1012 VanDerWaalsContact O-N 3.16Å; T1010-L1012 VanDerWaalsContact C-N 3.34Å; L1012-T1014 PolarHBondContact O-N 3.06Å; L1012-L1018 HydrophobicContact CD1-CD2 4.16Å; L1012-L1018 HydrophobicContact CD2-CB 4.5Å; L1012-L1018 HydrophobicContact CD2-CD2 3.61Å; L1012-L1018 VanDerWaalsContact CD2-CD2 3.45Å; L1012-L1018 HydrophobicContact CD2-CG 4.03Å; L1012-L1018 HydrophobicContact CG-CD2 3.69Å; L1012-L1018 VanDerWaalsContact CG-CD2 3.43Å; L1012-L1018 HydrophobicContact CG-CG 4.36Å; L1012-F1019 HydrophobicContact CD2-CB 4.34Å; L1012-F1019 HydrophobicContact CD2-CD2 4.44Å; L1012-V1022 HydrophobicContact CD2-CG2 4.43Å; L1012-L1056 HydrophobicContact CD1-CD1 4.05Å; L1012-L1056 HydrophobicContact CD1-CD2 3.86Å; L1012-L1056 HydrophobicContact CD1-CG 4.17Å; L1012-L1056 HydrophobicContact CD2-CD2 4.16Å; L1012-L1060 HydrophobicContact CB-CD1 3.6Å; L1012-L1060 HydrophobicContact CD1-CD1 3.82Å; L1012-L1060 HydrophobicContact CD2-CD1 4.34Å; L1012-L1060 HydrophobicContact CG-CD1 4.16Å; L1012-L1113 WeakPolarHBondContact O-CD1 3.27Å
1013L87.1Confident87.1Confident0.6 Ų0.621.3 Ų21.30%0.00311%0.11CC..THydrogen-bonded Turntrans-79.79.8169.6-71.1176.1000113.9A1009 T1010 Q1011 L1067 V1068 V1071 P1107 V1108 V1110A1009-L1013 WeakPolarHBondContact O-CB 3.46Å; A1009-L1013 WeakPolarHBondContact O-CD1 3.2Å; A1009-L1013 VanDerWaalsContact O-CG 3.23Å; A1009-L1013 WeakPolarHBondContact O-CG 3.37Å; A1009-L1013 PolarHBondContact O-N 3.17Å; T1010-L1013 PolarHBondContact O-N 3.19Å; Q1011-L1013 VanDerWaalsContact C-N 3.31Å; Q1011-L1013 PolarHBondContact O-N 2.86Å; L1013-L1067 HydrophobicContact CD1-CB 4.03Å; L1013-L1067 HydrophobicContact CD1-CD1 4.33Å; L1013-L1067 HydrophobicContact CD1-CD2 3.46Å; L1013-L1067 VanDerWaalsContact CD1-CD2 3.48Å; L1013-L1067 HydrophobicContact CD1-CG 3.67Å; L1013-L1067 HydrophobicContact CD2-CD2 3.93Å; L1013-L1067 HydrophobicContact CG-CD2 3.77Å; L1013-L1067 VanDerWaalsContact CG-CD2 3.42Å; L1013-L1067 HydrophobicContact CG-CG 4.48Å; L1013-V1068 HydrophobicContact CD1-CG2 4.26Å; L1013-V1068 HydrophobicContact CD2-CG2 4.03Å; L1013-V1071 HydrophobicContact CD1-CB 4.48Å; L1013-V1071 HydrophobicContact CD1-CG2 4.18Å; L1013-P1107 HydrophobicContact CB-CB 4.13Å; L1013-P1107 HydrophobicContact CD1-CB 3.99Å; L1013-V1108 WeakPolarHBondContact CD2-O 3.27Å; L1013-V1108 PolarHBondContact O-N 3.21Å; L1013-V1108 VanDerWaalsContact O-O 3.13Å; L1013-V1110 HydrophobicContact CD2-CG2 3.6Å
1014T85.2Confident87.8Confident35 Ų3522.4 Ų22.422%0.21512%0.121CC..THydrogen-bonded Turntrans-131.7160.917462.10000109.3Q1011 L1012 S1016 I1105Q1011-T1014 PolarHBondContact O-N 3.09Å; Q1011-T1014 VanDerWaalsContact O-O 3.08Å; Q1011-T1014 PolarHBondContact O-OG1 3.12Å; L1012-T1014 PolarHBondContact O-N 3.06Å; T1014-S1016 PolarHBondContact O-N 3.27Å; T1014-I1105 HydrophobicContact CG2-CG2 3.52Å; T1014-I1105 VanDerWaalsContact CG2-CG2 3.45Å
1015D85Confident88.2Confident71 Ų7122.6 Ų22.638%0.3812%0.122SC..THydrogen-bonded Turntrans-7464.5171.4-171.715.8000110.6R1020 L1113D1015-R1020 VanDerWaalsContact CG-CZ 3.45Å; D1015-R1020 VanDerWaalsContact CG-NE 3.33Å; D1015-R1020 PolarHBondContact O-NE 2.93Å; D1015-R1020 PolarHBondContact O-NH1 3.06Å; D1015-R1020 PolarHBondContact O-NH2 3.19Å; D1015-R1020 WeakPolarHBondContact OD1-CG 3.34Å; D1015-R1020 IonicContact OD1-CZ 3.19Å; D1015-R1020 VanDerWaalsContact OD1-CZ 3.3Å; D1015-R1020 IonicContact OD1-NE 3.34Å; D1015-R1020 PolarHBondContact OD1-NE 3.18Å; D1015-R1020 IonicContact OD1-NH1 3.35Å; D1015-R1020 IonicContact OD1-NH2 3.44Å; D1015-R1020 PolarHBondContact OD1-NH2 3.1Å; D1015-R1020 VanDerWaalsContact OD1-NH2 3.17Å; D1015-R1020 IonicContact OD2-CZ 3.06Å; D1015-R1020 IonicContact OD2-NE 3.23Å; D1015-R1020 PolarHBondContact OD2-NE 2.89Å; D1015-R1020 IonicContact OD2-NH2 3.33Å; D1015-R1020 PolarHBondContact OD2-NH2 3.26Å; D1015-L1113 HydrophobicContact CB-CD2 4.13Å
1016S88.1Confident88.6Confident18 Ų1822.6 Ų22.613%0.12612%0.122CC..  trans-86.6164.4-176.4670000112Q1011 T1014 L1018 F1019 R1020Q1011-S1016 VanDerWaalsContact O-CB 3.25Å; Q1011-S1016 WeakPolarHBondContact O-CB 3.37Å; Q1011-S1016 PolarHBondContact O-OG 3.29Å; T1014-S1016 PolarHBondContact O-N 3.27Å; S1016-L1018 PolarHBondContact O-N 3.31Å; S1016-L1018 PolarHBondContact OG-N 3.21Å; S1016-F1019 PolarHBondContact O-N 3.09Å; S1016-F1019 PolarHBondContact OG-N 3.15Å; S1016-F1019 VanDerWaalsContact OG-N 3.13Å; S1016-R1020 WeakPolarHBondContact O-CD 3.29Å; S1016-R1020 VanDerWaalsContact O-CG 3.3Å; S1016-R1020 WeakPolarHBondContact O-CG 3.36Å; S1016-R1020 PolarHBondContact O-N 3.04Å; S1016-R1020 VanDerWaalsContact O-N 3.08Å
1017S89Confident88.8Confident64.2 Ų64.224 Ų2445%0.44913%0.13SC..Hα-helixtrans-58.3-32.5170.350.40000112.3L860 M1021L860-S1017 VanDerWaalsContact CD1-OG 3.26Å; L860-S1017 WeakPolarHBondContact CD1-OG 3.33Å; L860-S1017 WeakPolarHBondContact CD2-O 3.44Å; S1017-M1021 VanDerWaalsContact O-CB 3.24Å; S1017-M1021 WeakPolarHBondContact O-CB 3.29Å; S1017-M1021 PolarHBondContact O-N 3.13Å
1018L90.6Very high89.1Confident1.2 Ų1.225.6 Ų25.61%0.00614%0.141CC..Hα-helixtrans-68-49.7177-175.2108.9000110.8T855 F859 F884 L1008 Q1011 L1012 S1016 R1020 M1021 V1022T855-L1018 HydrophobicContact CG2-CD1 3.84Å; T855-L1018 HydrophobicContact CG2-CD2 4.36Å; F859-L1018 HydrophobicContact CD1-CD1 3.97Å; F859-L1018 HydrophobicContact CD1-CG 4.44Å; F859-L1018 HydrophobicContact CE1-CD1 4.02Å; F859-L1018 HydrophobicContact CE1-CG 4.37Å; F884-L1018 HydrophobicContact CD2-CD1 4.37Å; F884-L1018 HydrophobicContact CE2-CD1 3.99Å; F884-L1018 HydrophobicContact CZ-CD1 4.45Å; L1008-L1018 HydrophobicContact CD2-CD1 4.09Å; L1008-L1018 HydrophobicContact CD2-CD2 3.81Å; Q1011-L1018 HydrophobicContact CB-CD2 4.29Å; L1012-L1018 HydrophobicContact CD1-CD2 4.16Å; L1012-L1018 HydrophobicContact CD2-CB 4.5Å; L1012-L1018 HydrophobicContact CD2-CD2 3.61Å; L1012-L1018 VanDerWaalsContact CD2-CD2 3.45Å; L1012-L1018 HydrophobicContact CD2-CG 4.03Å; L1012-L1018 HydrophobicContact CG-CD2 3.69Å; L1012-L1018 VanDerWaalsContact CG-CD2 3.43Å; L1012-L1018 HydrophobicContact CG-CG 4.36Å; S1016-L1018 PolarHBondContact O-N 3.31Å; S1016-L1018 PolarHBondContact OG-N 3.21Å; L1018-R1020 VanDerWaalsContact C-N 3.35Å; L1018-R1020 PolarHBondContact O-N 3.18Å; L1018-M1021 PolarHBondContact O-N 3.17Å; L1018-M1021 VanDerWaalsContact O-N 3.15Å; L1018-V1022 HydrophobicContact CD1-CG2 4.31Å; L1018-V1022 HydrophobicContact CD2-CG2 4.16Å; L1018-V1022 VanDerWaalsContact O-CG2 3.28Å; L1018-V1022 WeakPolarHBondContact O-CG2 3.32Å; L1018-V1022 PolarHBondContact O-N 3.07Å
1019F90.6Very high89.1Confident6.4 Ų6.425.5 Ų25.53%0.02814%0.14CC..Hα-helixtrans-55.7-49.7175.9178.2-102.2000111.5L1012 S1016 M1021 V1022 T1023 L1113 L1114 L1126L1012-F1019 HydrophobicContact CD2-CB 4.34Å; L1012-F1019 HydrophobicContact CD2-CD2 4.44Å; S1016-F1019 PolarHBondContact O-N 3.09Å; S1016-F1019 PolarHBondContact OG-N 3.15Å; S1016-F1019 VanDerWaalsContact OG-N 3.13Å; F1019-M1021 VanDerWaalsContact C-N 3.34Å; F1019-M1021 PolarHBondContact O-N 3.11Å; F1019-V1022 PolarHBondContact O-N 3.29Å; F1019-V1022 VanDerWaalsContact O-N 3.15Å; F1019-T1023 HydrophobicContact CD1-CG2 4.49Å; F1019-T1023 HydrophobicContact CE1-CG2 4.1Å; F1019-T1023 HydrophobicContact CE2-CG2 4.14Å; F1019-T1023 HydrophobicContact CZ-CG2 3.9Å; F1019-T1023 PolarHBondContact O-N 3.1Å; F1019-T1023 PolarHBondContact O-OG1 3.39Å; F1019-T1023 VanDerWaalsContact O-OG1 3.13Å; F1019-L1113 HydrophobicContact CE1-CB 4.15Å; F1019-L1113 HydrophobicContact CE2-CB 4.3Å; F1019-L1113 HydrophobicContact CZ-CB 3.79Å; F1019-L1114 HydrophobicContact CE2-CD2 4.4Å; F1019-L1114 HydrophobicContact CZ-CD2 4.04Å; F1019-L1114 HydrophobicContact CZ-CG 4.48Å; F1019-L1126 HydrophobicContact CE1-CD1 4.32Å; F1019-L1126 HydrophobicContact CZ-CD1 4.47Å
1020R90.3Very high89.2Confident99.6 Ų99.625.8 Ų25.838%0.37614%0.142SC..Hα-helixtrans-62.4-36.4178.3-67.3161.8176.5153.7-3.1113.5D1015 S1016 L1018 T1023 G1024 I1119D1015-R1020 VanDerWaalsContact CG-CZ 3.45Å; D1015-R1020 VanDerWaalsContact CG-NE 3.33Å; D1015-R1020 PolarHBondContact O-NE 2.93Å; D1015-R1020 PolarHBondContact O-NH1 3.06Å; D1015-R1020 PolarHBondContact O-NH2 3.19Å; D1015-R1020 WeakPolarHBondContact OD1-CG 3.34Å; D1015-R1020 IonicContact OD1-CZ 3.19Å; D1015-R1020 VanDerWaalsContact OD1-CZ 3.3Å; D1015-R1020 IonicContact OD1-NE 3.34Å; D1015-R1020 PolarHBondContact OD1-NE 3.18Å; D1015-R1020 IonicContact OD1-NH1 3.35Å; D1015-R1020 IonicContact OD1-NH2 3.44Å; D1015-R1020 PolarHBondContact OD1-NH2 3.1Å; D1015-R1020 VanDerWaalsContact OD1-NH2 3.17Å; D1015-R1020 IonicContact OD2-CZ 3.06Å; D1015-R1020 IonicContact OD2-NE 3.23Å; D1015-R1020 PolarHBondContact OD2-NE 2.89Å; D1015-R1020 IonicContact OD2-NH2 3.33Å; D1015-R1020 PolarHBondContact OD2-NH2 3.26Å; S1016-R1020 WeakPolarHBondContact O-CD 3.29Å; S1016-R1020 VanDerWaalsContact O-CG 3.3Å; S1016-R1020 WeakPolarHBondContact O-CG 3.36Å; S1016-R1020 PolarHBondContact O-N 3.04Å; S1016-R1020 VanDerWaalsContact O-N 3.08Å; L1018-R1020 VanDerWaalsContact C-N 3.35Å; L1018-R1020 PolarHBondContact O-N 3.18Å; R1020-T1023 WeakPolarHBondContact CA-OG1 3.43Å; R1020-T1023 PolarHBondContact O-OG1 3.15Å; R1020-T1023 VanDerWaalsContact O-OG1 3.09Å; R1020-G1024 PolarHBondContact O-N 3.19Å; R1020-I1119 HydrophobicContact CB-CD1 4.09Å; R1020-I1119 VanDerWaalsContact CD-CD1 3.49Å; R1020-I1119 HydrophobicContact CG-CD1 3.6Å
1021M91.6Very high89.3Confident34.6 Ų34.631 Ų3117%0.1717%0.165CC..Hα-helixtrans-69-41.5176-175.462.270.500111.1F859 L860 T863 S1017 L1018 F1019 G1024 L1025F859-M1021 HydrophobicContact CD1-CG 4.16Å; F859-M1021 HydrophobicContact CE1-CB 3.92Å; F859-M1021 HydrophobicContact CE1-CG 3.54Å; F859-M1021 VanDerWaalsContact CE1-CG 3.49Å; F859-M1021 HydrophobicContact CZ-CB 4.45Å; F859-M1021 HydrophobicContact CZ-CG 3.82Å; L860-M1021 HydrophobicContact CD2-CB 3.96Å; L860-M1021 HydrophobicContact CD2-CE 4.39Å; L860-M1021 HydrophobicContact CD2-CG 4.37Å; L860-M1021 WeakPolarHBondContact O-CE 3.34Å; T863-M1021 HydrophobicContact CG2-CE 3.96Å; T863-M1021 HydrophobicContact CG2-SD 3.54Å; T863-M1021 VanDerWaalsContact CG2-SD 3.56Å; T863-M1021 WeakPolarHBondContact CG2-SD 3.46Å; T863-M1021 WeakPolarHBondContact OG1-CE 3.25Å; S1017-M1021 VanDerWaalsContact O-CB 3.24Å; S1017-M1021 WeakPolarHBondContact O-CB 3.29Å; S1017-M1021 PolarHBondContact O-N 3.13Å; L1018-M1021 PolarHBondContact O-N 3.17Å; L1018-M1021 VanDerWaalsContact O-N 3.15Å; F1019-M1021 VanDerWaalsContact C-N 3.34Å; F1019-M1021 PolarHBondContact O-N 3.11Å; M1021-G1024 PolarHBondContact O-N 3.43Å; M1021-L1025 HydrophobicContact CG-CD1 4.33Å; M1021-L1025 VanDerWaalsContact O-CB 3.24Å; M1021-L1025 WeakPolarHBondContact O-CB 3.39Å; M1021-L1025 VanDerWaalsContact O-CG 3.28Å; M1021-L1025 WeakPolarHBondContact O-CG 3.42Å; M1021-L1025 PolarHBondContact O-N 3.22Å; M1021-L1025 HydrophobicContact SD-CG 4.38Å
1022V92.3Very high89.2Confident2.4 Ų2.433.4 Ų33.42%0.01517%0.172CC..Hα-helixtrans-62.2-50.9176174.90000110.3F859 L881 L1012 L1018 F1019 G1024 L1025 L1026 L1056 I1057F859-V1022 HydrophobicContact CE1-CG2 4.26Å; F859-V1022 HydrophobicContact CZ-CG2 4.22Å; L881-V1022 HydrophobicContact CD2-CG2 3.9Å; L1012-V1022 HydrophobicContact CD2-CG2 4.43Å; L1018-V1022 HydrophobicContact CD1-CG2 4.31Å; L1018-V1022 HydrophobicContact CD2-CG2 4.16Å; L1018-V1022 VanDerWaalsContact O-CG2 3.28Å; L1018-V1022 WeakPolarHBondContact O-CG2 3.32Å; L1018-V1022 PolarHBondContact O-N 3.07Å; F1019-V1022 PolarHBondContact O-N 3.29Å; F1019-V1022 VanDerWaalsContact O-N 3.15Å; V1022-G1024 PolarHBondContact O-N 3.02Å; V1022-L1025 PolarHBondContact O-N 3.32Å; V1022-L1026 HydrophobicContact CG1-CD1 4.36Å; V1022-L1026 WeakPolarHBondContact O-CG 3.4Å; V1022-L1026 PolarHBondContact O-N 3.04Å; V1022-L1026 VanDerWaalsContact O-N 3.11Å; V1022-L1056 HydrophobicContact CG2-CD2 4.47Å; V1022-I1057 HydrophobicContact CG1-CD1 4.38Å; V1022-I1057 HydrophobicContact CG1-CG1 4.49Å
1023T91.3Very high88.9Confident4.8 Ų4.833.8 Ų33.83%0.02917%0.174CC..Hα-helixtrans-64.9-39.5179.655.60000112.4F1019 R1020 L1025 L1026 E1027 I1057 L1126F1019-T1023 HydrophobicContact CD1-CG2 4.49Å; F1019-T1023 HydrophobicContact CE1-CG2 4.1Å; F1019-T1023 HydrophobicContact CE2-CG2 4.14Å; F1019-T1023 HydrophobicContact CZ-CG2 3.9Å; F1019-T1023 PolarHBondContact O-N 3.1Å; F1019-T1023 PolarHBondContact O-OG1 3.39Å; F1019-T1023 VanDerWaalsContact O-OG1 3.13Å; R1020-T1023 WeakPolarHBondContact CA-OG1 3.43Å; R1020-T1023 PolarHBondContact O-OG1 3.15Å; R1020-T1023 VanDerWaalsContact O-OG1 3.09Å; T1023-L1025 PolarHBondContact O-N 3.26Å; T1023-L1026 WeakPolarHBondContact O-CB 3.35Å; T1023-L1026 PolarHBondContact O-N 3.08Å; T1023-E1027 PolarHBondContact O-N 3.33Å; T1023-I1057 HydrophobicContact CG2-CD1 4.5Å; T1023-L1126 HydrophobicContact CG2-CD1 4.47Å; T1023-L1126 HydrophobicContact CG2-CD2 4.24Å
1024G90.8Very high88.8Confident22.6 Ų22.637.3 Ų37.323%0.23319%0.192CC..Hα-helixtrans-65.8-35.7175.700000113.5R1020 M1021 V1022 L1026 E1027 V1028R1020-G1024 PolarHBondContact O-N 3.19Å; M1021-G1024 PolarHBondContact O-N 3.43Å; V1022-G1024 PolarHBondContact O-N 3.02Å; G1024-L1026 VanDerWaalsContact C-N 3.34Å; G1024-E1027 PolarHBondContact O-N 2.95Å; G1024-V1028 VanDerWaalsContact O-CG2 3.32Å; G1024-V1028 WeakPolarHBondContact O-CG2 3.3Å; G1024-V1028 PolarHBondContact O-N 3.28Å; G1024-V1028 VanDerWaalsContact O-N 3.07Å
1025L90.8Very high88.6Confident6.4 Ų6.440.8 Ų40.83%0.03421%0.206CC..Hα-helixtrans-67.2-37.1173.3-90.4159.3000112.1F859 W874 A877 L881 M1021 V1022 T1023 G1029 A1049F859-L1025 HydrophobicContact CE2-CD1 3.77Å; F859-L1025 HydrophobicContact CZ-CD1 3.7Å; W874-L1025 HydrophobicContact CE3-CD1 4.12Å; W874-L1025 HydrophobicContact CH2-CD1 3.83Å; W874-L1025 HydrophobicContact CH2-CD2 4.22Å; W874-L1025 HydrophobicContact CH2-CG 4.27Å; W874-L1025 HydrophobicContact CZ3-CB 4.48Å; W874-L1025 HydrophobicContact CZ3-CD1 3.45Å; W874-L1025 VanDerWaalsContact CZ3-CD1 3.45Å; W874-L1025 HydrophobicContact CZ3-CD2 4.04Å; W874-L1025 HydrophobicContact CZ3-CG 3.69Å; A877-L1025 HydrophobicContact CB-CD1 4.3Å; A877-L1025 HydrophobicContact CB-CD2 3.9Å; L881-L1025 HydrophobicContact CD1-CD1 4.33Å; L881-L1025 HydrophobicContact CD1-CD2 3.62Å; M1021-L1025 HydrophobicContact CG-CD1 4.33Å; M1021-L1025 VanDerWaalsContact O-CB 3.24Å; M1021-L1025 WeakPolarHBondContact O-CB 3.39Å; M1021-L1025 VanDerWaalsContact O-CG 3.28Å; M1021-L1025 WeakPolarHBondContact O-CG 3.42Å; M1021-L1025 PolarHBondContact O-N 3.22Å; M1021-L1025 HydrophobicContact SD-CG 4.38Å; V1022-L1025 PolarHBondContact O-N 3.32Å; T1023-L1025 PolarHBondContact O-N 3.26Å; L1025-G1029 PolarHBondContact O-N 3.2Å; L1025-A1049 HydrophobicContact CD2-CB 4.38Å
1026L91.9Very high88.1Confident1.4 Ų1.441 Ų411%0.00720%0.204CC..Hα-helixtrans-65.6-42.7174.3-67.7174.7000111.5V1022 T1023 G1024 G1029 L1030 T1050 L1054 I1057 M1129 L1130 Y1133V1022-L1026 HydrophobicContact CG1-CD1 4.36Å; V1022-L1026 WeakPolarHBondContact O-CG 3.4Å; V1022-L1026 PolarHBondContact O-N 3.04Å; V1022-L1026 VanDerWaalsContact O-N 3.11Å; T1023-L1026 WeakPolarHBondContact O-CB 3.35Å; T1023-L1026 PolarHBondContact O-N 3.08Å; G1024-L1026 VanDerWaalsContact C-N 3.34Å; L1026-G1029 PolarHBondContact O-N 3.01Å; L1026-L1030 VanDerWaalsContact O-CB 3.3Å; L1026-L1030 WeakPolarHBondContact O-CB 3.37Å; L1026-L1030 PolarHBondContact O-N 3.14Å; L1026-T1050 HydrophobicContact CD2-CG2 4.39Å; L1026-T1050 VanDerWaalsContact CD2-O 3.27Å; L1026-T1050 WeakPolarHBondContact CD2-O 3.42Å; L1026-L1054 HydrophobicContact CD1-CD2 4.28Å; L1026-L1054 HydrophobicContact CD2-CD2 4.4Å; L1026-L1054 HydrophobicContact CD2-CG 3.98Å; L1026-I1057 HydrophobicContact CD1-CD1 3.5Å; L1026-I1057 VanDerWaalsContact CD1-CD1 3.47Å; L1026-M1129 HydrophobicContact CB-CE 4.24Å; L1026-M1129 HydrophobicContact CB-SD 4.13Å; L1026-L1130 HydrophobicContact CB-CD2 4.43Å; L1026-L1130 HydrophobicContact CD1-CD2 3.64Å; L1026-Y1133 HydrophobicContact CB-CE2 4.49Å; L1026-Y1133 HydrophobicContact CD2-CE2 4.4Å; L1026-Y1133 PolarHBondContact O-OH 3.29Å
1027E91Very high87Confident49 Ų4943.9 Ų43.923%0.22922%0.222CC..Hα-helixtrans-60.2-51175.6-177.9178.7-171.700111.9T1023 G1024 G1029 L1030 H1031 N1118 M1129T1023-E1027 PolarHBondContact O-N 3.33Å; G1024-E1027 PolarHBondContact O-N 2.95Å; E1027-G1029 VanDerWaalsContact C-N 3.3Å; E1027-G1029 PolarHBondContact O-N 3.22Å; E1027-L1030 PolarHBondContact O-N 3.09Å; E1027-H1031 PolarHBondContact O-CD2 3.11Å; E1027-H1031 PolarHBondContact O-N 3.12Å; E1027-N1118 VanDerWaalsContact CD-ND2 3.31Å; E1027-N1118 PolarHBondContact OE1-ND2 3.17Å; E1027-N1118 PolarHBondContact OE2-ND2 3Å; E1027-N1118 PolarHBondContact OE2-OD1 2.96Å; E1027-M1129 HydrophobicContact CB-CE 4.38Å; E1027-M1129 HydrophobicContact CB-CG 4.28Å; E1027-M1129 HydrophobicContact CB-SD 4.41Å; E1027-M1129 HydrophobicContact CG-CG 4.43Å
1028V89.2Confident85.4Confident57.2 Ų57.244.1 Ų44.135%0.34722%0.218SC..Hα-helixtrans-63.1-39.5177.9174.80000111.2W874 G1024 H1031 R1032W874-V1028 HydrophobicContact CH2-CB 4.41Å; W874-V1028 HydrophobicContact CH2-CG1 4.18Å; W874-V1028 HydrophobicContact CZ2-CG1 4.02Å; G1024-V1028 VanDerWaalsContact O-CG2 3.32Å; G1024-V1028 WeakPolarHBondContact O-CG2 3.3Å; G1024-V1028 PolarHBondContact O-N 3.28Å; G1024-V1028 VanDerWaalsContact O-N 3.07Å; V1028-H1031 PolarHBondContact O-N 3.05Å; V1028-R1032 WeakPolarHBondContact O-CG 3.36Å; V1028-R1032 PolarHBondContact O-N 3.32Å; V1028-R1032 VanDerWaalsContact O-N 3.12Å
1029G87.9Confident83.7Confident0 Ų048.7 Ų48.70%025%0.247CC..Hα-helixtrans-63.7-46.5177.500000112.2L1025 L1026 E1027 H1031 R1032 H1033 M1046L1025-G1029 PolarHBondContact O-N 3.2Å; L1026-G1029 PolarHBondContact O-N 3.01Å; E1027-G1029 VanDerWaalsContact C-N 3.3Å; E1027-G1029 PolarHBondContact O-N 3.22Å; G1029-H1031 PolarHBondContact O-N 3.07Å; G1029-R1032 PolarHBondContact O-N 3.1Å; G1029-H1033 WeakPolarHBondContact O-CB 3.4Å; G1029-H1033 PolarHBondContact O-CD2 3.27Å; G1029-H1033 VanDerWaalsContact O-CG 3.32Å; G1029-H1033 PolarHBondContact O-N 3.21Å; G1029-M1046 VanDerWaalsContact O-CE 3.24Å; G1029-M1046 WeakPolarHBondContact O-CE 3.43Å
1030L88.6Confident82.2Confident8.2 Ų8.254.4 Ų54.44%0.04328%0.278CS..Hα-helixtrans-58.8-48.6175.817871.3000111.4L1026 E1027 R1032 H1033 L1034 M1129 K1132 Y1133 L1136L1026-L1030 VanDerWaalsContact O-CB 3.3Å; L1026-L1030 WeakPolarHBondContact O-CB 3.37Å; L1026-L1030 PolarHBondContact O-N 3.14Å; E1027-L1030 PolarHBondContact O-N 3.09Å; L1030-R1032 VanDerWaalsContact C-N 3.31Å; L1030-R1032 PolarHBondContact O-N 3.13Å; L1030-H1033 PolarHBondContact O-N 3.11Å; L1030-H1033 VanDerWaalsContact O-N 3.17Å; L1030-L1034 HydrophobicContact CD1-CD1 4.18Å; L1030-L1034 HydrophobicContact CD1-CG 4.34Å; L1030-L1034 HydrophobicContact CG-CD1 4.05Å; L1030-L1034 HydrophobicContact CG-CG 4.49Å; L1030-L1034 WeakPolarHBondContact O-CG 3.34Å; L1030-L1034 PolarHBondContact O-N 2.97Å; L1030-M1129 HydrophobicContact CD2-CG 3.93Å; L1030-M1129 WeakPolarHBondContact CD2-O 3.42Å; L1030-M1129 HydrophobicContact CD2-SD 4.43Å; L1030-K1132 HydrophobicContact CD1-CB 4.12Å; L1030-K1132 HydrophobicContact CD2-CB 3.68Å; L1030-K1132 HydrophobicContact CD2-CD 4.23Å; L1030-K1132 HydrophobicContact CD2-CG 4.48Å; L1030-K1132 HydrophobicContact CG-CB 4.48Å; L1030-Y1133 HydrophobicContact CB-CE1 4.43Å; L1030-Y1133 HydrophobicContact CB-CE2 4.05Å; L1030-Y1133 HydrophobicContact CD1-CD1 4.13Å; L1030-Y1133 HydrophobicContact CD1-CD2 4.1Å; L1030-Y1133 HydrophobicContact CD1-CE1 4.25Å; L1030-Y1133 HydrophobicContact CD1-CE2 4.22Å; L1030-Y1133 HydrophobicContact CD1-CG 4.06Å; L1030-Y1133 PolarHBondContact N-OH 3.28Å; L1030-L1136 HydrophobicContact CD1-CD1 4.35Å
1031H87.7Confident81Confident116.6 Ų116.650.5 Ų50.554%0.5427%0.269SS..Hα-helixtrans-57.4-45.7-179.8-161.136.1000111.6E1027 V1028 G1029 H1033 L1034 E1035E1027-H1031 PolarHBondContact O-CD2 3.11Å; E1027-H1031 PolarHBondContact O-N 3.12Å; V1028-H1031 PolarHBondContact O-N 3.05Å; G1029-H1031 PolarHBondContact O-N 3.07Å; H1031-H1033 VanDerWaalsContact C-N 3.35Å; H1031-H1033 PolarHBondContact O-N 3.26Å; H1031-L1034 PolarHBondContact O-N 2.99Å; H1031-E1035 IonicContact CD2-OE1 3.44Å; H1031-E1035 IonicContact NE2-OE1 2.62Å; H1031-E1035 PolarHBondContact NE2-OE1 3.11Å; H1031-E1035 WeakPolarHBondContact O-CB 3.48Å; H1031-E1035 WeakPolarHBondContact O-CG 3.42Å; H1031-E1035 PolarHBondContact O-N 3.16Å
1032R85Confident80Confident98 Ų9849.7 Ų49.737%0.3727%0.267SS..Hα-helixtrans-66.6-36.5177.8-73.2-141.3-176.9-168.3-0.8113.5W874 V1028 G1029 L1030 L1034 E1035 F1036 P1042 M1046W874-R1032 VanDerWaalsContact CZ2-NH1 3.35Å; V1028-R1032 WeakPolarHBondContact O-CG 3.36Å; V1028-R1032 PolarHBondContact O-N 3.32Å; V1028-R1032 VanDerWaalsContact O-N 3.12Å; G1029-R1032 PolarHBondContact O-N 3.1Å; L1030-R1032 VanDerWaalsContact C-N 3.31Å; L1030-R1032 PolarHBondContact O-N 3.13Å; R1032-L1034 VanDerWaalsContact C-N 3.31Å; R1032-L1034 PolarHBondContact O-N 3Å; R1032-E1035 IonicContact CZ-OE2 2.94Å; R1032-E1035 IonicContact NH1-OE2 3.17Å; R1032-E1035 PolarHBondContact NH1-OE2 2.93Å; R1032-E1035 PolarHBondContact O-N 3.29Å; R1032-E1035 VanDerWaalsContact O-N 3.16Å; R1032-F1036 HydrophobicContact CB-CD2 4.44Å; R1032-F1036 HydrophobicContact CB-CE2 4.03Å; R1032-F1036 WeakPolarHBondContact O-CD2 3.3Å; R1032-F1036 PolarHBondContact O-N 3.08Å; R1032-F1036 VanDerWaalsContact O-N 3.1Å; R1032-P1042 HydrophobicContact CB-CG 4.31Å; R1032-M1046 HydrophobicContact CB-CE 3.58Å; R1032-M1046 HydrophobicContact CB-SD 3.71Å; R1032-M1046 VanDerWaalsContact CD-SD 3.59Å; R1032-M1046 WeakPolarHBondContact CD-SD 3.4Å; R1032-M1046 HydrophobicContact CG-SD 4.26Å
1033H83.1Confident79.1Confident11.6 Ų11.651.4 Ų51.45%0.05428%0.278CS..Hα-helixtrans-65.5-35.2174.6-80.5-62.9000112.3G1029 L1030 H1031 E1035 F1036 P1042 M1046 T1047 T1050 L1136G1029-H1033 WeakPolarHBondContact O-CB 3.4Å; G1029-H1033 PolarHBondContact O-CD2 3.27Å; G1029-H1033 VanDerWaalsContact O-CG 3.32Å; G1029-H1033 PolarHBondContact O-N 3.21Å; L1030-H1033 PolarHBondContact O-N 3.11Å; L1030-H1033 VanDerWaalsContact O-N 3.17Å; H1031-H1033 VanDerWaalsContact C-N 3.35Å; H1031-H1033 PolarHBondContact O-N 3.26Å; H1033-E1035 VanDerWaalsContact C-N 3.32Å; H1033-E1035 PolarHBondContact O-N 3.33Å; H1033-F1036 PolarHBondContact O-N 2.98Å; H1033-P1042 HydrophobicContact CB-CG 4.47Å; H1033-P1042 WeakPolarHBondContact CE1-CG 3.35Å; H1033-P1042 WeakPolarHBondContact ND1-CB 3.34Å; H1033-P1042 VanDerWaalsContact ND1-CG 3.33Å; H1033-P1042 WeakPolarHBondContact ND1-CG 3.33Å; H1033-M1046 HydrophobicContact CB-CE 4.39Å; H1033-M1046 WeakPolarHBondContact CD2-CE 3.3Å; H1033-M1046 WeakPolarHBondContact CE1-CE 3.22Å; H1033-M1046 WeakPolarHBondContact ND1-CE 3.15Å; H1033-M1046 VanDerWaalsContact NE2-CE 3.31Å; H1033-M1046 WeakPolarHBondContact NE2-CE 3.42Å; H1033-T1047 PolarHBondContact CE1-OG1 3.04Å; H1033-T1047 PolarHBondContact NE2-OG1 3.46Å; H1033-T1050 PolarHBondContact NE2-OG1 2.78Å; H1033-L1136 HydrophobicContact CB-CD1 3.62Å; H1033-L1136 HydrophobicContact CB-CD2 4.42Å
1034L83.8Confident78.2Confident74.6 Ų74.653.1 Ų53.139%0.39129%0.288SS..Hα-helixtrans-76.5-28.1176.5-66.2172.7000112.9S173 L1030 H1031 R1032 F1036 L1135 L1136S173-L1034 PolarHBondContact OG-O 2.91Å; L1030-L1034 HydrophobicContact CD1-CD1 4.18Å; L1030-L1034 HydrophobicContact CD1-CG 4.34Å; L1030-L1034 HydrophobicContact CG-CD1 4.05Å; L1030-L1034 HydrophobicContact CG-CG 4.49Å; L1030-L1034 WeakPolarHBondContact O-CG 3.34Å; L1030-L1034 PolarHBondContact O-N 2.97Å; H1031-L1034 PolarHBondContact O-N 2.99Å; R1032-L1034 VanDerWaalsContact C-N 3.31Å; R1032-L1034 PolarHBondContact O-N 3Å; L1034-F1036 VanDerWaalsContact C-N 3.26Å; L1034-F1036 VanDerWaalsContact O-CD2 3.3Å; L1034-F1036 WeakPolarHBondContact O-CD2 3.37Å; L1034-F1036 PolarHBondContact O-N 3.28Å; L1034-L1135 HydrophobicContact CD1-CD1 4.48Å; L1034-L1135 HydrophobicContact CD2-CB 4.28Å; L1034-L1135 HydrophobicContact CD2-CD1 4.26Å; L1034-L1136 HydrophobicContact CD2-CD2 4.1Å; L1034-L1136 HydrophobicContact CD2-CG 4.39Å
1035E82.5Confident77.3Confident109.2 Ų109.252.3 Ų52.351%0.5128%0.279SS..Hα-helixtrans-75.3-32.2178.2-134.5178.3-176.800113.2S173 H1031 R1032 H1033 P1037S173-E1035 WeakPolarHBondContact CB-O 2.8Å; H1031-E1035 IonicContact CD2-OE1 3.44Å; H1031-E1035 IonicContact NE2-OE1 2.62Å; H1031-E1035 PolarHBondContact NE2-OE1 3.11Å; H1031-E1035 WeakPolarHBondContact O-CB 3.48Å; H1031-E1035 WeakPolarHBondContact O-CG 3.42Å; H1031-E1035 PolarHBondContact O-N 3.16Å; R1032-E1035 IonicContact CZ-OE2 2.94Å; R1032-E1035 IonicContact NH1-OE2 3.17Å; R1032-E1035 PolarHBondContact NH1-OE2 2.93Å; R1032-E1035 PolarHBondContact O-N 3.29Å; R1032-E1035 VanDerWaalsContact O-N 3.16Å; H1033-E1035 VanDerWaalsContact C-N 3.32Å; H1033-E1035 PolarHBondContact O-N 3.33Å; E1035-P1037 WeakPolarHBondContact O-CD 3.38Å
1036F74Confident76.9Confident75 Ų7552 Ų5233%0.32928%0.277SS..SBendtrans-106.989.8-174.7-65-74.7000112.8K174 H177 R1032 H1033 L1034 I1038 G1041 P1042 M1046 L1136 Y1139K174-F1036 HydrophobicContact CB-CD2 3.96Å; K174-F1036 HydrophobicContact CB-CE2 3.68Å; K174-F1036 HydrophobicContact CB-CZ 4.25Å; K174-F1036 HydrophobicContact CD-CE2 4.46Å; K174-F1036 HydrophobicContact CD-CZ 4.37Å; K174-F1036 HydrophobicContact CG-CE2 3.96Å; K174-F1036 HydrophobicContact CG-CZ 4.01Å; H177-F1036 HydrophobicContact CB-CB 3.74Å; H177-F1036 HydrophobicContact CB-CD1 4.29Å; H177-F1036 HydrophobicContact CB-CG 4.21Å; H177-F1036 AromaticContact CD2-CD1 3.96Å; R1032-F1036 HydrophobicContact CB-CD2 4.44Å; R1032-F1036 HydrophobicContact CB-CE2 4.03Å; R1032-F1036 WeakPolarHBondContact O-CD2 3.3Å; R1032-F1036 PolarHBondContact O-N 3.08Å; R1032-F1036 VanDerWaalsContact O-N 3.1Å; H1033-F1036 PolarHBondContact O-N 2.98Å; L1034-F1036 VanDerWaalsContact C-N 3.26Å; L1034-F1036 VanDerWaalsContact O-CD2 3.3Å; L1034-F1036 WeakPolarHBondContact O-CD2 3.37Å; L1034-F1036 PolarHBondContact O-N 3.28Å; F1036-I1038 PolarHBondContact O-N 3.4Å; F1036-I1038 VanDerWaalsContact O-N 3.15Å; F1036-G1041 WeakPolarHBondContact O-CA 3.32Å; F1036-P1042 HydrophobicContact CD2-CB 3.92Å; F1036-P1042 HydrophobicContact CE2-CB 4.44Å; F1036-P1042 VanDerWaalsContact O-CD 3.25Å; F1036-P1042 WeakPolarHBondContact O-CD 3.28Å; F1036-M1046 HydrophobicContact CD2-CE 4.04Å; F1036-M1046 HydrophobicContact CE2-CE 3.85Å; F1036-M1046 HydrophobicContact CE2-SD 4.35Å; F1036-L1136 HydrophobicContact CE1-CD2 4.25Å; F1036-L1136 HydrophobicContact CE2-CD2 4.16Å; F1036-L1136 HydrophobicContact CZ-CD2 3.51Å; F1036-Y1139 HydrophobicContact CE1-CD1 4.27Å; F1036-Y1139 AromaticContact CE1-CD2 3.85Å; F1036-Y1139 HydrophobicContact CE1-CD2 3.85Å; F1036-Y1139 HydrophobicContact CE1-CE1 4.15Å; F1036-Y1139 AromaticContact CE1-CE2 3.68Å; F1036-Y1139 HydrophobicContact CE1-CE2 3.68Å; F1036-Y1139 HydrophobicContact CE1-CG 4.16Å; F1036-Y1139 AromaticContact CE1-CZ 3.87Å; F1036-Y1139 HydrophobicContact CZ-CD2 4.18Å; F1036-Y1139 HydrophobicContact CZ-CE2 4.09Å
1037P64.8Low76.3Confident78.2 Ų78.252.5 Ų52.551%0.50828%0.28SS..  trans-67.7142.6173.818.5-20.4000112.2E1035 N1040 G1041E1035-P1037 WeakPolarHBondContact O-CD 3.38Å; P1037-N1040 PolarHBondContact O-N 3.35Å; P1037-G1041 VanDerWaalsContact O-CA 3.22Å; P1037-G1041 WeakPolarHBondContact O-CA 3.26Å; P1037-G1041 PolarHBondContact O-N 3.01Å
1038I56Low75.6Confident69.6 Ų69.651.8 Ų51.836%0.35728%0.275SS..SBendtrans-64.7140.8175.3-60.5160.2000109F161 F180 F1036 Y1139 F1213 I1244 W1260F161-I1038 HydrophobicContact CZ-CD1 4.38Å; F180-I1038 HydrophobicContact CB-CD1 4.24Å; F180-I1038 HydrophobicContact CD1-CG2 3.65Å; F180-I1038 HydrophobicContact CD2-CG2 4.19Å; F180-I1038 HydrophobicContact CE1-CG2 3.64Å; F180-I1038 HydrophobicContact CE2-CG2 4.19Å; F180-I1038 HydrophobicContact CG-CD1 4.45Å; F180-I1038 HydrophobicContact CG-CG2 3.93Å; F180-I1038 HydrophobicContact CZ-CG2 3.93Å; F1036-I1038 PolarHBondContact O-N 3.4Å; F1036-I1038 VanDerWaalsContact O-N 3.15Å; I1038-Y1139 HydrophobicContact CD1-CD1 4.12Å; I1038-Y1139 HydrophobicContact CD1-CE1 4.01Å; I1038-Y1139 HydrophobicContact CD1-CE2 4.02Å; I1038-Y1139 HydrophobicContact CD1-CG 4.01Å; I1038-Y1139 VanDerWaalsContact CD1-OH 3.24Å; I1038-Y1139 WeakPolarHBondContact CD1-OH 3.34Å; I1038-Y1139 HydrophobicContact CG1-CE1 4.39Å; I1038-F1213 HydrophobicContact CD1-CD2 4.11Å; I1038-F1213 HydrophobicContact CD1-CE2 3.76Å; I1038-I1244 HydrophobicContact CD1-CD1 3.97Å; I1038-I1244 HydrophobicContact CD1-CG1 4.33Å; I1038-W1260 HydrophobicContact CD1-CZ2 3.49Å; I1038-W1260 VanDerWaalsContact CD1-CZ2 3.49Å; I1038-W1260 VanDerWaalsContact CD1-NE1 3.33Å; I1038-W1260 HydrophobicContact CG1-CZ2 3.83Å
1039P55.4Low75.3Confident96.8 Ų96.849.1 Ų49.163%0.62926%0.26SS*.SBendcis-91-19.917.833.6-35.1000116.2F180 M181 G1041F180-P1039 HydrophobicContact CE1-CB 4.25Å; M181-P1039 WeakPolarHBondContact CE-O 3.32Å; P1039-G1041 PolarHBondContact O-N 3.24Å; P1039-G1041 VanDerWaalsContact O-N 3.09Å
1040N58.4Low75.3Confident126 Ų12649.2 Ų49.267%0.67426%0.26SS*.SBendtrans-84.528.1179.9-67.6-17000112.1P1037P1037-N1040 PolarHBondContact O-N 3.35Å
1041G65.4Low75Confident17.6 Ų17.650.4 Ų50.418%0.18126%0.264CS..  trans-55.4177.2-175.700000112.7F1036 P1037 P1039 R1265F1036-G1041 WeakPolarHBondContact O-CA 3.32Å; P1037-G1041 VanDerWaalsContact O-CA 3.22Å; P1037-G1041 WeakPolarHBondContact O-CA 3.26Å; P1037-G1041 PolarHBondContact O-N 3.01Å; P1039-G1041 PolarHBondContact O-N 3.24Å; P1039-G1041 VanDerWaalsContact O-N 3.09Å; G1041-R1265 PolarHBondContact O-NH1 2.97Å
1042P71.1Confident74.6Confident19 Ų1945 Ų4512%0.12324%0.239CC..SBendtrans-60.9153.5-175.75.1-6.4000112.5R1032 H1033 F1036 V1044 M1046 T1047R1032-P1042 HydrophobicContact CB-CG 4.31Å; H1033-P1042 HydrophobicContact CB-CG 4.47Å; H1033-P1042 WeakPolarHBondContact CE1-CG 3.35Å; H1033-P1042 WeakPolarHBondContact ND1-CB 3.34Å; H1033-P1042 VanDerWaalsContact ND1-CG 3.33Å; H1033-P1042 WeakPolarHBondContact ND1-CG 3.33Å; F1036-P1042 HydrophobicContact CD2-CB 3.92Å; F1036-P1042 HydrophobicContact CE2-CB 4.44Å; F1036-P1042 VanDerWaalsContact O-CD 3.25Å; F1036-P1042 WeakPolarHBondContact O-CD 3.28Å; P1042-V1044 PolarHBondContact O-N 3.04Å; P1042-M1046 HydrophobicContact CB-CB 4.41Å; P1042-M1046 HydrophobicContact CB-CE 3.27Å; P1042-M1046 VanDerWaalsContact CB-CE 3.43Å; P1042-M1046 HydrophobicContact CB-SD 3.77Å; P1042-M1046 HydrophobicContact CG-CE 3.45Å; P1042-M1046 VanDerWaalsContact CG-CE 3.44Å; P1042-M1046 HydrophobicContact CG-SD 4.5Å; P1042-T1047 HydrophobicContact CB-CG2 4.32Å; P1042-T1047 HydrophobicContact CG-CG2 3.93Å
1043P72.7Confident74.8Confident38.6 Ų38.640.3 Ų40.325%0.25122%0.222SC..  trans-61.5140.718024.9-31.9000110.7V871 S1045 M1046 T1047V871-P1043 HydrophobicContact CB-CB 4.43Å; V871-P1043 HydrophobicContact CG1-CB 3.91Å; V871-P1043 HydrophobicContact CG1-CG 4.44Å; V871-P1043 HydrophobicContact CG2-CB 4.08Å; V871-P1043 HydrophobicContact CG2-CG 4.4Å; P1043-S1045 VanDerWaalsContact C-N 3.26Å; P1043-S1045 PolarHBondContact O-N 3.03Å; P1043-M1046 HydrophobicContact CG-CB 3.92Å; P1043-M1046 HydrophobicContact CG-SD 4.43Å; P1043-M1046 WeakPolarHBondContact O-CA 3.41Å; P1043-M1046 VanDerWaalsContact O-CB 3.28Å; P1043-M1046 WeakPolarHBondContact O-CB 3.31Å; P1043-M1046 PolarHBondContact O-N 3.19Å; P1043-T1047 PolarHBondContact O-N 3.2Å
1044V71.9Confident75Confident40 Ų4039.8 Ų39.824%0.24222%0.219CC..Hα-helixtrans-56.3-34.4-176.5-178.30000112.3P1042 M1046 T1047 R1048 A1247 A1251 F1253 W1260 F1262 E1268P1042-V1044 PolarHBondContact O-N 3.04Å; V1044-M1046 VanDerWaalsContact C-N 3.31Å; V1044-M1046 PolarHBondContact O-N 2.95Å; V1044-T1047 WeakPolarHBondContact O-CB 3.37Å; V1044-T1047 PolarHBondContact O-N 3.11Å; V1044-T1047 PolarHBondContact O-OG1 3.23Å; V1044-R1048 WeakPolarHBondContact O-CB 3.2Å; V1044-R1048 VanDerWaalsContact O-CG 3.31Å; V1044-R1048 WeakPolarHBondContact O-CG 3.33Å; V1044-R1048 PolarHBondContact O-N 3.07Å; V1044-R1048 VanDerWaalsContact O-N 3.09Å; V1044-A1247 HydrophobicContact CG1-CB 4.06Å; V1044-A1247 HydrophobicContact CG2-CB 4Å; V1044-A1251 HydrophobicContact CG1-CB 4.33Å; V1044-F1253 HydrophobicContact CG1-CD1 3.72Å; V1044-F1253 HydrophobicContact CG1-CE1 3.46Å; V1044-F1253 VanDerWaalsContact CG1-CE1 3.46Å; V1044-W1260 HydrophobicContact CG1-CE3 4.36Å; V1044-W1260 HydrophobicContact CG1-CZ3 4.16Å; V1044-W1260 HydrophobicContact CG2-CE3 4.24Å; V1044-W1260 HydrophobicContact CG2-CZ3 4.47Å; V1044-F1262 HydrophobicContact CB-CE1 4.37Å; V1044-F1262 HydrophobicContact CG1-CE1 3.94Å; V1044-F1262 HydrophobicContact CG2-CD1 4.46Å; V1044-F1262 HydrophobicContact CG2-CE1 4.15Å; V1044-E1268 HydrophobicContact CG1-CB 4.28Å; V1044-E1268 HydrophobicContact CG1-CG 4.4Å; V1044-E1268 HydrophobicContact CG2-CB 3.71Å; V1044-E1268 HydrophobicContact CG2-CG 3.83Å
1045S72.3Confident75Confident5 Ų536.3 Ų36.34%0.03520%0.201CC..Hα-helixtrans-63.5-34.6176.154.50000113.2V871 W874 D875 P1043 R1048 A1049V871-S1045 VanDerWaalsContact CG1-OG 3.3Å; V871-S1045 WeakPolarHBondContact CG1-OG 3.4Å; V871-S1045 PolarHBondContact O-OG 3.02Å; W874-S1045 VanDerWaalsContact CB-OG 3.28Å; W874-S1045 WeakPolarHBondContact CB-OG 3.26Å; D875-S1045 WeakPolarHBondContact OD1-CB 3.34Å; P1043-S1045 VanDerWaalsContact C-N 3.26Å; P1043-S1045 PolarHBondContact O-N 3.03Å; S1045-R1048 PolarHBondContact O-N 3.4Å; S1045-A1049 VanDerWaalsContact O-CB 3.29Å; S1045-A1049 WeakPolarHBondContact O-CB 3.27Å; S1045-A1049 PolarHBondContact O-N 3.27Å
1046M82.5Confident75.3Confident0.6 Ų0.631.2 Ų31.20%0.00318%0.177CC..Hα-helixtrans-66.9-43.5173.4-174.1179.59600111.2W874 G1029 R1032 H1033 F1036 P1042 P1043 V1044 R1048 A1049 T1050W874-M1046 HydrophobicContact CB-CB 4.31Å; W874-M1046 HydrophobicContact CD2-CB 3.65Å; W874-M1046 HydrophobicContact CD2-CG 3.63Å; W874-M1046 HydrophobicContact CD2-SD 4.39Å; W874-M1046 HydrophobicContact CE3-CB 3.93Å; W874-M1046 HydrophobicContact CE3-CG 3.68Å; W874-M1046 HydrophobicContact CG-CB 3.84Å; W874-M1046 HydrophobicContact CG-CG 4.32Å; W874-M1046 HydrophobicContact CH2-CG 3.75Å; W874-M1046 HydrophobicContact CH2-SD 4.16Å; W874-M1046 HydrophobicContact CZ2-CB 4.46Å; W874-M1046 HydrophobicContact CZ2-CG 3.71Å; W874-M1046 HydrophobicContact CZ2-SD 3.67Å; W874-M1046 VanDerWaalsContact CZ2-SD 3.56Å; W874-M1046 HydrophobicContact CZ3-CB 4.46Å; W874-M1046 HydrophobicContact CZ3-CG 3.73Å; G1029-M1046 VanDerWaalsContact O-CE 3.24Å; G1029-M1046 WeakPolarHBondContact O-CE 3.43Å; R1032-M1046 HydrophobicContact CB-CE 3.58Å; R1032-M1046 HydrophobicContact CB-SD 3.71Å; R1032-M1046 VanDerWaalsContact CD-SD 3.59Å; R1032-M1046 WeakPolarHBondContact CD-SD 3.4Å; R1032-M1046 HydrophobicContact CG-SD 4.26Å; H1033-M1046 HydrophobicContact CB-CE 4.39Å; H1033-M1046 WeakPolarHBondContact CD2-CE 3.3Å; H1033-M1046 WeakPolarHBondContact CE1-CE 3.22Å; H1033-M1046 WeakPolarHBondContact ND1-CE 3.15Å; H1033-M1046 VanDerWaalsContact NE2-CE 3.31Å; H1033-M1046 WeakPolarHBondContact NE2-CE 3.42Å; F1036-M1046 HydrophobicContact CD2-CE 4.04Å; F1036-M1046 HydrophobicContact CE2-CE 3.85Å; F1036-M1046 HydrophobicContact CE2-SD 4.35Å; P1042-M1046 HydrophobicContact CB-CB 4.41Å; P1042-M1046 HydrophobicContact CB-CE 3.27Å; P1042-M1046 VanDerWaalsContact CB-CE 3.43Å; P1042-M1046 HydrophobicContact CB-SD 3.77Å; P1042-M1046 HydrophobicContact CG-CE 3.45Å; P1042-M1046 VanDerWaalsContact CG-CE 3.44Å; P1042-M1046 HydrophobicContact CG-SD 4.5Å; P1043-M1046 HydrophobicContact CG-CB 3.92Å; P1043-M1046 HydrophobicContact CG-SD 4.43Å; P1043-M1046 WeakPolarHBondContact O-CA 3.41Å; P1043-M1046 VanDerWaalsContact O-CB 3.28Å; P1043-M1046 WeakPolarHBondContact O-CB 3.31Å; P1043-M1046 PolarHBondContact O-N 3.19Å; V1044-M1046 VanDerWaalsContact C-N 3.31Å; V1044-M1046 PolarHBondContact O-N 2.95Å; M1046-R1048 VanDerWaalsContact C-N 3.28Å; M1046-R1048 PolarHBondContact O-N 3.32Å; M1046-A1049 PolarHBondContact O-N 3.23Å; M1046-A1049 VanDerWaalsContact O-N 3.15Å; M1046-T1050 HydrophobicContact CG-CG2 4.45Å; M1046-T1050 WeakPolarHBondContact O-CB 3.45Å; M1046-T1050 WeakPolarHBondContact O-CG2 3.36Å; M1046-T1050 PolarHBondContact O-N 2.98Å; M1046-T1050 PolarHBondContact O-OG1 3.29Å; M1046-T1050 VanDerWaalsContact O-OG1 3.11Å
1047T79Confident76.1Confident11.6 Ų11.627.8 Ų27.87%0.07116%0.163CC..Hα-helixtrans-60.1-40.1176-34.70000111.9H1033 P1042 P1043 V1044 T1050 Y1051 L1140 H1143 P1254 W1260H1033-T1047 PolarHBondContact CE1-OG1 3.04Å; H1033-T1047 PolarHBondContact NE2-OG1 3.46Å; P1042-T1047 HydrophobicContact CB-CG2 4.32Å; P1042-T1047 HydrophobicContact CG-CG2 3.93Å; P1043-T1047 PolarHBondContact O-N 3.2Å; V1044-T1047 WeakPolarHBondContact O-CB 3.37Å; V1044-T1047 PolarHBondContact O-N 3.11Å; V1044-T1047 PolarHBondContact O-OG1 3.23Å; T1047-T1050 WeakPolarHBondContact CA-OG1 3.4Å; T1047-T1050 PolarHBondContact O-OG1 3.11Å; T1047-Y1051 WeakPolarHBondContact O-CB 3.43Å; T1047-Y1051 PolarHBondContact O-N 3.24Å; T1047-L1140 HydrophobicContact CG2-CD1 4.34Å; T1047-L1140 HydrophobicContact CG2-CD2 3.52Å; T1047-L1140 VanDerWaalsContact CG2-CD2 3.45Å; T1047-H1143 VanDerWaalsContact CG2-CE1 3.42Å; T1047-H1143 WeakPolarHBondContact CG2-CE1 3.37Å; T1047-H1143 PolarHBondContact O-CE1 3.02Å; T1047-H1143 PolarHBondContact O-NE2 3.21Å; T1047-H1143 VanDerWaalsContact O-NE2 3.12Å; T1047-P1254 HydrophobicContact CG2-CG 3.56Å; T1047-W1260 HydrophobicContact CG2-CH2 3.87Å; T1047-W1260 HydrophobicContact CG2-CZ3 4.21Å
1048R75.6Confident77.2Confident34 Ų3425.9 Ų25.913%0.12815%0.145CC..Hα-helixtrans-66.1-45.1174.7-67.7179.4-174.7170.32.9112.3A878 I882 V1044 S1045 M1046 T1050 Y1051 A1052 D1250 A1251 F1253 C1270A878-R1048 HydrophobicContact CB-CB 4.03Å; I882-R1048 VanDerWaalsContact CD1-NH2 3.29Å; V1044-R1048 WeakPolarHBondContact O-CB 3.2Å; V1044-R1048 VanDerWaalsContact O-CG 3.31Å; V1044-R1048 WeakPolarHBondContact O-CG 3.33Å; V1044-R1048 PolarHBondContact O-N 3.07Å; V1044-R1048 VanDerWaalsContact O-N 3.09Å; S1045-R1048 PolarHBondContact O-N 3.4Å; M1046-R1048 VanDerWaalsContact C-N 3.28Å; M1046-R1048 PolarHBondContact O-N 3.32Å; R1048-T1050 VanDerWaalsContact C-N 3.32Å; R1048-T1050 PolarHBondContact O-N 3.21Å; R1048-Y1051 PolarHBondContact O-N 3.3Å; R1048-A1052 VanDerWaalsContact O-CB 3.32Å; R1048-A1052 WeakPolarHBondContact O-CB 3.42Å; R1048-A1052 PolarHBondContact O-N 3.21Å; R1048-D1250 PolarHBondContact NH1-O 3.39Å; R1048-D1250 VanDerWaalsContact NH2-C 3.26Å; R1048-D1250 PolarHBondContact NH2-O 3.11Å; R1048-A1251 HydrophobicContact CG-CB 3.77Å; R1048-A1251 VanDerWaalsContact NE-CA 3.31Å; R1048-A1251 PolarHBondContact NH1-O 3.32Å; R1048-A1251 VanDerWaalsContact NH1-O 3.13Å; R1048-F1253 HydrophobicContact CG-CD1 4.38Å; R1048-F1253 PolarHBondContact NH1-O 3.27Å; R1048-C1270 PolarHBondContact NH1-SG 2.93Å; R1048-C1270 PolarHBondContact NH2-SG 3.12Å
1049A83.3Confident78.5Confident1.4 Ų1.423.7 Ų23.71%0.01213%0.133CC..Hα-helixtrans-61.1-45.1178.400000111.4W874 A877 A878 L881 L1025 S1045 M1046 A1052 G1053W874-A1049 HydrophobicContact CE3-CB 3.92Å; W874-A1049 HydrophobicContact CZ3-CB 4.32Å; A877-A1049 HydrophobicContact CB-CB 4.41Å; A878-A1049 HydrophobicContact CB-CB 3.99Å; L881-A1049 HydrophobicContact CD1-CB 4.23Å; L881-A1049 VanDerWaalsContact CD1-O 3.3Å; L881-A1049 WeakPolarHBondContact CD1-O 3.27Å; L1025-A1049 HydrophobicContact CD2-CB 4.38Å; S1045-A1049 VanDerWaalsContact O-CB 3.29Å; S1045-A1049 WeakPolarHBondContact O-CB 3.27Å; S1045-A1049 PolarHBondContact O-N 3.27Å; M1046-A1049 PolarHBondContact O-N 3.23Å; M1046-A1049 VanDerWaalsContact O-N 3.15Å; A1049-A1052 PolarHBondContact O-N 3.1Å; A1049-G1053 PolarHBondContact O-N 3.1Å
1050T87.4Confident80.1Confident1.2 Ų1.219.3 Ų19.31%0.00710%0.104CC..Hα-helixtrans-67.2-39.317954.50000112.1L1026 H1033 M1046 T1047 R1048 G1053 L1054 Y1133 H1143L1026-T1050 HydrophobicContact CD2-CG2 4.39Å; L1026-T1050 VanDerWaalsContact CD2-O 3.27Å; L1026-T1050 WeakPolarHBondContact CD2-O 3.42Å; H1033-T1050 PolarHBondContact NE2-OG1 2.78Å; M1046-T1050 HydrophobicContact CG-CG2 4.45Å; M1046-T1050 WeakPolarHBondContact O-CB 3.45Å; M1046-T1050 WeakPolarHBondContact O-CG2 3.36Å; M1046-T1050 PolarHBondContact O-N 2.98Å; M1046-T1050 PolarHBondContact O-OG1 3.29Å; M1046-T1050 VanDerWaalsContact O-OG1 3.11Å; T1047-T1050 WeakPolarHBondContact CA-OG1 3.4Å; T1047-T1050 PolarHBondContact O-OG1 3.11Å; R1048-T1050 VanDerWaalsContact C-N 3.32Å; R1048-T1050 PolarHBondContact O-N 3.21Å; T1050-G1053 PolarHBondContact O-N 3.25Å; T1050-L1054 WeakPolarHBondContact O-CB 3.49Å; T1050-L1054 VanDerWaalsContact O-CG 3.32Å; T1050-L1054 WeakPolarHBondContact O-CG 3.32Å; T1050-L1054 PolarHBondContact O-N 3.13Å; T1050-Y1133 WeakPolarHBondContact CB-OH 3.41Å; T1050-Y1133 VanDerWaalsContact CG2-OH 3.31Å; T1050-Y1133 WeakPolarHBondContact CG2-OH 3.36Å; T1050-H1143 PolarHBondContact OG1-CD2 3.19Å; T1050-H1143 PolarHBondContact OG1-NE2 3.19Å
1051Y82.9Confident81.5Confident34.4 Ų34.413.6 Ų13.614%0.1357%0.074CC..Hα-helixtrans-62.6-50.2174.2178.7-102.3000111.8T1047 R1048 G1053 L1054 S1055 D1142 H1143 C1146 I1244 A1252 L1274 F1278T1047-Y1051 WeakPolarHBondContact O-CB 3.43Å; T1047-Y1051 PolarHBondContact O-N 3.24Å; R1048-Y1051 PolarHBondContact O-N 3.3Å; Y1051-G1053 VanDerWaalsContact C-N 3.28Å; Y1051-G1053 PolarHBondContact O-N 3.31Å; Y1051-L1054 PolarHBondContact O-N 3.23Å; Y1051-L1054 VanDerWaalsContact O-N 3.13Å; Y1051-S1055 WeakPolarHBondContact O-CB 3.33Å; Y1051-S1055 PolarHBondContact O-N 3.18Å; Y1051-D1142 HydrophobicContact CD2-CB 4.01Å; Y1051-D1142 HydrophobicContact CE2-CB 3.7Å; Y1051-H1143 PolarHBondContact N-NE2 3Å; Y1051-C1146 VanDerWaalsContact CE2-SG 3.56Å; Y1051-I1244 HydrophobicContact CD1-CD1 3.75Å; Y1051-I1244 HydrophobicContact CE1-CD1 3.81Å; Y1051-A1252 HydrophobicContact CD1-CB 3.82Å; Y1051-A1252 HydrophobicContact CE1-CB 3.91Å; Y1051-L1274 HydrophobicContact CD1-CD1 3.61Å; Y1051-L1274 HydrophobicContact CD1-CD2 4.25Å; Y1051-L1274 HydrophobicContact CD1-CG 4.38Å; Y1051-L1274 HydrophobicContact CD2-CD1 4.31Å; Y1051-L1274 HydrophobicContact CE1-CB 4.04Å; Y1051-L1274 HydrophobicContact CE1-CD1 3.77Å; Y1051-L1274 HydrophobicContact CE1-CD2 3.74Å; Y1051-L1274 HydrophobicContact CE1-CG 4.05Å; Y1051-L1274 HydrophobicContact CE2-CB 4.23Å; Y1051-L1274 HydrophobicContact CE2-CD1 4.44Å; Y1051-L1274 HydrophobicContact CG-CD1 3.88Å; Y1051-F1278 HydrophobicContact CD1-CE1 4.39Å; Y1051-F1278 HydrophobicContact CE1-CD1 4.37Å; Y1051-F1278 AromaticContact CE1-CE1 3.64Å; Y1051-F1278 HydrophobicContact CE1-CE1 3.64Å; Y1051-F1278 HydrophobicContact CE1-CZ 4.38Å
1052A80.6Confident82.3Confident2.2 Ų2.213.9 Ų13.92%0.0187%0.074CC..Hα-helixtrans-61.2-37.8179.900000111.7L881 I882 R1048 A1049 S1055 L1056L881-A1052 HydrophobicContact CB-CB 3.72Å; I882-A1052 HydrophobicContact CG1-CB 4.03Å; R1048-A1052 VanDerWaalsContact O-CB 3.32Å; R1048-A1052 WeakPolarHBondContact O-CB 3.42Å; R1048-A1052 PolarHBondContact O-N 3.21Å; A1049-A1052 PolarHBondContact O-N 3.1Å; A1052-S1055 PolarHBondContact O-N 3.2Å; A1052-L1056 VanDerWaalsContact O-CB 3.27Å; A1052-L1056 WeakPolarHBondContact O-CB 3.29Å; A1052-L1056 PolarHBondContact O-N 3.13Å
1053G88.1Confident82.8Confident0.4 Ų0.413.3 Ų13.30%0.0047%0.07CC..Hα-helixtrans-63.3-45.8172.800000113.3A1049 T1050 Y1051 L1056 I1057A1049-G1053 PolarHBondContact O-N 3.1Å; T1050-G1053 PolarHBondContact O-N 3.25Å; Y1051-G1053 VanDerWaalsContact C-N 3.28Å; Y1051-G1053 PolarHBondContact O-N 3.31Å; G1053-L1056 PolarHBondContact O-N 3.34Å; G1053-I1057 WeakPolarHBondContact O-CG1 3.36Å; G1053-I1057 PolarHBondContact O-N 3.21Å; G1053-I1057 VanDerWaalsContact O-N 3.15Å
1054L87.9Confident83.5Confident0 Ų011.9 Ų11.90%06%0.061CC..Hα-helixtrans-64.1-44.1175.6-73171000111.9L1026 T1050 Y1051 L1056 I1057 R1058 L1130 Y1133 H1143 C1146 I1150L1026-L1054 HydrophobicContact CD1-CD2 4.28Å; L1026-L1054 HydrophobicContact CD2-CD2 4.4Å; L1026-L1054 HydrophobicContact CD2-CG 3.98Å; T1050-L1054 WeakPolarHBondContact O-CB 3.49Å; T1050-L1054 VanDerWaalsContact O-CG 3.32Å; T1050-L1054 WeakPolarHBondContact O-CG 3.32Å; T1050-L1054 PolarHBondContact O-N 3.13Å; Y1051-L1054 PolarHBondContact O-N 3.23Å; Y1051-L1054 VanDerWaalsContact O-N 3.13Å; L1054-L1056 VanDerWaalsContact C-N 3.33Å; L1054-L1056 PolarHBondContact O-N 3.05Å; L1054-I1057 PolarHBondContact O-N 3.21Å; L1054-R1058 WeakPolarHBondContact O-CB 3.38Å; L1054-R1058 PolarHBondContact O-N 3.16Å; L1054-L1130 HydrophobicContact CD2-CD2 3.75Å; L1054-Y1133 HydrophobicContact CD1-CD1 4.09Å; L1054-Y1133 HydrophobicContact CD1-CD2 3.99Å; L1054-Y1133 HydrophobicContact CD1-CE1 4.18Å; L1054-Y1133 HydrophobicContact CD1-CE2 4.15Å; L1054-Y1133 HydrophobicContact CD1-CG 3.94Å; L1054-Y1133 HydrophobicContact CD2-CD2 4.12Å; L1054-Y1133 HydrophobicContact CD2-CE2 4.21Å; L1054-Y1133 HydrophobicContact CG-CD2 4.45Å; L1054-Y1133 HydrophobicContact CG-CE2 4.42Å; L1054-H1143 HydrophobicContact CD1-CB 3.94Å; L1054-C1146 HydrophobicContact CB-CB 4.07Å; L1054-C1146 PolarHBondContact O-SG 3.48Å; L1054-C1146 VanDerWaalsContact O-SG 3.33Å; L1054-I1150 HydrophobicContact CD2-CD1 4.08Å
1055S84.3Confident84Confident1.8 Ų1.815 Ų151%0.0138%0.075CC..Hα-helixtrans-60-43.5177.7-177.60000111.6D885 Y1051 A1052 I1057 R1058 R1059D885-S1055 WeakPolarHBondContact OD2-CB 3.34Å; D885-S1055 PolarHBondContact OD2-OG 3.05Å; Y1051-S1055 WeakPolarHBondContact O-CB 3.33Å; Y1051-S1055 PolarHBondContact O-N 3.18Å; A1052-S1055 PolarHBondContact O-N 3.2Å; S1055-I1057 PolarHBondContact O-N 3.17Å; S1055-R1058 WeakPolarHBondContact O-CB 3.37Å; S1055-R1058 PolarHBondContact O-N 3.13Å; S1055-R1058 PolarHBondContact OG-NH2 3.43Å; S1055-R1059 VanDerWaalsContact O-CB 3.29Å; S1055-R1059 WeakPolarHBondContact O-CB 3.3Å; S1055-R1059 WeakPolarHBondContact O-CG 3.43Å; S1055-R1059 PolarHBondContact O-N 3.17Å; S1055-R1059 PolarHBondContact OG-NE 3.44Å; S1055-R1059 PolarHBondContact OG-NH2 3.24Å
1056L87.1Confident84.5Confident1 Ų116.1 Ų16.11%0.0058%0.081CC..Hα-helixtrans-60.7-46.7176.317777.7000111.6F884 D885 V888 L1012 V1022 A1052 G1053 L1054 R1059 L1060F884-L1056 HydrophobicContact CB-CD1 3.84Å; F884-L1056 HydrophobicContact CB-CD2 4.44Å; D885-L1056 HydrophobicContact CB-CB 4.35Å; D885-L1056 VanDerWaalsContact OD1-CA 3.28Å; D885-L1056 WeakPolarHBondContact OD1-CA 3.32Å; D885-L1056 PolarHBondContact OD1-N 3.33Å; V888-L1056 HydrophobicContact CB-CD1 4.07Å; V888-L1056 HydrophobicContact CG1-CD1 4.23Å; V888-L1056 HydrophobicContact CG2-CD1 4Å; L1012-L1056 HydrophobicContact CD1-CD1 4.05Å; L1012-L1056 HydrophobicContact CD1-CD2 3.86Å; L1012-L1056 HydrophobicContact CD1-CG 4.17Å; L1012-L1056 HydrophobicContact CD2-CD2 4.16Å; V1022-L1056 HydrophobicContact CG2-CD2 4.47Å; A1052-L1056 VanDerWaalsContact O-CB 3.27Å; A1052-L1056 WeakPolarHBondContact O-CB 3.29Å; A1052-L1056 PolarHBondContact O-N 3.13Å; G1053-L1056 PolarHBondContact O-N 3.34Å; L1054-L1056 VanDerWaalsContact C-N 3.33Å; L1054-L1056 PolarHBondContact O-N 3.05Å; L1056-R1059 PolarHBondContact O-N 2.96Å; L1056-L1060 HydrophobicContact CD1-CD1 4.46Å; L1056-L1060 HydrophobicContact CD2-CD1 3.9Å; L1056-L1060 HydrophobicContact CG-CD1 4.47Å; L1056-L1060 WeakPolarHBondContact O-CG 3.39Å; L1056-L1060 PolarHBondContact O-N 3.25Å; L1056-L1060 VanDerWaalsContact O-N 3.1Å
1057I91Very high84.6Confident4.8 Ų4.816.1 Ų16.13%0.0258%0.081CC..Hα-helixtrans-62.8-46.9176.7-67.5173000110.8V1022 T1023 L1026 G1053 L1054 S1055 R1059 L1060 L1061 L1114 L1130 I1150V1022-I1057 HydrophobicContact CG1-CD1 4.38Å; V1022-I1057 HydrophobicContact CG1-CG1 4.49Å; T1023-I1057 HydrophobicContact CG2-CD1 4.5Å; L1026-I1057 HydrophobicContact CD1-CD1 3.5Å; L1026-I1057 VanDerWaalsContact CD1-CD1 3.47Å; G1053-I1057 WeakPolarHBondContact O-CG1 3.36Å; G1053-I1057 PolarHBondContact O-N 3.21Å; G1053-I1057 VanDerWaalsContact O-N 3.15Å; L1054-I1057 PolarHBondContact O-N 3.21Å; S1055-I1057 PolarHBondContact O-N 3.17Å; I1057-R1059 VanDerWaalsContact C-N 3.28Å; I1057-R1059 PolarHBondContact O-N 3.1Å; I1057-L1060 PolarHBondContact O-N 3.13Å; I1057-L1061 HydrophobicContact CG2-CD1 3.94Å; I1057-L1061 HydrophobicContact CG2-CG 4.46Å; I1057-L1061 WeakPolarHBondContact O-CG 3.37Å; I1057-L1061 PolarHBondContact O-N 3.17Å; I1057-L1114 HydrophobicContact CG2-CD1 4.06Å; I1057-L1130 HydrophobicContact CD1-CD1 4.28Å; I1057-L1130 HydrophobicContact CD1-CD2 4.21Å; I1057-L1130 HydrophobicContact CG2-CD1 4.37Å; I1057-I1150 HydrophobicContact CB-CD1 4.47Å; I1057-I1150 HydrophobicContact CG2-CD1 4.2Å; I1057-I1150 HydrophobicContact CG2-CG1 4.47Å
1058R88.6Confident84.9Confident37 Ų3715.6 Ų15.614%0.148%0.078CC..Hα-helixtrans-55.5-44.8176.4-177.5-16867.386-1.3111.5L1054 S1055 L1061 A1062 S1149 I1150 Y1153L1054-R1058 WeakPolarHBondContact O-CB 3.38Å; L1054-R1058 PolarHBondContact O-N 3.16Å; S1055-R1058 WeakPolarHBondContact O-CB 3.37Å; S1055-R1058 PolarHBondContact O-N 3.13Å; S1055-R1058 PolarHBondContact OG-NH2 3.43Å; R1058-L1061 PolarHBondContact O-N 3.02Å; R1058-A1062 WeakPolarHBondContact O-CB 3.24Å; R1058-A1062 PolarHBondContact O-N 3.09Å; R1058-S1149 WeakPolarHBondContact CD-OG 3.29Å; R1058-S1149 VanDerWaalsContact CG-OG 3.29Å; R1058-S1149 WeakPolarHBondContact CG-OG 3.44Å; R1058-I1150 HydrophobicContact CB-CD1 4.3Å; R1058-I1150 HydrophobicContact CB-CG1 3.87Å; R1058-I1150 HydrophobicContact CG-CG1 4.37Å; R1058-Y1153 HydrophobicContact CG-CD2 4.39Å; R1058-Y1153 HydrophobicContact CG-CE2 4.05Å
1059R84.2Confident85.3Confident24.8 Ų24.816.6 Ų16.69%0.0949%0.088CC..Hα-helixtrans-66.9-38.7-179.3-139.2178.8-86.3-150.110.3112.7D885 H889 L892 S1055 L1056 I1057 A1062 S1063D885-R1059 VanDerWaalsContact CG-NE 3.32Å; D885-R1059 VanDerWaalsContact CG-NH2 3.33Å; D885-R1059 PolarHBondContact O-NH1 3.32Å; D885-R1059 WeakPolarHBondContact OD1-CD 3.43Å; D885-R1059 IonicContact OD1-CZ 3.48Å; D885-R1059 IonicContact OD1-NE 2.88Å; D885-R1059 PolarHBondContact OD1-NE 3.13Å; D885-R1059 IonicContact OD1-NH1 2.67Å; D885-R1059 PolarHBondContact OD1-NH1 2.89Å; D885-R1059 IonicContact OD1-NH2 3.29Å; D885-R1059 PolarHBondContact OD1-NH2 3.46Å; D885-R1059 IonicContact OD2-CZ 2.77Å; D885-R1059 IonicContact OD2-NE 3.23Å; D885-R1059 PolarHBondContact OD2-NE 3.38Å; D885-R1059 IonicContact OD2-NH1 2.76Å; D885-R1059 PolarHBondContact OD2-NH1 3.41Å; D885-R1059 IonicContact OD2-NH2 3.09Å; D885-R1059 PolarHBondContact OD2-NH2 3.08Å; H889-R1059 VanDerWaalsContact CB-NH1 3.32Å; H889-R1059 PolarHBondContact CD2-NH1 3.29Å; H889-R1059 PolarHBondContact CE1-NH1 3.05Å; H889-R1059 VanDerWaalsContact CG-NH1 3.31Å; H889-R1059 PolarHBondContact ND1-NE 3.33Å; H889-R1059 PolarHBondContact ND1-NH1 3.04Å; L892-R1059 HydrophobicContact CD1-CB 4.44Å; L892-R1059 HydrophobicContact CD1-CG 3.73Å; S1055-R1059 VanDerWaalsContact O-CB 3.29Å; S1055-R1059 WeakPolarHBondContact O-CB 3.3Å; S1055-R1059 WeakPolarHBondContact O-CG 3.43Å; S1055-R1059 PolarHBondContact O-N 3.17Å; S1055-R1059 PolarHBondContact OG-NE 3.44Å; S1055-R1059 PolarHBondContact OG-NH2 3.24Å; L1056-R1059 PolarHBondContact O-N 2.96Å; I1057-R1059 VanDerWaalsContact C-N 3.28Å; I1057-R1059 PolarHBondContact O-N 3.1Å; R1059-A1062 PolarHBondContact O-N 3.07Å; R1059-S1063 PolarHBondContact O-N 3.32Å; R1059-S1063 PolarHBondContact O-OG 3.02Å
1060L88.2Confident85.4Confident3.2 Ų3.216.6 Ų16.62%0.0179%0.087CC..Hα-helixtrans-66.7-42174.9-69.6170.4000111.9V888 A1009 L1012 L1056 I1057 A1062 S1063 E1064 L1067 V1110V888-L1060 HydrophobicContact CG1-CD2 3.99Å; A1009-L1060 HydrophobicContact CB-CD2 4.28Å; L1012-L1060 HydrophobicContact CB-CD1 3.6Å; L1012-L1060 HydrophobicContact CD1-CD1 3.82Å; L1012-L1060 HydrophobicContact CD2-CD1 4.34Å; L1012-L1060 HydrophobicContact CG-CD1 4.16Å; L1056-L1060 HydrophobicContact CD1-CD1 4.46Å; L1056-L1060 HydrophobicContact CD2-CD1 3.9Å; L1056-L1060 HydrophobicContact CG-CD1 4.47Å; L1056-L1060 WeakPolarHBondContact O-CG 3.39Å; L1056-L1060 PolarHBondContact O-N 3.25Å; L1056-L1060 VanDerWaalsContact O-N 3.1Å; I1057-L1060 PolarHBondContact O-N 3.13Å; L1060-A1062 VanDerWaalsContact C-N 3.32Å; L1060-A1062 PolarHBondContact O-N 2.95Å; L1060-S1063 CarbonylContact O-C 3.57Å; L1060-S1063 PolarHBondContact O-N 3.26Å; L1060-S1063 VanDerWaalsContact O-N 3.16Å; L1060-S1063 PolarHBondContact O-OG 3.1Å; L1060-E1064 WeakPolarHBondContact O-CA 3.39Å; L1060-E1064 WeakPolarHBondContact O-CB 3.22Å; L1060-E1064 PolarHBondContact O-N 3.18Å; L1060-E1064 VanDerWaalsContact O-N 3.11Å; L1060-L1067 HydrophobicContact CD2-CD1 4.02Å; L1060-L1067 HydrophobicContact CD2-CD2 4.04Å; L1060-V1110 HydrophobicContact CB-CG2 4.1Å
1061L87.3Confident85.2Confident7.6 Ų7.616.7 Ų16.74%0.049%0.088CC..Hα-helixtrans-63.1-40.9175.6-74169.9000111.9I1057 R1058 S1063 E1064 V1110 L1114 I1150 Y1153 L1154I1057-L1061 HydrophobicContact CG2-CD1 3.94Å; I1057-L1061 HydrophobicContact CG2-CG 4.46Å; I1057-L1061 WeakPolarHBondContact O-CG 3.37Å; I1057-L1061 PolarHBondContact O-N 3.17Å; R1058-L1061 PolarHBondContact O-N 3.02Å; L1061-S1063 VanDerWaalsContact C-N 3.26Å; L1061-S1063 PolarHBondContact O-N 3.22Å; L1061-S1063 VanDerWaalsContact O-N 3.15Å; L1061-E1064 WeakPolarHBondContact CD2-OE2 3.37Å; L1061-E1064 VanDerWaalsContact O-CB 3.31Å; L1061-E1064 WeakPolarHBondContact O-CB 3.29Å; L1061-E1064 WeakPolarHBondContact O-CG 3.28Å; L1061-E1064 PolarHBondContact O-N 3.23Å; L1061-V1110 HydrophobicContact CD2-CB 3.91Å; L1061-V1110 HydrophobicContact CD2-CG1 3.87Å; L1061-V1110 HydrophobicContact CG-CB 4.44Å; L1061-V1110 HydrophobicContact CG-CG1 4.09Å; L1061-L1114 HydrophobicContact CD1-CD1 4.1Å; L1061-L1114 HydrophobicContact CD2-CD1 4.42Å; L1061-I1150 HydrophobicContact CD1-CB 4.36Å; L1061-I1150 HydrophobicContact CD1-CG1 4.19Å; L1061-I1150 HydrophobicContact CD1-CG2 3.84Å; L1061-Y1153 HydrophobicContact CB-CD2 4.31Å; L1061-Y1153 HydrophobicContact CB-CG 4.18Å; L1061-L1154 HydrophobicContact CD1-CD2 4.37Å; L1061-L1154 HydrophobicContact CD1-CG 4.37Å; L1061-L1154 HydrophobicContact CD2-CD2 4.12Å
1062A82.2Confident85.2Confident23.4 Ų23.420 Ų2019%0.19310%0.1CC..Hα-helixtrans-62.3-27.5178.600000114R1058 R1059 L1060 Y1153 N1294R1058-A1062 WeakPolarHBondContact O-CB 3.24Å; R1058-A1062 PolarHBondContact O-N 3.09Å; R1059-A1062 PolarHBondContact O-N 3.07Å; L1060-A1062 VanDerWaalsContact C-N 3.32Å; L1060-A1062 PolarHBondContact O-N 2.95Å; A1062-Y1153 VanDerWaalsContact CA-CE1 3.46Å; A1062-Y1153 HydrophobicContact CB-CD1 4.43Å; A1062-Y1153 HydrophobicContact CB-CD2 4.46Å; A1062-Y1153 HydrophobicContact CB-CE1 3.78Å; A1062-Y1153 HydrophobicContact CB-CE2 3.92Å; A1062-Y1153 VanDerWaalsContact CB-CZ 3.47Å; A1062-Y1153 VanDerWaalsContact CB-OH 3.27Å; A1062-Y1153 WeakPolarHBondContact CB-OH 3.32Å; A1062-N1294 WeakPolarHBondContact CB-O 3.4Å
1063S82.1Confident85.1Confident6.8 Ų6.823.9 Ų23.95%0.04812%0.115CC..THydrogen-bonded Turntrans-114.113.5-176.742.40000113.3L892 R1059 L1060 L1061 D1065 I1066 L1067 N1294L892-S1063 VanDerWaalsContact CD1-OG 3.25Å; L892-S1063 WeakPolarHBondContact CD1-OG 3.3Å; L892-S1063 VanDerWaalsContact CD2-OG 3.3Å; L892-S1063 WeakPolarHBondContact CD2-OG 3.35Å; R1059-S1063 PolarHBondContact O-N 3.32Å; R1059-S1063 PolarHBondContact O-OG 3.02Å; L1060-S1063 CarbonylContact O-C 3.57Å; L1060-S1063 PolarHBondContact O-N 3.26Å; L1060-S1063 VanDerWaalsContact O-N 3.16Å; L1060-S1063 PolarHBondContact O-OG 3.1Å; L1061-S1063 VanDerWaalsContact C-N 3.26Å; L1061-S1063 PolarHBondContact O-N 3.22Å; L1061-S1063 VanDerWaalsContact O-N 3.15Å; S1063-D1065 PolarHBondContact O-N 2.91Å; S1063-I1066 PolarHBondContact O-N 3.26Å; S1063-L1067 WeakPolarHBondContact O-CB 3.27Å; S1063-L1067 WeakPolarHBondContact O-CG 3.45Å; S1063-L1067 PolarHBondContact O-N 3.18Å; S1063-L1067 WeakPolarHBondContact OG-CD1 3.26Å; S1063-N1294 VanDerWaalsContact CB-OD1 3.3Å; S1063-N1294 WeakPolarHBondContact CB-OD1 3.41Å
1064E86Confident84.6Confident9.4 Ų9.424.4 Ų24.44%0.04412%0.117CC..Hα-helixtrans-59-46.8-166.5174.8175.9-169.300113L1060 L1061 I1066 L1067 V1068 Y1109 V1110 S1111 S1157L1060-E1064 WeakPolarHBondContact O-CA 3.39Å; L1060-E1064 WeakPolarHBondContact O-CB 3.22Å; L1060-E1064 PolarHBondContact O-N 3.18Å; L1060-E1064 VanDerWaalsContact O-N 3.11Å; L1061-E1064 WeakPolarHBondContact CD2-OE2 3.37Å; L1061-E1064 VanDerWaalsContact O-CB 3.31Å; L1061-E1064 WeakPolarHBondContact O-CB 3.29Å; L1061-E1064 WeakPolarHBondContact O-CG 3.28Å; L1061-E1064 PolarHBondContact O-N 3.23Å; E1064-I1066 PolarHBondContact O-N 3.05Å; E1064-L1067 PolarHBondContact O-N 3.07Å; E1064-V1068 HydrophobicContact CG-CG2 4.36Å; E1064-V1068 VanDerWaalsContact O-CB 3.29Å; E1064-V1068 WeakPolarHBondContact O-CB 3.32Å; E1064-V1068 VanDerWaalsContact O-CG2 3.26Å; E1064-V1068 WeakPolarHBondContact O-CG2 3.32Å; E1064-V1068 PolarHBondContact O-N 3.25Å; E1064-Y1109 HydrophobicContact CB-CD1 4.19Å; E1064-Y1109 VanDerWaalsContact CD-CD1 3.47Å; E1064-Y1109 HydrophobicContact CG-CD1 3.74Å; E1064-Y1109 HydrophobicContact CG-CE1 4.33Å; E1064-Y1109 HydrophobicContact CG-CG 4.43Å; E1064-Y1109 WeakPolarHBondContact OE1-CA 3.38Å; E1064-Y1109 WeakPolarHBondContact OE1-CB 3.35Å; E1064-Y1109 VanDerWaalsContact OE1-CD1 3.31Å; E1064-Y1109 WeakPolarHBondContact OE1-CD1 3.31Å; E1064-V1110 WeakPolarHBondContact OE1-CA 3.31Å; E1064-V1110 PolarHBondContact OE1-N 3.23Å; E1064-V1110 PolarHBondContact OE2-N 2.89Å; E1064-S1111 WeakPolarHBondContact OE1-CB 3.36Å; E1064-S1111 PolarHBondContact OE1-N 2.95Å; E1064-S1111 PolarHBondContact OE1-OG 3.26Å; E1064-S1111 PolarHBondContact OE2-N 3.49Å; E1064-S1111 VanDerWaalsContact OE2-N 3.11Å; E1064-S1111 PolarHBondContact OE2-OG 2.97Å; E1064-S1111 VanDerWaalsContact OE2-OG 3.12Å; E1064-S1157 WeakPolarHBondContact OE1-CB 3.43Å
1065D83.6Confident83.8Confident103.6 Ų103.625.9 Ų25.955%0.55413%0.13SC*.Hα-helixtrans-64.5-45.5-178.9-75.2-39000112.8S1063 L1067 T1069 Y1109S1063-D1065 PolarHBondContact O-N 2.91Å; D1065-L1067 VanDerWaalsContact C-N 3.33Å; D1065-L1067 PolarHBondContact O-N 2.83Å; D1065-T1069 VanDerWaalsContact O-CB 3.3Å; D1065-T1069 WeakPolarHBondContact O-CB 3.34Å; D1065-T1069 VanDerWaalsContact O-CG2 3.26Å; D1065-T1069 WeakPolarHBondContact O-CG2 3.45Å; D1065-T1069 PolarHBondContact O-N 3.22Å; D1065-T1069 PolarHBondContact O-OG1 3.11Å; D1065-Y1109 VanDerWaalsContact OD1-CE1 3.25Å; D1065-Y1109 WeakPolarHBondContact OD1-CE1 3.4Å; D1065-Y1109 PolarHBondContact OD1-OH 3.31Å
1066I82.9Confident83Confident29.4 Ų29.429.8 Ų29.815%0.15115%0.154CC..Hα-helixtrans-64.2-44.8178.9-66.3173.4000109.6L895 N896 T899 W949 S1063 E1064 T1069 F1070 N1293 N1294L895-I1066 HydrophobicContact CD2-CG2 3.72Å; L895-I1066 HydrophobicContact CG-CG2 4.11Å; N896-I1066 VanDerWaalsContact OD1-CD1 3.24Å; N896-I1066 WeakPolarHBondContact OD1-CD1 3.26Å; T899-I1066 HydrophobicContact CG2-CD1 4.33Å; T899-I1066 HydrophobicContact CG2-CG2 4.06Å; W949-I1066 HydrophobicContact CH2-CG2 3.68Å; W949-I1066 HydrophobicContact CZ2-CG1 4.33Å; W949-I1066 HydrophobicContact CZ2-CG2 3.93Å; S1063-I1066 PolarHBondContact O-N 3.26Å; E1064-I1066 PolarHBondContact O-N 3.05Å; I1066-T1069 PolarHBondContact O-N 3.47Å; I1066-T1069 PolarHBondContact O-OG1 3.26Å; I1066-T1069 VanDerWaalsContact O-OG1 3.05Å; I1066-F1070 VanDerWaalsContact O-CB 3.26Å; I1066-F1070 WeakPolarHBondContact O-CB 3.3Å; I1066-F1070 PolarHBondContact O-N 3.08Å; I1066-N1293 HydrophobicContact CD1-CB 3.38Å; I1066-N1294 HydrophobicContact CD1-CB 3.65Å; I1066-N1294 WeakPolarHBondContact CD1-ND2 3.41Å; I1066-N1294 WeakPolarHBondContact CD1-OD1 3.46Å; I1066-N1294 HydrophobicContact CG1-CB 4.11Å; I1066-N1294 WeakPolarHBondContact CG1-ND2 3.34Å; I1066-N1294 WeakPolarHBondContact CG1-OD1 3.39Å
1067L84.7Confident81.7Confident0.4 Ų0.432.6 Ų32.60%0.00217%0.168CC..Hα-helixtrans-66.4-48.9-178.2-160.190.6000111.5F891 L892 L895 A1009 L1013 L1060 S1063 E1064 D1065 T1069 F1070 V1071F891-L1067 HydrophobicContact CE1-CD1 3.57Å; F891-L1067 HydrophobicContact CE1-CD2 3.77Å; F891-L1067 HydrophobicContact CZ-CD1 4.28Å; L892-L1067 HydrophobicContact CD2-CD1 4.07Å; L892-L1067 HydrophobicContact CD2-CD2 3.69Å; L892-L1067 HydrophobicContact CD2-CG 3.86Å; L895-L1067 HydrophobicContact CD2-CD1 4.38Å; A1009-L1067 HydrophobicContact CB-CD1 4.12Å; A1009-L1067 HydrophobicContact CB-CD2 4.19Å; L1013-L1067 HydrophobicContact CD1-CB 4.03Å; L1013-L1067 HydrophobicContact CD1-CD1 4.33Å; L1013-L1067 HydrophobicContact CD1-CD2 3.46Å; L1013-L1067 VanDerWaalsContact CD1-CD2 3.48Å; L1013-L1067 HydrophobicContact CD1-CG 3.67Å; L1013-L1067 HydrophobicContact CD2-CD2 3.93Å; L1013-L1067 HydrophobicContact CG-CD2 3.77Å; L1013-L1067 VanDerWaalsContact CG-CD2 3.42Å; L1013-L1067 HydrophobicContact CG-CG 4.48Å; L1060-L1067 HydrophobicContact CD2-CD1 4.02Å; L1060-L1067 HydrophobicContact CD2-CD2 4.04Å; S1063-L1067 WeakPolarHBondContact O-CB 3.27Å; S1063-L1067 WeakPolarHBondContact O-CG 3.45Å; S1063-L1067 PolarHBondContact O-N 3.18Å; S1063-L1067 WeakPolarHBondContact OG-CD1 3.26Å; E1064-L1067 PolarHBondContact O-N 3.07Å; D1065-L1067 VanDerWaalsContact C-N 3.33Å; D1065-L1067 PolarHBondContact O-N 2.83Å; L1067-T1069 VanDerWaalsContact C-N 3.35Å; L1067-T1069 PolarHBondContact O-N 3.09Å; L1067-F1070 PolarHBondContact O-N 3.22Å; L1067-V1071 HydrophobicContact CD1-CG2 4.38Å; L1067-V1071 WeakPolarHBondContact O-CB 3.27Å; L1067-V1071 VanDerWaalsContact O-CG2 3.26Å; L1067-V1071 WeakPolarHBondContact O-CG2 3.34Å; L1067-V1071 PolarHBondContact O-N 3.14Å
1068V86Confident79.8Confident0 Ų038.1 Ų38.10%020%0.197CC..Hα-helixtrans-64.5-42179.6171.10000110.9L1013 E1064 F1070 V1071 R1072 P1107 Y1109L1013-V1068 HydrophobicContact CD1-CG2 4.26Å; L1013-V1068 HydrophobicContact CD2-CG2 4.03Å; E1064-V1068 HydrophobicContact CG-CG2 4.36Å; E1064-V1068 VanDerWaalsContact O-CB 3.29Å; E1064-V1068 WeakPolarHBondContact O-CB 3.32Å; E1064-V1068 VanDerWaalsContact O-CG2 3.26Å; E1064-V1068 WeakPolarHBondContact O-CG2 3.32Å; E1064-V1068 PolarHBondContact O-N 3.25Å; V1068-F1070 VanDerWaalsContact C-N 3.34Å; V1068-F1070 PolarHBondContact O-N 3.43Å; V1068-V1071 PolarHBondContact O-N 3.05Å; V1068-R1072 HydrophobicContact CG1-CG 4.31Å; V1068-R1072 VanDerWaalsContact CG1-CZ 3.43Å; V1068-R1072 VanDerWaalsContact O-CB 3.31Å; V1068-R1072 WeakPolarHBondContact O-CB 3.37Å; V1068-R1072 VanDerWaalsContact O-CG 3.26Å; V1068-R1072 WeakPolarHBondContact O-CG 3.34Å; V1068-R1072 PolarHBondContact O-N 3.23Å; V1068-P1107 HydrophobicContact CG1-CG 4.22Å; V1068-Y1109 HydrophobicContact CB-CE1 4.28Å; V1068-Y1109 HydrophobicContact CB-CE2 4.48Å; V1068-Y1109 HydrophobicContact CG1-CD2 4.4Å; V1068-Y1109 HydrophobicContact CG1-CE1 4.3Å; V1068-Y1109 HydrophobicContact CG1-CE2 3.96Å; V1068-Y1109 HydrophobicContact CG2-CD1 4.19Å; V1068-Y1109 HydrophobicContact CG2-CE1 4.23Å; V1068-Y1109 HydrophobicContact CG2-CG 4.38Å
1069T83.8Confident77.5Confident56.4 Ų56.443.2 Ų43.235%0.34622%0.222SC..Hα-helixtrans-61.9-45.5176.2-20.40000111.3W949 A950 D1065 I1066 L1067 R1072 R1073W949-T1069 HydrophobicContact CZ2-CG2 4.18Å; A950-T1069 HydrophobicContact CB-CG2 4.41Å; D1065-T1069 VanDerWaalsContact O-CB 3.3Å; D1065-T1069 WeakPolarHBondContact O-CB 3.34Å; D1065-T1069 VanDerWaalsContact O-CG2 3.26Å; D1065-T1069 WeakPolarHBondContact O-CG2 3.45Å; D1065-T1069 PolarHBondContact O-N 3.22Å; D1065-T1069 PolarHBondContact O-OG1 3.11Å; I1066-T1069 PolarHBondContact O-N 3.47Å; I1066-T1069 PolarHBondContact O-OG1 3.26Å; I1066-T1069 VanDerWaalsContact O-OG1 3.05Å; L1067-T1069 VanDerWaalsContact C-N 3.35Å; L1067-T1069 PolarHBondContact O-N 3.09Å; T1069-R1072 PolarHBondContact O-N 2.99Å; T1069-R1073 WeakPolarHBondContact O-CB 3.39Å; T1069-R1073 WeakPolarHBondContact O-CG 3.13Å; T1069-R1073 PolarHBondContact O-N 3.25Å
1070F84.7Confident75.1Confident0 Ų046.9 Ų46.90%025%0.25CC..Hα-helixtrans-62.3-50.3178.1-175.9-118000112.2F891 L895 W949 A950 L953 L954 W999 P1000 Y1006 I1066 L1067 V1068 R1072 R1073 I1074F891-F1070 HydrophobicContact CE2-CE1 4.43Å; F891-F1070 HydrophobicContact CZ-CD1 4.35Å; F891-F1070 HydrophobicContact CZ-CE1 4.2Å; L895-F1070 HydrophobicContact CD1-CB 4.39Å; L895-F1070 HydrophobicContact CD1-CD1 3.72Å; L895-F1070 HydrophobicContact CD1-CD2 4.11Å; L895-F1070 HydrophobicContact CD1-CE1 3.93Å; L895-F1070 HydrophobicContact CD1-CE2 4.26Å; L895-F1070 HydrophobicContact CD1-CG 3.81Å; L895-F1070 HydrophobicContact CD1-CZ 4.25Å; L895-F1070 HydrophobicContact CD2-CB 4.48Å; L895-F1070 HydrophobicContact CD2-CD1 4.3Å; L895-F1070 HydrophobicContact CD2-CG 4.48Å; W949-F1070 HydrophobicContact CH2-CB 4.16Å; W949-F1070 HydrophobicContact CH2-CD2 4.36Å; W949-F1070 HydrophobicContact CZ3-CD2 4.32Å; A950-F1070 HydrophobicContact CB-CD2 4.42Å; L953-F1070 HydrophobicContact CD1-CE2 4.48Å; L953-F1070 HydrophobicContact CD2-CE2 4.05Å; L953-F1070 HydrophobicContact CD2-CZ 4.38Å; L954-F1070 HydrophobicContact CD2-CE2 4.24Å; L954-F1070 HydrophobicContact CG-CE2 4.4Å; W999-F1070 HydrophobicContact CE3-CZ 4.45Å; W999-F1070 AromaticContact CH2-CE1 3.63Å; W999-F1070 HydrophobicContact CH2-CE1 3.72Å; W999-F1070 AromaticContact CH2-CE2 3.89Å; W999-F1070 HydrophobicContact CH2-CE2 3.89Å; W999-F1070 AromaticContact CH2-CZ 3.18Å; W999-F1070 HydrophobicContact CH2-CZ 3.18Å; W999-F1070 HydrophobicContact CZ2-CE1 4.19Å; W999-F1070 HydrophobicContact CZ2-CZ 4.12Å; W999-F1070 HydrophobicContact CZ3-CE1 4.26Å; W999-F1070 AromaticContact CZ3-CE2 3.95Å; W999-F1070 HydrophobicContact CZ3-CE2 4Å; W999-F1070 AromaticContact CZ3-CZ 3.36Å; W999-F1070 HydrophobicContact CZ3-CZ 3.36Å; W999-F1070 VanDerWaalsContact CZ3-CZ 3.45Å; P1000-F1070 HydrophobicContact CB-CE1 4.03Å; P1000-F1070 HydrophobicContact CB-CZ 4.06Å; P1000-F1070 HydrophobicContact CG-CE1 4.16Å; P1000-F1070 HydrophobicContact CG-CZ 3.92Å; Y1006-F1070 HydrophobicContact CD2-CE1 4.37Å; Y1006-F1070 HydrophobicContact CE2-CD1 4.43Å; Y1006-F1070 HydrophobicContact CE2-CE1 4.28Å; I1066-F1070 VanDerWaalsContact O-CB 3.26Å; I1066-F1070 WeakPolarHBondContact O-CB 3.3Å; I1066-F1070 PolarHBondContact O-N 3.08Å; L1067-F1070 PolarHBondContact O-N 3.22Å; V1068-F1070 VanDerWaalsContact C-N 3.34Å; V1068-F1070 PolarHBondContact O-N 3.43Å; F1070-R1072 VanDerWaalsContact C-N 3.35Å; F1070-R1072 PolarHBondContact O-N 3.28Å; F1070-R1073 PolarHBondContact O-N 3.18Å; F1070-R1073 VanDerWaalsContact O-N 3.16Å; F1070-I1074 HydrophobicContact CD1-CD1 3.8Å; F1070-I1074 HydrophobicContact CD2-CD1 4.42Å; F1070-I1074 HydrophobicContact CE1-CD1 3.44Å; F1070-I1074 VanDerWaalsContact CE1-CD1 3.45Å; F1070-I1074 HydrophobicContact CE1-CG1 4.49Å; F1070-I1074 HydrophobicContact CE2-CD1 4.09Å; F1070-I1074 HydrophobicContact CE2-CG1 4.38Å; F1070-I1074 HydrophobicContact CG-CD1 4.29Å; F1070-I1074 HydrophobicContact CZ-CD1 3.58Å; F1070-I1074 HydrophobicContact CZ-CG1 4.33Å; F1070-I1074 WeakPolarHBondContact O-CG1 3.35Å; F1070-I1074 PolarHBondContact O-N 3.12Å
1071V83.2Confident72.3Confident4.2 Ų4.258.6 Ų58.63%0.02529%0.293CS..Hα-helixtrans-63.2-41.5179.5175.50000111.4Y1006 T1010 L1013 L1067 V1068 R1073 I1074 A1075 P1107Y1006-V1071 HydrophobicContact CE2-CG2 4.04Å; T1010-V1071 HydrophobicContact CG2-CG1 4.1Å; T1010-V1071 HydrophobicContact CG2-CG2 3.74Å; L1013-V1071 HydrophobicContact CD1-CB 4.48Å; L1013-V1071 HydrophobicContact CD1-CG2 4.18Å; L1067-V1071 HydrophobicContact CD1-CG2 4.38Å; L1067-V1071 WeakPolarHBondContact O-CB 3.27Å; L1067-V1071 VanDerWaalsContact O-CG2 3.26Å; L1067-V1071 WeakPolarHBondContact O-CG2 3.34Å; L1067-V1071 PolarHBondContact O-N 3.14Å; V1068-V1071 PolarHBondContact O-N 3.05Å; V1071-R1073 VanDerWaalsContact C-N 3.33Å; V1071-R1073 PolarHBondContact O-N 3.21Å; V1071-I1074 PolarHBondContact O-N 3.2Å; V1071-A1075 WeakPolarHBondContact O-CB 3.35Å; V1071-A1075 PolarHBondContact O-N 3.19Å; V1071-P1107 HydrophobicContact CB-CB 4.37Å; V1071-P1107 HydrophobicContact CB-CG 4.11Å; V1071-P1107 HydrophobicContact CG1-CB 3.96Å; V1071-P1107 HydrophobicContact CG1-CG 3.8Å
1072R82.3Confident69.6Low103.4 Ų103.466.1 Ų66.139%0.3933%0.332SS..Hα-helixtrans-62-40175.2-90.5-178.8-163.9165.36.8112.1V1068 T1069 F1070 A1075 T1076 P1107 Y1109V1068-R1072 HydrophobicContact CG1-CG 4.31Å; V1068-R1072 VanDerWaalsContact CG1-CZ 3.43Å; V1068-R1072 VanDerWaalsContact O-CB 3.31Å; V1068-R1072 WeakPolarHBondContact O-CB 3.37Å; V1068-R1072 VanDerWaalsContact O-CG 3.26Å; V1068-R1072 WeakPolarHBondContact O-CG 3.34Å; V1068-R1072 PolarHBondContact O-N 3.23Å; T1069-R1072 PolarHBondContact O-N 2.99Å; F1070-R1072 VanDerWaalsContact C-N 3.35Å; F1070-R1072 PolarHBondContact O-N 3.28Å; R1072-A1075 PolarHBondContact O-N 3.26Å; R1072-T1076 WeakPolarHBondContact O-CG2 3.32Å; R1072-T1076 PolarHBondContact O-N 3.25Å; R1072-T1076 PolarHBondContact O-OG1 3.05Å; R1072-P1107 HydrophobicContact CB-CG 4.48Å; R1072-P1107 HydrophobicContact CG-CG 3.54Å; R1072-Y1109 PolarHBondContact NH1-OH 3.39Å
1073R79.3Confident67.2Low84 Ų8468 Ų6832%0.31735%0.354SS..Hα-helixtrans-70-37.1179.2-144.252.6164.6176.6-0.9112.1D948 A950 S951 L954 T1069 F1070 V1071 A1075 T1076 N1077D948-R1073 VanDerWaalsContact CG-NH2 3.28Å; D948-R1073 IonicContact OD1-NH2 3.46Å; D948-R1073 PolarHBondContact OD1-NH2 3.08Å; D948-R1073 IonicContact OD2-CZ 3.41Å; D948-R1073 IonicContact OD2-NE 2.7Å; D948-R1073 PolarHBondContact OD2-NE 2.93Å; D948-R1073 IonicContact OD2-NH1 3.31Å; D948-R1073 PolarHBondContact OD2-NH1 2.85Å; D948-R1073 IonicContact OD2-NH2 3.53Å; D948-R1073 PolarHBondContact OD2-NH2 3.26Å; A950-R1073 HydrophobicContact CB-CB 4.03Å; A950-R1073 HydrophobicContact CB-CG 4.17Å; S951-R1073 WeakPolarHBondContact OG-CD 3.39Å; S951-R1073 PolarHBondContact OG-NE 3.11Å; S951-R1073 PolarHBondContact OG-NH1 3.04Å; S951-R1073 PolarHBondContact OG-NH2 3.09Å; L954-R1073 HydrophobicContact CD1-CB 4.1Å; L954-R1073 HydrophobicContact CD1-CG 3.76Å; T1069-R1073 WeakPolarHBondContact O-CB 3.39Å; T1069-R1073 WeakPolarHBondContact O-CG 3.13Å; T1069-R1073 PolarHBondContact O-N 3.25Å; F1070-R1073 PolarHBondContact O-N 3.18Å; F1070-R1073 VanDerWaalsContact O-N 3.16Å; V1071-R1073 VanDerWaalsContact C-N 3.33Å; V1071-R1073 PolarHBondContact O-N 3.21Å; R1073-A1075 VanDerWaalsContact C-N 3.34Å; R1073-A1075 PolarHBondContact O-N 3.42Å; R1073-T1076 WeakPolarHBondContact CA-OG1 3.37Å; R1073-T1076 PolarHBondContact O-N 3.27Å; R1073-T1076 PolarHBondContact O-OG1 3.25Å; R1073-N1077 VanDerWaalsContact O-CB 3.3Å; R1073-N1077 WeakPolarHBondContact O-CB 3.42Å; R1073-N1077 PolarHBondContact O-N 3.2Å
1074I76.5Confident64.7Low10.4 Ų10.473 Ų735%0.05339%0.389CS..Hα-helixtrans-59-47.8170.4-69.2166.1000110.9L954 P1000 Y1001 Y1006 F1070 V1071 T1076 N1077 I1078L954-I1074 HydrophobicContact CD1-CB 4.49Å; L954-I1074 HydrophobicContact CD1-CG1 3.93Å; L954-I1074 HydrophobicContact CD2-CD1 4.46Å; L954-I1074 HydrophobicContact CD2-CG1 3.75Å; L954-I1074 HydrophobicContact CG-CG1 4.45Å; P1000-I1074 HydrophobicContact CG-CD1 3.73Å; Y1001-I1074 HydrophobicContact CE1-CG2 3.99Å; Y1001-I1074 VanDerWaalsContact OH-CG2 3.26Å; Y1001-I1074 WeakPolarHBondContact OH-CG2 3.46Å; Y1006-I1074 HydrophobicContact CE2-CD1 3.69Å; F1070-I1074 HydrophobicContact CD1-CD1 3.8Å; F1070-I1074 HydrophobicContact CD2-CD1 4.42Å; F1070-I1074 HydrophobicContact CE1-CD1 3.44Å; F1070-I1074 VanDerWaalsContact CE1-CD1 3.45Å; F1070-I1074 HydrophobicContact CE1-CG1 4.49Å; F1070-I1074 HydrophobicContact CE2-CD1 4.09Å; F1070-I1074 HydrophobicContact CE2-CG1 4.38Å; F1070-I1074 HydrophobicContact CG-CD1 4.29Å; F1070-I1074 HydrophobicContact CZ-CD1 3.58Å; F1070-I1074 HydrophobicContact CZ-CG1 4.33Å; F1070-I1074 WeakPolarHBondContact O-CG1 3.35Å; F1070-I1074 PolarHBondContact O-N 3.12Å; V1071-I1074 PolarHBondContact O-N 3.2Å; I1074-T1076 VanDerWaalsContact C-N 3.3Å; I1074-T1076 PolarHBondContact O-N 3.05Å; I1074-N1077 PolarHBondContact O-N 2.93Å; I1074-I1078 WeakPolarHBondContact O-CG1 3.42Å
1075A71.6Confident62Low32.4 Ų32.478 Ų7827%0.26842%0.42SS..Hα-helixtrans-64.8-30.4-178.300000113.2V1071 R1072 R1073V1071-A1075 WeakPolarHBondContact O-CB 3.35Å; V1071-A1075 PolarHBondContact O-N 3.19Å; R1072-A1075 PolarHBondContact O-N 3.26Å; R1073-A1075 VanDerWaalsContact C-N 3.34Å; R1073-A1075 PolarHBondContact O-N 3.42Å
1076T68.7Low59.5Low83.8 Ų83.881.4 Ų81.451%0.51443%0.432SS..Hα-helixtrans-89.7-24.5-177.950.60000114.5R1072 R1073 I1074 I1078 Q1079R1072-T1076 WeakPolarHBondContact O-CG2 3.32Å; R1072-T1076 PolarHBondContact O-N 3.25Å; R1072-T1076 PolarHBondContact O-OG1 3.05Å; R1073-T1076 WeakPolarHBondContact CA-OG1 3.37Å; R1073-T1076 PolarHBondContact O-N 3.27Å; R1073-T1076 PolarHBondContact O-OG1 3.25Å; I1074-T1076 VanDerWaalsContact C-N 3.3Å; I1074-T1076 PolarHBondContact O-N 3.05Å; T1076-I1078 VanDerWaalsContact C-N 3.31Å; T1076-I1078 PolarHBondContact O-N 3.18Å; T1076-Q1079 PolarHBondContact O-N 3.44Å
1077N59.7Low57Low58.8 Ų58.885.5 Ų85.531%0.31446%0.463SS..SBendtrans-74.420.6-178.2-115-10.7000113.6L954 R1073 I1074 Q1079L954-N1077 HydrophobicContact CD1-CB 4.48Å; R1073-N1077 VanDerWaalsContact O-CB 3.3Å; R1073-N1077 WeakPolarHBondContact O-CB 3.42Å; R1073-N1077 PolarHBondContact O-N 3.2Å; I1074-N1077 PolarHBondContact O-N 2.93Å; N1077-Q1079 VanDerWaalsContact C-N 3.34Å; N1077-Q1079 PolarHBondContact O-N 3.32Å
1078I51Low54.4Low120.4 Ų120.490.6 Ų90.662%0.61750%0.499SS*.  trans-8070.6172.7-55.4172.2000109.2I1074 T1076 P1080I1074-I1078 WeakPolarHBondContact O-CG1 3.42Å; T1076-I1078 VanDerWaalsContact C-N 3.31Å; T1076-I1078 PolarHBondContact O-N 3.18Å; I1078-P1080 WeakPolarHBondContact O-CD 3.45Å
1079Q40.2Very low51.7Low145 Ų14595.6 Ų95.668%0.67853%0.534SS*.  trans-55.3119.5173-84.9-179-28.700114.4T1076 N1077 R1081 L1095T1076-Q1079 PolarHBondContact O-N 3.44Å; N1077-Q1079 VanDerWaalsContact C-N 3.34Å; N1077-Q1079 PolarHBondContact O-N 3.32Å; Q1079-R1081 PolarHBondContact O-N 3.01Å; Q1079-R1081 VanDerWaalsContact O-N 3.16Å; Q1079-L1095 HydrophobicContact CG-CD1 4Å; Q1079-L1095 VanDerWaalsContact NE2-CD1 3.28Å
1080P33.1Very low49Very low103.2 Ų103.2100.8 Ų100.867%0.6756%0.56SS**  trans-72120.8171.829.2-30.4000109.6I1078 I1082I1078-P1080 WeakPolarHBondContact O-CD 3.45Å; P1080-I1082 PolarHBondContact O-N 2.99Å; P1080-I1082 VanDerWaalsContact O-N 3.16Å
1081R30.1Very low46.4Very low247.4 Ų247.4107.4 Ų107.493%0.93459%0.594SS**  trans-58.899.1174.2-109.6-178.3179.7179.2-0110.3Q1079 G1083Q1079-R1081 PolarHBondContact O-N 3.01Å; Q1079-R1081 VanDerWaalsContact O-N 3.16Å; R1081-G1083 VanDerWaalsContact C-N 3.3Å; R1081-G1083 PolarHBondContact O-N 3.09Å; R1081-G1083 VanDerWaalsContact O-N 3.15Å
1082I30.2Very low43.7Very low164.8 Ų164.8112.1 Ų112.185%0.84563%0.627SS**  trans-80107.1167.1-60.4171.8000107.5P1080P1080-I1082 PolarHBondContact O-N 2.99Å; P1080-I1082 VanDerWaalsContact O-N 3.16Å
1083G31.5Very low41.1Very low65 Ų65113.5 Ų113.567%0.6764%0.641SS**  trans-113.4117.9170.700000113.5R1081 V1085R1081-G1083 VanDerWaalsContact C-N 3.3Å; R1081-G1083 PolarHBondContact O-N 3.09Å; R1081-G1083 VanDerWaalsContact O-N 3.15Å; G1083-V1085 PolarHBondContact O-N 2.92Å
1084S29.9Very low38.7Very low111.2 Ų111.2114.3 Ų114.378%0.77866%0.656SS**  trans-9.3129.8160.9-1650000117H1086S1084-H1086 PolarHBondContact O-N 3.07Å; S1084-H1086 VanDerWaalsContact O-N 3.08Å
1085V30.1Very low36.6Very low114.2 Ų114.2119 Ų11969%0.69268%0.681SS**  trans5.299.6146.4-174.40000114.1G1083G1083-V1085 PolarHBondContact O-N 2.92Å
1086H30.1Very low34.6Very low175.4 Ų175.4121.8 Ų121.881%0.81270%0.696SS**  trans-139.5107.7138.3-75.5-50.6000111.4S1084 S1088S1084-H1086 PolarHBondContact O-N 3.07Å; S1084-H1086 VanDerWaalsContact O-N 3.08Å; H1086-S1088 VanDerWaalsContact C-N 3.28Å; H1086-S1088 PolarHBondContact O-N 3.07Å; H1086-S1088 VanDerWaalsContact O-N 3.09Å
1087S30.4Very low33.1Very low115 Ų115123.6 Ų123.680%0.80470%0.703SS**  trans-43.896.5169.6-42.70000113.6
1088S29.8Very low32Very low108.4 Ų108.4124.7 Ų124.776%0.75871%0.712SS**SBendtrans170111.5133.551.80000110.9H1086H1086-S1088 VanDerWaalsContact C-N 3.28Å; H1086-S1088 PolarHBondContact O-N 3.07Å; H1086-S1088 VanDerWaalsContact O-N 3.09Å
1089S30.4Very low31.2Very low105 Ų105122.3 Ų122.373%0.73470%0.704SS**  trans102.880.6165.862.50000113.9I1091S1089-I1091 PolarHBondContact O-N 3.12Å; S1089-I1091 VanDerWaalsContact O-N 3.1Å
1090N27.2Very low31.2Very low164.8 Ų164.8120.8 Ų120.888%0.88171%0.709SS**  trans-73.287.3164.8-71.1-18.4000110S1092N1090-S1092 VanDerWaalsContact C-N 3.3Å; N1090-S1092 PolarHBondContact O-N 3.15Å
1091I29.4Very low31.5Very low139.6 Ų139.6121.5 Ų121.572%0.71670%0.702SS**  trans-110.985.7158-62.5169.3000106.1S1089 I1093S1089-I1091 PolarHBondContact O-N 3.12Å; S1089-I1091 VanDerWaalsContact O-N 3.1Å; I1091-I1093 VanDerWaalsContact C-N 3.33Å; I1091-I1093 HydrophobicContact CG2-CD1 4.13Å; I1091-I1093 HydrophobicContact CG2-CG1 4.05Å; I1091-I1093 PolarHBondContact O-N 2.99Å; I1091-I1093 VanDerWaalsContact O-N 3.11Å
1092S27.1Very low32.1Very low101.8 Ų101.8112.7 Ų112.771%0.71269%0.688SS**  trans-66.3109157.951.40000106.5N1090 P1094N1090-S1092 VanDerWaalsContact C-N 3.3Å; N1090-S1092 PolarHBondContact O-N 3.15Å; S1092-P1094 VanDerWaalsContact O-CD 3.26Å; S1092-P1094 WeakPolarHBondContact O-CD 3.39Å; S1092-P1094 VanDerWaalsContact O-N 3.12Å
1093I27.5Very low33Very low133.2 Ų133.2111.3 Ų111.368%0.68368%0.682SS**  trans-78.7101.5169.2-56.3171.4000105.4I1091 L1095I1091-I1093 VanDerWaalsContact C-N 3.33Å; I1091-I1093 HydrophobicContact CG2-CD1 4.13Å; I1091-I1093 HydrophobicContact CG2-CG1 4.05Å; I1091-I1093 PolarHBondContact O-N 2.99Å; I1091-I1093 VanDerWaalsContact O-N 3.11Å; I1093-L1095 PolarHBondContact O-N 3.09Å
1094P28.8Very low34Very low99.8 Ų99.8113.7 Ų113.765%0.64868%0.683SS**  trans-67.213316911.50.1000106.1S1092 P1096S1092-P1094 VanDerWaalsContact O-CD 3.26Å; S1092-P1094 WeakPolarHBondContact O-CD 3.39Å; S1092-P1094 VanDerWaalsContact O-N 3.12Å; P1094-P1096 VanDerWaalsContact O-CD 3.27Å; P1094-P1096 WeakPolarHBondContact O-CD 3.42Å; P1094-P1096 VanDerWaalsContact O-N 3.14Å
1095L31.3Very low35.5Very low109.8 Ų109.8111.3 Ų111.358%0.57566%0.661SS**  trans-53.5125.2168.2-90.890.1000107.8F958 Q1079 I1093 N1097F958-L1095 HydrophobicContact CD1-CD2 4.13Å; F958-L1095 HydrophobicContact CE1-CD1 3.99Å; F958-L1095 HydrophobicContact CE1-CD2 4.02Å; F958-L1095 HydrophobicContact CE1-CG 4.38Å; Q1079-L1095 HydrophobicContact CG-CD1 4Å; Q1079-L1095 VanDerWaalsContact NE2-CD1 3.28Å; I1093-L1095 PolarHBondContact O-N 3.09Å; L1095-N1097 PolarHBondContact O-N 3.11Å
1096P30.1Very low37.4Very low90.4 Ų90.4112.5 Ų112.559%0.58766%0.663SS**SBendtrans-69119.3-172.618.4-20.9000109.8P1094 V1098P1094-P1096 VanDerWaalsContact O-CD 3.27Å; P1094-P1096 WeakPolarHBondContact O-CD 3.42Å; P1094-P1096 VanDerWaalsContact O-N 3.14Å; P1096-V1098 PolarHBondContact O-N 3.19Å
1097N36.4Very low39.8Very low123.4 Ų123.4104.3 Ų104.366%0.6663%0.626SS**  trans56.353.7150.9-57.5-17.8000116.8S842 L1095 P1099S842-N1097 VanDerWaalsContact CB-ND2 3.34Å; S842-N1097 WeakPolarHBondContact CB-ND2 3.35Å; L1095-N1097 PolarHBondContact O-N 3.11Å; N1097-P1099 WeakPolarHBondContact O-CD 3.33Å
1098V36.7Very low42.4Very low80.8 Ų80.8101.2 Ų101.249%0.4960%0.602SS.*  trans-63.4123153.6-174.50000106.5Y1001 P1096 S1100Y1001-V1098 HydrophobicContact CD1-CG1 4.41Å; P1096-V1098 PolarHBondContact O-N 3.19Å; V1098-S1100 PolarHBondContact O-N 2.95Å; V1098-S1100 VanDerWaalsContact O-N 3.15Å
1099P35.1Very low45.1Very low70.2 Ų70.298.8 Ų98.846%0.45658%0.576SS.*  trans-56.6131176.523.4-31.7000108.4L848 N1097 F1101L848-P1099 HydrophobicContact CD2-CG 4.44Å; N1097-P1099 WeakPolarHBondContact O-CD 3.33Å; P1099-F1101 HydrophobicContact CB-CD2 4.29Å; P1099-F1101 HydrophobicContact CB-CE2 4.18Å; P1099-F1101 HydrophobicContact CG-CD2 4.01Å; P1099-F1101 HydrophobicContact CG-CE2 4.13Å; P1099-F1101 WeakPolarHBondContact O-CD2 3.36Å; P1099-F1101 PolarHBondContact O-N 3.01Å
1100S39.5Very low47.8Very low112.4 Ų112.493.8 Ų93.879%0.78654%0.541SS*.SBendtrans-3622.4-173.5-33.40000118.4V1098 G1102V1098-S1100 PolarHBondContact O-N 2.95Å; V1098-S1100 VanDerWaalsContact O-N 3.15Å; S1100-G1102 PolarHBondContact O-N 3.2Å
1101F39.9Very low50.6Low118.8 Ų118.886.3 Ų86.352%0.52150%0.502SS..  trans-77.210168.3-72.2-76.1000112.8P1099 L1103P1099-F1101 HydrophobicContact CB-CD2 4.29Å; P1099-F1101 HydrophobicContact CB-CE2 4.18Å; P1099-F1101 HydrophobicContact CG-CD2 4.01Å; P1099-F1101 HydrophobicContact CG-CE2 4.13Å; P1099-F1101 WeakPolarHBondContact O-CD2 3.36Å; P1099-F1101 PolarHBondContact O-N 3.01Å; F1101-L1103 PolarHBondContact O-N 3.14Å; F1101-L1103 VanDerWaalsContact O-N 3.14Å
1102G42.4Very low53.4Low62.2 Ų62.287.9 Ų87.964%0.64150%0.499SS*.  trans-72.26.616900000114.6S1100 T1104S1100-G1102 PolarHBondContact O-N 3.2Å; G1102-T1104 PolarHBondContact O-N 2.98Å; G1102-T1104 VanDerWaalsContact O-N 3.15Å
1103L48.8Very low56.3Low136.8 Ų136.883.5 Ų83.572%0.71647%0.467SS*.SBendtrans-66.9117.1162.3-76154.2000107.5F1101 I1105F1101-L1103 PolarHBondContact O-N 3.14Å; F1101-L1103 VanDerWaalsContact O-N 3.14Å; L1103-I1105 VanDerWaalsContact C-N 3.29Å; L1103-I1105 WeakPolarHBondContact O-CG1 3.26Å; L1103-I1105 PolarHBondContact O-N 3Å
1104T53.4Low59.2Low114.4 Ų114.477.2 Ų77.270%0.70244%0.435SS*.  trans-40.985.7170.245.10000110.9G1102 L1106G1102-T1104 PolarHBondContact O-N 2.98Å; G1102-T1104 VanDerWaalsContact O-N 3.15Å; T1104-L1106 PolarHBondContact O-N 3.36Å
1105I61.3Low61.8Low60.2 Ų60.274.9 Ų74.931%0.30942%0.416SS..  trans-71.5113.1170.6-62.3172.7000105.2T1014 L1103 P1107T1014-I1105 HydrophobicContact CG2-CG2 3.52Å; T1014-I1105 VanDerWaalsContact CG2-CG2 3.45Å; L1103-I1105 VanDerWaalsContact C-N 3.29Å; L1103-I1105 WeakPolarHBondContact O-CG1 3.26Å; L1103-I1105 PolarHBondContact O-N 3Å; I1105-P1107 WeakPolarHBondContact O-CD 3.44Å
1106L69.9Low64.4Low139.6 Ų139.671.2 Ų71.273%0.73140%0.4SS*.  trans-84.8101.8171.4-160.3112.9000106.9T1104 V1108T1104-L1106 PolarHBondContact O-N 3.36Å; L1106-V1108 PolarHBondContact O-N 3.06Å
1107P80.1Confident66.9Low4.4 Ų4.471.5 Ų71.53%0.02940%0.4CS..PPolyproline II helixtrans-65.5135-177.728.7-36.4000109.9L1013 V1068 V1071 R1072 I1105L1013-P1107 HydrophobicContact CB-CB 4.13Å; L1013-P1107 HydrophobicContact CD1-CB 3.99Å; V1068-P1107 HydrophobicContact CG1-CG 4.22Å; V1071-P1107 HydrophobicContact CB-CB 4.37Å; V1071-P1107 HydrophobicContact CB-CG 4.11Å; V1071-P1107 HydrophobicContact CG1-CB 3.96Å; V1071-P1107 HydrophobicContact CG1-CG 3.8Å; R1072-P1107 HydrophobicContact CB-CG 4.48Å; R1072-P1107 HydrophobicContact CG-CG 3.54Å; I1105-P1107 WeakPolarHBondContact O-CD 3.44Å
1108V84.6Confident69Low49.4 Ų49.466 Ų6630%0.29937%0.371SS..PPolyproline II helixtrans-100.7138.9172.7-173.20000107.6L1013 L1106 V1110 R1112 L1113L1013-V1108 WeakPolarHBondContact CD2-O 3.27Å; L1013-V1108 PolarHBondContact O-N 3.21Å; L1013-V1108 VanDerWaalsContact O-O 3.13Å; L1106-V1108 PolarHBondContact O-N 3.06Å; V1108-V1110 PolarHBondContact O-N 3.13Å; V1108-R1112 HydrophobicContact CG1-CB 4.15Å; V1108-R1112 HydrophobicContact CG1-CG 4.18Å; V1108-L1113 HydrophobicContact CB-CD1 4.32Å; V1108-L1113 HydrophobicContact CB-CD2 3.93Å; V1108-L1113 HydrophobicContact CB-CG 3.96Å; V1108-L1113 HydrophobicContact CG1-CD2 3.88Å; V1108-L1113 HydrophobicContact CG1-CG 3.85Å; V1108-L1113 HydrophobicContact CG2-CD2 4.48Å
1109Y86.5Confident71Confident57.2 Ų57.267.9 Ų67.922%0.22438%0.377CS..PPolyproline II helixtrans-55.1129.8170.7-78.1-87.2000110E1064 D1065 V1068 R1072 S1111 R1112 L1113E1064-Y1109 HydrophobicContact CB-CD1 4.19Å; E1064-Y1109 VanDerWaalsContact CD-CD1 3.47Å; E1064-Y1109 HydrophobicContact CG-CD1 3.74Å; E1064-Y1109 HydrophobicContact CG-CE1 4.33Å; E1064-Y1109 HydrophobicContact CG-CG 4.43Å; E1064-Y1109 WeakPolarHBondContact OE1-CA 3.38Å; E1064-Y1109 WeakPolarHBondContact OE1-CB 3.35Å; E1064-Y1109 VanDerWaalsContact OE1-CD1 3.31Å; E1064-Y1109 WeakPolarHBondContact OE1-CD1 3.31Å; D1065-Y1109 VanDerWaalsContact OD1-CE1 3.25Å; D1065-Y1109 WeakPolarHBondContact OD1-CE1 3.4Å; D1065-Y1109 PolarHBondContact OD1-OH 3.31Å; V1068-Y1109 HydrophobicContact CB-CE1 4.28Å; V1068-Y1109 HydrophobicContact CB-CE2 4.48Å; V1068-Y1109 HydrophobicContact CG1-CD2 4.4Å; V1068-Y1109 HydrophobicContact CG1-CE1 4.3Å; V1068-Y1109 HydrophobicContact CG1-CE2 3.96Å; V1068-Y1109 HydrophobicContact CG2-CD1 4.19Å; V1068-Y1109 HydrophobicContact CG2-CE1 4.23Å; V1068-Y1109 HydrophobicContact CG2-CG 4.38Å; R1072-Y1109 PolarHBondContact NH1-OH 3.39Å; Y1109-S1111 VanDerWaalsContact C-N 3.28Å; Y1109-S1111 PolarHBondContact O-N 3.16Å; Y1109-R1112 CarbonylContact O-C 3.57Å; Y1109-R1112 WeakPolarHBondContact O-CA 3.33Å; Y1109-R1112 WeakPolarHBondContact O-CB 3.3Å; Y1109-R1112 PolarHBondContact O-N 3.16Å; Y1109-R1112 VanDerWaalsContact O-N 3.08Å; Y1109-L1113 PolarHBondContact O-N 3.17Å
1110V87.2Confident72.8Confident0.8 Ų0.867.3 Ų67.31%0.00538%0.384CS..Hα-helixtrans-57.4-39.5175.7-1780000110.8L1013 L1060 L1061 E1064 V1108 R1112 L1113 L1114L1013-V1110 HydrophobicContact CD2-CG2 3.6Å; L1060-V1110 HydrophobicContact CB-CG2 4.1Å; L1061-V1110 HydrophobicContact CD2-CB 3.91Å; L1061-V1110 HydrophobicContact CD2-CG1 3.87Å; L1061-V1110 HydrophobicContact CG-CB 4.44Å; L1061-V1110 HydrophobicContact CG-CG1 4.09Å; E1064-V1110 WeakPolarHBondContact OE1-CA 3.31Å; E1064-V1110 PolarHBondContact OE1-N 3.23Å; E1064-V1110 PolarHBondContact OE2-N 2.89Å; V1108-V1110 PolarHBondContact O-N 3.13Å; V1110-R1112 PolarHBondContact O-N 3.08Å; V1110-L1113 PolarHBondContact O-N 3.37Å; V1110-L1113 VanDerWaalsContact O-N 3.11Å; V1110-L1114 HydrophobicContact CG1-CD1 4.15Å; V1110-L1114 HydrophobicContact CG1-CG 4.31Å; V1110-L1114 WeakPolarHBondContact O-CG 3.29Å; V1110-L1114 PolarHBondContact O-N 3.26Å
1111S87.1Confident74.7Confident7.6 Ų7.664.1 Ų64.15%0.05336%0.361CS..Hα-helixtrans-53.2-40.1172.751.40000112.2E1064 Y1109 M1115 S1157E1064-S1111 WeakPolarHBondContact OE1-CB 3.36Å; E1064-S1111 PolarHBondContact OE1-N 2.95Å; E1064-S1111 PolarHBondContact OE1-OG 3.26Å; E1064-S1111 PolarHBondContact OE2-N 3.49Å; E1064-S1111 VanDerWaalsContact OE2-N 3.11Å; E1064-S1111 PolarHBondContact OE2-OG 2.97Å; E1064-S1111 VanDerWaalsContact OE2-OG 3.12Å; Y1109-S1111 VanDerWaalsContact C-N 3.28Å; Y1109-S1111 PolarHBondContact O-N 3.16Å; S1111-M1115 WeakPolarHBondContact O-CG 3.23Å; S1111-S1157 VanDerWaalsContact CB-OG 3.27Å; S1111-S1157 WeakPolarHBondContact CB-OG 3.44Å
1112R88.1Confident76.7Confident171.8 Ų171.861.1 Ų61.165%0.64836%0.364SS*.Hα-helixtrans-78.6-34.6175.4-134177.8-139.4178-0.8113.4V1108 Y1109 V1110 L1114 M1115 S1116V1108-R1112 HydrophobicContact CG1-CB 4.15Å; V1108-R1112 HydrophobicContact CG1-CG 4.18Å; Y1109-R1112 CarbonylContact O-C 3.57Å; Y1109-R1112 WeakPolarHBondContact O-CA 3.33Å; Y1109-R1112 WeakPolarHBondContact O-CB 3.3Å; Y1109-R1112 PolarHBondContact O-N 3.16Å; Y1109-R1112 VanDerWaalsContact O-N 3.08Å; V1110-R1112 PolarHBondContact O-N 3.08Å; R1112-L1114 VanDerWaalsContact C-N 3.27Å; R1112-L1114 PolarHBondContact O-N 3.31Å; R1112-M1115 WeakPolarHBondContact O-CB 3.38Å; R1112-M1115 PolarHBondContact O-N 3.26Å; R1112-M1115 VanDerWaalsContact O-N 3.12Å; R1112-S1116 PolarHBondContact O-N 2.86Å
1113L87.1Confident78.6Confident10.2 Ų10.266 Ų665%0.05336%0.363CS..Hα-helixtrans-63.2-36.3173.6-70.9172.4000111.3L1012 D1015 F1019 V1108 Y1109 V1110 M1115 S1116L1012-L1113 WeakPolarHBondContact O-CD1 3.27Å; D1015-L1113 HydrophobicContact CB-CD2 4.13Å; F1019-L1113 HydrophobicContact CE1-CB 4.15Å; F1019-L1113 HydrophobicContact CE2-CB 4.3Å; F1019-L1113 HydrophobicContact CZ-CB 3.79Å; V1108-L1113 HydrophobicContact CB-CD1 4.32Å; V1108-L1113 HydrophobicContact CB-CD2 3.93Å; V1108-L1113 HydrophobicContact CB-CG 3.96Å; V1108-L1113 HydrophobicContact CG1-CD2 3.88Å; V1108-L1113 HydrophobicContact CG1-CG 3.85Å; V1108-L1113 HydrophobicContact CG2-CD2 4.48Å; Y1109-L1113 PolarHBondContact O-N 3.17Å; V1110-L1113 PolarHBondContact O-N 3.37Å; V1110-L1113 VanDerWaalsContact O-N 3.11Å; L1113-M1115 PolarHBondContact O-N 3.25Å; L1113-S1116 VanDerWaalsContact O-CB 3.24Å; L1113-S1116 WeakPolarHBondContact O-CB 3.34Å; L1113-S1116 PolarHBondContact O-N 3.13Å; L1113-S1116 VanDerWaalsContact O-N 3.07Å; L1113-S1116 PolarHBondContact O-OG 3.12Å
1114L88Confident80.3Confident0.6 Ų0.661 Ų610%0.00334%0.342CS..THydrogen-bonded Turntrans-69.4-17.5174.8-68.8173.2000113.3F1019 I1057 L1061 V1110 R1112 S1116 L1126 I1127 L1130 L1154F1019-L1114 HydrophobicContact CE2-CD2 4.4Å; F1019-L1114 HydrophobicContact CZ-CD2 4.04Å; F1019-L1114 HydrophobicContact CZ-CG 4.48Å; I1057-L1114 HydrophobicContact CG2-CD1 4.06Å; L1061-L1114 HydrophobicContact CD1-CD1 4.1Å; L1061-L1114 HydrophobicContact CD2-CD1 4.42Å; V1110-L1114 HydrophobicContact CG1-CD1 4.15Å; V1110-L1114 HydrophobicContact CG1-CG 4.31Å; V1110-L1114 WeakPolarHBondContact O-CG 3.29Å; V1110-L1114 PolarHBondContact O-N 3.26Å; R1112-L1114 VanDerWaalsContact C-N 3.27Å; R1112-L1114 PolarHBondContact O-N 3.31Å; L1114-S1116 VanDerWaalsContact C-N 3.3Å; L1114-L1126 HydrophobicContact CD2-CB 4.36Å; L1114-L1126 WeakPolarHBondContact O-CB 3.33Å; L1114-I1127 HydrophobicContact CB-CD1 4.34Å; L1114-I1127 HydrophobicContact CB-CG1 3.89Å; L1114-I1127 WeakPolarHBondContact O-CG1 3.24Å; L1114-L1130 HydrophobicContact CD1-CD1 4.16Å; L1114-L1130 HydrophobicContact CD2-CD1 3.69Å; L1114-L1130 HydrophobicContact CG-CD1 4.47Å; L1114-L1154 HydrophobicContact CD1-CD2 4.08Å
1115M85.2Confident81.9Confident51.8 Ų51.857.8 Ų57.826%0.25532%0.32SS..THydrogen-bonded Turntrans-83-5.2169.8-62.9179.887.100113.2S1111 R1112 L1113 I1127 I1158 D1163 L1167S1111-M1115 WeakPolarHBondContact O-CG 3.23Å; R1112-M1115 WeakPolarHBondContact O-CB 3.38Å; R1112-M1115 PolarHBondContact O-N 3.26Å; R1112-M1115 VanDerWaalsContact O-N 3.12Å; L1113-M1115 PolarHBondContact O-N 3.25Å; M1115-I1127 HydrophobicContact CG-CD1 3.89Å; M1115-I1158 HydrophobicContact CE-CB 4.18Å; M1115-I1158 HydrophobicContact CE-CD1 3.52Å; M1115-I1158 HydrophobicContact CE-CG1 3.75Å; M1115-I1158 HydrophobicContact CE-CG2 3.34Å; M1115-I1158 HydrophobicContact CG-CD1 4.22Å; M1115-I1158 HydrophobicContact SD-CD1 3.93Å; M1115-I1158 HydrophobicContact SD-CG1 4.34Å; M1115-I1158 HydrophobicContact SD-CG2 4.35Å; M1115-D1163 HydrophobicContact CE-CB 3.8Å; M1115-L1167 HydrophobicContact CB-CD1 4.19Å; M1115-L1167 HydrophobicContact CE-CD1 4Å; M1115-L1167 HydrophobicContact CG-CD1 3.86Å; M1115-L1167 HydrophobicContact SD-CD1 4.42Å
1116S85.2Confident83.2Confident32.8 Ų32.855.1 Ų55.123%0.22931%0.306CS..SBendtrans-71.9165.2179.277.10000112.2R1112 L1113 L1114 N1118R1112-S1116 PolarHBondContact O-N 2.86Å; L1113-S1116 VanDerWaalsContact O-CB 3.24Å; L1113-S1116 WeakPolarHBondContact O-CB 3.34Å; L1113-S1116 PolarHBondContact O-N 3.13Å; L1113-S1116 VanDerWaalsContact O-N 3.07Å; L1113-S1116 PolarHBondContact O-OG 3.12Å; L1114-S1116 VanDerWaalsContact C-N 3.3Å; S1116-N1118 PolarHBondContact O-N 3.13Å
1117T82.5Confident84.2Confident97 Ų9748.5 Ų48.560%0.59527%0.272SS*.PPolyproline II helixtrans-66.4126.3174.751.90000110.7R1123T1117-R1123 CarbonylContact C-O 3.59Å
1118N81.6Confident84.7Confident8 Ų848.6 Ų48.64%0.04327%0.272CS..PPolyproline II helixtrans-66.7136.1167.9-174.85.2000110E1027 S1116 G1120 S1121 G1122 R1123 D1125 L1126E1027-N1118 VanDerWaalsContact CD-ND2 3.31Å; E1027-N1118 PolarHBondContact OE1-ND2 3.17Å; E1027-N1118 PolarHBondContact OE2-ND2 3Å; E1027-N1118 PolarHBondContact OE2-OD1 2.96Å; S1116-N1118 PolarHBondContact O-N 3.13Å; N1118-G1120 VanDerWaalsContact C-N 3.34Å; N1118-G1120 PolarHBondContact OD1-N 3.3Å; N1118-G1120 VanDerWaalsContact OD1-N 3.1Å; N1118-S1121 WeakPolarHBondContact CB-OG 3.22Å; N1118-S1121 PolarHBondContact ND2-N 3.39Å; N1118-G1122 VanDerWaalsContact O-CA 3.22Å; N1118-G1122 WeakPolarHBondContact O-CA 3.3Å; N1118-G1122 PolarHBondContact O-N 3.22Å; N1118-R1123 WeakPolarHBondContact CB-O 3.39Å; N1118-R1123 PolarHBondContact N-O 3.24Å; N1118-D1125 WeakPolarHBondContact CB-OD1 3.26Å; N1118-D1125 PolarHBondContact ND2-OD1 3.19Å; N1118-D1125 VanDerWaalsContact ND2-OD1 3.12Å; N1118-L1126 HydrophobicContact CB-CD2 3.76Å; N1118-L1126 HydrophobicContact CB-CG 3.95Å
1119I78.3Confident85Confident120.2 Ų120.246.8 Ų46.862%0.61626%0.261SS*.THydrogen-bonded Turntrans-71.4-32.6177.7-63.5174000111.2R1020R1020-I1119 HydrophobicContact CB-CD1 4.09Å; R1020-I1119 VanDerWaalsContact CD-CD1 3.49Å; R1020-I1119 HydrophobicContact CG-CD1 3.6Å
1120G72.4Confident85.2Confident58 Ų5844.1 Ų44.160%0.59825%0.25SS*.THydrogen-bonded Turntrans-65.8-53.4179.600000112.2N1118N1118-G1120 VanDerWaalsContact C-N 3.34Å; N1118-G1120 PolarHBondContact OD1-N 3.3Å; N1118-G1120 VanDerWaalsContact OD1-N 3.1Å
1121S79.8Confident85.5Confident44.6 Ų44.644.1 Ų44.131%0.31225%0.25SS..THydrogen-bonded Turntrans-90.4-18.3-17772.50000114.7N1118 R1123 D1125N1118-S1121 WeakPolarHBondContact CB-OG 3.22Å; N1118-S1121 PolarHBondContact ND2-N 3.39Å; S1121-R1123 PolarHBondContact O-N 3.05Å; S1121-R1123 PolarHBondContact OG-N 3Å; S1121-R1123 VanDerWaalsContact OG-N 3.12Å; S1121-R1123 PolarHBondContact OG-O 3.26Å; S1121-D1125 VanDerWaalsContact CB-OD2 3.25Å; S1121-D1125 WeakPolarHBondContact CB-OD2 3.36Å; S1121-D1125 PolarHBondContact OG-OD1 3.16Å; S1121-D1125 PolarHBondContact OG-OD2 2.88Å; S1121-D1125 VanDerWaalsContact OG-OD2 3.07Å
1122G80.8Confident85.7Confident56.4 Ų56.445.8 Ų45.858%0.58126%0.256SS*.SBendtrans70.19.6-171.200000114.3N1118N1118-G1122 VanDerWaalsContact O-CA 3.22Å; N1118-G1122 WeakPolarHBondContact O-CA 3.3Å; N1118-G1122 PolarHBondContact O-N 3.22Å
1123R83Confident85.7Confident164.4 Ų164.437.6 Ų37.662%0.6223%0.226SC*.SBendtrans-123.2161.4-177.5-63.6179.2180177.3-0.2110.6T1117 N1118 S1121 D1125T1117-R1123 CarbonylContact C-O 3.59Å; N1118-R1123 WeakPolarHBondContact CB-O 3.39Å; N1118-R1123 PolarHBondContact N-O 3.24Å; S1121-R1123 PolarHBondContact O-N 3.05Å; S1121-R1123 PolarHBondContact OG-N 3Å; S1121-R1123 VanDerWaalsContact OG-N 3.12Å; S1121-R1123 PolarHBondContact OG-O 3.26Å; R1123-D1125 HydrophobicContact CB-CB 4.47Å; R1123-D1125 VanDerWaalsContact CB-CG 3.5Å; R1123-D1125 WeakPolarHBondContact CB-OD1 3.34Å; R1123-D1125 VanDerWaalsContact CB-OD2 3.28Å; R1123-D1125 WeakPolarHBondContact CB-OD2 3.3Å; R1123-D1125 PolarHBondContact O-N 3.02Å
1124A84.3Confident85.7Confident32.2 Ų32.237.1 Ų37.127%0.26622%0.223SC..SBendtrans-78.260.4176.100000111.7L1167A1124-L1167 HydrophobicContact CB-CD2 3.74Å; A1124-L1167 VanDerWaalsContact CB-CD2 3.5Å; A1124-L1167 WeakPolarHBondContact O-CD2 3.28Å
1125D86.7Confident85.7Confident47.6 Ų47.639.9 Ų39.926%0.25524%0.238SC..  trans-1088.4-17126.2-12.3000114.1N1118 S1121 R1123 I1127 P1128 M1129N1118-D1125 WeakPolarHBondContact CB-OD1 3.26Å; N1118-D1125 PolarHBondContact ND2-OD1 3.19Å; N1118-D1125 VanDerWaalsContact ND2-OD1 3.12Å; S1121-D1125 VanDerWaalsContact CB-OD2 3.25Å; S1121-D1125 WeakPolarHBondContact CB-OD2 3.36Å; S1121-D1125 PolarHBondContact OG-OD1 3.16Å; S1121-D1125 PolarHBondContact OG-OD2 2.88Å; S1121-D1125 VanDerWaalsContact OG-OD2 3.07Å; R1123-D1125 HydrophobicContact CB-CB 4.47Å; R1123-D1125 VanDerWaalsContact CB-CG 3.5Å; R1123-D1125 WeakPolarHBondContact CB-OD1 3.34Å; R1123-D1125 VanDerWaalsContact CB-OD2 3.28Å; R1123-D1125 WeakPolarHBondContact CB-OD2 3.3Å; R1123-D1125 PolarHBondContact O-N 3.02Å; D1125-I1127 PolarHBondContact O-N 3.08Å; D1125-P1128 WeakPolarHBondContact O-CD 3.38Å; D1125-M1129 VanDerWaalsContact O-CB 3.3Å; D1125-M1129 WeakPolarHBondContact O-CB 3.26Å; D1125-M1129 PolarHBondContact O-N 3.22Å
1126L89Confident85.5Confident2.6 Ų2.638 Ų381%0.01423%0.228CC..Hα-helixtrans-59.8-45-178.7-68.1175.9000112.2F1019 T1023 L1114 N1118 M1129 L1130F1019-L1126 HydrophobicContact CE1-CD1 4.32Å; F1019-L1126 HydrophobicContact CZ-CD1 4.47Å; T1023-L1126 HydrophobicContact CG2-CD1 4.47Å; T1023-L1126 HydrophobicContact CG2-CD2 4.24Å; L1114-L1126 HydrophobicContact CD2-CB 4.36Å; L1114-L1126 WeakPolarHBondContact O-CB 3.33Å; N1118-L1126 HydrophobicContact CB-CD2 3.76Å; N1118-L1126 HydrophobicContact CB-CG 3.95Å; L1126-M1129 HydrophobicContact CD2-CE 4.01Å; L1126-M1129 WeakPolarHBondContact O-CB 3.34Å; L1126-M1129 PolarHBondContact O-N 3.21Å; L1126-L1130 VanDerWaalsContact O-CG 3.31Å; L1126-L1130 WeakPolarHBondContact O-CG 3.29Å; L1126-L1130 PolarHBondContact O-N 3.16Å
1127I91.3Very high85.1Confident0.6 Ų0.636.6 Ų36.60%0.00322%0.219CC..Hα-helixtrans-63.3-54.5177.9-65.7170.4000111L1114 M1115 D1125 M1129 L1130 L1131 L1154 I1158 L1164 L1167 L1168L1114-I1127 HydrophobicContact CB-CD1 4.34Å; L1114-I1127 HydrophobicContact CB-CG1 3.89Å; L1114-I1127 WeakPolarHBondContact O-CG1 3.24Å; M1115-I1127 HydrophobicContact CG-CD1 3.89Å; D1125-I1127 PolarHBondContact O-N 3.08Å; I1127-M1129 VanDerWaalsContact C-N 3.26Å; I1127-M1129 PolarHBondContact O-N 3.08Å; I1127-L1130 PolarHBondContact O-N 3.21Å; I1127-L1131 HydrophobicContact CG2-CD1 3.78Å; I1127-L1131 HydrophobicContact CG2-CG 4.4Å; I1127-L1131 VanDerWaalsContact O-CG 3.31Å; I1127-L1131 WeakPolarHBondContact O-CG 3.35Å; I1127-L1131 PolarHBondContact O-N 3.17Å; I1127-L1154 HydrophobicContact CD1-CD1 4.3Å; I1127-L1154 HydrophobicContact CD1-CD2 4.46Å; I1127-L1154 HydrophobicContact CG1-CD1 4.04Å; I1127-L1154 HydrophobicContact CG2-CD1 4.01Å; I1127-I1158 HydrophobicContact CD1-CD1 4.27Å; I1127-L1164 HydrophobicContact CD1-CD1 4.23Å; I1127-L1164 HydrophobicContact CG2-CD1 4.04Å; I1127-L1167 HydrophobicContact CD1-CD1 4.12Å; I1127-L1168 HydrophobicContact CG2-CD2 4.1Å
1128P90.3Very high84.5Confident6 Ų635.6 Ų35.64%0.03921%0.21CC..Hα-helixtrans-52.3-39.7172.4-27.131.3000113.9D1125 L1131 K1132 L1167 L1168 L1178D1125-P1128 WeakPolarHBondContact O-CD 3.38Å; P1128-L1131 PolarHBondContact O-N 3.1Å; P1128-K1132 VanDerWaalsContact O-CG 3.32Å; P1128-K1132 WeakPolarHBondContact O-CG 3.39Å; P1128-K1132 PolarHBondContact O-N 2.95Å; P1128-L1167 WeakPolarHBondContact CG-O 3.38Å; P1128-L1168 HydrophobicContact CG-CD2 4.33Å; P1128-L1178 HydrophobicContact CB-CD1 4.32Å
1129M90.5Very high83.9Confident12.2 Ų12.239.5 Ų39.56%0.0623%0.225CC..Hα-helixtrans-62.2-49.2177.3177.2-82-70.900111.7L1026 E1027 L1030 D1125 L1126 I1127 L1131 K1132 Y1133L1026-M1129 HydrophobicContact CB-CE 4.24Å; L1026-M1129 HydrophobicContact CB-SD 4.13Å; E1027-M1129 HydrophobicContact CB-CE 4.38Å; E1027-M1129 HydrophobicContact CB-CG 4.28Å; E1027-M1129 HydrophobicContact CB-SD 4.41Å; E1027-M1129 HydrophobicContact CG-CG 4.43Å; L1030-M1129 HydrophobicContact CD2-CG 3.93Å; L1030-M1129 WeakPolarHBondContact CD2-O 3.42Å; L1030-M1129 HydrophobicContact CD2-SD 4.43Å; D1125-M1129 VanDerWaalsContact O-CB 3.3Å; D1125-M1129 WeakPolarHBondContact O-CB 3.26Å; D1125-M1129 PolarHBondContact O-N 3.22Å; L1126-M1129 HydrophobicContact CD2-CE 4.01Å; L1126-M1129 WeakPolarHBondContact O-CB 3.34Å; L1126-M1129 PolarHBondContact O-N 3.21Å; I1127-M1129 VanDerWaalsContact C-N 3.26Å; I1127-M1129 PolarHBondContact O-N 3.08Å; M1129-L1131 VanDerWaalsContact C-N 3.28Å; M1129-L1131 PolarHBondContact O-N 3.01Å; M1129-K1132 WeakPolarHBondContact O-CB 3.33Å; M1129-K1132 PolarHBondContact O-N 3.14Å; M1129-Y1133 HydrophobicContact SD-CE2 4.31Å
1130L91.5Very high83.8Confident0.4 Ų0.434.1 Ų34.10%0.00220%0.197CC..Hα-helixtrans-62.8-35.9178.1-66.1177.2000112.1L1026 L1054 I1057 L1114 L1126 I1127 Y1133L1026-L1130 HydrophobicContact CB-CD2 4.43Å; L1026-L1130 HydrophobicContact CD1-CD2 3.64Å; L1054-L1130 HydrophobicContact CD2-CD2 3.75Å; I1057-L1130 HydrophobicContact CD1-CD1 4.28Å; I1057-L1130 HydrophobicContact CD1-CD2 4.21Å; I1057-L1130 HydrophobicContact CG2-CD1 4.37Å; L1114-L1130 HydrophobicContact CD1-CD1 4.16Å; L1114-L1130 HydrophobicContact CD2-CD1 3.69Å; L1114-L1130 HydrophobicContact CG-CD1 4.47Å; L1126-L1130 VanDerWaalsContact O-CG 3.31Å; L1126-L1130 WeakPolarHBondContact O-CG 3.29Å; L1126-L1130 PolarHBondContact O-N 3.16Å; I1127-L1130 PolarHBondContact O-N 3.21Å; L1130-Y1133 WeakPolarHBondContact O-CD2 3.34Å; L1130-Y1133 PolarHBondContact O-N 3.23Å
1131L92Very high83.6Confident0.6 Ų0.631.9 Ų31.90%0.00317%0.172CC..Hα-helixtrans-77.1-23179.8-62.8173.6000113.3I1127 P1128 M1129 Y1133 C1134 L1151 L1168 L1178 F1182I1127-L1131 HydrophobicContact CG2-CD1 3.78Å; I1127-L1131 HydrophobicContact CG2-CG 4.4Å; I1127-L1131 VanDerWaalsContact O-CG 3.31Å; I1127-L1131 WeakPolarHBondContact O-CG 3.35Å; I1127-L1131 PolarHBondContact O-N 3.17Å; P1128-L1131 PolarHBondContact O-N 3.1Å; M1129-L1131 VanDerWaalsContact C-N 3.28Å; M1129-L1131 PolarHBondContact O-N 3.01Å; L1131-Y1133 PolarHBondContact O-N 3.1Å; L1131-Y1133 VanDerWaalsContact O-N 3.15Å; L1131-C1134 VanDerWaalsContact O-CB 3.28Å; L1131-C1134 WeakPolarHBondContact O-CB 3.32Å; L1131-C1134 PolarHBondContact O-N 3.05Å; L1131-C1134 PolarHBondContact O-SG 3.22Å; L1131-C1134 VanDerWaalsContact O-SG 3.39Å; L1131-L1151 HydrophobicContact CD1-CD1 3.92Å; L1131-L1151 HydrophobicContact CD2-CB 3.73Å; L1131-L1151 HydrophobicContact CD2-CD1 4.01Å; L1131-L1151 HydrophobicContact CD2-CD2 4.36Å; L1131-L1151 HydrophobicContact CD2-CG 4.32Å; L1131-L1168 HydrophobicContact CD1-CD2 3.56Å; L1131-L1178 VanDerWaalsContact C-CD2 3.49Å; L1131-L1178 HydrophobicContact CB-CD2 3.71Å; L1131-F1182 HydrophobicContact CB-CZ 4.33Å; L1131-F1182 HydrophobicContact CD1-CZ 4.31Å; L1131-F1182 HydrophobicContact CD2-CZ 4.39Å
1132K91.5Very high83.2Confident43.2 Ų43.231 Ų3119%0.18816%0.164CC..G310 helixtrans-63.2-16.4174-83.7177.6-178.7-1730113.3L1030 P1128 M1129 C1134 L1135 T1174 Q1177 L1178L1030-K1132 HydrophobicContact CD1-CB 4.12Å; L1030-K1132 HydrophobicContact CD2-CB 3.68Å; L1030-K1132 HydrophobicContact CD2-CD 4.23Å; L1030-K1132 HydrophobicContact CD2-CG 4.48Å; L1030-K1132 HydrophobicContact CG-CB 4.48Å; P1128-K1132 VanDerWaalsContact O-CG 3.32Å; P1128-K1132 WeakPolarHBondContact O-CG 3.39Å; P1128-K1132 PolarHBondContact O-N 2.95Å; M1129-K1132 WeakPolarHBondContact O-CB 3.33Å; M1129-K1132 PolarHBondContact O-N 3.14Å; K1132-C1134 PolarHBondContact O-N 3.1Å; K1132-C1134 VanDerWaalsContact O-N 3.15Å; K1132-L1135 HydrophobicContact CB-CD1 4.14Å; K1132-L1135 HydrophobicContact CG-CD1 4.1Å; K1132-L1135 VanDerWaalsContact O-CB 3.26Å; K1132-L1135 WeakPolarHBondContact O-CB 3.32Å; K1132-L1135 WeakPolarHBondContact O-CG 3.34Å; K1132-L1135 PolarHBondContact O-N 3.18Å; K1132-T1174 VanDerWaalsContact NZ-CG2 3.28Å; K1132-Q1177 VanDerWaalsContact CE-OE1 3.31Å; K1132-L1178 HydrophobicContact CG-CD2 4.13Å
1133Y88.8Confident83.2Confident0 Ų028.5 Ų28.50%014%0.137CC..G310 helixtrans-59.1-23.9168.3-81.2-81.6000112.8L1026 L1030 T1050 L1054 M1129 L1130 L1131 L1135 L1136 H1143 T1144L1026-Y1133 HydrophobicContact CB-CE2 4.49Å; L1026-Y1133 HydrophobicContact CD2-CE2 4.4Å; L1026-Y1133 PolarHBondContact O-OH 3.29Å; L1030-Y1133 HydrophobicContact CB-CE1 4.43Å; L1030-Y1133 HydrophobicContact CB-CE2 4.05Å; L1030-Y1133 HydrophobicContact CD1-CD1 4.13Å; L1030-Y1133 HydrophobicContact CD1-CD2 4.1Å; L1030-Y1133 HydrophobicContact CD1-CE1 4.25Å; L1030-Y1133 HydrophobicContact CD1-CE2 4.22Å; L1030-Y1133 HydrophobicContact CD1-CG 4.06Å; L1030-Y1133 PolarHBondContact N-OH 3.28Å; T1050-Y1133 WeakPolarHBondContact CB-OH 3.41Å; T1050-Y1133 VanDerWaalsContact CG2-OH 3.31Å; T1050-Y1133 WeakPolarHBondContact CG2-OH 3.36Å; L1054-Y1133 HydrophobicContact CD1-CD1 4.09Å; L1054-Y1133 HydrophobicContact CD1-CD2 3.99Å; L1054-Y1133 HydrophobicContact CD1-CE1 4.18Å; L1054-Y1133 HydrophobicContact CD1-CE2 4.15Å; L1054-Y1133 HydrophobicContact CD1-CG 3.94Å; L1054-Y1133 HydrophobicContact CD2-CD2 4.12Å; L1054-Y1133 HydrophobicContact CD2-CE2 4.21Å; L1054-Y1133 HydrophobicContact CG-CD2 4.45Å; L1054-Y1133 HydrophobicContact CG-CE2 4.42Å; M1129-Y1133 HydrophobicContact SD-CE2 4.31Å; L1130-Y1133 WeakPolarHBondContact O-CD2 3.34Å; L1130-Y1133 PolarHBondContact O-N 3.23Å; L1131-Y1133 PolarHBondContact O-N 3.1Å; L1131-Y1133 VanDerWaalsContact O-N 3.15Å; Y1133-L1135 PolarHBondContact O-N 3.16Å; Y1133-L1135 VanDerWaalsContact O-N 3.14Å; Y1133-L1136 HydrophobicContact CD1-CD1 4.29Å; Y1133-L1136 WeakPolarHBondContact O-CB 3.22Å; Y1133-L1136 PolarHBondContact O-N 3.21Å; Y1133-H1143 HydrophobicContact CD1-CB 4.1Å; Y1133-H1143 AromaticContact CD1-CD2 3.94Å; Y1133-H1143 AromaticContact CE1-CD2 3.86Å; Y1133-H1143 HydrophobicContact CG-CB 4.48Å; Y1133-T1144 VanDerWaalsContact O-CG2 3.32Å; Y1133-T1144 WeakPolarHBondContact O-CG2 3.38Å; Y1133-T1144 PolarHBondContact O-OG1 2.89Å; Y1133-T1144 VanDerWaalsContact O-OG1 3.09Å
1134C87.7Confident83.1Confident0.6 Ų0.620.7 Ų20.70%0.00411%0.108CC..G310 helixtrans-63.7-19.1173.5-61.70000113.8L1131 K1132 L1136 A1137 T1144 A1181 F1182 L1185L1131-C1134 VanDerWaalsContact O-CB 3.28Å; L1131-C1134 WeakPolarHBondContact O-CB 3.32Å; L1131-C1134 PolarHBondContact O-N 3.05Å; L1131-C1134 PolarHBondContact O-SG 3.22Å; L1131-C1134 VanDerWaalsContact O-SG 3.39Å; K1132-C1134 PolarHBondContact O-N 3.1Å; K1132-C1134 VanDerWaalsContact O-N 3.15Å; C1134-L1136 PolarHBondContact O-N 3.27Å; C1134-A1137 PolarHBondContact O-N 3.13Å; C1134-T1144 HydrophobicContact CB-CG2 4.34Å; C1134-A1181 HydrophobicContact CB-CB 4.04Å; C1134-F1182 HydrophobicContact CB-CE1 4.49Å; C1134-L1185 HydrophobicContact CB-CD1 4.35Å; C1134-L1185 HydrophobicContact CB-CD2 4.48Å
1135L86.5Confident82.8Confident59 Ų5920.6 Ų20.631%0.30911%0.105SC..G310 helixtrans-65.7-20.3173-67.5164.9000112.6L1034 K1132 Y1133 Q1177 A1181L1034-L1135 HydrophobicContact CD1-CD1 4.48Å; L1034-L1135 HydrophobicContact CD2-CB 4.28Å; L1034-L1135 HydrophobicContact CD2-CD1 4.26Å; K1132-L1135 HydrophobicContact CB-CD1 4.14Å; K1132-L1135 HydrophobicContact CG-CD1 4.1Å; K1132-L1135 VanDerWaalsContact O-CB 3.26Å; K1132-L1135 WeakPolarHBondContact O-CB 3.32Å; K1132-L1135 WeakPolarHBondContact O-CG 3.34Å; K1132-L1135 PolarHBondContact O-N 3.18Å; Y1133-L1135 PolarHBondContact O-N 3.16Å; Y1133-L1135 VanDerWaalsContact O-N 3.14Å; L1135-Q1177 HydrophobicContact CD1-CB 4.43Å; L1135-Q1177 HydrophobicContact CD2-CB 4.34Å; L1135-Q1177 WeakPolarHBondContact CD2-O 3.49Å; L1135-A1181 HydrophobicContact CD2-CB 3.8Å; L1135-A1181 HydrophobicContact CG-CB 4.14Å
1136L81.1Confident82.6Confident10.6 Ų10.618.6 Ų18.66%0.05510%0.095CC..G310 helixtrans-100.222.9-174.8-60167.7000112.1L1030 H1033 L1034 F1036 Y1133 C1134 D1138 Y1139 L1140L1030-L1136 HydrophobicContact CD1-CD1 4.35Å; H1033-L1136 HydrophobicContact CB-CD1 3.62Å; H1033-L1136 HydrophobicContact CB-CD2 4.42Å; L1034-L1136 HydrophobicContact CD2-CD2 4.1Å; L1034-L1136 HydrophobicContact CD2-CG 4.39Å; F1036-L1136 HydrophobicContact CE1-CD2 4.25Å; F1036-L1136 HydrophobicContact CE2-CD2 4.16Å; F1036-L1136 HydrophobicContact CZ-CD2 3.51Å; Y1133-L1136 HydrophobicContact CD1-CD1 4.29Å; Y1133-L1136 WeakPolarHBondContact O-CB 3.22Å; Y1133-L1136 PolarHBondContact O-N 3.21Å; C1134-L1136 PolarHBondContact O-N 3.27Å; L1136-D1138 VanDerWaalsContact C-N 3.26Å; L1136-D1138 PolarHBondContact O-N 3.21Å; L1136-D1138 VanDerWaalsContact O-N 3.13Å; L1136-Y1139 HydrophobicContact CD2-CD2 4.37Å; L1136-Y1139 WeakPolarHBondContact O-CA 3.4Å; L1136-Y1139 PolarHBondContact O-N 3.18Å; L1136-L1140 HydrophobicContact CB-CB 4.3Å; L1136-L1140 HydrophobicContact CB-CD1 4.41Å; L1136-L1140 HydrophobicContact CB-CG 4.48Å; L1136-L1140 HydrophobicContact CD1-CD1 4.05Å; L1136-L1140 WeakPolarHBondContact O-CA 3.2Å; L1136-L1140 PolarHBondContact O-N 3.21Å
1137A76.7Confident82.6Confident5.4 Ų5.418.4 Ų18.45%0.0459%0.094CC..THydrogen-bonded Turntrans-53.8-35.5-174.300000114.5C1134 Y1139 T1144 Y1184 L1185C1134-A1137 PolarHBondContact O-N 3.13Å; A1137-Y1139 VanDerWaalsContact C-N 3.34Å; A1137-T1144 VanDerWaalsContact CA-CG2 3.45Å; A1137-T1144 VanDerWaalsContact CA-OG1 3.29Å; A1137-T1144 WeakPolarHBondContact CA-OG1 3.4Å; A1137-T1144 HydrophobicContact CB-CG2 4.04Å; A1137-T1144 PolarHBondContact N-OG1 3.49Å; A1137-Y1184 HydrophobicContact CB-CD1 4.07Å; A1137-Y1184 HydrophobicContact CB-CE1 4.09Å; A1137-L1185 HydrophobicContact CB-CD2 4.02Å
1138D70Confident82.4Confident74.2 Ų74.218.5 Ų18.540%0.3979%0.094SC..THydrogen-bonded Turntrans-74-28.4178.8-62.1-34.2000113.3L1136 Y1184 F1235L1136-D1138 VanDerWaalsContact C-N 3.26Å; L1136-D1138 PolarHBondContact O-N 3.21Å; L1136-D1138 VanDerWaalsContact O-N 3.13Å; D1138-Y1184 VanDerWaalsContact CG-OH 3.24Å; D1138-Y1184 VanDerWaalsContact OD1-CE1 3.26Å; D1138-Y1184 WeakPolarHBondContact OD1-CE1 3.27Å; D1138-Y1184 VanDerWaalsContact OD1-CZ 3.28Å; D1138-Y1184 PolarHBondContact OD1-OH 3.07Å; D1138-Y1184 PolarHBondContact OD2-OH 3.27Å; D1138-F1235 VanDerWaalsContact OD1-CE1 3.31Å; D1138-F1235 WeakPolarHBondContact OD1-CE1 3.22Å
1139Y70.6Confident82Confident90.4 Ų90.419 Ų1936%0.35510%0.099SC..THydrogen-bonded Turntrans-100.6-33.9-173.3-58.6-70.4000112.8D178 F1036 I1038 L1136 A1137D178-Y1139 PolarHBondContact OD1-OH 3.26Å; F1036-Y1139 HydrophobicContact CE1-CD1 4.27Å; F1036-Y1139 AromaticContact CE1-CD2 3.85Å; F1036-Y1139 HydrophobicContact CE1-CD2 3.85Å; F1036-Y1139 HydrophobicContact CE1-CE1 4.15Å; F1036-Y1139 AromaticContact CE1-CE2 3.68Å; F1036-Y1139 HydrophobicContact CE1-CE2 3.68Å; F1036-Y1139 HydrophobicContact CE1-CG 4.16Å; F1036-Y1139 AromaticContact CE1-CZ 3.87Å; F1036-Y1139 HydrophobicContact CZ-CD2 4.18Å; F1036-Y1139 HydrophobicContact CZ-CE2 4.09Å; I1038-Y1139 HydrophobicContact CD1-CD1 4.12Å; I1038-Y1139 HydrophobicContact CD1-CE1 4.01Å; I1038-Y1139 HydrophobicContact CD1-CE2 4.02Å; I1038-Y1139 HydrophobicContact CD1-CG 4.01Å; I1038-Y1139 VanDerWaalsContact CD1-OH 3.24Å; I1038-Y1139 WeakPolarHBondContact CD1-OH 3.34Å; I1038-Y1139 HydrophobicContact CG1-CE1 4.39Å; L1136-Y1139 HydrophobicContact CD2-CD2 4.37Å; L1136-Y1139 WeakPolarHBondContact O-CA 3.4Å; L1136-Y1139 PolarHBondContact O-N 3.18Å; A1137-Y1139 VanDerWaalsContact C-N 3.34Å
1140L74.5Confident81.9Confident7 Ų718.5 Ų18.54%0.03710%0.096CC..  trans-138.767.3-171-63.7179.5000111.1T1047 L1136 D1142 H1143 T1144 P1254 W1260T1047-L1140 HydrophobicContact CG2-CD1 4.34Å; T1047-L1140 HydrophobicContact CG2-CD2 3.52Å; T1047-L1140 VanDerWaalsContact CG2-CD2 3.45Å; L1136-L1140 HydrophobicContact CB-CB 4.3Å; L1136-L1140 HydrophobicContact CB-CD1 4.41Å; L1136-L1140 HydrophobicContact CB-CG 4.48Å; L1136-L1140 HydrophobicContact CD1-CD1 4.05Å; L1136-L1140 WeakPolarHBondContact O-CA 3.2Å; L1136-L1140 PolarHBondContact O-N 3.21Å; L1140-D1142 VanDerWaalsContact C-N 3.29Å; L1140-D1142 PolarHBondContact O-N 3.25Å; L1140-H1143 HydrophobicContact CB-CB 4.02Å; L1140-H1143 PolarHBondContact O-N 3.11Å; L1140-T1144 WeakPolarHBondContact O-CG2 3.22Å; L1140-T1144 PolarHBondContact O-N 3.32Å; L1140-T1144 VanDerWaalsContact O-N 3.11Å; L1140-T1144 PolarHBondContact O-OG1 3.27Å; L1140-P1254 HydrophobicContact CD2-CB 4.3Å; L1140-P1254 HydrophobicContact CD2-CG 3.94Å; L1140-W1260 HydrophobicContact CD2-CH2 4.13Å
1141P70.1Confident81.8Confident12 Ų1218.5 Ų18.58%0.07810%0.096CC..Hα-helixtrans-63.5-30.9-178.125.7-34.7000113.1H1143 T1144 S1145 W1188 F1235 L1255 Y1273 I1317P1141-H1143 PolarHBondContact O-N 2.85Å; P1141-T1144 WeakPolarHBondContact CA-OG1 3.46Å; P1141-T1144 CarbonylContact O-C 3.59Å; P1141-T1144 WeakPolarHBondContact O-CB 3.31Å; P1141-T1144 PolarHBondContact O-N 3.11Å; P1141-T1144 PolarHBondContact O-OG1 3.36Å; P1141-S1145 WeakPolarHBondContact O-CB 3.39Å; P1141-S1145 PolarHBondContact O-N 3.05Å; P1141-W1188 HydrophobicContact CB-CZ2 4.37Å; P1141-F1235 HydrophobicContact CB-CE2 3.73Å; P1141-F1235 HydrophobicContact CB-CZ 3.63Å; P1141-F1235 WeakPolarHBondContact CB-O 3.43Å; P1141-F1235 HydrophobicContact CG-CE2 4.32Å; P1141-F1235 HydrophobicContact CG-CZ 3.69Å; P1141-L1255 HydrophobicContact CB-CD1 4.34Å; P1141-L1255 HydrophobicContact CG-CB 3.55Å; P1141-L1255 HydrophobicContact CG-CD1 3.68Å; P1141-L1255 HydrophobicContact CG-CG 4.25Å; P1141-Y1273 HydrophobicContact CG-CD1 4.11Å; P1141-Y1273 HydrophobicContact CG-CE1 3.73Å; P1141-I1317 HydrophobicContact CB-CD1 4.17Å; P1141-I1317 WeakPolarHBondContact O-CD1 3.49Å
1142D69.7Low81.6Confident26.4 Ų26.418.7 Ų18.714%0.14110%0.098CC..Hα-helixtrans-69.9-37.5178.8-63.6-19.1000112.2Y1051 L1140 T1144 S1145 C1146 S1237 R1248 P1254 L1255 S1272 Y1273 L1274Y1051-D1142 HydrophobicContact CD2-CB 4.01Å; Y1051-D1142 HydrophobicContact CE2-CB 3.7Å; L1140-D1142 VanDerWaalsContact C-N 3.29Å; L1140-D1142 PolarHBondContact O-N 3.25Å; D1142-T1144 VanDerWaalsContact C-N 3.31Å; D1142-S1145 PolarHBondContact O-N 3.13Å; D1142-C1146 WeakPolarHBondContact O-CB 3.46Å; D1142-C1146 PolarHBondContact O-N 2.96Å; D1142-C1146 PolarHBondContact O-SG 3.2Å; D1142-C1146 VanDerWaalsContact O-SG 3.34Å; D1142-S1237 WeakPolarHBondContact OD1-CA 3.32Å; D1142-S1237 WeakPolarHBondContact OD1-CB 3.46Å; D1142-R1248 IonicContact OD1-NH2 3.4Å; D1142-R1248 PolarHBondContact OD1-NH2 3.49Å; D1142-R1248 IonicContact OD2-CZ 3.8Å; D1142-R1248 IonicContact OD2-NE 2.86Å; D1142-R1248 PolarHBondContact OD2-NE 2.94Å; D1142-R1248 IonicContact OD2-NH2 3.2Å; D1142-R1248 PolarHBondContact OD2-NH2 3.4Å; D1142-P1254 HydrophobicContact CB-CB 4.04Å; D1142-P1254 VanDerWaalsContact OD2-C 3.31Å; D1142-P1254 WeakPolarHBondContact OD2-CA 3.38Å; D1142-L1255 WeakPolarHBondContact OD1-CD1 3.29Å; D1142-L1255 PolarHBondContact OD2-N 3.14Å; D1142-S1272 VanDerWaalsContact OD2-O 3.08Å; D1142-Y1273 VanDerWaalsContact OD2-C 3.28Å; D1142-Y1273 WeakPolarHBondContact OD2-CA 3.35Å; D1142-L1274 PolarHBondContact OD2-N 3.44Å
1143H80.8Confident81.3Confident3.4 Ų3.418 Ų182%0.0169%0.094CC..Hα-helixtrans-65.2-40.3172.1-63.464.8000110.8T1047 T1050 Y1051 L1054 Y1133 L1140 P1141 C1146 A1147T1047-H1143 VanDerWaalsContact CG2-CE1 3.42Å; T1047-H1143 WeakPolarHBondContact CG2-CE1 3.37Å; T1047-H1143 PolarHBondContact O-CE1 3.02Å; T1047-H1143 PolarHBondContact O-NE2 3.21Å; T1047-H1143 VanDerWaalsContact O-NE2 3.12Å; T1050-H1143 PolarHBondContact OG1-CD2 3.19Å; T1050-H1143 PolarHBondContact OG1-NE2 3.19Å; Y1051-H1143 PolarHBondContact N-NE2 3Å; L1054-H1143 HydrophobicContact CD1-CB 3.94Å; Y1133-H1143 HydrophobicContact CD1-CB 4.1Å; Y1133-H1143 AromaticContact CD1-CD2 3.94Å; Y1133-H1143 AromaticContact CE1-CD2 3.86Å; Y1133-H1143 HydrophobicContact CG-CB 4.48Å; L1140-H1143 HydrophobicContact CB-CB 4.02Å; L1140-H1143 PolarHBondContact O-N 3.11Å; P1141-H1143 PolarHBondContact O-N 2.85Å; H1143-C1146 WeakPolarHBondContact O-CB 3.45Å; H1143-C1146 PolarHBondContact O-N 3.11Å; H1143-A1147 VanDerWaalsContact O-CB 3.31Å; H1143-A1147 WeakPolarHBondContact O-CB 3.39Å; H1143-A1147 PolarHBondContact O-N 3.34Å
1144T82.4Confident81.3Confident0 Ų018 Ų180%010%0.095CC..Hα-helixtrans-67.1-42.2177.4-17.90000111.5Y1133 C1134 A1137 L1140 P1141 D1142 C1146 A1147 V1148 L1185 I1317Y1133-T1144 VanDerWaalsContact O-CG2 3.32Å; Y1133-T1144 WeakPolarHBondContact O-CG2 3.38Å; Y1133-T1144 PolarHBondContact O-OG1 2.89Å; Y1133-T1144 VanDerWaalsContact O-OG1 3.09Å; C1134-T1144 HydrophobicContact CB-CG2 4.34Å; A1137-T1144 VanDerWaalsContact CA-CG2 3.45Å; A1137-T1144 VanDerWaalsContact CA-OG1 3.29Å; A1137-T1144 WeakPolarHBondContact CA-OG1 3.4Å; A1137-T1144 HydrophobicContact CB-CG2 4.04Å; A1137-T1144 PolarHBondContact N-OG1 3.49Å; L1140-T1144 WeakPolarHBondContact O-CG2 3.22Å; L1140-T1144 PolarHBondContact O-N 3.32Å; L1140-T1144 VanDerWaalsContact O-N 3.11Å; L1140-T1144 PolarHBondContact O-OG1 3.27Å; P1141-T1144 WeakPolarHBondContact CA-OG1 3.46Å; P1141-T1144 CarbonylContact O-C 3.59Å; P1141-T1144 WeakPolarHBondContact O-CB 3.31Å; P1141-T1144 PolarHBondContact O-N 3.11Å; P1141-T1144 PolarHBondContact O-OG1 3.36Å; D1142-T1144 VanDerWaalsContact C-N 3.31Å; T1144-C1146 VanDerWaalsContact C-N 3.33Å; T1144-C1146 PolarHBondContact O-N 3.05Å; T1144-A1147 PolarHBondContact O-N 3.05Å; T1144-A1147 VanDerWaalsContact O-N 3.12Å; T1144-V1148 HydrophobicContact CG2-CG2 4.37Å; T1144-V1148 WeakPolarHBondContact O-CB 3.38Å; T1144-V1148 VanDerWaalsContact O-CG2 3.27Å; T1144-V1148 WeakPolarHBondContact O-CG2 3.33Å; T1144-V1148 PolarHBondContact O-N 2.97Å; T1144-L1185 HydrophobicContact CG2-CD1 4.41Å; T1144-L1185 HydrophobicContact CG2-CD2 3.56Å; T1144-I1317 HydrophobicContact CG2-CD1 3.98Å; T1144-I1317 HydrophobicContact CG2-CG2 4.13Å; T1144-I1317 WeakPolarHBondContact OG1-CD1 3.14Å
1145S77.3Confident81.2Confident30.4 Ų30.418.1 Ų18.121%0.21310%0.095CC..Hα-helixtrans-58.8-44.6172.9-179.50000111.5P1141 D1142 A1147 V1148 S1149P1141-S1145 WeakPolarHBondContact O-CB 3.39Å; P1141-S1145 PolarHBondContact O-N 3.05Å; D1142-S1145 PolarHBondContact O-N 3.13Å; S1145-A1147 PolarHBondContact O-N 3.36Å; S1145-V1148 PolarHBondContact O-N 3.38Å; S1145-S1149 WeakPolarHBondContact O-CB 3.27Å; S1145-S1149 PolarHBondContact O-N 2.99Å; S1145-S1149 PolarHBondContact O-OG 3.23Å; S1145-S1149 VanDerWaalsContact O-OG 3.13Å
1146C82Confident81.1Confident5 Ų517.2 Ų17.23%0.0349%0.094CC..Hα-helixtrans-62.6-43173.7-84.40000112.3Y1051 L1054 D1142 H1143 T1144 V1148 S1149 I1150Y1051-C1146 VanDerWaalsContact CE2-SG 3.56Å; L1054-C1146 HydrophobicContact CB-CB 4.07Å; L1054-C1146 PolarHBondContact O-SG 3.48Å; L1054-C1146 VanDerWaalsContact O-SG 3.33Å; D1142-C1146 WeakPolarHBondContact O-CB 3.46Å; D1142-C1146 PolarHBondContact O-N 2.96Å; D1142-C1146 PolarHBondContact O-SG 3.2Å; D1142-C1146 VanDerWaalsContact O-SG 3.34Å; H1143-C1146 WeakPolarHBondContact O-CB 3.45Å; H1143-C1146 PolarHBondContact O-N 3.11Å; T1144-C1146 VanDerWaalsContact C-N 3.33Å; T1144-C1146 PolarHBondContact O-N 3.05Å; C1146-V1148 PolarHBondContact O-N 3.48Å; C1146-S1149 WeakPolarHBondContact CA-OG 3.24Å; C1146-S1149 PolarHBondContact O-N 3.2Å; C1146-S1149 PolarHBondContact O-OG 3.22Å; C1146-S1149 VanDerWaalsContact O-OG 3.05Å; C1146-I1150 WeakPolarHBondContact O-CB 3.39Å; C1146-I1150 WeakPolarHBondContact O-CD1 3.24Å; C1146-I1150 VanDerWaalsContact O-CG1 3.26Å; C1146-I1150 WeakPolarHBondContact O-CG1 3.22Å; C1146-I1150 PolarHBondContact O-N 3.14Å
1147A89.1Confident81.1Confident0 Ų018.9 Ų18.90%011%0.107CC..Hα-helixtrans-65.9-39.1178.300000112.6H1143 T1144 S1145 I1150 L1151H1143-A1147 VanDerWaalsContact O-CB 3.31Å; H1143-A1147 WeakPolarHBondContact O-CB 3.39Å; H1143-A1147 PolarHBondContact O-N 3.34Å; T1144-A1147 PolarHBondContact O-N 3.05Å; T1144-A1147 VanDerWaalsContact O-N 3.12Å; S1145-A1147 PolarHBondContact O-N 3.36Å; A1147-I1150 WeakPolarHBondContact O-CB 3.41Å; A1147-I1150 PolarHBondContact O-N 3.15Å; A1147-L1151 PolarHBondContact O-N 3.19Å
1148V86.8Confident81.5Confident0.8 Ų0.819.3 Ų19.31%0.00511%0.108CC..Hα-helixtrans-66.3-43.5175.31700000111T1144 S1145 C1146 I1150 L1151 G1152 L1185 I1317 F1321 I1324T1144-V1148 HydrophobicContact CG2-CG2 4.37Å; T1144-V1148 WeakPolarHBondContact O-CB 3.38Å; T1144-V1148 VanDerWaalsContact O-CG2 3.27Å; T1144-V1148 WeakPolarHBondContact O-CG2 3.33Å; T1144-V1148 PolarHBondContact O-N 2.97Å; S1145-V1148 PolarHBondContact O-N 3.38Å; C1146-V1148 PolarHBondContact O-N 3.48Å; V1148-I1150 VanDerWaalsContact C-N 3.35Å; V1148-I1150 PolarHBondContact O-N 3.11Å; V1148-L1151 VanDerWaalsContact O-CB 3.3Å; V1148-L1151 WeakPolarHBondContact O-CB 3.31Å; V1148-L1151 PolarHBondContact O-N 3.15Å; V1148-L1151 VanDerWaalsContact O-N 3.14Å; V1148-G1152 PolarHBondContact O-N 3.12Å; V1148-L1185 HydrophobicContact CG2-CD1 3.55Å; V1148-L1185 VanDerWaalsContact CG2-CD1 3.49Å; V1148-I1317 HydrophobicContact CG2-CG2 4.02Å; V1148-F1321 HydrophobicContact CG1-CB 4.17Å; V1148-F1321 HydrophobicContact CG1-CD2 4.36Å; V1148-F1321 HydrophobicContact CG2-CD2 4.45Å; V1148-I1324 HydrophobicContact CG1-CD1 3.59Å; V1148-I1324 VanDerWaalsContact CG1-CD1 3.48Å; V1148-I1324 WeakPolarHBondContact O-CD1 3.35Å
1149S83.3Confident82Confident18.4 Ų18.421.5 Ų21.513%0.12912%0.116CC..Hα-helixtrans-64.7-40.2174.542.20000112.3R1058 S1145 C1146 L1151 G1152 Y1153R1058-S1149 WeakPolarHBondContact CD-OG 3.29Å; R1058-S1149 VanDerWaalsContact CG-OG 3.29Å; R1058-S1149 WeakPolarHBondContact CG-OG 3.44Å; S1145-S1149 WeakPolarHBondContact O-CB 3.27Å; S1145-S1149 PolarHBondContact O-N 2.99Å; S1145-S1149 PolarHBondContact O-OG 3.23Å; S1145-S1149 VanDerWaalsContact O-OG 3.13Å; C1146-S1149 WeakPolarHBondContact CA-OG 3.24Å; C1146-S1149 PolarHBondContact O-N 3.2Å; C1146-S1149 PolarHBondContact O-OG 3.22Å; C1146-S1149 VanDerWaalsContact O-OG 3.05Å; S1149-L1151 VanDerWaalsContact C-N 3.31Å; S1149-L1151 PolarHBondContact O-N 3.2Å; S1149-G1152 WeakPolarHBondContact O-CA 3.4Å; S1149-G1152 PolarHBondContact O-N 3.18Å; S1149-G1152 VanDerWaalsContact O-N 3.12Å; S1149-Y1153 WeakPolarHBondContact O-CD2 3.36Å; S1149-Y1153 PolarHBondContact O-N 3.03Å
1150I88.7Confident82.6Confident0.4 Ų0.420.8 Ų20.80%0.00212%0.122CC..Hα-helixtrans-57.3-44.8171.6-71.9165.3000110.4L1054 I1057 R1058 L1061 C1146 A1147 V1148 G1152 Y1153 L1154L1054-I1150 HydrophobicContact CD2-CD1 4.08Å; I1057-I1150 HydrophobicContact CB-CD1 4.47Å; I1057-I1150 HydrophobicContact CG2-CD1 4.2Å; I1057-I1150 HydrophobicContact CG2-CG1 4.47Å; R1058-I1150 HydrophobicContact CB-CD1 4.3Å; R1058-I1150 HydrophobicContact CB-CG1 3.87Å; R1058-I1150 HydrophobicContact CG-CG1 4.37Å; L1061-I1150 HydrophobicContact CD1-CB 4.36Å; L1061-I1150 HydrophobicContact CD1-CG1 4.19Å; L1061-I1150 HydrophobicContact CD1-CG2 3.84Å; C1146-I1150 WeakPolarHBondContact O-CB 3.39Å; C1146-I1150 WeakPolarHBondContact O-CD1 3.24Å; C1146-I1150 VanDerWaalsContact O-CG1 3.26Å; C1146-I1150 WeakPolarHBondContact O-CG1 3.22Å; C1146-I1150 PolarHBondContact O-N 3.14Å; A1147-I1150 WeakPolarHBondContact O-CB 3.41Å; A1147-I1150 PolarHBondContact O-N 3.15Å; V1148-I1150 VanDerWaalsContact C-N 3.35Å; V1148-I1150 PolarHBondContact O-N 3.11Å; I1150-G1152 VanDerWaalsContact C-N 3.3Å; I1150-G1152 PolarHBondContact O-N 3.18Å; I1150-Y1153 PolarHBondContact O-N 3.31Å; I1150-L1154 HydrophobicContact CG2-CD1 3.72Å; I1150-L1154 HydrophobicContact CG2-CG 4.18Å; I1150-L1154 WeakPolarHBondContact O-CB 3.38Å; I1150-L1154 VanDerWaalsContact O-CG 3.25Å; I1150-L1154 WeakPolarHBondContact O-CG 3.34Å; I1150-L1154 PolarHBondContact O-N 3.31Å
1151L89.5Confident83Confident0.2 Ų0.220.6 Ų20.60%0.00112%0.121CC..Hα-helixtrans-57.3-44.9174.7-177.563.6000111.7L1131 A1147 V1148 S1149 L1154 A1155 F1182 F1321 L1336L1131-L1151 HydrophobicContact CD1-CD1 3.92Å; L1131-L1151 HydrophobicContact CD2-CB 3.73Å; L1131-L1151 HydrophobicContact CD2-CD1 4.01Å; L1131-L1151 HydrophobicContact CD2-CD2 4.36Å; L1131-L1151 HydrophobicContact CD2-CG 4.32Å; A1147-L1151 PolarHBondContact O-N 3.19Å; V1148-L1151 VanDerWaalsContact O-CB 3.3Å; V1148-L1151 WeakPolarHBondContact O-CB 3.31Å; V1148-L1151 PolarHBondContact O-N 3.15Å; V1148-L1151 VanDerWaalsContact O-N 3.14Å; S1149-L1151 VanDerWaalsContact C-N 3.31Å; S1149-L1151 PolarHBondContact O-N 3.2Å; L1151-L1154 PolarHBondContact O-N 3.27Å; L1151-A1155 VanDerWaalsContact O-CB 3.26Å; L1151-A1155 WeakPolarHBondContact O-CB 3.4Å; L1151-A1155 PolarHBondContact O-N 3.14Å; L1151-F1182 HydrophobicContact CD2-CE1 3.85Å; L1151-F1182 HydrophobicContact CD2-CZ 3.93Å; L1151-F1321 HydrophobicContact CD2-CD2 4.37Å; L1151-F1321 HydrophobicContact CD2-CE2 3.97Å; L1151-L1336 HydrophobicContact CD1-CD2 3.94Å; L1151-L1336 HydrophobicContact CD2-CD2 4.41Å; L1151-L1336 HydrophobicContact CG-CD2 4.33Å
1152G86.6Confident83.7Confident4.8 Ų4.822.5 Ų22.55%0.04914%0.135CC..Hα-helixtrans-60.7-45.7177.400000113.1V1148 S1149 I1150 A1155 S1156V1148-G1152 PolarHBondContact O-N 3.12Å; S1149-G1152 WeakPolarHBondContact O-CA 3.4Å; S1149-G1152 PolarHBondContact O-N 3.18Å; S1149-G1152 VanDerWaalsContact O-N 3.12Å; I1150-G1152 VanDerWaalsContact C-N 3.3Å; I1150-G1152 PolarHBondContact O-N 3.18Å; G1152-A1155 PolarHBondContact O-N 3.35Å; G1152-S1156 WeakPolarHBondContact O-CB 3.42Å; G1152-S1156 PolarHBondContact O-N 3.17Å; G1152-S1156 VanDerWaalsContact O-N 3.08Å; G1152-S1156 PolarHBondContact O-OG 3.32Å
1153Y85.6Confident84.4Confident29 Ų2925.2 Ų25.211%0.11415%0.149CC..Hα-helixtrans-65.5-41175.6-68-61.4000112.4R1058 L1061 A1062 S1149 I1150 A1155 S1156 S1157 D1295 Y1297R1058-Y1153 HydrophobicContact CG-CD2 4.39Å; R1058-Y1153 HydrophobicContact CG-CE2 4.05Å; L1061-Y1153 HydrophobicContact CB-CD2 4.31Å; L1061-Y1153 HydrophobicContact CB-CG 4.18Å; A1062-Y1153 VanDerWaalsContact CA-CE1 3.46Å; A1062-Y1153 HydrophobicContact CB-CD1 4.43Å; A1062-Y1153 HydrophobicContact CB-CD2 4.46Å; A1062-Y1153 HydrophobicContact CB-CE1 3.78Å; A1062-Y1153 HydrophobicContact CB-CE2 3.92Å; A1062-Y1153 VanDerWaalsContact CB-CZ 3.47Å; A1062-Y1153 VanDerWaalsContact CB-OH 3.27Å; A1062-Y1153 WeakPolarHBondContact CB-OH 3.32Å; S1149-Y1153 WeakPolarHBondContact O-CD2 3.36Å; S1149-Y1153 PolarHBondContact O-N 3.03Å; I1150-Y1153 PolarHBondContact O-N 3.31Å; Y1153-A1155 PolarHBondContact O-N 2.89Å; Y1153-S1156 PolarHBondContact O-N 3Å; Y1153-S1156 PolarHBondContact O-OG 3.29Å; Y1153-S1157 WeakPolarHBondContact O-CB 3.34Å; Y1153-S1157 PolarHBondContact O-N 3.08Å; Y1153-S1157 VanDerWaalsContact O-N 3.15Å; Y1153-S1157 PolarHBondContact O-OG 3.16Å; Y1153-D1295 PolarHBondContact OH-OD1 3.22Å; Y1153-Y1297 AromaticContact CD1-CD1 3.69Å; Y1153-Y1297 HydrophobicContact CD1-CD1 3.69Å; Y1153-Y1297 AromaticContact CD1-CD2 3.9Å; Y1153-Y1297 HydrophobicContact CD1-CD2 4.13Å; Y1153-Y1297 AromaticContact CD1-CE1 3.67Å; Y1153-Y1297 HydrophobicContact CD1-CE1 3.67Å; Y1153-Y1297 AromaticContact CD1-CE2 3.88Å; Y1153-Y1297 HydrophobicContact CD1-CE2 3.88Å; Y1153-Y1297 AromaticContact CD1-CG 3.82Å; Y1153-Y1297 HydrophobicContact CD1-CG 4Å; Y1153-Y1297 AromaticContact CD1-CZ 3.78Å; Y1153-Y1297 HydrophobicContact CD2-CD2 4.32Å; Y1153-Y1297 AromaticContact CE1-CD1 3.69Å; Y1153-Y1297 HydrophobicContact CE1-CD1 4.03Å; Y1153-Y1297 AromaticContact CE1-CD2 3.64Å; Y1153-Y1297 HydrophobicContact CE1-CD2 4.06Å; Y1153-Y1297 HydrophobicContact CE1-CE1 4.16Å; Y1153-Y1297 HydrophobicContact CE1-CE2 4.1Å; Y1153-Y1297 AromaticContact CE1-CG 3.53Å; Y1153-Y1297 HydrophobicContact CE1-CG 3.77Å; Y1153-Y1297 VanDerWaalsContact CE1-CG 3.43Å; Y1153-Y1297 HydrophobicContact CE2-CD1 4.49Å; Y1153-Y1297 HydrophobicContact CE2-CD2 4.09Å; Y1153-Y1297 HydrophobicContact CE2-CG 4.35Å; Y1153-Y1297 HydrophobicContact CG-CD2 4.44Å; Y1153-Y1297 VanDerWaalsContact CZ-CB 3.42Å; Y1153-Y1297 AromaticContact CZ-CD1 3.95Å; Y1153-Y1297 AromaticContact CZ-CD2 3.96Å; Y1153-Y1297 AromaticContact CZ-CG 3.81Å; Y1153-Y1297 WeakPolarHBondContact OH-CB 3.32Å
1154L88Confident84.7Confident0.6 Ų0.625 Ų250%0.00315%0.148CC..Hα-helixtrans-65.1-41.6176.4-71.3175.6000112.2L1061 L1114 I1127 I1150 L1151 S1156 S1157 I1158L1061-L1154 HydrophobicContact CD1-CD2 4.37Å; L1061-L1154 HydrophobicContact CD1-CG 4.37Å; L1061-L1154 HydrophobicContact CD2-CD2 4.12Å; L1114-L1154 HydrophobicContact CD1-CD2 4.08Å; I1127-L1154 HydrophobicContact CD1-CD1 4.3Å; I1127-L1154 HydrophobicContact CD1-CD2 4.46Å; I1127-L1154 HydrophobicContact CG1-CD1 4.04Å; I1127-L1154 HydrophobicContact CG2-CD1 4.01Å; I1150-L1154 HydrophobicContact CG2-CD1 3.72Å; I1150-L1154 HydrophobicContact CG2-CG 4.18Å; I1150-L1154 WeakPolarHBondContact O-CB 3.38Å; I1150-L1154 VanDerWaalsContact O-CG 3.25Å; I1150-L1154 WeakPolarHBondContact O-CG 3.34Å; I1150-L1154 PolarHBondContact O-N 3.31Å; L1151-L1154 PolarHBondContact O-N 3.27Å; L1154-S1156 VanDerWaalsContact C-N 3.3Å; L1154-S1156 PolarHBondContact O-N 3.05Å; L1154-S1157 WeakPolarHBondContact CA-OG 3.37Å; L1154-S1157 PolarHBondContact O-N 3.09Å; L1154-S1157 PolarHBondContact O-OG 3.2Å; L1154-I1158 HydrophobicContact CB-CD1 4.34Å; L1154-I1158 HydrophobicContact CD2-CD1 4.06Å; L1154-I1158 WeakPolarHBondContact O-CB 3.33Å; L1154-I1158 WeakPolarHBondContact O-CG1 3.4Å; L1154-I1158 PolarHBondContact O-N 3.02Å
1155A86.6Confident84.9Confident1.8 Ų1.825.4 Ų25.42%0.01515%0.15CC..Hα-helixtrans-67.2-26.4178.400000112.6L1151 G1152 Y1153 H1161 L1164 V1328L1151-A1155 VanDerWaalsContact O-CB 3.26Å; L1151-A1155 WeakPolarHBondContact O-CB 3.4Å; L1151-A1155 PolarHBondContact O-N 3.14Å; G1152-A1155 PolarHBondContact O-N 3.35Å; Y1153-A1155 PolarHBondContact O-N 2.89Å; A1155-H1161 PolarHBondContact O-CE1 2.84Å; A1155-H1161 PolarHBondContact O-NE2 3.27Å; A1155-H1161 VanDerWaalsContact O-NE2 3.1Å; A1155-L1164 HydrophobicContact CB-CD2 4.4Å; A1155-V1328 HydrophobicContact CB-CG2 3.74Å
1156S82.9Confident85.3Confident41.2 Ų41.226.7 Ų26.729%0.28816%0.163SC..Hα-helixtrans-82.9-37.4177.165.90000112.9G1152 Y1153 L1154 Q1159 Y1297G1152-S1156 WeakPolarHBondContact O-CB 3.42Å; G1152-S1156 PolarHBondContact O-N 3.17Å; G1152-S1156 VanDerWaalsContact O-N 3.08Å; G1152-S1156 PolarHBondContact O-OG 3.32Å; Y1153-S1156 PolarHBondContact O-N 3Å; Y1153-S1156 PolarHBondContact O-OG 3.29Å; L1154-S1156 VanDerWaalsContact C-N 3.3Å; L1154-S1156 PolarHBondContact O-N 3.05Å; S1156-Q1159 PolarHBondContact O-NE2 3.24Å; S1156-Y1297 WeakPolarHBondContact CB-OH 3.33Å; S1156-Y1297 WeakPolarHBondContact OG-CE1 3.13Å; S1156-Y1297 VanDerWaalsContact OG-CZ 3.29Å; S1156-Y1297 PolarHBondContact OG-OH 2.9Å
1157S83Confident85.5Confident46.4 Ų46.428.1 Ų28.132%0.32417%0.17SC..Hα-helixtrans-82.7-35.6-176.553.40000113.9E1064 S1111 Y1153 L1154 Q1159E1064-S1157 WeakPolarHBondContact OE1-CB 3.43Å; S1111-S1157 VanDerWaalsContact CB-OG 3.27Å; S1111-S1157 WeakPolarHBondContact CB-OG 3.44Å; Y1153-S1157 WeakPolarHBondContact O-CB 3.34Å; Y1153-S1157 PolarHBondContact O-N 3.08Å; Y1153-S1157 VanDerWaalsContact O-N 3.15Å; Y1153-S1157 PolarHBondContact O-OG 3.16Å; L1154-S1157 WeakPolarHBondContact CA-OG 3.37Å; L1154-S1157 PolarHBondContact O-N 3.09Å; L1154-S1157 PolarHBondContact O-OG 3.2Å; S1157-Q1159 PolarHBondContact O-N 3.11Å
1158I83.4Confident85.3Confident13.8 Ų13.828.1 Ų28.17%0.07117%0.17CC..SBendtrans-91.6105-177.4-59168.3000109.6M1115 I1127 L1154 H1161 L1164M1115-I1158 HydrophobicContact CE-CB 4.18Å; M1115-I1158 HydrophobicContact CE-CD1 3.52Å; M1115-I1158 HydrophobicContact CE-CG1 3.75Å; M1115-I1158 HydrophobicContact CE-CG2 3.34Å; M1115-I1158 HydrophobicContact CG-CD1 4.22Å; M1115-I1158 HydrophobicContact SD-CD1 3.93Å; M1115-I1158 HydrophobicContact SD-CG1 4.34Å; M1115-I1158 HydrophobicContact SD-CG2 4.35Å; I1127-I1158 HydrophobicContact CD1-CD1 4.27Å; L1154-I1158 HydrophobicContact CB-CD1 4.34Å; L1154-I1158 HydrophobicContact CD2-CD1 4.06Å; L1154-I1158 WeakPolarHBondContact O-CB 3.33Å; L1154-I1158 WeakPolarHBondContact O-CG1 3.4Å; L1154-I1158 PolarHBondContact O-N 3.02Å; I1158-H1161 PolarHBondContact O-CD2 3.17Å; I1158-H1161 PolarHBondContact O-NE2 2.71Å; I1158-L1164 HydrophobicContact CD1-CD1 4.36Å; I1158-L1164 HydrophobicContact CG2-CB 4.28Å
1159Q81.1Confident85.2Confident120.2 Ų120.230.5 Ų30.556%0.56218%0.184SC*.  trans-131130.6174.1-60.1-179.922.700110S1156 S1157 H1331S1156-Q1159 PolarHBondContact O-NE2 3.24Å; S1157-Q1159 PolarHBondContact O-N 3.11Å; Q1159-H1331 PolarHBondContact NE2-CE1 3.34Å
1160P82.6Confident85.2Confident74.6 Ų74.633.6 Ų33.648%0.48421%0.211SC..SBendcis-75157.51.732-36.1000114.2S1162P1160-S1162 WeakPolarHBondContact CG-OG 3.35Å; P1160-S1162 PolarHBondContact O-N 2.97Å; P1160-S1162 VanDerWaalsContact O-N 3.11Å
1161H84.7Confident85.1Confident4 Ų436.4 Ų36.42%0.01923%0.226CC..Hα-helixtrans-70.2-5.6-179.7-72.1-173.5000114.3A1155 I1158 D1163 L1164 L1165 H1331 N1335 L1336A1155-H1161 PolarHBondContact O-CE1 2.84Å; A1155-H1161 PolarHBondContact O-NE2 3.27Å; A1155-H1161 VanDerWaalsContact O-NE2 3.1Å; I1158-H1161 PolarHBondContact O-CD2 3.17Å; I1158-H1161 PolarHBondContact O-NE2 2.71Å; H1161-D1163 PolarHBondContact O-N 2.99Å; H1161-L1164 PolarHBondContact O-N 3.11Å; H1161-L1165 HydrophobicContact CB-CD1 4.34Å; H1161-L1165 VanDerWaalsContact O-CB 3.31Å; H1161-L1165 WeakPolarHBondContact O-CB 3.34Å; H1161-L1165 WeakPolarHBondContact O-CD1 3.36Å; H1161-L1165 VanDerWaalsContact O-CG 3.25Å; H1161-L1165 WeakPolarHBondContact O-CG 3.33Å; H1161-L1165 PolarHBondContact O-N 3.25Å; H1161-H1331 AromaticContact CE1-CD2 3.41Å; H1161-H1331 PolarHBondContact CE1-CD2 3.25Å; H1161-H1331 AromaticContact CE1-CG 3.83Å; H1161-H1331 AromaticContact NE2-CD2 3.46Å; H1161-H1331 PolarHBondContact NE2-CD2 3.37Å; H1161-H1331 VanDerWaalsContact NE2-CD2 3.29Å; H1161-H1331 AromaticContact NE2-CG 3.79Å; H1161-H1331 AromaticContact NE2-NE2 3.96Å; H1161-N1335 HydrophobicContact CB-CB 4.41Å; H1161-N1335 WeakPolarHBondContact ND1-CB 3.29Å; H1161-L1336 PolarHBondContact ND1-N 3.01Å
1162S84.1Confident84.9Confident51 Ų5142.2 Ų42.236%0.35725%0.253SS..Hα-helixtrans-55.4-38.717651.50000112.3P1160 A1166P1160-S1162 WeakPolarHBondContact CG-OG 3.35Å; P1160-S1162 PolarHBondContact O-N 2.97Å; P1160-S1162 VanDerWaalsContact O-N 3.11Å; S1162-A1166 VanDerWaalsContact O-CB 3.31Å; S1162-A1166 WeakPolarHBondContact O-CB 3.41Å; S1162-A1166 PolarHBondContact O-N 3.05Å
1163D84.8Confident84.9Confident82.4 Ų82.445.9 Ų45.944%0.44128%0.275SS..Hα-helixtrans-75.5-42-175.3-60.1-1.7000110.4M1115 H1161 L1165 A1166 L1167M1115-D1163 HydrophobicContact CE-CB 3.8Å; H1161-D1163 PolarHBondContact O-N 2.99Å; D1163-L1165 VanDerWaalsContact C-N 3.34Å; D1163-L1165 PolarHBondContact O-N 3.45Å; D1163-A1166 PolarHBondContact O-N 3.11Å; D1163-L1167 WeakPolarHBondContact O-CG 3.25Å; D1163-L1167 PolarHBondContact O-N 3.12Å; D1163-L1167 VanDerWaalsContact O-N 3.16Å
1164L86.5Confident84.9Confident0 Ų045.1 Ų45.10%027%0.273CS..Hα-helixtrans-61.2-45.6173.1-179.662.2000110.9I1127 A1155 I1158 H1161 A1166 L1167 L1168I1127-L1164 HydrophobicContact CD1-CD1 4.23Å; I1127-L1164 HydrophobicContact CG2-CD1 4.04Å; A1155-L1164 HydrophobicContact CB-CD2 4.4Å; I1158-L1164 HydrophobicContact CD1-CD1 4.36Å; I1158-L1164 HydrophobicContact CG2-CB 4.28Å; H1161-L1164 PolarHBondContact O-N 3.11Å; L1164-A1166 PolarHBondContact O-N 3.08Å; L1164-L1167 PolarHBondContact O-N 3.16Å; L1164-L1168 HydrophobicContact CD1-CD1 4.22Å; L1164-L1168 HydrophobicContact CD1-CG 4.37Å; L1164-L1168 HydrophobicContact CG-CD1 4.04Å; L1164-L1168 VanDerWaalsContact O-CG 3.3Å; L1164-L1168 WeakPolarHBondContact O-CG 3.33Å; L1164-L1168 PolarHBondContact O-N 3.06Å; L1164-L1168 VanDerWaalsContact O-N 3.13Å
1165L86.3Confident84.8Confident8.6 Ų8.648.9 Ų48.95%0.04529%0.287CS..Hα-helixtrans-61.4-45.8177-89.2152.3000111.4H1161 D1163 L1167 L1168 T1169 P1334 L1336 W1339 V1345H1161-L1165 HydrophobicContact CB-CD1 4.34Å; H1161-L1165 VanDerWaalsContact O-CB 3.31Å; H1161-L1165 WeakPolarHBondContact O-CB 3.34Å; H1161-L1165 WeakPolarHBondContact O-CD1 3.36Å; H1161-L1165 VanDerWaalsContact O-CG 3.25Å; H1161-L1165 WeakPolarHBondContact O-CG 3.33Å; H1161-L1165 PolarHBondContact O-N 3.25Å; D1163-L1165 VanDerWaalsContact C-N 3.34Å; D1163-L1165 PolarHBondContact O-N 3.45Å; L1165-L1167 VanDerWaalsContact C-N 3.25Å; L1165-L1167 PolarHBondContact O-N 3.18Å; L1165-L1168 PolarHBondContact O-N 3.06Å; L1165-L1168 VanDerWaalsContact O-N 3.12Å; L1165-T1169 HydrophobicContact CD1-CG2 3.76Å; L1165-T1169 HydrophobicContact CG-CG2 4.16Å; L1165-T1169 WeakPolarHBondContact O-CB 3.37Å; L1165-T1169 WeakPolarHBondContact O-CG2 3.3Å; L1165-T1169 PolarHBondContact O-N 2.94Å; L1165-T1169 PolarHBondContact O-OG1 2.99Å; L1165-P1334 HydrophobicContact CD1-CB 4.33Å; L1165-P1334 HydrophobicContact CD2-CB 4.26Å; L1165-L1336 HydrophobicContact CD2-CD1 4.28Å; L1165-W1339 HydrophobicContact CD1-CB 3.65Å; L1165-W1339 HydrophobicContact CD1-CD2 4.44Å; L1165-W1339 HydrophobicContact CD1-CG 3.83Å; L1165-W1339 HydrophobicContact CD2-CB 3.57Å; L1165-W1339 HydrophobicContact CD2-CD2 4.38Å; L1165-W1339 HydrophobicContact CD2-CG 3.97Å; L1165-V1345 HydrophobicContact CD1-CB 4.34Å; L1165-V1345 HydrophobicContact CD1-CG1 3.9Å; L1165-V1345 VanDerWaalsContact CD1-CG1 3.45Å; L1165-V1345 HydrophobicContact CD1-CG2 4.46Å; L1165-V1345 HydrophobicContact CD2-CB 3.9Å; L1165-V1345 HydrophobicContact CD2-CG1 4.04Å; L1165-V1345 HydrophobicContact CG-CG1 4.41Å
1166A85.7Confident84.9Confident57.8 Ų57.850.8 Ų50.848%0.47830%0.297SS..Hα-helixtrans-56.8-38.6178.400000112.3S1162 D1163 L1164 A1170S1162-A1166 VanDerWaalsContact O-CB 3.31Å; S1162-A1166 WeakPolarHBondContact O-CB 3.41Å; S1162-A1166 PolarHBondContact O-N 3.05Å; D1163-A1166 PolarHBondContact O-N 3.11Å; L1164-A1166 PolarHBondContact O-N 3.08Å; A1166-A1170 WeakPolarHBondContact O-CB 3.33Å; A1166-A1170 PolarHBondContact O-N 3.03Å; A1166-A1170 VanDerWaalsContact O-N 3.17Å
1167L85.8Confident85.1Confident33.6 Ų33.652.8 Ų52.818%0.17630%0.302CS..Hα-helixtrans-70-41.4175.7-65.1174.2000112.6M1115 A1124 I1127 P1128 D1163 L1164 L1165M1115-L1167 HydrophobicContact CB-CD1 4.19Å; M1115-L1167 HydrophobicContact CE-CD1 4Å; M1115-L1167 HydrophobicContact CG-CD1 3.86Å; M1115-L1167 HydrophobicContact SD-CD1 4.42Å; A1124-L1167 HydrophobicContact CB-CD2 3.74Å; A1124-L1167 VanDerWaalsContact CB-CD2 3.5Å; A1124-L1167 WeakPolarHBondContact O-CD2 3.28Å; I1127-L1167 HydrophobicContact CD1-CD1 4.12Å; P1128-L1167 WeakPolarHBondContact CG-O 3.38Å; D1163-L1167 WeakPolarHBondContact O-CG 3.25Å; D1163-L1167 PolarHBondContact O-N 3.12Å; D1163-L1167 VanDerWaalsContact O-N 3.16Å; L1164-L1167 PolarHBondContact O-N 3.16Å; L1165-L1167 VanDerWaalsContact C-N 3.25Å; L1165-L1167 PolarHBondContact O-N 3.18Å
1168L86.2Confident85.4Confident0 Ų050.6 Ų50.60%029%0.286CS..Hα-helixtrans-73.9-28.6-179.1-64.6175.3000113.4I1127 P1128 L1131 L1164 L1165 L1178 L1336 W1339I1127-L1168 HydrophobicContact CG2-CD2 4.1Å; P1128-L1168 HydrophobicContact CG-CD2 4.33Å; L1131-L1168 HydrophobicContact CD1-CD2 3.56Å; L1164-L1168 HydrophobicContact CD1-CD1 4.22Å; L1164-L1168 HydrophobicContact CD1-CG 4.37Å; L1164-L1168 HydrophobicContact CG-CD1 4.04Å; L1164-L1168 VanDerWaalsContact O-CG 3.3Å; L1164-L1168 WeakPolarHBondContact O-CG 3.33Å; L1164-L1168 PolarHBondContact O-N 3.06Å; L1164-L1168 VanDerWaalsContact O-N 3.13Å; L1165-L1168 PolarHBondContact O-N 3.06Å; L1165-L1168 VanDerWaalsContact O-N 3.12Å; L1168-L1178 HydrophobicContact CD2-CD1 4.02Å; L1168-L1336 HydrophobicContact CD1-CD1 3.62Å; L1168-L1336 VanDerWaalsContact CD1-CD1 3.42Å; L1168-W1339 HydrophobicContact CD1-CZ3 4.37Å
1169T84.6Confident85.6Confident50.8 Ų50.850.5 Ų50.531%0.31229%0.286SS..Hα-helixtrans-101.41.6-177.5660000114L1165 D1171 R1175 W1339L1165-T1169 HydrophobicContact CD1-CG2 3.76Å; L1165-T1169 HydrophobicContact CG-CG2 4.16Å; L1165-T1169 WeakPolarHBondContact O-CB 3.37Å; L1165-T1169 WeakPolarHBondContact O-CG2 3.3Å; L1165-T1169 PolarHBondContact O-N 2.94Å; L1165-T1169 PolarHBondContact O-OG1 2.99Å; T1169-D1171 VanDerWaalsContact C-N 3.33Å; T1169-D1171 PolarHBondContact O-N 3.19Å; T1169-R1175 HydrophobicContact CG2-CG 4.21Å; T1169-W1339 HydrophobicContact CG2-CD2 4.37Å; T1169-W1339 HydrophobicContact CG2-CG 4.41Å; T1169-W1339 HydrophobicContact CG2-CZ2 4.47Å
1170A83.4Confident85.9Confident83.6 Ų83.646.3 Ų46.369%0.69128%0.275SS*.SBendtrans-61.9-39.9-176.100000113.6A1166A1166-A1170 WeakPolarHBondContact O-CB 3.33Å; A1166-A1170 PolarHBondContact O-N 3.03Å; A1166-A1170 VanDerWaalsContact O-N 3.17Å
1171D85.2Confident86.1Confident59 Ų5942.9 Ų42.932%0.31625%0.253SS..SBendtrans-112.7119.7177.1177.9-5.7000109.4T1169 T1173 T1174 R1175T1169-D1171 VanDerWaalsContact C-N 3.33Å; T1169-D1171 PolarHBondContact O-N 3.19Å; D1171-T1173 VanDerWaalsContact C-N 3.26Å; D1171-T1173 VanDerWaalsContact CG-OG1 3.26Å; D1171-T1173 PolarHBondContact O-N 3.21Å; D1171-T1173 WeakPolarHBondContact OD1-CB 3.39Å; D1171-T1173 PolarHBondContact OD1-N 3.11Å; D1171-T1173 PolarHBondContact OD1-OG1 3.13Å; D1171-T1173 PolarHBondContact OD2-OG1 3.13Å; D1171-T1173 VanDerWaalsContact OD2-OG1 3.09Å; D1171-T1174 HydrophobicContact CB-CG2 4.01Å; D1171-T1174 WeakPolarHBondContact CB-OG1 3.22Å; D1171-T1174 PolarHBondContact O-N 3.16Å; D1171-T1174 VanDerWaalsContact O-N 3.14Å; D1171-T1174 PolarHBondContact O-OG1 3.25Å; D1171-R1175 WeakPolarHBondContact O-CB 3.32Å; D1171-R1175 PolarHBondContact O-N 3.02Å
1172E85.4Confident86.3Confident123.6 Ų123.642.7 Ų42.758%0.57825%0.253SS*.Hα-helixtrans-55.4-39.1-179.6177.2163.9-149.500112.2T1174 R1175 N1176E1172-T1174 PolarHBondContact O-N 3.39Å; E1172-R1175 WeakPolarHBondContact O-CB 3.02Å; E1172-R1175 PolarHBondContact O-N 3.09Å; E1172-R1175 IonicContact OE1-CZ 2.77Å; E1172-R1175 IonicContact OE1-NH1 3.07Å; E1172-R1175 IonicContact OE1-NH2 3.5Å; E1172-R1175 PolarHBondContact OE1-NH2 3.14Å; E1172-R1175 VanDerWaalsContact OE1-NH2 3.14Å; E1172-N1176 WeakPolarHBondContact O-CB 3.38Å; E1172-N1176 PolarHBondContact O-N 3.3Å; E1172-N1176 PolarHBondContact O-ND2 3.07Å; E1172-N1176 PolarHBondContact O-OD1 2.97Å; E1172-N1176 VanDerWaalsContact O-OD1 3.1Å
1173T85.9Confident86.5Confident81.2 Ų81.240.6 Ų40.650%0.49824%0.237SC..Hα-helixtrans-65.6-44.2-179.765.40000111.3D1171 N1176 Q1177D1171-T1173 VanDerWaalsContact C-N 3.26Å; D1171-T1173 VanDerWaalsContact CG-OG1 3.26Å; D1171-T1173 PolarHBondContact O-N 3.21Å; D1171-T1173 WeakPolarHBondContact OD1-CB 3.39Å; D1171-T1173 PolarHBondContact OD1-N 3.11Å; D1171-T1173 PolarHBondContact OD1-OG1 3.13Å; D1171-T1173 PolarHBondContact OD2-OG1 3.13Å; D1171-T1173 VanDerWaalsContact OD2-OG1 3.09Å; T1173-N1176 PolarHBondContact O-N 3.23Å; T1173-Q1177 WeakPolarHBondContact O-CB 3.32Å; T1173-Q1177 VanDerWaalsContact O-CG 3.29Å; T1173-Q1177 WeakPolarHBondContact O-CG 3.4Å; T1173-Q1177 PolarHBondContact O-N 3.16Å
1174T85.7Confident86.4Confident12.4 Ų12.440.2 Ų40.28%0.07623%0.23CC..Hα-helixtrans-69.1-40.1178.467.40000111.9K1132 D1171 E1172 N1176 Q1177 L1178K1132-T1174 VanDerWaalsContact NZ-CG2 3.28Å; D1171-T1174 HydrophobicContact CB-CG2 4.01Å; D1171-T1174 WeakPolarHBondContact CB-OG1 3.22Å; D1171-T1174 PolarHBondContact O-N 3.16Å; D1171-T1174 VanDerWaalsContact O-N 3.14Å; D1171-T1174 PolarHBondContact O-OG1 3.25Å; E1172-T1174 PolarHBondContact O-N 3.39Å; T1174-N1176 VanDerWaalsContact C-N 3.31Å; T1174-N1176 PolarHBondContact O-N 3.18Å; T1174-Q1177 PolarHBondContact O-N 3.05Å; T1174-L1178 VanDerWaalsContact O-CB 3.25Å; T1174-L1178 WeakPolarHBondContact O-CB 3.36Å; T1174-L1178 VanDerWaalsContact O-CG 3.29Å; T1174-L1178 WeakPolarHBondContact O-CG 3.45Å; T1174-L1178 PolarHBondContact O-N 3.18Å
1175R87.8Confident86.3Confident80.2 Ų80.240.5 Ų40.530%0.30323%0.232SC..Hα-helixtrans-55.6-48.4175.2-176.5-166.668.9169.1-4.3110.5T1169 D1171 E1172 L1179 W1339T1169-R1175 HydrophobicContact CG2-CG 4.21Å; D1171-R1175 WeakPolarHBondContact O-CB 3.32Å; D1171-R1175 PolarHBondContact O-N 3.02Å; E1172-R1175 WeakPolarHBondContact O-CB 3.02Å; E1172-R1175 PolarHBondContact O-N 3.09Å; E1172-R1175 IonicContact OE1-CZ 2.77Å; E1172-R1175 IonicContact OE1-NH1 3.07Å; E1172-R1175 IonicContact OE1-NH2 3.5Å; E1172-R1175 PolarHBondContact OE1-NH2 3.14Å; E1172-R1175 VanDerWaalsContact OE1-NH2 3.14Å; R1175-L1179 VanDerWaalsContact O-CB 3.27Å; R1175-L1179 WeakPolarHBondContact O-CB 3.4Å; R1175-L1179 PolarHBondContact O-N 3.28Å; R1175-W1339 HydrophobicContact CB-CZ2 4.48Å; R1175-W1339 HydrophobicContact CG-CZ2 3.7Å
1176N86.7Confident86.1Confident41.6 Ų41.640.1 Ų40.122%0.22223%0.23CC..Hα-helixtrans-69.4-41.5-177.7-59-10000111.5E1172 T1173 T1174 L1179 G1180 Q1365E1172-N1176 WeakPolarHBondContact O-CB 3.38Å; E1172-N1176 PolarHBondContact O-N 3.3Å; E1172-N1176 PolarHBondContact O-ND2 3.07Å; E1172-N1176 PolarHBondContact O-OD1 2.97Å; E1172-N1176 VanDerWaalsContact O-OD1 3.1Å; T1173-N1176 PolarHBondContact O-N 3.23Å; T1174-N1176 VanDerWaalsContact C-N 3.31Å; T1174-N1176 PolarHBondContact O-N 3.18Å; N1176-L1179 PolarHBondContact O-N 3.01Å; N1176-G1180 PolarHBondContact O-N 3.18Å; N1176-Q1365 VanDerWaalsContact CG-CD 3.46Å; N1176-Q1365 VanDerWaalsContact CG-OE1 3.27Å; N1176-Q1365 PolarHBondContact ND2-NE2 3.23Å; N1176-Q1365 VanDerWaalsContact ND2-NE2 3.18Å; N1176-Q1365 VanDerWaalsContact OD1-CD 3.29Å; N1176-Q1365 PolarHBondContact OD1-NE2 3.2Å; N1176-Q1365 VanDerWaalsContact OD1-NE2 3.1Å; N1176-Q1365 PolarHBondContact OD1-OE1 2.89Å; N1176-Q1365 VanDerWaalsContact OD1-OE1 3.06Å
1177Q88.4Confident85.6Confident83.2 Ų83.241.2 Ų41.239%0.38922%0.224SC..Hα-helixtrans-61.8-47.4175.3-76.1175.2-6.700112K1132 L1135 T1173 T1174 G1180 A1181K1132-Q1177 VanDerWaalsContact CE-OE1 3.31Å; L1135-Q1177 HydrophobicContact CD1-CB 4.43Å; L1135-Q1177 HydrophobicContact CD2-CB 4.34Å; L1135-Q1177 WeakPolarHBondContact CD2-O 3.49Å; T1173-Q1177 WeakPolarHBondContact O-CB 3.32Å; T1173-Q1177 VanDerWaalsContact O-CG 3.29Å; T1173-Q1177 WeakPolarHBondContact O-CG 3.4Å; T1173-Q1177 PolarHBondContact O-N 3.16Å; T1174-Q1177 PolarHBondContact O-N 3.05Å; Q1177-G1180 PolarHBondContact O-N 3.23Å; Q1177-A1181 WeakPolarHBondContact O-CB 3.42Å; Q1177-A1181 PolarHBondContact O-N 3.06Å
1178L89.3Confident84.4Confident0 Ų040.9 Ų40.90%022%0.22CC..Hα-helixtrans-65.7-43.4179.2-71.8175.1000111.4P1128 L1131 K1132 L1168 T1174 G1180 A1181 F1182 W1339P1128-L1178 HydrophobicContact CB-CD1 4.32Å; L1131-L1178 VanDerWaalsContact C-CD2 3.49Å; L1131-L1178 HydrophobicContact CB-CD2 3.71Å; K1132-L1178 HydrophobicContact CG-CD2 4.13Å; L1168-L1178 HydrophobicContact CD2-CD1 4.02Å; T1174-L1178 VanDerWaalsContact O-CB 3.25Å; T1174-L1178 WeakPolarHBondContact O-CB 3.36Å; T1174-L1178 VanDerWaalsContact O-CG 3.29Å; T1174-L1178 WeakPolarHBondContact O-CG 3.45Å; T1174-L1178 PolarHBondContact O-N 3.18Å; L1178-G1180 VanDerWaalsContact C-N 3.32Å; L1178-G1180 PolarHBondContact O-N 3.19Å; L1178-A1181 WeakPolarHBondContact O-CB 3.18Å; L1178-A1181 PolarHBondContact O-N 3.15Å; L1178-A1181 VanDerWaalsContact O-N 3.17Å; L1178-F1182 HydrophobicContact CB-CD2 4.35Å; L1178-F1182 HydrophobicContact CB-CE2 3.97Å; L1178-F1182 HydrophobicContact CD2-CZ 4.44Å; L1178-F1182 WeakPolarHBondContact O-CB 3.26Å; L1178-F1182 WeakPolarHBondContact O-CD2 3.38Å; L1178-F1182 VanDerWaalsContact O-CG 3.29Å; L1178-F1182 WeakPolarHBondContact O-CG 3.34Å; L1178-F1182 PolarHBondContact O-N 3.34Å; L1178-W1339 HydrophobicContact CB-CH2 4.24Å
1179L88Confident82.9Confident12.8 Ų12.842.5 Ų42.57%0.06723%0.23CC..Hα-helixtrans-58.7-45.8175-171.977.4000110.7R1175 N1176 A1181 F1182 T1183 W1339 L1340 Q1365 R1366 T1367R1175-L1179 VanDerWaalsContact O-CB 3.27Å; R1175-L1179 WeakPolarHBondContact O-CB 3.4Å; R1175-L1179 PolarHBondContact O-N 3.28Å; N1176-L1179 PolarHBondContact O-N 3.01Å; L1179-A1181 PolarHBondContact O-N 2.79Å; L1179-F1182 PolarHBondContact O-N 3.28Å; L1179-T1183 HydrophobicContact CG-CG2 4.47Å; L1179-T1183 VanDerWaalsContact O-CB 3.23Å; L1179-T1183 WeakPolarHBondContact O-CB 3.32Å; L1179-T1183 WeakPolarHBondContact O-CG2 3.33Å; L1179-T1183 PolarHBondContact O-N 3.1Å; L1179-T1183 PolarHBondContact O-OG1 2.95Å; L1179-W1339 HydrophobicContact CB-CH2 4.49Å; L1179-W1339 HydrophobicContact CB-CZ2 4.32Å; L1179-W1339 HydrophobicContact CD1-CZ2 4.47Å; L1179-L1340 HydrophobicContact CD1-CD2 4.5Å; L1179-Q1365 HydrophobicContact CD2-CB 3.95Å; L1179-R1366 WeakPolarHBondContact CD2-O 3.49Å; L1179-R1366 WeakPolarHBondContact CG-O 3.23Å; L1179-T1367 HydrophobicContact CD1-CG2 4.49Å; L1179-T1367 HydrophobicContact CD2-CG2 4.28Å
1180G86.5Confident81.1Confident31.4 Ų31.444.2 Ų44.232%0.32424%0.236SC..Hα-helixtrans-58.4-45.5173.600000113.1N1176 Q1177 L1178 T1183 Y1184N1176-G1180 PolarHBondContact O-N 3.18Å; Q1177-G1180 PolarHBondContact O-N 3.23Å; L1178-G1180 VanDerWaalsContact C-N 3.32Å; L1178-G1180 PolarHBondContact O-N 3.19Å; G1180-T1183 PolarHBondContact O-N 3.21Å; G1180-T1183 PolarHBondContact O-OG1 2.96Å; G1180-Y1184 WeakPolarHBondContact O-CB 3.17Å; G1180-Y1184 PolarHBondContact O-N 3.25Å
1181A86.7Confident79.1Confident4 Ų445.9 Ų45.93%0.03323%0.233CC..Hα-helixtrans-61.2-50.1177.300000112C1134 L1135 Q1177 L1178 L1179 T1183 Y1184 L1185C1134-A1181 HydrophobicContact CB-CB 4.04Å; L1135-A1181 HydrophobicContact CD2-CB 3.8Å; L1135-A1181 HydrophobicContact CG-CB 4.14Å; Q1177-A1181 WeakPolarHBondContact O-CB 3.42Å; Q1177-A1181 PolarHBondContact O-N 3.06Å; L1178-A1181 WeakPolarHBondContact O-CB 3.18Å; L1178-A1181 PolarHBondContact O-N 3.15Å; L1178-A1181 VanDerWaalsContact O-N 3.17Å; L1179-A1181 PolarHBondContact O-N 2.79Å; A1181-T1183 VanDerWaalsContact C-N 3.31Å; A1181-T1183 PolarHBondContact O-N 2.97Å; A1181-Y1184 CarbonylContact O-C 3.6Å; A1181-Y1184 WeakPolarHBondContact O-CA 3.31Å; A1181-Y1184 VanDerWaalsContact O-CB 3.28Å; A1181-Y1184 WeakPolarHBondContact O-CB 3.39Å; A1181-Y1184 PolarHBondContact O-N 3.11Å; A1181-Y1184 VanDerWaalsContact O-N 3.08Å; A1181-L1185 WeakPolarHBondContact O-CG 3.34Å; A1181-L1185 PolarHBondContact O-N 3.01Å; A1181-L1185 VanDerWaalsContact O-N 3.12Å
1182F89.7Confident76.9Confident0.2 Ų0.245.4 Ų45.40%0.00123%0.232CC..Hα-helixtrans-63.8-36.6179.1-65.7-42.3000112.6L1131 C1134 L1151 L1178 L1179 Y1184 L1185 I1186 F1321 W1339 L1340L1131-F1182 HydrophobicContact CB-CZ 4.33Å; L1131-F1182 HydrophobicContact CD1-CZ 4.31Å; L1131-F1182 HydrophobicContact CD2-CZ 4.39Å; C1134-F1182 HydrophobicContact CB-CE1 4.49Å; L1151-F1182 HydrophobicContact CD2-CE1 3.85Å; L1151-F1182 HydrophobicContact CD2-CZ 3.93Å; L1178-F1182 HydrophobicContact CB-CD2 4.35Å; L1178-F1182 HydrophobicContact CB-CE2 3.97Å; L1178-F1182 HydrophobicContact CD2-CZ 4.44Å; L1178-F1182 WeakPolarHBondContact O-CB 3.26Å; L1178-F1182 WeakPolarHBondContact O-CD2 3.38Å; L1178-F1182 VanDerWaalsContact O-CG 3.29Å; L1178-F1182 WeakPolarHBondContact O-CG 3.34Å; L1178-F1182 PolarHBondContact O-N 3.34Å; L1179-F1182 PolarHBondContact O-N 3.28Å; F1182-Y1184 VanDerWaalsContact C-N 3.26Å; F1182-Y1184 PolarHBondContact O-N 3.19Å; F1182-L1185 HydrophobicContact CD1-CD1 4.03Å; F1182-L1185 WeakPolarHBondContact O-CB 3.19Å; F1182-L1185 PolarHBondContact O-N 3Å; F1182-L1185 VanDerWaalsContact O-N 3.16Å; F1182-I1186 PolarHBondContact O-N 2.99Å; F1182-F1321 HydrophobicContact CB-CE1 4.29Å; F1182-F1321 HydrophobicContact CB-CE2 4.28Å; F1182-F1321 HydrophobicContact CB-CZ 3.67Å; F1182-F1321 HydrophobicContact CD1-CD2 4.39Å; F1182-F1321 AromaticContact CD1-CE2 3.63Å; F1182-F1321 HydrophobicContact CD1-CE2 3.63Å; F1182-F1321 VanDerWaalsContact CD1-CE2 3.41Å; F1182-F1321 AromaticContact CD1-CZ 3.88Å; F1182-F1321 HydrophobicContact CD1-CZ 3.92Å; F1182-F1321 AromaticContact CE1-CE2 3.95Å; F1182-F1321 HydrophobicContact CE1-CE2 4.23Å; F1182-F1321 HydrophobicContact CG-CE2 4.08Å; F1182-F1321 AromaticContact CG-CZ 3.92Å; F1182-F1321 HydrophobicContact CG-CZ 3.92Å; F1182-W1339 HydrophobicContact CD2-CH2 4.33Å; F1182-W1339 HydrophobicContact CD2-CZ3 4.16Å; F1182-W1339 HydrophobicContact CE2-CH2 4.29Å; F1182-W1339 AromaticContact CE2-CZ3 3.93Å; F1182-W1339 HydrophobicContact CE2-CZ3 4.03Å; F1182-L1340 HydrophobicContact CB-CD2 4.01Å; F1182-L1340 HydrophobicContact CD2-CD2 3.41Å; F1182-L1340 VanDerWaalsContact CD2-CD2 3.43Å; F1182-L1340 HydrophobicContact CE2-CD2 4.15Å; F1182-L1340 HydrophobicContact CG-CD2 3.96Å
1183T87Confident74.6Confident5.8 Ų5.844.6 Ų44.64%0.03623%0.232CC..Hα-helixtrans-63.3-34172.3-21.50000111.9L1179 G1180 A1181 I1186 R1366 T1367 C1368 S1371L1179-T1183 HydrophobicContact CG-CG2 4.47Å; L1179-T1183 VanDerWaalsContact O-CB 3.23Å; L1179-T1183 WeakPolarHBondContact O-CB 3.32Å; L1179-T1183 WeakPolarHBondContact O-CG2 3.33Å; L1179-T1183 PolarHBondContact O-N 3.1Å; L1179-T1183 PolarHBondContact O-OG1 2.95Å; G1180-T1183 PolarHBondContact O-N 3.21Å; G1180-T1183 PolarHBondContact O-OG1 2.96Å; A1181-T1183 VanDerWaalsContact C-N 3.31Å; A1181-T1183 PolarHBondContact O-N 2.97Å; T1183-I1186 PolarHBondContact O-N 3.45Å; T1183-R1366 HydrophobicContact CG2-CB 4.26Å; T1183-R1366 HydrophobicContact CG2-CG 3.92Å; T1183-R1366 VanDerWaalsContact CG2-NE 3.3Å; T1183-R1366 VanDerWaalsContact CG2-O 3.23Å; T1183-R1366 WeakPolarHBondContact CG2-O 3.27Å; T1183-R1366 PolarHBondContact OG1-O 3.34Å; T1183-R1366 VanDerWaalsContact OG1-O 3.14Å; T1183-T1367 VanDerWaalsContact CG2-CA 3.49Å; T1183-T1367 WeakPolarHBondContact CG2-O 3.36Å; T1183-T1367 WeakPolarHBondContact OG1-CA 3.1Å; T1183-T1367 PolarHBondContact OG1-O 3.24Å; T1183-C1368 PolarHBondContact OG1-N 3.11Å; T1183-S1371 WeakPolarHBondContact CB-OG 3.38Å; T1183-S1371 WeakPolarHBondContact CG2-OG 3.33Å; T1183-S1371 VanDerWaalsContact O-CB 3.31Å; T1183-S1371 WeakPolarHBondContact O-CB 3.35Å; T1183-S1371 PolarHBondContact O-OG 3.2Å
1184Y84.2Confident72.3Confident74.6 Ų74.643.4 Ų43.429%0.29322%0.222SC..Hα-helixtrans-71.8-34.5176.9-171.4-100.9000112.5A1137 D1138 G1180 A1181 F1182 I1186 K1187 W1188 N1191 F1235A1137-Y1184 HydrophobicContact CB-CD1 4.07Å; A1137-Y1184 HydrophobicContact CB-CE1 4.09Å; D1138-Y1184 VanDerWaalsContact CG-OH 3.24Å; D1138-Y1184 VanDerWaalsContact OD1-CE1 3.26Å; D1138-Y1184 WeakPolarHBondContact OD1-CE1 3.27Å; D1138-Y1184 VanDerWaalsContact OD1-CZ 3.28Å; D1138-Y1184 PolarHBondContact OD1-OH 3.07Å; D1138-Y1184 PolarHBondContact OD2-OH 3.27Å; G1180-Y1184 WeakPolarHBondContact O-CB 3.17Å; G1180-Y1184 PolarHBondContact O-N 3.25Å; A1181-Y1184 CarbonylContact O-C 3.6Å; A1181-Y1184 WeakPolarHBondContact O-CA 3.31Å; A1181-Y1184 VanDerWaalsContact O-CB 3.28Å; A1181-Y1184 WeakPolarHBondContact O-CB 3.39Å; A1181-Y1184 PolarHBondContact O-N 3.11Å; A1181-Y1184 VanDerWaalsContact O-N 3.08Å; F1182-Y1184 VanDerWaalsContact C-N 3.26Å; F1182-Y1184 PolarHBondContact O-N 3.19Å; Y1184-I1186 VanDerWaalsContact C-N 3.3Å; Y1184-I1186 PolarHBondContact O-N 2.99Å; Y1184-K1187 HydrophobicContact CD2-CD 4.08Å; Y1184-K1187 HydrophobicContact CE2-CD 3.98Å; Y1184-K1187 WeakPolarHBondContact O-CA 3.23Å; Y1184-K1187 VanDerWaalsContact O-CB 3.31Å; Y1184-K1187 WeakPolarHBondContact O-CB 3.34Å; Y1184-K1187 PolarHBondContact O-N 3.22Å; Y1184-K1187 VanDerWaalsContact O-N 3.07Å; Y1184-W1188 AromaticContact CE1-CD1 3.9Å; Y1184-W1188 PolarHBondContact O-N 3.12Å; Y1184-N1191 WeakPolarHBondContact CE2-ND2 3.37Å; Y1184-N1191 PolarHBondContact OH-ND2 2.97Å; Y1184-F1235 HydrophobicContact CE1-CZ 4.09Å
1185L83.9Confident69.7Low5.8 Ų5.849 Ų493%0.0325%0.252CS..Hα-helixtrans-62.1-28.6178.3-61.8-177.4000113.8C1134 A1137 T1144 V1148 A1181 F1182 K1187 W1188 I1317 S1318 F1321C1134-L1185 HydrophobicContact CB-CD1 4.35Å; C1134-L1185 HydrophobicContact CB-CD2 4.48Å; A1137-L1185 HydrophobicContact CB-CD2 4.02Å; T1144-L1185 HydrophobicContact CG2-CD1 4.41Å; T1144-L1185 HydrophobicContact CG2-CD2 3.56Å; V1148-L1185 HydrophobicContact CG2-CD1 3.55Å; V1148-L1185 VanDerWaalsContact CG2-CD1 3.49Å; A1181-L1185 WeakPolarHBondContact O-CG 3.34Å; A1181-L1185 PolarHBondContact O-N 3.01Å; A1181-L1185 VanDerWaalsContact O-N 3.12Å; F1182-L1185 HydrophobicContact CD1-CD1 4.03Å; F1182-L1185 WeakPolarHBondContact O-CB 3.19Å; F1182-L1185 PolarHBondContact O-N 3Å; F1182-L1185 VanDerWaalsContact O-N 3.16Å; L1185-K1187 PolarHBondContact O-N 3.14Å; L1185-W1188 WeakPolarHBondContact O-CB 3.21Å; L1185-I1317 HydrophobicContact CB-CG2 4.47Å; L1185-I1317 HydrophobicContact CD1-CG2 4.41Å; L1185-I1317 HydrophobicContact CD2-CG2 3.98Å; L1185-I1317 HydrophobicContact CG-CG2 4.49Å; L1185-S1318 WeakPolarHBondContact O-CA 3.43Å; L1185-S1318 WeakPolarHBondContact O-CB 3.09Å; L1185-F1321 HydrophobicContact CB-CD1 4.3Å; L1185-F1321 HydrophobicContact CB-CG 4.4Å; L1185-F1321 HydrophobicContact CD1-CB 4.4Å; L1185-F1321 HydrophobicContact CD1-CD1 4.46Å; L1185-F1321 HydrophobicContact CD1-CD2 4Å; L1185-F1321 HydrophobicContact CD1-CE2 4.36Å; L1185-F1321 HydrophobicContact CD1-CG 4.12Å
1186I82.5Confident67Low0.4 Ų0.448.5 Ų48.50%0.00226%0.26CS..Hα-helixtrans-81.2-12.4175.3-59.1175.3000110.7F1182 T1183 Y1184 W1188 F1321 L1322 C1368 M1372 M1375 I1404F1182-I1186 PolarHBondContact O-N 2.99Å; T1183-I1186 PolarHBondContact O-N 3.45Å; Y1184-I1186 VanDerWaalsContact C-N 3.3Å; Y1184-I1186 PolarHBondContact O-N 2.99Å; I1186-W1188 PolarHBondContact O-N 3.06Å; I1186-F1321 HydrophobicContact CD1-CD1 4.13Å; I1186-F1321 HydrophobicContact CD1-CE1 3.91Å; I1186-F1321 HydrophobicContact CG1-CD1 3.77Å; I1186-F1321 HydrophobicContact CG1-CE1 3.99Å; I1186-L1322 HydrophobicContact CD1-CD2 4.05Å; I1186-L1322 HydrophobicContact CG1-CD2 4.23Å; I1186-C1368 HydrophobicContact CD1-CB 3.74Å; I1186-M1372 HydrophobicContact CD1-CE 3.84Å; I1186-M1372 HydrophobicContact CD1-CG 4.05Å; I1186-M1372 HydrophobicContact CG2-CG 4.25Å; I1186-M1375 HydrophobicContact CG2-CE 3.89Å; I1186-M1375 HydrophobicContact CG2-SD 4.42Å; I1186-I1404 HydrophobicContact CG2-CD1 4.26Å
1187K73.6Confident64.3Low81 Ų8153.3 Ų53.335%0.35229%0.286SS..PPolyproline II helixtrans-77.5124.9179.2-111.1-174.6174.2-173.90110.4Y1184 L1185 P1189 M1190 F1235 R1366 D1374Y1184-K1187 HydrophobicContact CD2-CD 4.08Å; Y1184-K1187 HydrophobicContact CE2-CD 3.98Å; Y1184-K1187 WeakPolarHBondContact O-CA 3.23Å; Y1184-K1187 VanDerWaalsContact O-CB 3.31Å; Y1184-K1187 WeakPolarHBondContact O-CB 3.34Å; Y1184-K1187 PolarHBondContact O-N 3.22Å; Y1184-K1187 VanDerWaalsContact O-N 3.07Å; L1185-K1187 PolarHBondContact O-N 3.14Å; K1187-P1189 VanDerWaalsContact C-N 3.35Å; K1187-P1189 WeakPolarHBondContact O-CD 3.45Å; K1187-P1189 VanDerWaalsContact O-N 3.12Å; K1187-M1190 WeakPolarHBondContact O-CB 3.12Å; K1187-M1190 PolarHBondContact O-N 2.82Å; K1187-F1235 WeakPolarHBondContact O-CE2 3.39Å; K1187-F1235 WeakPolarHBondContact O-CZ 3.38Å; K1187-R1366 VanDerWaalsContact CE-NH1 3.32Å; K1187-R1366 VanDerWaalsContact NZ-NH1 3.18Å; K1187-D1374 VanDerWaalsContact CE-OD2 3.29Å; K1187-D1374 WeakPolarHBondContact CE-OD2 3.06Å; K1187-D1374 IonicContact NZ-OD2 2.68Å; K1187-D1374 PolarHBondContact NZ-OD2 2.96Å
1188W62.5Low61.7Low27.4 Ų27.454.3 Ų54.310%0.10429%0.293CS..PPolyproline II helixtrans-71.1136.6176.3-159-90.4000111.1P1141 Y1184 L1185 I1186 M1190 N1191 V1192 V1232 G1233 F1235 S1318 M1375 F1393 T1396 L1397 N1400P1141-W1188 HydrophobicContact CB-CZ2 4.37Å; Y1184-W1188 AromaticContact CE1-CD1 3.9Å; Y1184-W1188 PolarHBondContact O-N 3.12Å; L1185-W1188 WeakPolarHBondContact O-CB 3.21Å; I1186-W1188 PolarHBondContact O-N 3.06Å; W1188-M1190 HydrophobicContact CB-CE 3.98Å; W1188-M1190 HydrophobicContact CG-CE 4.13Å; W1188-M1190 WeakPolarHBondContact O-CE 3.34Å; W1188-M1190 PolarHBondContact O-N 3.05Å; W1188-M1190 VanDerWaalsContact O-N 3.16Å; W1188-N1191 PolarHBondContact O-N 3.3Å; W1188-V1192 HydrophobicContact CZ2-CG2 4.13Å; W1188-V1232 WeakPolarHBondContact CH2-O 3.26Å; W1188-G1233 WeakPolarHBondContact CH2-O 3.36Å; W1188-G1233 VanDerWaalsContact CZ3-O 3.25Å; W1188-G1233 WeakPolarHBondContact CZ3-O 3.34Å; W1188-F1235 AromaticContact CH2-CD2 3.6Å; W1188-F1235 HydrophobicContact CH2-CD2 3.6Å; W1188-F1235 AromaticContact CH2-CE2 3.1Å; W1188-F1235 HydrophobicContact CH2-CE2 3.1Å; W1188-F1235 AromaticContact CH2-CZ 3.65Å; W1188-F1235 HydrophobicContact CH2-CZ 3.65Å; W1188-F1235 AromaticContact CZ2-CE2 3.99Å; W1188-F1235 HydrophobicContact CZ2-CE2 3.99Å; W1188-F1235 HydrophobicContact CZ2-CZ 4.35Å; W1188-F1235 AromaticContact CZ3-CD2 3.61Å; W1188-F1235 HydrophobicContact CZ3-CD2 3.61Å; W1188-F1235 AromaticContact CZ3-CE2 3.57Å; W1188-F1235 HydrophobicContact CZ3-CE2 3.57Å; W1188-F1235 HydrophobicContact CZ3-CZ 4.49Å; W1188-S1318 WeakPolarHBondContact CZ3-OG 3.39Å; W1188-M1375 HydrophobicContact CB-CG 4.17Å; W1188-F1393 AromaticContact CE2-CE2 3.9Å; W1188-F1393 AromaticContact CE2-CZ 3.94Å; W1188-F1393 HydrophobicContact CZ2-CD2 4.21Å; W1188-F1393 HydrophobicContact CZ2-CE1 4.35Å; W1188-F1393 AromaticContact CZ2-CE2 3.64Å; W1188-F1393 HydrophobicContact CZ2-CE2 3.64Å; W1188-F1393 AromaticContact CZ2-CZ 3.78Å; W1188-F1393 HydrophobicContact CZ2-CZ 3.78Å; W1188-F1393 AromaticContact NE1-CD2 3.95Å; W1188-F1393 AromaticContact NE1-CE2 3.59Å; W1188-F1393 AromaticContact NE1-CZ 3.52Å; W1188-T1396 HydrophobicContact CH2-CG2 3.53Å; W1188-T1396 HydrophobicContact CZ3-CG2 3.82Å; W1188-L1397 HydrophobicContact CD2-CD1 4.38Å; W1188-L1397 HydrophobicContact CH2-CD1 4.27Å; W1188-L1397 HydrophobicContact CZ2-CB 4.36Å; W1188-L1397 HydrophobicContact CZ2-CD1 3.8Å; W1188-N1400 VanDerWaalsContact CZ3-ND2 3.33Å; W1188-N1400 WeakPolarHBondContact CZ3-ND2 3.16Å
1189P54.4Low58.7Low32.6 Ų32.659.3 Ų59.321%0.21232%0.319CS..  trans-6798.5173.518.8-21.9000110K1187 N1191 V1192 V1232 G1233 F1235 F1393K1187-P1189 VanDerWaalsContact C-N 3.35Å; K1187-P1189 WeakPolarHBondContact O-CD 3.45Å; K1187-P1189 VanDerWaalsContact O-N 3.12Å; P1189-N1191 PolarHBondContact O-N 3.12Å; P1189-V1192 HydrophobicContact CB-CG2 4.32Å; P1189-V1192 HydrophobicContact CG-CG2 4.26Å; P1189-V1192 PolarHBondContact O-N 3.43Å; P1189-V1232 HydrophobicContact CB-CG1 3.67Å; P1189-V1232 VanDerWaalsContact CB-CG1 3.42Å; P1189-V1232 VanDerWaalsContact CD-O 3.27Å; P1189-V1232 WeakPolarHBondContact CD-O 3.39Å; P1189-V1232 HydrophobicContact CG-CB 4.4Å; P1189-V1232 HydrophobicContact CG-CG1 3.45Å; P1189-V1232 VanDerWaalsContact CG-O 3.29Å; P1189-V1232 WeakPolarHBondContact CG-O 3.38Å; P1189-G1233 VanDerWaalsContact CG-CA 3.45Å; P1189-F1235 HydrophobicContact CG-CZ 4.25Å; P1189-F1393 WeakPolarHBondContact O-CE2 3.3Å
1190M46Very low55.9Low87.2 Ų87.263.9 Ų63.943%0.4335%0.349SS..  trans-76.7-18.8178.1-66.8-68.2114.800113K1187 W1188 V1192 S1378 W1382 F1393 L1397K1187-M1190 WeakPolarHBondContact O-CB 3.12Å; K1187-M1190 PolarHBondContact O-N 2.82Å; W1188-M1190 HydrophobicContact CB-CE 3.98Å; W1188-M1190 HydrophobicContact CG-CE 4.13Å; W1188-M1190 WeakPolarHBondContact O-CE 3.34Å; W1188-M1190 PolarHBondContact O-N 3.05Å; W1188-M1190 VanDerWaalsContact O-N 3.16Å; M1190-V1192 PolarHBondContact O-N 3Å; M1190-V1192 VanDerWaalsContact O-N 3.12Å; M1190-S1378 VanDerWaalsContact CE-OG 3.31Å; M1190-S1378 WeakPolarHBondContact CE-OG 3.31Å; M1190-S1378 WeakPolarHBondContact SD-CB 3.33Å; M1190-W1382 HydrophobicContact CE-CZ2 4.45Å; M1190-W1382 HydrophobicContact SD-CZ2 4.35Å; M1190-F1393 HydrophobicContact CE-CE1 4.42Å; M1190-F1393 HydrophobicContact CE-CE2 3.65Å; M1190-F1393 HydrophobicContact CE-CZ 3.43Å; M1190-F1393 VanDerWaalsContact CE-CZ 3.43Å; M1190-F1393 HydrophobicContact SD-CZ 4.5Å; M1190-L1397 HydrophobicContact CE-CD1 3.45Å; M1190-L1397 VanDerWaalsContact CE-CD1 3.45Å; M1190-L1397 HydrophobicContact SD-CD1 4.1Å
1191N41.4Very low53.1Low119 Ų11968.8 Ų68.864%0.63637%0.366SS*.  trans-99.841.4-172.9-72.5-3.5000113.1Y1184 W1188 P1189 D1193Y1184-N1191 WeakPolarHBondContact CE2-ND2 3.37Å; Y1184-N1191 PolarHBondContact OH-ND2 2.97Å; W1188-N1191 PolarHBondContact O-N 3.3Å; P1189-N1191 PolarHBondContact O-N 3.12Å; N1191-D1193 VanDerWaalsContact C-N 3.32Å; N1191-D1193 PolarHBondContact O-N 3.21Å
1192V39.9Very low50.3Low49 Ų4975.6 Ų75.630%0.29740%0.401SS..  trans-86.2102.7163-169.50000106.5W1188 P1189 M1190 I1194 L1229 V1232 G1233 W1382W1188-V1192 HydrophobicContact CZ2-CG2 4.13Å; P1189-V1192 HydrophobicContact CB-CG2 4.32Å; P1189-V1192 HydrophobicContact CG-CG2 4.26Å; P1189-V1192 PolarHBondContact O-N 3.43Å; M1190-V1192 PolarHBondContact O-N 3Å; M1190-V1192 VanDerWaalsContact O-N 3.12Å; V1192-I1194 VanDerWaalsContact C-N 3.27Å; V1192-I1194 HydrophobicContact CB-CD1 3.48Å; V1192-I1194 VanDerWaalsContact CB-CD1 3.48Å; V1192-I1194 HydrophobicContact CG1-CD1 3.28Å; V1192-I1194 HydrophobicContact CG1-CG1 4.17Å; V1192-I1194 WeakPolarHBondContact O-CD1 3.24Å; V1192-I1194 WeakPolarHBondContact O-CG1 3.1Å; V1192-I1194 PolarHBondContact O-N 3.28Å; V1192-L1229 HydrophobicContact CB-CD2 4.28Å; V1192-L1229 HydrophobicContact CG1-CD2 3.74Å; V1192-L1229 HydrophobicContact CG1-CG 4.41Å; V1192-V1232 HydrophobicContact CG2-CB 4.18Å; V1192-V1232 HydrophobicContact CG2-CG1 3.47Å; V1192-V1232 HydrophobicContact CG2-CG2 3.92Å; V1192-G1233 VanDerWaalsContact CG2-CA 3.44Å; V1192-W1382 HydrophobicContact CB-CH2 4.06Å; V1192-W1382 HydrophobicContact CB-CZ2 4.37Å; V1192-W1382 HydrophobicContact CG1-CH2 4.45Å
1193D35.7Very low47.4Very low106.4 Ų106.482.1 Ų82.157%0.56944%0.436SS*.  trans-66.496.1171.3-75.4-44.8000108.9N1191 N1195 S1196N1191-D1193 VanDerWaalsContact C-N 3.32Å; N1191-D1193 PolarHBondContact O-N 3.21Å; D1193-N1195 PolarHBondContact O-N 3.1Å; D1193-N1195 VanDerWaalsContact O-N 3.12Å; D1193-S1196 PolarHBondContact O-N 2.8Å; D1193-S1196 VanDerWaalsContact O-N 3.1Å; D1193-S1196 PolarHBondContact O-OG 2.95Å; D1193-S1196 VanDerWaalsContact O-OG 3.05Å
1194I37.6Very low44.7Very low56.8 Ų56.888.3 Ų88.329%0.29147%0.469SS..THydrogen-bonded Turntrans-71.92.5-179.3-61.7154.8000112.2V1192 S1196 W1382 L1389 P1390 F1393V1192-I1194 VanDerWaalsContact C-N 3.27Å; V1192-I1194 HydrophobicContact CB-CD1 3.48Å; V1192-I1194 VanDerWaalsContact CB-CD1 3.48Å; V1192-I1194 HydrophobicContact CG1-CD1 3.28Å; V1192-I1194 HydrophobicContact CG1-CG1 4.17Å; V1192-I1194 WeakPolarHBondContact O-CD1 3.24Å; V1192-I1194 WeakPolarHBondContact O-CG1 3.1Å; V1192-I1194 PolarHBondContact O-N 3.28Å; I1194-S1196 VanDerWaalsContact C-N 3.33Å; I1194-S1196 PolarHBondContact O-N 3.12Å; I1194-W1382 HydrophobicContact CB-CH2 4.1Å; I1194-W1382 HydrophobicContact CD1-CD2 4.38Å; I1194-W1382 HydrophobicContact CD1-CE3 3.88Å; I1194-W1382 HydrophobicContact CD1-CH2 3.45Å; I1194-W1382 VanDerWaalsContact CD1-CH2 3.5Å; I1194-W1382 HydrophobicContact CD1-CZ2 4Å; I1194-W1382 HydrophobicContact CD1-CZ3 3.27Å; I1194-W1382 HydrophobicContact CG1-CE3 4.37Å; I1194-W1382 HydrophobicContact CG1-CH2 3.74Å; I1194-W1382 HydrophobicContact CG1-CZ2 4.35Å; I1194-W1382 HydrophobicContact CG1-CZ3 3.53Å; I1194-W1382 VanDerWaalsContact CG1-CZ3 3.44Å; I1194-W1382 HydrophobicContact CG2-CH2 4.13Å; I1194-W1382 HydrophobicContact CG2-CZ3 4.09Å; I1194-L1389 HydrophobicContact CD1-CD2 4.27Å; I1194-P1390 HydrophobicContact CG2-CG 3.76Å; I1194-F1393 HydrophobicContact CD1-CZ 4.29Å
1195N32.8Very low42.1Very low130 Ų13090.8 Ų90.870%0.69549%0.487SS*.THydrogen-bonded Turntrans-10315.4175.3-74.8-14.7000113.4D1193 N1197D1193-N1195 PolarHBondContact O-N 3.1Å; D1193-N1195 VanDerWaalsContact O-N 3.12Å; N1195-N1197 VanDerWaalsContact C-N 3.28Å; N1195-N1197 PolarHBondContact O-N 3.11Å
1196S31.1Very low39.5Very low69.6 Ų69.695.6 Ų95.649%0.48751%0.513SS..SBendtrans-93.392.7159.561.90000109D1193 I1194 L1198D1193-S1196 PolarHBondContact O-N 2.8Å; D1193-S1196 VanDerWaalsContact O-N 3.1Å; D1193-S1196 PolarHBondContact O-OG 2.95Å; D1193-S1196 VanDerWaalsContact O-OG 3.05Å; I1194-S1196 VanDerWaalsContact C-N 3.33Å; I1194-S1196 PolarHBondContact O-N 3.12Å; S1196-L1198 VanDerWaalsContact C-N 3.31Å; S1196-L1198 PolarHBondContact O-N 3.16Å
1197N29.5Very low37Very low142.2 Ų142.2101.2 Ų101.276%0.7654%0.542SS*.  trans-53.296.5165.5-73.3-22.1000108.7N1195 I1199N1195-N1197 VanDerWaalsContact C-N 3.28Å; N1195-N1197 PolarHBondContact O-N 3.11Å; N1197-I1199 VanDerWaalsContact C-N 3.31Å; N1197-I1199 WeakPolarHBondContact O-CA 3.31Å; N1197-I1199 WeakPolarHBondContact O-CG1 3.41Å; N1197-I1199 PolarHBondContact O-N 3.25Å; N1197-I1199 VanDerWaalsContact O-N 3.14Å
1198L32.4Very low35Very low103.6 Ų103.6103.8 Ų103.854%0.54256%0.556SS.*  trans-48.790.7164.6-77.9158.4000109.5S1196 P1200 N1225S1196-L1198 VanDerWaalsContact C-N 3.31Å; S1196-L1198 PolarHBondContact O-N 3.16Å; L1198-P1200 WeakPolarHBondContact O-CD 3.22Å; L1198-N1225 VanDerWaalsContact CD1-CG 3.49Å; L1198-N1225 WeakPolarHBondContact CD1-ND2 3.22Å; L1198-N1225 VanDerWaalsContact CD1-OD1 3.23Å; L1198-N1225 WeakPolarHBondContact CD1-OD1 3.39Å; L1198-N1225 HydrophobicContact CD2-CB 3.66Å; L1198-N1225 WeakPolarHBondContact CD2-OD1 3.49Å; L1198-N1225 WeakPolarHBondContact CG-ND2 3.32Å; L1198-N1225 WeakPolarHBondContact CG-OD1 3.47Å
1199I28.2Very low33.5Very low105.6 Ų105.6104.7 Ų104.754%0.54257%0.574SS.*  trans-50.4120.6170.2-59.2170.8000107.2N1197 M1201N1197-I1199 VanDerWaalsContact C-N 3.31Å; N1197-I1199 WeakPolarHBondContact O-CA 3.31Å; N1197-I1199 WeakPolarHBondContact O-CG1 3.41Å; N1197-I1199 PolarHBondContact O-N 3.25Å; N1197-I1199 VanDerWaalsContact O-N 3.14Å; I1199-M1201 VanDerWaalsContact C-N 3.3Å; I1199-M1201 HydrophobicContact CG2-CG 4.48Å; I1199-M1201 PolarHBondContact O-N 3.07Å
1200P27.9Very low32.3Very low108.4 Ų108.4109.2 Ų109.270%0.70459%0.592SS**  trans-66.8107.6169.619.2-15000106.5L1198 D1202L1198-P1200 WeakPolarHBondContact O-CD 3.22Å; P1200-D1202 PolarHBondContact O-N 3.06Å
1201M27.5Very low31.6Very low135.8 Ų135.8110.8 Ų110.867%0.66960%0.597SS**  trans-70.3119.9171.4-70.5-68.7-81.100107I1199 N1203 L1205I1199-M1201 VanDerWaalsContact C-N 3.3Å; I1199-M1201 HydrophobicContact CG2-CG 4.48Å; I1199-M1201 PolarHBondContact O-N 3.07Å; M1201-N1203 PolarHBondContact O-N 3.25Å; M1201-L1205 HydrophobicContact CE-CD1 4.47Å
1202D27.6Very low31.4Very low145.2 Ų145.2106.9 Ų106.978%0.77658%0.581SS**  trans-58.9115.1-179.8-93.1-35.8000110.2P1200 N1204P1200-D1202 PolarHBondContact O-N 3.06Å; D1202-N1204 VanDerWaalsContact C-N 3.32Å; D1202-N1204 PolarHBondContact O-N 3.22Å
1203N30.3Very low31.4Very low137.4 Ų137.4109.4 Ų109.474%0.73559%0.588SS**SBendtrans-71.534.6-175.4-78.1-27.5000114M1201 L1205M1201-N1203 PolarHBondContact O-N 3.25Å; N1203-L1205 PolarHBondContact O-N 3.23Å; N1203-L1205 VanDerWaalsContact O-N 3.09Å
1204N29.1Very low31.7Very low135.6 Ų135.6106.6 Ų106.673%0.72558%0.575SS**  trans-111.229.5178.9-77.9-19.7000113.7D1202 D1206D1202-N1204 VanDerWaalsContact C-N 3.32Å; D1202-N1204 PolarHBondContact O-N 3.22Å; N1204-D1206 VanDerWaalsContact C-N 3.33Å; N1204-D1206 PolarHBondContact O-N 3.41Å
1205L30.4Very low32.1Very low127.6 Ų127.6106.1 Ų106.167%0.66857%0.573SS**  trans-10180.3167.7-82.8144.9000110M1201 N1203 N1207 F1211M1201-L1205 HydrophobicContact CE-CD1 4.47Å; N1203-L1205 PolarHBondContact O-N 3.23Å; N1203-L1205 VanDerWaalsContact O-N 3.09Å; L1205-N1207 VanDerWaalsContact C-N 3.27Å; L1205-N1207 PolarHBondContact O-N 2.99Å; L1205-F1211 HydrophobicContact CB-CD2 4.48Å; L1205-F1211 HydrophobicContact CB-CE2 3.74Å; L1205-F1211 HydrophobicContact CB-CZ 4.35Å; L1205-F1211 HydrophobicContact CD1-CE1 4.35Å; L1205-F1211 HydrophobicContact CD1-CE2 3.85Å; L1205-F1211 HydrophobicContact CD1-CZ 3.74Å; L1205-F1211 HydrophobicContact CD2-CE1 4.49Å; L1205-F1211 HydrophobicContact CD2-CE2 3.58Å; L1205-F1211 HydrophobicContact CD2-CZ 3.35Å; L1205-F1211 HydrophobicContact CG-CE2 3.9Å; L1205-F1211 HydrophobicContact CG-CZ 3.98Å
1206D29.2Very low32.6Very low106.2 Ų106.2104.5 Ų104.557%0.56856%0.561SS**  trans-57.3110.1171-68.4-33.3000111.1N1204 E1208 G1209 L1239N1204-D1206 VanDerWaalsContact C-N 3.33Å; N1204-D1206 PolarHBondContact O-N 3.41Å; D1206-E1208 PolarHBondContact O-N 2.99Å; D1206-G1209 WeakPolarHBondContact O-CA 3.49Å; D1206-G1209 PolarHBondContact O-N 3.13Å; D1206-L1239 HydrophobicContact CB-CD2 3.99Å; D1206-L1239 VanDerWaalsContact CG-CD1 3.49Å; D1206-L1239 WeakPolarHBondContact OD1-CD1 3.49Å; D1206-L1239 VanDerWaalsContact OD1-CD2 3.31Å; D1206-L1239 WeakPolarHBondContact OD1-CD2 3.46Å; D1206-L1239 WeakPolarHBondContact OD2-CD1 3.24Å
1207N30.6Very low33.4Very low117.8 Ų117.8106.9 Ų106.963%0.6356%0.56SS**SBendtrans-47.177173-77.3-16.8000115.9L1205 F1211 R1285L1205-N1207 VanDerWaalsContact C-N 3.27Å; L1205-N1207 PolarHBondContact O-N 2.99Å; N1207-F1211 WeakPolarHBondContact O-CE2 2.93Å; N1207-F1211 WeakPolarHBondContact O-CZ 2.9Å; N1207-R1285 PolarHBondContact OD1-NH2 3.49Å
1208E30.9Very low34.1Very low135.8 Ų135.8102.7 Ų102.764%0.63554%0.537SS*.  trans135.660.7155.8-61.7-175.517200115.4D1206 H1210 F1211D1206-E1208 PolarHBondContact O-N 2.99Å; E1208-H1210 HydrophobicContact CB-CB 4.26Å; E1208-H1210 WeakPolarHBondContact CB-CD2 3.38Å; E1208-H1210 WeakPolarHBondContact CB-NE2 3.21Å; E1208-H1210 PolarHBondContact O-CD2 3.12Å; E1208-H1210 VanDerWaalsContact O-CD2 3.28Å; E1208-H1210 PolarHBondContact O-N 3.27Å; E1208-H1210 IonicContact OE2-CD2 3.37Å; E1208-H1210 PolarHBondContact OE2-CD2 3.45Å; E1208-H1210 IonicContact OE2-NE2 3.24Å; E1208-H1210 PolarHBondContact OE2-NE2 3.27Å; E1208-F1211 HydrophobicContact CB-CE2 4.46Å; E1208-F1211 WeakPolarHBondContact O-CD2 3.31Å
1209G30.1Very low34.7Very low46.6 Ų46.6104.3 Ų104.348%0.4854%0.537SS..  trans-77.778.9165.500000111.7D1206 F1211 A1212D1206-G1209 WeakPolarHBondContact O-CA 3.49Å; D1206-G1209 PolarHBondContact O-N 3.13Å; G1209-F1211 VanDerWaalsContact C-N 3.33Å; G1209-F1211 WeakPolarHBondContact O-CD2 3.47Å; G1209-F1211 PolarHBondContact O-N 3.17Å; G1209-A1212 WeakPolarHBondContact O-CB 2.95Å; G1209-A1212 PolarHBondContact O-N 2.97Å
1210H31.1Very low35.3Very low127 Ų127101.9 Ų101.959%0.58854%0.537SS*.  trans-62.663.2178.3-69.8-62.3000112E1208 A1212 T1282 D1283E1208-H1210 HydrophobicContact CB-CB 4.26Å; E1208-H1210 WeakPolarHBondContact CB-CD2 3.38Å; E1208-H1210 WeakPolarHBondContact CB-NE2 3.21Å; E1208-H1210 PolarHBondContact O-CD2 3.12Å; E1208-H1210 VanDerWaalsContact O-CD2 3.28Å; E1208-H1210 PolarHBondContact O-N 3.27Å; E1208-H1210 IonicContact OE2-CD2 3.37Å; E1208-H1210 PolarHBondContact OE2-CD2 3.45Å; E1208-H1210 IonicContact OE2-NE2 3.24Å; E1208-H1210 PolarHBondContact OE2-NE2 3.27Å; H1210-A1212 VanDerWaalsContact C-N 3.33Å; H1210-A1212 PolarHBondContact O-N 3.15Å; H1210-A1212 VanDerWaalsContact O-N 3.11Å; H1210-T1282 PolarHBondContact CD2-OG1 3.37Å; H1210-D1283 IonicContact CD2-OD1 3.51Å; H1210-D1283 IonicContact CE1-OD1 3.2Å; H1210-D1283 PolarHBondContact CE1-OD1 2.83Å; H1210-D1283 IonicContact NE2-OD1 3.46Å; H1210-D1283 PolarHBondContact NE2-OD1 3.17Å; H1210-D1283 IonicContact NE2-OD2 2.77Å
1211F31Very low35.8Very low121.4 Ų121.4103.5 Ų103.553%0.53254%0.54SS..  trans-66.448.8172.6-66.1-74.9000111.2L1205 N1207 E1208 G1209 F1213 T1214 E1216 P1242L1205-F1211 HydrophobicContact CB-CD2 4.48Å; L1205-F1211 HydrophobicContact CB-CE2 3.74Å; L1205-F1211 HydrophobicContact CB-CZ 4.35Å; L1205-F1211 HydrophobicContact CD1-CE1 4.35Å; L1205-F1211 HydrophobicContact CD1-CE2 3.85Å; L1205-F1211 HydrophobicContact CD1-CZ 3.74Å; L1205-F1211 HydrophobicContact CD2-CE1 4.49Å; L1205-F1211 HydrophobicContact CD2-CE2 3.58Å; L1205-F1211 HydrophobicContact CD2-CZ 3.35Å; L1205-F1211 HydrophobicContact CG-CE2 3.9Å; L1205-F1211 HydrophobicContact CG-CZ 3.98Å; N1207-F1211 WeakPolarHBondContact O-CE2 2.93Å; N1207-F1211 WeakPolarHBondContact O-CZ 2.9Å; E1208-F1211 HydrophobicContact CB-CE2 4.46Å; E1208-F1211 WeakPolarHBondContact O-CD2 3.31Å; G1209-F1211 VanDerWaalsContact C-N 3.33Å; G1209-F1211 WeakPolarHBondContact O-CD2 3.47Å; G1209-F1211 PolarHBondContact O-N 3.17Å; F1211-F1213 PolarHBondContact O-N 3.14Å; F1211-F1213 VanDerWaalsContact O-N 3.16Å; F1211-T1214 HydrophobicContact CD1-CG2 4.11Å; F1211-T1214 HydrophobicContact CE1-CG2 4.31Å; F1211-T1214 PolarHBondContact O-N 3.27Å; F1211-E1216 WeakPolarHBondContact CE1-OE2 3.33Å; F1211-P1242 HydrophobicContact CB-CG 4.38Å
1212A36.3Very low36.4Very low36.8 Ų36.8103.8 Ų103.830%0.30455%0.545SS..  trans-57.782.9166.300000108.8G1209 H1210 T1214 P1242 A1246 Y1249G1209-A1212 WeakPolarHBondContact O-CB 2.95Å; G1209-A1212 PolarHBondContact O-N 2.97Å; H1210-A1212 VanDerWaalsContact C-N 3.33Å; H1210-A1212 PolarHBondContact O-N 3.15Å; H1210-A1212 VanDerWaalsContact O-N 3.11Å; A1212-T1214 HydrophobicContact CB-CG2 4.34Å; A1212-T1214 PolarHBondContact O-N 2.81Å; A1212-T1214 PolarHBondContact O-OG1 2.81Å; A1212-P1242 CarbonylContact O-C 3.38Å; A1212-P1242 WeakPolarHBondContact O-CB 3.33Å; A1212-P1242 WeakPolarHBondContact O-CG 3.45Å; A1212-A1246 HydrophobicContact CB-CB 3.68Å; A1212-Y1249 HydrophobicContact CB-CD2 3.85Å; A1212-Y1249 HydrophobicContact CB-CE2 3.33Å
1213F39.4Very low36.8Very low101.8 Ų101.8103.9 Ų103.945%0.44655%0.545SS..G310 helixtrans-85.160.6175-74.6-87.7000110.9R563 M697 I1038 F1211 V1243 W1281R563-F1213 WeakPolarHBondContact CB-O 3.47Å; R563-F1213 WeakPolarHBondContact CD-O 3.3Å; M697-F1213 HydrophobicContact SD-CD1 4.04Å; M697-F1213 HydrophobicContact SD-CE1 4.04Å; I1038-F1213 HydrophobicContact CD1-CD2 4.11Å; I1038-F1213 HydrophobicContact CD1-CE2 3.76Å; F1211-F1213 PolarHBondContact O-N 3.14Å; F1211-F1213 VanDerWaalsContact O-N 3.16Å; F1213-V1243 HydrophobicContact CD1-CG2 4.2Å; F1213-V1243 HydrophobicContact CE1-CG2 4Å; F1213-W1281 HydrophobicContact CD2-CZ2 4.29Å; F1213-W1281 HydrophobicContact CE2-CH2 4.47Å; F1213-W1281 AromaticContact CE2-CZ2 3.89Å; F1213-W1281 HydrophobicContact CE2-CZ2 3.89Å
1214T42.9Very low37.2Very low46.6 Ų46.6103.5 Ų103.529%0.28654%0.543SS..  trans-79.5143163.8590000107F1211 A1212 E1216 W1217 R1238F1211-T1214 HydrophobicContact CD1-CG2 4.11Å; F1211-T1214 HydrophobicContact CE1-CG2 4.31Å; F1211-T1214 PolarHBondContact O-N 3.27Å; A1212-T1214 HydrophobicContact CB-CG2 4.34Å; A1212-T1214 PolarHBondContact O-N 2.81Å; A1212-T1214 PolarHBondContact O-OG1 2.81Å; T1214-E1216 WeakPolarHBondContact CB-OE2 3.46Å; T1214-E1216 PolarHBondContact O-N 3.22Å; T1214-E1216 PolarHBondContact OG1-OE2 3.05Å; T1214-W1217 PolarHBondContact O-NE1 2.99Å; T1214-W1217 VanDerWaalsContact O-NE1 3.11Å; T1214-R1238 HydrophobicContact CG2-CG 4.29Å; T1214-R1238 PolarHBondContact OG1-NH1 3.06Å
1215D46Very low37.6Very low47.8 Ų47.8102.8 Ų102.826%0.25654%0.539SS..SBendtrans-77.517.5-180-68.1-37.9000112.7S562 R563 S564 W1217 L1218 Y1219 P1242S562-D1215 WeakPolarHBondContact CB-OD1 3.33Å; R563-D1215 PolarHBondContact N-OD1 3.01Å; S564-D1215 WeakPolarHBondContact CB-OD2 3.35Å; S564-D1215 PolarHBondContact N-OD2 3.45Å; S564-D1215 PolarHBondContact OG-OD2 3.13Å; D1215-W1217 VanDerWaalsContact C-N 3.3Å; D1215-W1217 PolarHBondContact O-N 3.3Å; D1215-L1218 HydrophobicContact CB-CB 4.04Å; D1215-L1218 HydrophobicContact CB-CD1 4.14Å; D1215-L1218 WeakPolarHBondContact O-CA 3.1Å; D1215-L1218 VanDerWaalsContact O-CB 3.26Å; D1215-L1218 WeakPolarHBondContact O-CB 3.37Å; D1215-L1218 WeakPolarHBondContact O-CG 3.2Å; D1215-L1218 PolarHBondContact O-N 3.24Å; D1215-Y1219 HydrophobicContact CB-CE2 4.28Å; D1215-Y1219 VanDerWaalsContact O-CD2 3.25Å; D1215-Y1219 WeakPolarHBondContact O-CD2 3.33Å; D1215-Y1219 WeakPolarHBondContact O-CE2 3.22Å; D1215-Y1219 PolarHBondContact O-N 3.35Å; D1215-P1242 HydrophobicContact CB-CG 4.28Å; D1215-P1242 WeakPolarHBondContact OD2-CD 3Å; D1215-P1242 WeakPolarHBondContact OD2-CG 3.5Å
1216E43.9Very low37.9Very low96 Ų96103.5 Ų103.545%0.44954%0.539SS..G310 helixtrans-60.7-34.5-177.3-101.9166.2-179.800112.1F1211 T1214 L1218 Y1219 G1220 R1238F1211-E1216 WeakPolarHBondContact CE1-OE2 3.33Å; T1214-E1216 WeakPolarHBondContact CB-OE2 3.46Å; T1214-E1216 PolarHBondContact O-N 3.22Å; T1214-E1216 PolarHBondContact OG1-OE2 3.05Å; E1216-L1218 PolarHBondContact O-N 3.12Å; E1216-L1218 VanDerWaalsContact O-N 3.14Å; E1216-Y1219 CarbonylContact O-C 3.45Å; E1216-Y1219 WeakPolarHBondContact O-CA 3.16Å; E1216-Y1219 PolarHBondContact O-N 3.34Å; E1216-Y1219 VanDerWaalsContact O-O 3.07Å; E1216-G1220 PolarHBondContact O-N 3.49Å; E1216-R1238 IonicContact OE1-CZ 3.8Å; E1216-R1238 IonicContact OE1-NH1 3.87Å; E1216-R1238 PolarHBondContact OE1-NH1 3.01Å; E1216-R1238 IonicContact OE1-NH2 2.68Å; E1216-R1238 PolarHBondContact OE1-NH2 3.31Å
1217W46.6Very low38.3Very low120.2 Ų120.2102.7 Ų102.746%0.45553%0.534SS..G310 helixtrans-65.5-17.7175.473-79.1000114.8R469 T1214 D1215 Y1219 P1242 V1243R469-W1217 HydrophobicContact CB-CE3 4.1Å; R469-W1217 HydrophobicContact CB-CZ3 3.65Å; R469-W1217 HydrophobicContact CG-CE3 4.2Å; R469-W1217 HydrophobicContact CG-CZ3 4.15Å; R469-W1217 PolarHBondContact NE-O 3.3Å; T1214-W1217 PolarHBondContact O-NE1 2.99Å; T1214-W1217 VanDerWaalsContact O-NE1 3.11Å; D1215-W1217 VanDerWaalsContact C-N 3.3Å; D1215-W1217 PolarHBondContact O-N 3.3Å; W1217-Y1219 VanDerWaalsContact C-N 3.32Å; W1217-P1242 HydrophobicContact CB-CB 3.38Å; W1217-P1242 HydrophobicContact CB-CG 3.87Å; W1217-P1242 HydrophobicContact CD2-CG 3.85Å; W1217-P1242 VanDerWaalsContact CE2-CD 3.43Å; W1217-P1242 HydrophobicContact CG-CB 3.83Å; W1217-P1242 HydrophobicContact CG-CG 4Å; W1217-V1243 HydrophobicContact CE3-CG2 3.6Å; W1217-V1243 HydrophobicContact CZ3-CG2 3.65Å
1218L45Very low38.6Very low54.2 Ų54.2101.2 Ų101.228%0.28453%0.532SS..G310 helixtrans-81.7-23.4177.7-82.7154.7000111.7R469 L476 D1215 E1216 P1242R469-L1218 HydrophobicContact CG-CD2 4.36Å; R469-L1218 PolarHBondContact NE-O 2.92Å; R469-L1218 PolarHBondContact NH2-O 2.87Å; L476-L1218 HydrophobicContact CD1-CD1 3.59Å; D1215-L1218 HydrophobicContact CB-CB 4.04Å; D1215-L1218 HydrophobicContact CB-CD1 4.14Å; D1215-L1218 WeakPolarHBondContact O-CA 3.1Å; D1215-L1218 VanDerWaalsContact O-CB 3.26Å; D1215-L1218 WeakPolarHBondContact O-CB 3.37Å; D1215-L1218 WeakPolarHBondContact O-CG 3.2Å; D1215-L1218 PolarHBondContact O-N 3.24Å; E1216-L1218 PolarHBondContact O-N 3.12Å; E1216-L1218 VanDerWaalsContact O-N 3.14Å; L1218-P1242 HydrophobicContact CD1-CG 3.94Å; L1218-P1242 HydrophobicContact CD2-CG 4.1Å
1219Y45.2Very low38.9Very low137.2 Ų137.298 Ų9854%0.53852%0.519SS..SBendtrans-99.793177.1-56.4-75.4000109.2R469 D1215 E1216 W1217 D1221 L1227R469-Y1219 PolarHBondContact NH2-O 3.36Å; D1215-Y1219 HydrophobicContact CB-CE2 4.28Å; D1215-Y1219 VanDerWaalsContact O-CD2 3.25Å; D1215-Y1219 WeakPolarHBondContact O-CD2 3.33Å; D1215-Y1219 WeakPolarHBondContact O-CE2 3.22Å; D1215-Y1219 PolarHBondContact O-N 3.35Å; E1216-Y1219 CarbonylContact O-C 3.45Å; E1216-Y1219 WeakPolarHBondContact O-CA 3.16Å; E1216-Y1219 PolarHBondContact O-N 3.34Å; E1216-Y1219 VanDerWaalsContact O-O 3.07Å; W1217-Y1219 VanDerWaalsContact C-N 3.32Å; Y1219-D1221 PolarHBondContact O-N 2.82Å; Y1219-L1227 HydrophobicContact CD1-CD2 3.56Å; Y1219-L1227 HydrophobicContact CE1-CD2 4.16Å; Y1219-L1227 HydrophobicContact CG-CD2 4.5Å
1220G39.4Very low39.2Very low54.2 Ų54.2100.5 Ų100.556%0.55952%0.518SS*.  trans-60.2140.5-176.600000112.8E1216 N1222E1216-G1220 PolarHBondContact O-N 3.49Å; G1220-N1222 PolarHBondContact O-N 2.96Å
1221D38.7Very low39.5Very low142.6 Ų142.696.8 Ų96.876%0.76351%0.506SS*.SBendtrans-39.146.8178.7-79.3-21.3000116.5Y1219 D1223Y1219-D1221 PolarHBondContact O-N 2.82Å; D1221-D1223 PolarHBondContact O-N 3.09Å
1222N39.7Very low39.9Very low142 Ų14293.2 Ų93.276%0.75949%0.494SS*.  trans-89.175.5179.3-77-8.4000112G1220 N1224G1220-N1222 PolarHBondContact O-N 2.96Å; N1222-N1224 PolarHBondContact O-N 3.38Å
1223D37.8Very low40Very low146.2 Ų146.292.2 Ų92.278%0.78249%0.488SS*.SBendtrans-68.760.9171.6-71-36.2000116D1221 N1225D1221-D1223 PolarHBondContact O-N 3.09Å; D1223-N1225 PolarHBondContact O-N 2.99Å
1224N38.2Very low40Very low129.2 Ų129.288.8 Ų88.869%0.69148%0.475SS*.  trans-108.289.7168.3-68.8-22.9000113.4N1222 E1226 L1227N1222-N1224 PolarHBondContact O-N 3.38Å; N1224-E1226 VanDerWaalsContact C-N 3.26Å; N1224-E1226 HydrophobicContact CB-CB 4.4Å; N1224-E1226 HydrophobicContact CB-CG 4.26Å; N1224-E1226 PolarHBondContact ND2-OE2 2.97Å; N1224-E1226 PolarHBondContact O-N 2.98Å; N1224-L1227 PolarHBondContact O-N 3.29Å
1225N37.1Very low39.7Very low121.2 Ų121.290.2 Ų90.265%0.64848%0.478SS*.  trans-64.219.6171.8-84.5-18.9000114.2R473 L1198 D1223 L1227R473-N1225 PolarHBondContact NH2-O 3.29Å; R473-N1225 VanDerWaalsContact NH2-O 3.13Å; L1198-N1225 VanDerWaalsContact CD1-CG 3.49Å; L1198-N1225 WeakPolarHBondContact CD1-ND2 3.22Å; L1198-N1225 VanDerWaalsContact CD1-OD1 3.23Å; L1198-N1225 WeakPolarHBondContact CD1-OD1 3.39Å; L1198-N1225 HydrophobicContact CD2-CB 3.66Å; L1198-N1225 WeakPolarHBondContact CD2-OD1 3.49Å; L1198-N1225 WeakPolarHBondContact CG-ND2 3.32Å; L1198-N1225 WeakPolarHBondContact CG-OD1 3.47Å; D1223-N1225 PolarHBondContact O-N 2.99Å; N1225-L1227 VanDerWaalsContact C-N 3.29Å; N1225-L1227 HydrophobicContact CB-CD1 4.22Å; N1225-L1227 PolarHBondContact O-N 3.28Å
1226E36.9Very low39.4Very low143.6 Ų143.690 Ų9067%0.67148%0.479SS*.  trans-77.255.9176.1-65.9-178.3160.900111.5N1224 C1228 L1229 H1230N1224-E1226 VanDerWaalsContact C-N 3.26Å; N1224-E1226 HydrophobicContact CB-CB 4.4Å; N1224-E1226 HydrophobicContact CB-CG 4.26Å; N1224-E1226 PolarHBondContact ND2-OE2 2.97Å; N1224-E1226 PolarHBondContact O-N 2.98Å; E1226-C1228 PolarHBondContact O-N 3.26Å; E1226-L1229 PolarHBondContact O-N 3.26Å; E1226-H1230 PolarHBondContact O-CD2 3.28Å; E1226-H1230 VanDerWaalsContact O-CD2 3.3Å; E1226-H1230 PolarHBondContact O-N 3.36Å
1227L36.5Very low39.1Very low89.4 Ų89.487.8 Ų87.847%0.46848%0.475SS..  trans-51.640.9173.6-12990.7000112.1Y410 R473 Y1219 N1224 N1225 L1229 H1230Y410-L1227 HydrophobicContact CD2-CD2 4.26Å; Y410-L1227 HydrophobicContact CE2-CD2 3.55Å; R473-L1227 VanDerWaalsContact CD-CD1 3.44Å; R473-L1227 HydrophobicContact CG-CD1 4.26Å; Y1219-L1227 HydrophobicContact CD1-CD2 3.56Å; Y1219-L1227 HydrophobicContact CE1-CD2 4.16Å; Y1219-L1227 HydrophobicContact CG-CD2 4.5Å; N1224-L1227 PolarHBondContact O-N 3.29Å; N1225-L1227 VanDerWaalsContact C-N 3.29Å; N1225-L1227 HydrophobicContact CB-CD1 4.22Å; N1225-L1227 PolarHBondContact O-N 3.28Å; L1227-L1229 VanDerWaalsContact C-N 3.35Å; L1227-L1229 PolarHBondContact O-N 3.12Å; L1227-L1229 VanDerWaalsContact O-N 3.15Å; L1227-H1230 PolarHBondContact O-N 3.29Å
1228C38.2Very low38.7Very low85.6 Ų85.688.5 Ų88.558%0.57848%0.477SS*.Hα-helixtrans-65.832.5176-73.20000111.2E1226 H1230 S1231 V1232E1226-C1228 PolarHBondContact O-N 3.26Å; C1228-H1230 PolarHBondContact O-N 2.99Å; C1228-S1231 WeakPolarHBondContact O-CB 3.49Å; C1228-S1231 PolarHBondContact O-N 3.28Å; C1228-S1231 PolarHBondContact O-OG 3.04Å; C1228-S1231 VanDerWaalsContact O-OG 3.06Å; C1228-V1232 WeakPolarHBondContact O-CG2 3.27Å
1229L36.6Very low38.4Very low67.4 Ų67.490.9 Ų90.935%0.35349%0.49SS..Hα-helixtrans-64-18.4176.6-82.7164.3000113.8V1192 E1226 L1227 S1231 V1232 G1233 W1382 L1389 P1390 F1393V1192-L1229 HydrophobicContact CB-CD2 4.28Å; V1192-L1229 HydrophobicContact CG1-CD2 3.74Å; V1192-L1229 HydrophobicContact CG1-CG 4.41Å; E1226-L1229 PolarHBondContact O-N 3.26Å; L1227-L1229 VanDerWaalsContact C-N 3.35Å; L1227-L1229 PolarHBondContact O-N 3.12Å; L1227-L1229 VanDerWaalsContact O-N 3.15Å; L1229-S1231 VanDerWaalsContact C-N 3.34Å; L1229-S1231 PolarHBondContact O-N 3.37Å; L1229-S1231 VanDerWaalsContact O-N 3.15Å; L1229-V1232 HydrophobicContact CD2-CB 4.48Å; L1229-V1232 VanDerWaalsContact O-CG2 3.29Å; L1229-V1232 WeakPolarHBondContact O-CG2 3.34Å; L1229-V1232 PolarHBondContact O-N 3.17Å; L1229-V1232 VanDerWaalsContact O-N 3.08Å; L1229-G1233 PolarHBondContact O-N 2.91Å; L1229-W1382 HydrophobicContact CD2-CH2 4Å; L1229-W1382 HydrophobicContact CD2-CZ3 3.93Å; L1229-L1389 HydrophobicContact CD1-CD2 4.02Å; L1229-P1390 HydrophobicContact CB-CG 4.13Å; L1229-F1393 VanDerWaalsContact O-CD2 3.29Å; L1229-F1393 WeakPolarHBondContact O-CD2 3.26Å
1230H35.7Very low38.2Very low99.6 Ų99.686.2 Ų86.246%0.46148%0.477SS..Hα-helixtrans-70-24.2175.4-71.5-76.8000113.3E1226 L1227 C1228 V1232 T1234 P1390 E1392E1226-H1230 PolarHBondContact O-CD2 3.28Å; E1226-H1230 VanDerWaalsContact O-CD2 3.3Å; E1226-H1230 PolarHBondContact O-N 3.36Å; L1227-H1230 PolarHBondContact O-N 3.29Å; C1228-H1230 PolarHBondContact O-N 2.99Å; H1230-V1232 VanDerWaalsContact C-N 3.31Å; H1230-V1232 PolarHBondContact O-N 3.32Å; H1230-T1234 WeakPolarHBondContact O-CG2 3.45Å; H1230-T1234 PolarHBondContact O-OG1 2.89Å; H1230-P1390 VanDerWaalsContact NE2-CB 3.29Å; H1230-P1390 WeakPolarHBondContact NE2-CB 3.29Å; H1230-E1392 IonicContact CE1-OE2 2.95Å; H1230-E1392 IonicContact CG-OE2 3.92Å; H1230-E1392 IonicContact ND1-OE2 3.39Å; H1230-E1392 PolarHBondContact ND1-OE2 3.21Å
1231S38.6Very low38.4Very low50 Ų5085.4 Ų85.435%0.3546%0.462SS..Hα-helixtrans-81.8-11.1177.764.60000114.4C1228 L1229 G1233 T1234 F1235 S1237 R1238C1228-S1231 WeakPolarHBondContact O-CB 3.49Å; C1228-S1231 PolarHBondContact O-N 3.28Å; C1228-S1231 PolarHBondContact O-OG 3.04Å; C1228-S1231 VanDerWaalsContact O-OG 3.06Å; L1229-S1231 VanDerWaalsContact C-N 3.34Å; L1229-S1231 PolarHBondContact O-N 3.37Å; L1229-S1231 VanDerWaalsContact O-N 3.15Å; S1231-G1233 PolarHBondContact O-N 3.04Å; S1231-G1233 VanDerWaalsContact O-N 3.08Å; S1231-T1234 PolarHBondContact O-N 3.31Å; S1231-F1235 PolarHBondContact O-N 3.37Å; S1231-S1237 VanDerWaalsContact CB-O 3.28Å; S1231-S1237 WeakPolarHBondContact CB-O 3.35Å; S1231-R1238 WeakPolarHBondContact O-CG 3.12Å
1232V38.6Very low38.6Very low44.6 Ų44.680.7 Ų80.727%0.2744%0.439SS..THydrogen-bonded Turntrans-79.5-11.6-172179.30000112.4P406 L470 W1188 P1189 V1192 C1228 L1229 H1230 F1393P406-V1232 HydrophobicContact CB-CG1 3.98Å; L470-V1232 HydrophobicContact CB-CG1 4.41Å; L470-V1232 HydrophobicContact CD1-CG1 3.53Å; W1188-V1232 WeakPolarHBondContact CH2-O 3.26Å; P1189-V1232 HydrophobicContact CB-CG1 3.67Å; P1189-V1232 VanDerWaalsContact CB-CG1 3.42Å; P1189-V1232 VanDerWaalsContact CD-O 3.27Å; P1189-V1232 WeakPolarHBondContact CD-O 3.39Å; P1189-V1232 HydrophobicContact CG-CB 4.4Å; P1189-V1232 HydrophobicContact CG-CG1 3.45Å; P1189-V1232 VanDerWaalsContact CG-O 3.29Å; P1189-V1232 WeakPolarHBondContact CG-O 3.38Å; V1192-V1232 HydrophobicContact CG2-CB 4.18Å; V1192-V1232 HydrophobicContact CG2-CG1 3.47Å; V1192-V1232 HydrophobicContact CG2-CG2 3.92Å; C1228-V1232 WeakPolarHBondContact O-CG2 3.27Å; L1229-V1232 HydrophobicContact CD2-CB 4.48Å; L1229-V1232 VanDerWaalsContact O-CG2 3.29Å; L1229-V1232 WeakPolarHBondContact O-CG2 3.34Å; L1229-V1232 PolarHBondContact O-N 3.17Å; L1229-V1232 VanDerWaalsContact O-N 3.08Å; H1230-V1232 VanDerWaalsContact C-N 3.31Å; H1230-V1232 PolarHBondContact O-N 3.32Å; V1232-F1393 HydrophobicContact CB-CE2 4.03Å; V1232-F1393 HydrophobicContact CG1-CE2 3.97Å; V1232-F1393 WeakPolarHBondContact O-CE2 3.36Å
1233G39.5Very low38.8Very low16.6 Ų16.676.8 Ų76.817%0.17142%0.421CS..THydrogen-bonded Turntrans-109.6-12.4-179.500000115.8W1188 P1189 V1192 L1229 S1231W1188-G1233 WeakPolarHBondContact CH2-O 3.36Å; W1188-G1233 VanDerWaalsContact CZ3-O 3.25Å; W1188-G1233 WeakPolarHBondContact CZ3-O 3.34Å; P1189-G1233 VanDerWaalsContact CG-CA 3.45Å; V1192-G1233 VanDerWaalsContact CG2-CA 3.44Å; L1229-G1233 PolarHBondContact O-N 2.91Å; S1231-G1233 PolarHBondContact O-N 3.04Å; S1231-G1233 VanDerWaalsContact O-N 3.08Å
1234T38.3Very low39.2Very low31.6 Ų31.671.9 Ų71.919%0.19439%0.394CS..THydrogen-bonded Turntrans-111.159.9179.953.80000109.9H1230 S1231 S1236 S1237 R1238 P1316 I1317 E1392 F1393 T1396H1230-T1234 WeakPolarHBondContact O-CG2 3.45Å; H1230-T1234 PolarHBondContact O-OG1 2.89Å; S1231-T1234 PolarHBondContact O-N 3.31Å; T1234-S1236 WeakPolarHBondContact O-CA 3.48Å; T1234-S1236 PolarHBondContact O-N 3.15Å; T1234-S1237 CarbonylContact O-C 3.4Å; T1234-S1237 PolarHBondContact O-N 3.36Å; T1234-S1237 WeakPolarHBondContact OG1-CB 3.32Å; T1234-S1237 PolarHBondContact OG1-OG 3.23Å; T1234-R1238 PolarHBondContact O-N 3.3Å; T1234-R1238 VanDerWaalsContact O-N 3.16Å; T1234-P1316 HydrophobicContact CG2-CG 4.1Å; T1234-P1316 WeakPolarHBondContact O-CA 2.91Å; T1234-P1316 WeakPolarHBondContact O-CB 3.43Å; T1234-I1317 PolarHBondContact O-N 3.37Å; T1234-E1392 HydrophobicContact CG2-CG 4.47Å; T1234-F1393 HydrophobicContact CG2-CB 4.2Å; T1234-F1393 HydrophobicContact CG2-CD2 3.83Å; T1234-T1396 HydrophobicContact CG2-CG2 4.41Å
1235F37.4Very low39.4Very low75.6 Ų75.667.2 Ų67.233%0.33237%0.369SS..  trans-36.455.8178.9-63.7-72.7000112.3D1138 P1141 Y1184 K1187 W1188 P1189 S1231 S1237 S1314 I1317D1138-F1235 VanDerWaalsContact OD1-CE1 3.31Å; D1138-F1235 WeakPolarHBondContact OD1-CE1 3.22Å; P1141-F1235 HydrophobicContact CB-CE2 3.73Å; P1141-F1235 HydrophobicContact CB-CZ 3.63Å; P1141-F1235 WeakPolarHBondContact CB-O 3.43Å; P1141-F1235 HydrophobicContact CG-CE2 4.32Å; P1141-F1235 HydrophobicContact CG-CZ 3.69Å; Y1184-F1235 HydrophobicContact CE1-CZ 4.09Å; K1187-F1235 WeakPolarHBondContact O-CE2 3.39Å; K1187-F1235 WeakPolarHBondContact O-CZ 3.38Å; W1188-F1235 AromaticContact CH2-CD2 3.6Å; W1188-F1235 HydrophobicContact CH2-CD2 3.6Å; W1188-F1235 AromaticContact CH2-CE2 3.1Å; W1188-F1235 HydrophobicContact CH2-CE2 3.1Å; W1188-F1235 AromaticContact CH2-CZ 3.65Å; W1188-F1235 HydrophobicContact CH2-CZ 3.65Å; W1188-F1235 AromaticContact CZ2-CE2 3.99Å; W1188-F1235 HydrophobicContact CZ2-CE2 3.99Å; W1188-F1235 HydrophobicContact CZ2-CZ 4.35Å; W1188-F1235 AromaticContact CZ3-CD2 3.61Å; W1188-F1235 HydrophobicContact CZ3-CD2 3.61Å; W1188-F1235 AromaticContact CZ3-CE2 3.57Å; W1188-F1235 HydrophobicContact CZ3-CE2 3.57Å; W1188-F1235 HydrophobicContact CZ3-CZ 4.49Å; P1189-F1235 HydrophobicContact CG-CZ 4.25Å; S1231-F1235 PolarHBondContact O-N 3.37Å; F1235-S1237 PolarHBondContact O-N 3.15Å; F1235-S1314 PolarHBondContact O-OG 2.95Å; F1235-I1317 HydrophobicContact CB-CB 4.31Å; F1235-I1317 HydrophobicContact CB-CD1 4.03Å; F1235-I1317 HydrophobicContact CB-CG1 4.24Å; F1235-I1317 HydrophobicContact CE2-CD1 4.3Å; F1235-I1317 WeakPolarHBondContact O-CD1 3.4Å; F1235-I1317 VanDerWaalsContact O-CG1 3.25Å; F1235-I1317 WeakPolarHBondContact O-CG1 3.45Å
1236S39.1Very low39.7Very low42 Ų4262.4 Ų62.429%0.29435%0.346SS..  trans-79.997.5170.8-170.10000111.4T1234 R1238 T1312 S1314 E1392T1234-S1236 WeakPolarHBondContact O-CA 3.48Å; T1234-S1236 PolarHBondContact O-N 3.15Å; S1236-R1238 PolarHBondContact O-N 3.2Å; S1236-R1238 PolarHBondContact OG-N 3.5Å; S1236-R1238 PolarHBondContact OG-O 2.91Å; S1236-T1312 WeakPolarHBondContact OG-CG2 3.36Å; S1236-S1314 WeakPolarHBondContact OG-CB 3.19Å; S1236-S1314 PolarHBondContact OG-OG 2.84Å; S1236-E1392 VanDerWaalsContact CB-OE1 3.26Å; S1236-E1392 WeakPolarHBondContact CB-OE1 3.07Å; S1236-E1392 WeakPolarHBondContact CB-OE2 2.9Å; S1236-E1392 PolarHBondContact OG-OE1 2.93Å; S1236-E1392 PolarHBondContact OG-OE2 2.94Å
1237S37.5Very low40.1Very low50.2 Ų50.256.6 Ų56.635%0.35132%0.323SS..  trans-88.441.9174.570.20000111.9D1142 S1231 T1234 F1235 L1239 N1311 T1312 S1314D1142-S1237 WeakPolarHBondContact OD1-CA 3.32Å; D1142-S1237 WeakPolarHBondContact OD1-CB 3.46Å; S1231-S1237 VanDerWaalsContact CB-O 3.28Å; S1231-S1237 WeakPolarHBondContact CB-O 3.35Å; T1234-S1237 CarbonylContact O-C 3.4Å; T1234-S1237 PolarHBondContact O-N 3.36Å; T1234-S1237 WeakPolarHBondContact OG1-CB 3.32Å; T1234-S1237 PolarHBondContact OG1-OG 3.23Å; F1235-S1237 PolarHBondContact O-N 3.15Å; S1237-L1239 PolarHBondContact O-N 3.14Å; S1237-N1311 PolarHBondContact OG-O 3.13Å; S1237-T1312 WeakPolarHBondContact OG-CG2 3.45Å; S1237-S1314 WeakPolarHBondContact O-CB 3.23Å
1238R38.2Very low40.4Very low134.6 Ų134.655.9 Ų55.951%0.50831%0.314SS..SBendtrans-81.8132162.5-70-169.7-177.3-177.40.5108.8T1214 E1216 S1231 T1234 S1236 P1240T1214-R1238 HydrophobicContact CG2-CG 4.29Å; T1214-R1238 PolarHBondContact OG1-NH1 3.06Å; E1216-R1238 IonicContact OE1-CZ 3.8Å; E1216-R1238 IonicContact OE1-NH1 3.87Å; E1216-R1238 PolarHBondContact OE1-NH1 3.01Å; E1216-R1238 IonicContact OE1-NH2 2.68Å; E1216-R1238 PolarHBondContact OE1-NH2 3.31Å; S1231-R1238 WeakPolarHBondContact O-CG 3.12Å; T1234-R1238 PolarHBondContact O-N 3.3Å; T1234-R1238 VanDerWaalsContact O-N 3.16Å; S1236-R1238 PolarHBondContact O-N 3.2Å; S1236-R1238 PolarHBondContact OG-N 3.5Å; S1236-R1238 PolarHBondContact OG-O 2.91Å; R1238-P1240 WeakPolarHBondContact O-CD 3.31Å
1239L40.1Very low40.6Very low106 Ų10656.5 Ų56.556%0.55531%0.305SS*.PPolyproline II helixtrans-39.7127.2178.1-78.393.5000109.7D1206 S1237 S1241 N1275D1206-L1239 HydrophobicContact CB-CD2 3.99Å; D1206-L1239 VanDerWaalsContact CG-CD1 3.49Å; D1206-L1239 WeakPolarHBondContact OD1-CD1 3.49Å; D1206-L1239 VanDerWaalsContact OD1-CD2 3.31Å; D1206-L1239 WeakPolarHBondContact OD1-CD2 3.46Å; D1206-L1239 WeakPolarHBondContact OD2-CD1 3.24Å; S1237-L1239 PolarHBondContact O-N 3.14Å; L1239-S1241 PolarHBondContact O-N 3.05Å; L1239-N1275 HydrophobicContact CD2-CB 3.46Å; L1239-N1275 VanDerWaalsContact CD2-CB 3.46Å; L1239-N1275 WeakPolarHBondContact CD2-ND2 3.35Å
1240P40.4Very low40.8Very low39 Ų3955.8 Ų55.825%0.25330%0.302SS..PPolyproline II helixtrans-54.6137.5175.413.3-19.3000108.8R1238 I1244 N1245R1238-P1240 WeakPolarHBondContact O-CD 3.31Å; P1240-I1244 HydrophobicContact CB-CB 3.96Å; P1240-I1244 HydrophobicContact CB-CD1 4.32Å; P1240-I1244 HydrophobicContact CB-CG2 3.73Å; P1240-I1244 HydrophobicContact CG-CG2 4.31Å; P1240-N1245 VanDerWaalsContact CB-OD1 3.28Å; P1240-N1245 WeakPolarHBondContact CB-OD1 3.36Å; P1240-N1245 WeakPolarHBondContact CD-OD1 3.27Å; P1240-N1245 VanDerWaalsContact CG-OD1 3.32Å; P1240-N1245 WeakPolarHBondContact CG-OD1 3.35Å; P1240-N1245 PolarHBondContact O-ND2 3.18Å; P1240-N1245 VanDerWaalsContact O-ND2 3.13Å
1241S43.7Very low41.1Very low36.8 Ų36.852 Ų5226%0.25729%0.288SS..PPolyproline II helixtrans-52.4144.5-178.276.70000109.7G467 L1239 V1243 I1244 N1245G467-S1241 WeakPolarHBondContact O-CB 3.36Å; G467-S1241 PolarHBondContact O-OG 2.94Å; L1239-S1241 PolarHBondContact O-N 3.05Å; S1241-V1243 CarbonylContact O-C 3.55Å; S1241-V1243 PolarHBondContact O-N 3.16Å; S1241-V1243 VanDerWaalsContact O-N 3.12Å; S1241-V1243 PolarHBondContact OG-N 3.1Å; S1241-I1244 CarbonylContact O-C 3.46Å; S1241-I1244 VanDerWaalsContact O-CA 3.29Å; S1241-I1244 WeakPolarHBondContact O-CA 3.38Å; S1241-I1244 WeakPolarHBondContact O-CB 3.36Å; S1241-I1244 PolarHBondContact O-N 3Å; S1241-I1244 WeakPolarHBondContact OG-CB 3.4Å; S1241-I1244 WeakPolarHBondContact OG-CD1 3.44Å; S1241-I1244 VanDerWaalsContact OG-CG1 3.25Å; S1241-I1244 WeakPolarHBondContact OG-CG1 3.24Å; S1241-I1244 PolarHBondContact OG-N 3.16Å; S1241-I1244 VanDerWaalsContact OG-N 3.13Å; S1241-N1245 PolarHBondContact O-N 3.14Å
1242P43.3Very low41.2Very low43.4 Ų43.451.2 Ų51.228%0.28228%0.283SS..Hα-helixtrans-58.6-22179.912.7-19.9000112F1211 A1212 D1215 W1217 L1218 N1245 A1246 A1271F1211-P1242 HydrophobicContact CB-CG 4.38Å; A1212-P1242 CarbonylContact O-C 3.38Å; A1212-P1242 WeakPolarHBondContact O-CB 3.33Å; A1212-P1242 WeakPolarHBondContact O-CG 3.45Å; D1215-P1242 HydrophobicContact CB-CG 4.28Å; D1215-P1242 WeakPolarHBondContact OD2-CD 3Å; D1215-P1242 WeakPolarHBondContact OD2-CG 3.5Å; W1217-P1242 HydrophobicContact CB-CB 3.38Å; W1217-P1242 HydrophobicContact CB-CG 3.87Å; W1217-P1242 HydrophobicContact CD2-CG 3.85Å; W1217-P1242 VanDerWaalsContact CE2-CD 3.43Å; W1217-P1242 HydrophobicContact CG-CB 3.83Å; W1217-P1242 HydrophobicContact CG-CG 4Å; L1218-P1242 HydrophobicContact CD1-CG 3.94Å; L1218-P1242 HydrophobicContact CD2-CG 4.1Å; P1242-N1245 PolarHBondContact O-N 3.09Å; P1242-A1246 WeakPolarHBondContact O-CA 3.31Å; P1242-A1246 WeakPolarHBondContact O-CB 3.34Å; P1242-A1246 PolarHBondContact O-N 3.27Å; P1242-A1271 HydrophobicContact CB-CB 3.81Å
1243V43.9Very low41.3Very low61 Ų6151.5 Ų51.537%0.3728%0.281SS..Hα-helixtrans-66.2-43.4168.3-179.70000112.1F1213 W1217 S1241 A1246 A1247 W1267F1213-V1243 HydrophobicContact CD1-CG2 4.2Å; F1213-V1243 HydrophobicContact CE1-CG2 4Å; W1217-V1243 HydrophobicContact CE3-CG2 3.6Å; W1217-V1243 HydrophobicContact CZ3-CG2 3.65Å; S1241-V1243 CarbonylContact O-C 3.55Å; S1241-V1243 PolarHBondContact O-N 3.16Å; S1241-V1243 VanDerWaalsContact O-N 3.12Å; S1241-V1243 PolarHBondContact OG-N 3.1Å; V1243-A1246 PolarHBondContact O-N 3.26Å; V1243-A1247 WeakPolarHBondContact O-CA 3.4Å; V1243-A1247 VanDerWaalsContact O-CB 3.29Å; V1243-A1247 WeakPolarHBondContact O-CB 3.34Å; V1243-A1247 PolarHBondContact O-N 3.23Å; V1243-W1267 HydrophobicContact CG1-CD2 4.21Å; V1243-W1267 HydrophobicContact CG1-CE3 3.54Å; V1243-W1267 HydrophobicContact CG1-CH2 3.16Å; V1243-W1267 HydrophobicContact CG1-CZ2 3.65Å; V1243-W1267 HydrophobicContact CG1-CZ3 3.09Å
1244I44.6Very low41.4Very low43.4 Ų43.452.5 Ų52.522%0.22329%0.285CS..Hα-helixtrans-68.7-39.4173.8-66.6166.3000110.2I1038 Y1051 P1240 S1241 A1247 R1248 C1270I1038-I1244 HydrophobicContact CD1-CD1 3.97Å; I1038-I1244 HydrophobicContact CD1-CG1 4.33Å; Y1051-I1244 HydrophobicContact CD1-CD1 3.75Å; Y1051-I1244 HydrophobicContact CE1-CD1 3.81Å; P1240-I1244 HydrophobicContact CB-CB 3.96Å; P1240-I1244 HydrophobicContact CB-CD1 4.32Å; P1240-I1244 HydrophobicContact CB-CG2 3.73Å; P1240-I1244 HydrophobicContact CG-CG2 4.31Å; S1241-I1244 CarbonylContact O-C 3.46Å; S1241-I1244 VanDerWaalsContact O-CA 3.29Å; S1241-I1244 WeakPolarHBondContact O-CA 3.38Å; S1241-I1244 WeakPolarHBondContact O-CB 3.36Å; S1241-I1244 PolarHBondContact O-N 3Å; S1241-I1244 WeakPolarHBondContact OG-CB 3.4Å; S1241-I1244 WeakPolarHBondContact OG-CD1 3.44Å; S1241-I1244 VanDerWaalsContact OG-CG1 3.25Å; S1241-I1244 WeakPolarHBondContact OG-CG1 3.24Å; S1241-I1244 PolarHBondContact OG-N 3.16Å; S1241-I1244 VanDerWaalsContact OG-N 3.13Å; I1244-A1247 CarbonylContact O-C 3.55Å; I1244-A1247 PolarHBondContact O-N 3.18Å; I1244-R1248 HydrophobicContact CG2-CG 4.28Å; I1244-R1248 VanDerWaalsContact CG2-NE 3.32Å; I1244-R1248 WeakPolarHBondContact O-CA 3.15Å; I1244-R1248 VanDerWaalsContact O-CB 3.25Å; I1244-R1248 WeakPolarHBondContact O-CB 3.35Å; I1244-R1248 VanDerWaalsContact O-CD 3.27Å; I1244-R1248 WeakPolarHBondContact O-CD 3.26Å; I1244-R1248 WeakPolarHBondContact O-CG 3.31Å; I1244-R1248 PolarHBondContact O-N 3.03Å; I1244-C1270 HydrophobicContact CG1-CB 4.44Å
1245N43.6Very low41.5Very low28.8 Ų28.855.6 Ų55.615%0.15430%0.3CS..Hα-helixtrans-65.7-45.4174.4-78.1-12.5000111.5P1240 S1241 P1242 A1247 R1248 Y1249 N1275P1240-N1245 VanDerWaalsContact CB-OD1 3.28Å; P1240-N1245 WeakPolarHBondContact CB-OD1 3.36Å; P1240-N1245 WeakPolarHBondContact CD-OD1 3.27Å; P1240-N1245 VanDerWaalsContact CG-OD1 3.32Å; P1240-N1245 WeakPolarHBondContact CG-OD1 3.35Å; P1240-N1245 PolarHBondContact O-ND2 3.18Å; P1240-N1245 VanDerWaalsContact O-ND2 3.13Å; S1241-N1245 PolarHBondContact O-N 3.14Å; P1242-N1245 PolarHBondContact O-N 3.09Å; N1245-A1247 VanDerWaalsContact C-N 3.32Å; N1245-A1247 PolarHBondContact O-N 3.14Å; N1245-R1248 CarbonylContact O-C 3.55Å; N1245-R1248 WeakPolarHBondContact O-CA 3.4Å; N1245-R1248 WeakPolarHBondContact O-CB 3.32Å; N1245-R1248 PolarHBondContact O-N 3.06Å; N1245-R1248 VanDerWaalsContact O-N 3.12Å; N1245-R1248 WeakPolarHBondContact OD1-CD 3.38Å; N1245-R1248 PolarHBondContact OD1-NH1 3.42Å; N1245-Y1249 VanDerWaalsContact C-CD2 3.47Å; N1245-Y1249 HydrophobicContact CB-CD2 4.11Å; N1245-Y1249 HydrophobicContact CB-CE2 4.1Å; N1245-Y1249 VanDerWaalsContact O-CB 3.27Å; N1245-Y1249 WeakPolarHBondContact O-CB 3.42Å; N1245-Y1249 WeakPolarHBondContact O-CD2 3.4Å; N1245-Y1249 PolarHBondContact O-N 3.22Å; N1245-N1275 PolarHBondContact ND2-OD1 3.45Å
1246A43.7Very low41.7Very low21.2 Ų21.255.3 Ų55.318%0.17530%0.299CS..Hα-helixtrans-60.9-44.1172.900000111.1A1212 P1242 V1243 R1248 Y1249 D1250 C1270 A1271A1212-A1246 HydrophobicContact CB-CB 3.68Å; P1242-A1246 WeakPolarHBondContact O-CA 3.31Å; P1242-A1246 WeakPolarHBondContact O-CB 3.34Å; P1242-A1246 PolarHBondContact O-N 3.27Å; V1243-A1246 PolarHBondContact O-N 3.26Å; A1246-R1248 VanDerWaalsContact C-N 3.31Å; A1246-R1248 PolarHBondContact O-N 3.15Å; A1246-Y1249 CarbonylContact O-C 3.58Å; A1246-Y1249 PolarHBondContact O-N 3.14Å; A1246-D1250 WeakPolarHBondContact O-CA 3.48Å; A1246-D1250 VanDerWaalsContact O-CB 3.31Å; A1246-D1250 WeakPolarHBondContact O-CB 3.35Å; A1246-D1250 PolarHBondContact O-N 3.38Å; A1246-D1250 VanDerWaalsContact O-OD2 3.06Å; A1246-C1270 HydrophobicContact CB-CB 3.82Å; A1246-A1271 HydrophobicContact CB-CB 4.27Å
1247A44Very low41.7Very low22.6 Ų22.657 Ų5719%0.18731%0.308CS..Hα-helixtrans-64.3-33.8174.400000112.2V1044 V1243 I1244 N1245 D1250 A1251 F1253 A1271V1044-A1247 HydrophobicContact CG1-CB 4.06Å; V1044-A1247 HydrophobicContact CG2-CB 4Å; V1243-A1247 WeakPolarHBondContact O-CA 3.4Å; V1243-A1247 VanDerWaalsContact O-CB 3.29Å; V1243-A1247 WeakPolarHBondContact O-CB 3.34Å; V1243-A1247 PolarHBondContact O-N 3.23Å; I1244-A1247 CarbonylContact O-C 3.55Å; I1244-A1247 PolarHBondContact O-N 3.18Å; N1245-A1247 VanDerWaalsContact C-N 3.32Å; N1245-A1247 PolarHBondContact O-N 3.14Å; A1247-D1250 CarbonylContact O-C 3.54Å; A1247-D1250 PolarHBondContact O-N 2.94Å; A1247-A1251 VanDerWaalsContact O-CA 3.28Å; A1247-A1251 WeakPolarHBondContact O-CA 3.32Å; A1247-A1251 WeakPolarHBondContact O-CB 3.12Å; A1247-A1251 PolarHBondContact O-N 3.09Å; A1247-F1253 HydrophobicContact CB-CD2 4.35Å; A1247-F1253 HydrophobicContact CB-CE2 3.77Å; A1247-F1253 WeakPolarHBondContact O-CD2 3.22Å; A1247-F1253 WeakPolarHBondContact O-CE2 3.3Å; A1247-A1271 HydrophobicContact CB-CB 3.9Å
1248R43.6Very low41.7Very low73.8 Ų73.860.9 Ų60.928%0.27833%0.325SS..Hα-helixtrans-68.4-43.4173.4-77166.4161.2-169.8-0.6111.2D1142 I1244 N1245 A1246 D1250 A1251 A1252 F1253 N1275 F1278D1142-R1248 IonicContact OD1-NH2 3.4Å; D1142-R1248 PolarHBondContact OD1-NH2 3.49Å; D1142-R1248 IonicContact OD2-CZ 3.8Å; D1142-R1248 IonicContact OD2-NE 2.86Å; D1142-R1248 PolarHBondContact OD2-NE 2.94Å; D1142-R1248 IonicContact OD2-NH2 3.2Å; D1142-R1248 PolarHBondContact OD2-NH2 3.4Å; I1244-R1248 HydrophobicContact CG2-CG 4.28Å; I1244-R1248 VanDerWaalsContact CG2-NE 3.32Å; I1244-R1248 WeakPolarHBondContact O-CA 3.15Å; I1244-R1248 VanDerWaalsContact O-CB 3.25Å; I1244-R1248 WeakPolarHBondContact O-CB 3.35Å; I1244-R1248 VanDerWaalsContact O-CD 3.27Å; I1244-R1248 WeakPolarHBondContact O-CD 3.26Å; I1244-R1248 WeakPolarHBondContact O-CG 3.31Å; I1244-R1248 PolarHBondContact O-N 3.03Å; N1245-R1248 CarbonylContact O-C 3.55Å; N1245-R1248 WeakPolarHBondContact O-CA 3.4Å; N1245-R1248 WeakPolarHBondContact O-CB 3.32Å; N1245-R1248 PolarHBondContact O-N 3.06Å; N1245-R1248 VanDerWaalsContact O-N 3.12Å; N1245-R1248 WeakPolarHBondContact OD1-CD 3.38Å; N1245-R1248 PolarHBondContact OD1-NH1 3.42Å; A1246-R1248 VanDerWaalsContact C-N 3.31Å; A1246-R1248 PolarHBondContact O-N 3.15Å; R1248-D1250 VanDerWaalsContact C-N 3.26Å; R1248-D1250 PolarHBondContact O-N 2.97Å; R1248-A1251 PolarHBondContact O-N 3.02Å; R1248-A1251 VanDerWaalsContact O-N 3.16Å; R1248-A1252 WeakPolarHBondContact O-CB 2.91Å; R1248-A1252 PolarHBondContact O-N 3.09Å; R1248-A1252 VanDerWaalsContact O-N 3.14Å; R1248-F1253 HydrophobicContact CG-CB 4.27Å; R1248-N1275 PolarHBondContact NH2-O 3.18Å; R1248-F1278 VanDerWaalsContact CD-CE2 3.45Å; R1248-F1278 HydrophobicContact CG-CZ 4.33Å; R1248-F1278 VanDerWaalsContact CZ-CE2 3.42Å; R1248-F1278 VanDerWaalsContact NH1-CD2 3.35Å
1249Y41.6Very low41.6Very low97.4 Ų97.460.6 Ų60.638%0.38233%0.333SS..Hα-helixtrans-67.6-40.4175.6-76.6-60.4000111.9A1212 N1245 A1246 A1251 A1252 F1253 Y1273 F1278 E1280 W1281A1212-Y1249 HydrophobicContact CB-CD2 3.85Å; A1212-Y1249 HydrophobicContact CB-CE2 3.33Å; N1245-Y1249 VanDerWaalsContact C-CD2 3.47Å; N1245-Y1249 HydrophobicContact CB-CD2 4.11Å; N1245-Y1249 HydrophobicContact CB-CE2 4.1Å; N1245-Y1249 VanDerWaalsContact O-CB 3.27Å; N1245-Y1249 WeakPolarHBondContact O-CB 3.42Å; N1245-Y1249 WeakPolarHBondContact O-CD2 3.4Å; N1245-Y1249 PolarHBondContact O-N 3.22Å; A1246-Y1249 CarbonylContact O-C 3.58Å; A1246-Y1249 PolarHBondContact O-N 3.14Å; Y1249-A1251 VanDerWaalsContact C-N 3.26Å; Y1249-A1251 PolarHBondContact O-N 3.07Å; Y1249-A1252 WeakPolarHBondContact O-CA 3.38Å; Y1249-A1252 VanDerWaalsContact O-CB 3.32Å; Y1249-A1252 WeakPolarHBondContact O-CB 3.48Å; Y1249-A1252 PolarHBondContact O-N 3.09Å; Y1249-A1252 VanDerWaalsContact O-N 3.11Å; Y1249-F1253 AromaticContact CD1-CD2 3.93Å; Y1249-F1253 HydrophobicContact CD1-CD2 3.93Å; Y1249-F1253 HydrophobicContact CD1-CE2 4.09Å; Y1249-F1253 HydrophobicContact CE1-CD2 4.31Å; Y1249-F1253 HydrophobicContact CE1-CE2 4.04Å; Y1249-F1253 WeakPolarHBondContact O-CD2 3.23Å; Y1249-F1253 WeakPolarHBondContact O-CE2 3.38Å; Y1249-F1253 PolarHBondContact O-N 3.25Å; Y1249-F1253 VanDerWaalsContact O-N 3.13Å; Y1249-Y1273 HydrophobicContact CE2-CD1 4.01Å; Y1249-Y1273 HydrophobicContact CE2-CG 4.26Å; Y1249-Y1273 AromaticContact CZ-CD1 3.65Å; Y1249-Y1273 WeakPolarHBondContact OH-CD1 3.32Å; Y1249-Y1273 WeakPolarHBondContact OH-CE1 3.35Å; Y1249-F1278 WeakPolarHBondContact O-CB 3.22Å; Y1249-E1280 WeakPolarHBondContact OH-CB 3.35Å; Y1249-E1280 PolarHBondContact OH-OE2 3.2Å; Y1249-W1281 AromaticContact CD1-CD1 3.86Å; Y1249-W1281 AromaticContact CD1-NE1 3.53Å; Y1249-W1281 AromaticContact CE1-CD1 3.21Å; Y1249-W1281 AromaticContact CE1-CZ3 3.93Å; Y1249-W1281 HydrophobicContact CE1-CZ3 3.93Å; Y1249-W1281 AromaticContact CE1-NE1 2.91Å; Y1249-W1281 AromaticContact CZ-CD1 3.85Å; Y1249-W1281 AromaticContact CZ-CZ3 3.71Å; Y1249-W1281 AromaticContact CZ-NE1 3.16Å; Y1249-W1281 WeakPolarHBondContact OH-CH2 3.21Å; Y1249-W1281 WeakPolarHBondContact OH-CZ3 3.44Å; Y1249-W1281 PolarHBondContact OH-NE1 3.38Å; Y1249-W1281 VanDerWaalsContact OH-NE1 3.09Å
1250D41.4Very low41.4Very low54.4 Ų54.461.8 Ų61.829%0.29133%0.33SS..Hα-helixtrans-75-30.1176.1-73.6-12.3000111.9R696 R1048 A1246 A1247 R1248 A1252 F1253 Q1256 F1262 W1267 Y1273 L1274 N1275R696-D1250 IonicContact CZ-OD1 3.49Å; R696-D1250 IonicContact CZ-OD2 3.77Å; R696-D1250 IonicContact NE-OD1 3.9Å; R696-D1250 PolarHBondContact NE-OD1 3.01Å; R696-D1250 IonicContact NE-OD2 3.06Å; R696-D1250 IonicContact NH2-OD1 3.57Å; R696-D1250 PolarHBondContact NH2-OD1 3.48Å; R696-D1250 IonicContact NH2-OD2 2.67Å; R696-D1250 PolarHBondContact NH2-OD2 3.12Å; R1048-D1250 PolarHBondContact NH1-O 3.39Å; R1048-D1250 VanDerWaalsContact NH2-C 3.26Å; R1048-D1250 PolarHBondContact NH2-O 3.11Å; A1246-D1250 WeakPolarHBondContact O-CA 3.48Å; A1246-D1250 VanDerWaalsContact O-CB 3.31Å; A1246-D1250 WeakPolarHBondContact O-CB 3.35Å; A1246-D1250 PolarHBondContact O-N 3.38Å; A1246-D1250 VanDerWaalsContact O-OD2 3.06Å; A1247-D1250 CarbonylContact O-C 3.54Å; A1247-D1250 PolarHBondContact O-N 2.94Å; R1248-D1250 VanDerWaalsContact C-N 3.26Å; R1248-D1250 PolarHBondContact O-N 2.97Å; D1250-A1252 VanDerWaalsContact C-N 3.25Å; D1250-F1253 CarbonylContact O-C 3.5Å; D1250-F1253 PolarHBondContact O-N 3.25Å; D1250-Q1256 PolarHBondContact OD2-NE2 2.82Å; D1250-F1262 WeakPolarHBondContact OD2-CE1 3.29Å; D1250-W1267 HydrophobicContact CB-CZ3 4.34Å; D1250-Y1273 WeakPolarHBondContact CB-O 3.33Å; D1250-L1274 VanDerWaalsContact OD1-C 3.28Å; D1250-N1275 WeakPolarHBondContact OD1-CA 3.43Å; D1250-N1275 PolarHBondContact OD1-N 2.96Å; D1250-N1275 PolarHBondContact OD1-OD1 3.26Å
1251A41.1Very low41.2Very low20 Ų2067.9 Ų67.917%0.16535%0.35CS..Hα-helixtrans-80.5-24177.200000113.6V1044 R1048 A1247 R1248 Y1249 F1253 C1270 A1271 Y1273 R1285V1044-A1251 HydrophobicContact CG1-CB 4.33Å; R1048-A1251 HydrophobicContact CG-CB 3.77Å; R1048-A1251 VanDerWaalsContact NE-CA 3.31Å; R1048-A1251 PolarHBondContact NH1-O 3.32Å; R1048-A1251 VanDerWaalsContact NH1-O 3.13Å; A1247-A1251 VanDerWaalsContact O-CA 3.28Å; A1247-A1251 WeakPolarHBondContact O-CA 3.32Å; A1247-A1251 WeakPolarHBondContact O-CB 3.12Å; A1247-A1251 PolarHBondContact O-N 3.09Å; R1248-A1251 PolarHBondContact O-N 3.02Å; R1248-A1251 VanDerWaalsContact O-N 3.16Å; Y1249-A1251 VanDerWaalsContact C-N 3.26Å; Y1249-A1251 PolarHBondContact O-N 3.07Å; A1251-F1253 VanDerWaalsContact C-N 3.29Å; A1251-F1253 HydrophobicContact CB-CD2 4.11Å; A1251-F1253 HydrophobicContact CB-CE2 3.76Å; A1251-F1253 PolarHBondContact O-N 2.98Å; A1251-F1253 VanDerWaalsContact O-N 3.13Å; A1251-C1270 HydrophobicContact CB-CB 3.86Å; A1251-C1270 WeakPolarHBondContact CB-O 3.16Å; A1251-A1271 HydrophobicContact CB-CB 3.68Å; A1251-Y1273 HydrophobicContact CB-CD2 3.87Å; A1251-R1285 VanDerWaalsContact C-NH2 3.28Å; A1251-R1285 PolarHBondContact O-NE 3.41Å; A1251-R1285 PolarHBondContact O-NH2 3Å
1252A41.7Very low40.7Very low31.4 Ų31.470.2 Ų70.226%0.2636%0.355SS..THydrogen-bonded Turntrans-53.5-10.3172.900000113.6Y1051 R1248 Y1249 D1250 P1254 F1278 R1285Y1051-A1252 HydrophobicContact CD1-CB 3.82Å; Y1051-A1252 HydrophobicContact CE1-CB 3.91Å; R1248-A1252 WeakPolarHBondContact O-CB 2.91Å; R1248-A1252 PolarHBondContact O-N 3.09Å; R1248-A1252 VanDerWaalsContact O-N 3.14Å; Y1249-A1252 WeakPolarHBondContact O-CA 3.38Å; Y1249-A1252 VanDerWaalsContact O-CB 3.32Å; Y1249-A1252 WeakPolarHBondContact O-CB 3.48Å; Y1249-A1252 PolarHBondContact O-N 3.09Å; Y1249-A1252 VanDerWaalsContact O-N 3.11Å; D1250-A1252 VanDerWaalsContact C-N 3.25Å; A1252-P1254 WeakPolarHBondContact O-CD 3.48Å; A1252-F1278 HydrophobicContact CB-CD1 3.91Å; A1252-F1278 HydrophobicContact CB-CD2 3.8Å; A1252-F1278 HydrophobicContact CB-CE1 3.37Å; A1252-F1278 HydrophobicContact CB-CE2 3.24Å; A1252-F1278 HydrophobicContact CB-CG 4.13Å; A1252-F1278 HydrophobicContact CB-CZ 3.01Å; A1252-R1285 HydrophobicContact CB-CB 4.46Å; A1252-R1285 HydrophobicContact CB-CG 4.33Å
1253F40.3Very low40.5Very low52.4 Ų52.471.9 Ų71.923%0.2337%0.366CS..SBendtrans-118.4112.6179.1-67.6-78.9000111.3T738 K742 T799 V803 V1044 R1048 A1247 R1248 Y1249 D1250 A1251 L1255 F1262 C1270 M1609 M1613T738-F1253 HydrophobicContact CG2-CD1 4.27Å; T738-F1253 HydrophobicContact CG2-CE1 3.44Å; T738-F1253 VanDerWaalsContact CG2-CE1 3.44Å; T738-F1253 HydrophobicContact CG2-CZ 4.17Å; K742-F1253 VanDerWaalsContact CE-CE2 3.47Å; K742-F1253 VanDerWaalsContact CE-CZ 3.41Å; T799-F1253 HydrophobicContact CG2-CD1 4.12Å; V803-F1253 HydrophobicContact CG2-CE1 3.5Å; V803-F1253 VanDerWaalsContact CG2-CE1 3.5Å; V803-F1253 HydrophobicContact CG2-CZ 3.61Å; V1044-F1253 HydrophobicContact CG1-CD1 3.72Å; V1044-F1253 HydrophobicContact CG1-CE1 3.46Å; V1044-F1253 VanDerWaalsContact CG1-CE1 3.46Å; R1048-F1253 HydrophobicContact CG-CD1 4.38Å; R1048-F1253 PolarHBondContact NH1-O 3.27Å; A1247-F1253 HydrophobicContact CB-CD2 4.35Å; A1247-F1253 HydrophobicContact CB-CE2 3.77Å; A1247-F1253 WeakPolarHBondContact O-CD2 3.22Å; A1247-F1253 WeakPolarHBondContact O-CE2 3.3Å; R1248-F1253 HydrophobicContact CG-CB 4.27Å; Y1249-F1253 AromaticContact CD1-CD2 3.93Å; Y1249-F1253 HydrophobicContact CD1-CD2 3.93Å; Y1249-F1253 HydrophobicContact CD1-CE2 4.09Å; Y1249-F1253 HydrophobicContact CE1-CD2 4.31Å; Y1249-F1253 HydrophobicContact CE1-CE2 4.04Å; Y1249-F1253 WeakPolarHBondContact O-CD2 3.23Å; Y1249-F1253 WeakPolarHBondContact O-CE2 3.38Å; Y1249-F1253 PolarHBondContact O-N 3.25Å; Y1249-F1253 VanDerWaalsContact O-N 3.13Å; D1250-F1253 CarbonylContact O-C 3.5Å; D1250-F1253 PolarHBondContact O-N 3.25Å; A1251-F1253 VanDerWaalsContact C-N 3.29Å; A1251-F1253 HydrophobicContact CB-CD2 4.11Å; A1251-F1253 HydrophobicContact CB-CE2 3.76Å; A1251-F1253 PolarHBondContact O-N 2.98Å; A1251-F1253 VanDerWaalsContact O-N 3.13Å; F1253-L1255 VanDerWaalsContact C-N 3.32Å; F1253-L1255 HydrophobicContact CB-CD1 4.42Å; F1253-L1255 HydrophobicContact CD1-CD1 4.14Å; F1253-L1255 PolarHBondContact O-N 3.17Å; F1253-F1262 HydrophobicContact CD1-CE1 4.34Å; F1253-F1262 HydrophobicContact CD1-CZ 4.04Å; F1253-F1262 AromaticContact CE1-CE1 3.43Å; F1253-F1262 HydrophobicContact CE1-CE1 3.43Å; F1253-F1262 VanDerWaalsContact CE1-CE1 3.43Å; F1253-F1262 AromaticContact CE1-CZ 3.45Å; F1253-F1262 HydrophobicContact CE1-CZ 3.45Å; F1253-F1262 VanDerWaalsContact CE1-CZ 3.45Å; F1253-F1262 AromaticContact CZ-CE1 3.85Å; F1253-F1262 HydrophobicContact CZ-CE1 3.85Å; F1253-F1262 AromaticContact CZ-CZ 3.82Å; F1253-F1262 HydrophobicContact CZ-CZ 3.82Å; F1253-C1270 HydrophobicContact CE2-CB 4.12Å; F1253-C1270 HydrophobicContact CZ-CB 4.13Å; F1253-M1609 HydrophobicContact CE1-CE 3.83Å; F1253-M1609 HydrophobicContact CE1-SD 3.76Å; F1253-M1609 HydrophobicContact CZ-CE 3.65Å; F1253-M1609 HydrophobicContact CZ-SD 3.85Å; F1253-M1613 HydrophobicContact CD1-CE 4.32Å; F1253-M1613 HydrophobicContact CD1-SD 3.55Å; F1253-M1613 VanDerWaalsContact CD1-SD 3.55Å; F1253-M1613 HydrophobicContact CE1-SD 3.76Å
1254P41.5Very low40.4Very low37 Ų3772.3 Ų72.324%0.2437%0.371CS..  trans-68.3109.6169.919.7-20.6000109.3D875 A878 S879 I882 T1047 L1140 D1142 A1252 Q1256D875-P1254 HydrophobicContact CB-CB 4.35Å; A878-P1254 HydrophobicContact CB-CG 4.46Å; S879-P1254 WeakPolarHBondContact OG-CB 3.41Å; S879-P1254 VanDerWaalsContact OG-CG 3.27Å; S879-P1254 WeakPolarHBondContact OG-CG 3.41Å; I882-P1254 HydrophobicContact CD1-CG 4.49Å; T1047-P1254 HydrophobicContact CG2-CG 3.56Å; L1140-P1254 HydrophobicContact CD2-CB 4.3Å; L1140-P1254 HydrophobicContact CD2-CG 3.94Å; D1142-P1254 HydrophobicContact CB-CB 4.04Å; D1142-P1254 VanDerWaalsContact OD2-C 3.31Å; D1142-P1254 WeakPolarHBondContact OD2-CA 3.38Å; A1252-P1254 WeakPolarHBondContact O-CD 3.48Å; P1254-Q1256 WeakPolarHBondContact O-CA 3.4Å; P1254-Q1256 PolarHBondContact O-N 2.83Å
1255L41.5Very low40.3Very low96.8 Ų96.878.6 Ų78.651%0.50739%0.393SS..  trans-57.893.1178.1-71.2156.1000111.5D875 P1141 D1142 F1253D875-L1255 HydrophobicContact CB-CD1 4.05Å; D875-L1255 HydrophobicContact CB-CG 4.04Å; D875-L1255 WeakPolarHBondContact OD1-CD1 3.46Å; P1141-L1255 HydrophobicContact CB-CD1 4.34Å; P1141-L1255 HydrophobicContact CG-CB 3.55Å; P1141-L1255 HydrophobicContact CG-CD1 3.68Å; P1141-L1255 HydrophobicContact CG-CG 4.25Å; D1142-L1255 WeakPolarHBondContact OD1-CD1 3.29Å; D1142-L1255 PolarHBondContact OD2-N 3.14Å; F1253-L1255 VanDerWaalsContact C-N 3.32Å; F1253-L1255 HydrophobicContact CB-CD1 4.42Å; F1253-L1255 HydrophobicContact CD1-CD1 4.14Å; F1253-L1255 PolarHBondContact O-N 3.17Å
1256Q40.3Very low40.2Very low68.6 Ų68.681.4 Ų81.432%0.32141%0.407SS..  trans-97.4137.4161.4-104.8174.4-3.800110R696 D1250 P1254 N1258 W1260 F1262R696-Q1256 VanDerWaalsContact NH2-NE2 3.12Å; D1250-Q1256 PolarHBondContact OD2-NE2 2.82Å; P1254-Q1256 WeakPolarHBondContact O-CA 3.4Å; P1254-Q1256 PolarHBondContact O-N 2.83Å; Q1256-N1258 PolarHBondContact O-N 2.68Å; Q1256-W1260 HydrophobicContact CB-CB 4.33Å; Q1256-W1260 HydrophobicContact CB-CD2 3.87Å; Q1256-W1260 HydrophobicContact CB-CE3 3.54Å; Q1256-W1260 HydrophobicContact CB-CG 4.29Å; Q1256-W1260 HydrophobicContact CB-CZ3 3.89Å; Q1256-W1260 HydrophobicContact CG-CB 3.6Å; Q1256-W1260 HydrophobicContact CG-CD2 4.38Å; Q1256-W1260 HydrophobicContact CG-CE3 4Å; Q1256-W1260 HydrophobicContact CG-CG 4.16Å; Q1256-W1260 HydrophobicContact CG-CH2 4.27Å; Q1256-W1260 HydrophobicContact CG-CZ3 3.59Å; Q1256-W1260 PolarHBondContact NE2-O 3.37Å; Q1256-W1260 VanDerWaalsContact OE1-CZ3 3.27Å; Q1256-F1262 VanDerWaalsContact NE2-CE2 3.3Å
1257T40Very low40.2Very low77.6 Ų77.685.7 Ų85.748%0.47642%0.418SS..  trans-66.5143.7176.160.30000111.4R689 N1259 W1260R689-T1257 HydrophobicContact CG-CG2 4.34Å; T1257-N1259 VanDerWaalsContact C-N 3.34Å; T1257-N1259 PolarHBondContact O-N 2.98Å; T1257-N1259 VanDerWaalsContact O-N 3.12Å; T1257-W1260 PolarHBondContact O-N 3.04Å; T1257-W1260 PolarHBondContact OG1-NE1 2.87Å
1258N38.3Very low40.1Very low132.8 Ų132.889.2 Ų89.271%0.7143%0.431SS*.SBendtrans-62.221.1-178.1-75.7-16.8000115Q1256 W1260Q1256-N1258 PolarHBondContact O-N 2.68Å; N1258-W1260 PolarHBondContact O-N 2.99Å
1259N35.8Very low40Very low127.6 Ų127.692.2 Ų92.268%0.68244%0.442SS*.  trans-114.953.6172.8-72.5-22.1000111.3T1257 Y1261T1257-N1259 VanDerWaalsContact C-N 3.34Å; T1257-N1259 PolarHBondContact O-N 2.98Å; T1257-N1259 VanDerWaalsContact O-N 3.12Å; N1259-Y1261 PolarHBondContact O-N 2.96Å
1260W35.1Very low39.9Very low131 Ų13189.6 Ų89.650%0.49644%0.438SS..  trans-106.999.4167.7-80.233.1000110.2I1038 V1044 T1047 L1140 Q1256 T1257 N1258 F1262I1038-W1260 HydrophobicContact CD1-CZ2 3.49Å; I1038-W1260 VanDerWaalsContact CD1-CZ2 3.49Å; I1038-W1260 VanDerWaalsContact CD1-NE1 3.33Å; I1038-W1260 HydrophobicContact CG1-CZ2 3.83Å; V1044-W1260 HydrophobicContact CG1-CE3 4.36Å; V1044-W1260 HydrophobicContact CG1-CZ3 4.16Å; V1044-W1260 HydrophobicContact CG2-CE3 4.24Å; V1044-W1260 HydrophobicContact CG2-CZ3 4.47Å; T1047-W1260 HydrophobicContact CG2-CH2 3.87Å; T1047-W1260 HydrophobicContact CG2-CZ3 4.21Å; L1140-W1260 HydrophobicContact CD2-CH2 4.13Å; Q1256-W1260 HydrophobicContact CB-CB 4.33Å; Q1256-W1260 HydrophobicContact CB-CD2 3.87Å; Q1256-W1260 HydrophobicContact CB-CE3 3.54Å; Q1256-W1260 HydrophobicContact CB-CG 4.29Å; Q1256-W1260 HydrophobicContact CB-CZ3 3.89Å; Q1256-W1260 HydrophobicContact CG-CB 3.6Å; Q1256-W1260 HydrophobicContact CG-CD2 4.38Å; Q1256-W1260 HydrophobicContact CG-CE3 4Å; Q1256-W1260 HydrophobicContact CG-CG 4.16Å; Q1256-W1260 HydrophobicContact CG-CH2 4.27Å; Q1256-W1260 HydrophobicContact CG-CZ3 3.59Å; Q1256-W1260 PolarHBondContact NE2-O 3.37Å; Q1256-W1260 VanDerWaalsContact OE1-CZ3 3.27Å; T1257-W1260 PolarHBondContact O-N 3.04Å; T1257-W1260 PolarHBondContact OG1-NE1 2.87Å; N1258-W1260 PolarHBondContact O-N 2.99Å; W1260-F1262 HydrophobicContact CB-CD2 3.93Å; W1260-F1262 HydrophobicContact CB-CE2 3.83Å; W1260-F1262 VanDerWaalsContact CB-CE2 3.48Å; W1260-F1262 HydrophobicContact CB-CZ 4.26Å; W1260-F1262 AromaticContact CD2-CE2 3.78Å; W1260-F1262 HydrophobicContact CD2-CE2 4.09Å; W1260-F1262 HydrophobicContact CD2-CZ 4.33Å; W1260-F1262 HydrophobicContact CE3-CD2 4.33Å; W1260-F1262 HydrophobicContact CE3-CE1 4.13Å; W1260-F1262 AromaticContact CE3-CE2 3.52Å; W1260-F1262 HydrophobicContact CE3-CE2 3.52Å; W1260-F1262 AromaticContact CE3-CZ 3.38Å; W1260-F1262 HydrophobicContact CE3-CZ 3.38Å; W1260-F1262 HydrophobicContact CG-CE2 4.18Å; W1260-F1262 HydrophobicContact CZ3-CE2 4.07Å; W1260-F1262 AromaticContact CZ3-CZ 3.77Å; W1260-F1262 HydrophobicContact CZ3-CZ 3.94Å; W1260-F1262 WeakPolarHBondContact O-CD2 3.32Å; W1260-F1262 PolarHBondContact O-N 2.68Å
1261Y36Very low39.9Very low168.2 Ų168.288.4 Ų88.466%0.6644%0.436SS*.  trans-87.9123.2173.8178.7-110.3000109.1E403 N1259 P1263E403-Y1261 HydrophobicContact CB-CE2 4.06Å; E403-Y1261 HydrophobicContact CG-CE2 4.16Å; E403-Y1261 WeakPolarHBondContact CG-OH 3.41Å; E403-Y1261 PolarHBondContact OE1-OH 3.24Å; E403-Y1261 WeakPolarHBondContact OE2-CE2 3.3Å; E403-Y1261 PolarHBondContact OE2-OH 3.42Å; E403-Y1261 VanDerWaalsContact OE2-OH 3.07Å; N1259-Y1261 PolarHBondContact O-N 2.96Å; Y1261-P1263 VanDerWaalsContact C-CD 3.41Å; Y1261-P1263 HydrophobicContact CD1-CB 4Å; Y1261-P1263 VanDerWaalsContact CD1-CD 3.48Å; Y1261-P1263 HydrophobicContact CD1-CG 3.87Å; Y1261-P1263 HydrophobicContact CE1-CB 3.53Å; Y1261-P1263 VanDerWaalsContact CE1-CB 3.44Å; Y1261-P1263 HydrophobicContact CE1-CG 4.06Å; Y1261-P1263 VanDerWaalsContact CE1-CG 3.42Å; Y1261-P1263 HydrophobicContact CG-CG 4.45Å; Y1261-P1263 WeakPolarHBondContact O-CD 3.35Å
1262F33.6Very low39.9Very low85 Ų8589.9 Ų89.937%0.37345%0.445SS..  trans-109.4104.8175.1-73.6-86.6000110.1V1044 D1250 F1253 Q1256 W1260 S1264 W1267V1044-F1262 HydrophobicContact CB-CE1 4.37Å; V1044-F1262 HydrophobicContact CG1-CE1 3.94Å; V1044-F1262 HydrophobicContact CG2-CD1 4.46Å; V1044-F1262 HydrophobicContact CG2-CE1 4.15Å; D1250-F1262 WeakPolarHBondContact OD2-CE1 3.29Å; F1253-F1262 HydrophobicContact CD1-CE1 4.34Å; F1253-F1262 HydrophobicContact CD1-CZ 4.04Å; F1253-F1262 AromaticContact CE1-CE1 3.43Å; F1253-F1262 HydrophobicContact CE1-CE1 3.43Å; F1253-F1262 VanDerWaalsContact CE1-CE1 3.43Å; F1253-F1262 AromaticContact CE1-CZ 3.45Å; F1253-F1262 HydrophobicContact CE1-CZ 3.45Å; F1253-F1262 VanDerWaalsContact CE1-CZ 3.45Å; F1253-F1262 AromaticContact CZ-CE1 3.85Å; F1253-F1262 HydrophobicContact CZ-CE1 3.85Å; F1253-F1262 AromaticContact CZ-CZ 3.82Å; F1253-F1262 HydrophobicContact CZ-CZ 3.82Å; Q1256-F1262 VanDerWaalsContact NE2-CE2 3.3Å; W1260-F1262 HydrophobicContact CB-CD2 3.93Å; W1260-F1262 HydrophobicContact CB-CE2 3.83Å; W1260-F1262 VanDerWaalsContact CB-CE2 3.48Å; W1260-F1262 HydrophobicContact CB-CZ 4.26Å; W1260-F1262 AromaticContact CD2-CE2 3.78Å; W1260-F1262 HydrophobicContact CD2-CE2 4.09Å; W1260-F1262 HydrophobicContact CD2-CZ 4.33Å; W1260-F1262 HydrophobicContact CE3-CD2 4.33Å; W1260-F1262 HydrophobicContact CE3-CE1 4.13Å; W1260-F1262 AromaticContact CE3-CE2 3.52Å; W1260-F1262 HydrophobicContact CE3-CE2 3.52Å; W1260-F1262 AromaticContact CE3-CZ 3.38Å; W1260-F1262 HydrophobicContact CE3-CZ 3.38Å; W1260-F1262 HydrophobicContact CG-CE2 4.18Å; W1260-F1262 HydrophobicContact CZ3-CE2 4.07Å; W1260-F1262 AromaticContact CZ3-CZ 3.77Å; W1260-F1262 HydrophobicContact CZ3-CZ 3.94Å; W1260-F1262 WeakPolarHBondContact O-CD2 3.32Å; W1260-F1262 PolarHBondContact O-N 2.68Å; F1262-S1264 PolarHBondContact O-N 3.05Å; F1262-S1264 VanDerWaalsContact O-N 3.16Å; F1262-W1267 HydrophobicContact CB-CZ2 3.48Å; F1262-W1267 VanDerWaalsContact CB-CZ2 3.48Å; F1262-W1267 VanDerWaalsContact CB-NE1 3.3Å; F1262-W1267 HydrophobicContact CD1-CB 4.31Å; F1262-W1267 AromaticContact CD1-CD2 3.85Å; F1262-W1267 HydrophobicContact CD1-CD2 3.85Å; F1262-W1267 AromaticContact CD1-CE2 3.33Å; F1262-W1267 HydrophobicContact CD1-CE3 4.34Å; F1262-W1267 HydrophobicContact CD1-CG 4.45Å; F1262-W1267 AromaticContact CD1-CH2 4Å; F1262-W1267 HydrophobicContact CD1-CH2 4Å; F1262-W1267 AromaticContact CD1-CZ2 3.48Å; F1262-W1267 HydrophobicContact CD1-CZ2 3.48Å; F1262-W1267 VanDerWaalsContact CD1-CZ2 3.48Å; F1262-W1267 HydrophobicContact CD1-CZ3 4.38Å; F1262-W1267 AromaticContact CD1-NE1 3.6Å; F1262-W1267 AromaticContact CD2-CH2 3.67Å; F1262-W1267 HydrophobicContact CD2-CH2 3.67Å; F1262-W1267 AromaticContact CD2-CZ2 3.35Å; F1262-W1267 HydrophobicContact CD2-CZ2 3.35Å; F1262-W1267 AromaticContact CE1-CD2 3.96Å; F1262-W1267 HydrophobicContact CE1-CD2 3.96Å; F1262-W1267 AromaticContact CE1-CE2 3.8Å; F1262-W1267 AromaticContact CE1-CE3 3.99Å; F1262-W1267 HydrophobicContact CE1-CE3 3.99Å; F1262-W1267 AromaticContact CE1-CH2 3.81Å; F1262-W1267 HydrophobicContact CE1-CH2 3.81Å; F1262-W1267 AromaticContact CE1-CZ2 3.79Å; F1262-W1267 HydrophobicContact CE1-CZ2 3.79Å; F1262-W1267 AromaticContact CE1-CZ3 3.89Å; F1262-W1267 HydrophobicContact CE1-CZ3 3.89Å; F1262-W1267 AromaticContact CE2-CH2 3.49Å; F1262-W1267 HydrophobicContact CE2-CH2 3.49Å; F1262-W1267 VanDerWaalsContact CE2-CH2 3.49Å; F1262-W1267 AromaticContact CE2-CZ2 3.7Å; F1262-W1267 HydrophobicContact CE2-CZ2 3.7Å; F1262-W1267 HydrophobicContact CE2-CZ3 4.21Å; F1262-W1267 HydrophobicContact CG-CD2 4.41Å; F1262-W1267 AromaticContact CG-CE2 3.45Å; F1262-W1267 VanDerWaalsContact CG-CE2 3.45Å; F1262-W1267 AromaticContact CG-CH2 3.89Å; F1262-W1267 HydrophobicContact CG-CH2 3.89Å; F1262-W1267 AromaticContact CG-CZ2 3.2Å; F1262-W1267 HydrophobicContact CG-CZ2 3.2Å; F1262-W1267 AromaticContact CG-NE1 3.7Å; F1262-W1267 HydrophobicContact CZ-CE3 4.34Å; F1262-W1267 AromaticContact CZ-CH2 3.53Å; F1262-W1267 HydrophobicContact CZ-CH2 3.53Å; F1262-W1267 AromaticContact CZ-CZ2 3.87Å; F1262-W1267 HydrophobicContact CZ-CZ2 3.87Å; F1262-W1267 AromaticContact CZ-CZ3 3.77Å; F1262-W1267 HydrophobicContact CZ-CZ3 3.77Å
1263P38.7Very low39.7Very low78.2 Ų78.293.2 Ų93.251%0.50845%0.452SS..  trans-71.854.6176.87.6-3000112.5Y1261 R1265 I1266Y1261-P1263 VanDerWaalsContact C-CD 3.41Å; Y1261-P1263 HydrophobicContact CD1-CB 4Å; Y1261-P1263 VanDerWaalsContact CD1-CD 3.48Å; Y1261-P1263 HydrophobicContact CD1-CG 3.87Å; Y1261-P1263 HydrophobicContact CE1-CB 3.53Å; Y1261-P1263 VanDerWaalsContact CE1-CB 3.44Å; Y1261-P1263 HydrophobicContact CE1-CG 4.06Å; Y1261-P1263 VanDerWaalsContact CE1-CG 3.42Å; Y1261-P1263 HydrophobicContact CG-CG 4.45Å; Y1261-P1263 WeakPolarHBondContact O-CD 3.35Å; P1263-R1265 PolarHBondContact O-N 3.45Å; P1263-I1266 HydrophobicContact CB-CD1 4.33Å; P1263-I1266 HydrophobicContact CG-CD1 3.84Å; P1263-I1266 PolarHBondContact O-N 3.42Å
1264S41.8Very low39.5Very low69.2 Ų69.295 Ų9548%0.48446%0.463SS..  trans-141.1128.3172.850.80000113.1F1262 I1266 W1267F1262-S1264 PolarHBondContact O-N 3.05Å; F1262-S1264 VanDerWaalsContact O-N 3.16Å; S1264-I1266 PolarHBondContact O-N 3.11Å; S1264-I1266 WeakPolarHBondContact OG-CD1 3.37Å; S1264-I1266 WeakPolarHBondContact OG-CG1 3.36Å; S1264-W1267 PolarHBondContact O-NE1 3.2Å
1265R43.8Very low39.1Very low176 Ų17697.6 Ų97.666%0.66448%0.475SS*.THydrogen-bonded Turntrans-85.812.9-178.2-74.3179.6-180-169.4-1.4114.7G1041 P1263 W1267 E1268 R1269G1041-R1265 PolarHBondContact O-NH1 2.97Å; P1263-R1265 PolarHBondContact O-N 3.45Å; R1265-W1267 VanDerWaalsContact C-N 3.3Å; R1265-W1267 PolarHBondContact O-N 3.31Å; R1265-E1268 WeakPolarHBondContact O-CB 3.4Å; R1265-E1268 PolarHBondContact O-N 2.94Å; R1265-R1269 VanDerWaalsContact O-CB 3.25Å; R1265-R1269 WeakPolarHBondContact O-CB 3.45Å; R1265-R1269 WeakPolarHBondContact O-CD 3.25Å; R1265-R1269 VanDerWaalsContact O-CG 3.25Å; R1265-R1269 WeakPolarHBondContact O-CG 3.37Å; R1265-R1269 PolarHBondContact O-N 3.16Å
1266I41.1Very low38.7Very low88.2 Ų88.295.8 Ų95.845%0.45247%0.468SS..Hα-helixtrans-84.3-35.8-173.4-65.1174.9000112.8P1263 S1264 E1268 R1269 C1270P1263-I1266 HydrophobicContact CB-CD1 4.33Å; P1263-I1266 HydrophobicContact CG-CD1 3.84Å; P1263-I1266 PolarHBondContact O-N 3.42Å; S1264-I1266 PolarHBondContact O-N 3.11Å; S1264-I1266 WeakPolarHBondContact OG-CD1 3.37Å; S1264-I1266 WeakPolarHBondContact OG-CG1 3.36Å; I1266-E1268 VanDerWaalsContact C-N 3.32Å; I1266-E1268 PolarHBondContact O-N 3.24Å; I1266-E1268 VanDerWaalsContact O-N 3.15Å; I1266-R1269 WeakPolarHBondContact O-CA 3.24Å; I1266-R1269 VanDerWaalsContact O-CB 3.3Å; I1266-R1269 WeakPolarHBondContact O-CB 3.44Å; I1266-R1269 PolarHBondContact O-N 3.19Å; I1266-R1269 VanDerWaalsContact O-N 3.12Å; I1266-C1270 WeakPolarHBondContact O-CB 3.45Å; I1266-C1270 PolarHBondContact O-N 3.32Å; I1266-C1270 VanDerWaalsContact O-N 3.1Å; I1266-C1270 PolarHBondContact O-SG 2.79Å; I1266-C1270 VanDerWaalsContact O-SG 3.37Å
1267W42.2Very low38.3Very low111 Ų11199.9 Ų99.942%0.4248%0.481SS..Hα-helixtrans-77.3-28178.973.7-87.2000113.7P466 M697 V1243 D1250 F1262 S1264 R1265 R1269 C1270 A1271P466-W1267 HydrophobicContact CB-CH2 3.77Å; P466-W1267 HydrophobicContact CB-CZ2 3.19Å; P466-W1267 HydrophobicContact CG-CH2 3.96Å; P466-W1267 HydrophobicContact CG-CZ2 3.1Å; P466-W1267 VanDerWaalsContact O-CE2 3.31Å; P466-W1267 WeakPolarHBondContact O-CZ2 3.33Å; P466-W1267 PolarHBondContact O-NE1 3.29Å; M697-W1267 HydrophobicContact CE-CH2 4.21Å; V1243-W1267 HydrophobicContact CG1-CD2 4.21Å; V1243-W1267 HydrophobicContact CG1-CE3 3.54Å; V1243-W1267 HydrophobicContact CG1-CH2 3.16Å; V1243-W1267 HydrophobicContact CG1-CZ2 3.65Å; V1243-W1267 HydrophobicContact CG1-CZ3 3.09Å; D1250-W1267 HydrophobicContact CB-CZ3 4.34Å; F1262-W1267 HydrophobicContact CB-CZ2 3.48Å; F1262-W1267 VanDerWaalsContact CB-CZ2 3.48Å; F1262-W1267 VanDerWaalsContact CB-NE1 3.3Å; F1262-W1267 HydrophobicContact CD1-CB 4.31Å; F1262-W1267 AromaticContact CD1-CD2 3.85Å; F1262-W1267 HydrophobicContact CD1-CD2 3.85Å; F1262-W1267 AromaticContact CD1-CE2 3.33Å; F1262-W1267 HydrophobicContact CD1-CE3 4.34Å; F1262-W1267 HydrophobicContact CD1-CG 4.45Å; F1262-W1267 AromaticContact CD1-CH2 4Å; F1262-W1267 HydrophobicContact CD1-CH2 4Å; F1262-W1267 AromaticContact CD1-CZ2 3.48Å; F1262-W1267 HydrophobicContact CD1-CZ2 3.48Å; F1262-W1267 VanDerWaalsContact CD1-CZ2 3.48Å; F1262-W1267 HydrophobicContact CD1-CZ3 4.38Å; F1262-W1267 AromaticContact CD1-NE1 3.6Å; F1262-W1267 AromaticContact CD2-CH2 3.67Å; F1262-W1267 HydrophobicContact CD2-CH2 3.67Å; F1262-W1267 AromaticContact CD2-CZ2 3.35Å; F1262-W1267 HydrophobicContact CD2-CZ2 3.35Å; F1262-W1267 AromaticContact CE1-CD2 3.96Å; F1262-W1267 HydrophobicContact CE1-CD2 3.96Å; F1262-W1267 AromaticContact CE1-CE2 3.8Å; F1262-W1267 AromaticContact CE1-CE3 3.99Å; F1262-W1267 HydrophobicContact CE1-CE3 3.99Å; F1262-W1267 AromaticContact CE1-CH2 3.81Å; F1262-W1267 HydrophobicContact CE1-CH2 3.81Å; F1262-W1267 AromaticContact CE1-CZ2 3.79Å; F1262-W1267 HydrophobicContact CE1-CZ2 3.79Å; F1262-W1267 AromaticContact CE1-CZ3 3.89Å; F1262-W1267 HydrophobicContact CE1-CZ3 3.89Å; F1262-W1267 AromaticContact CE2-CH2 3.49Å; F1262-W1267 HydrophobicContact CE2-CH2 3.49Å; F1262-W1267 VanDerWaalsContact CE2-CH2 3.49Å; F1262-W1267 AromaticContact CE2-CZ2 3.7Å; F1262-W1267 HydrophobicContact CE2-CZ2 3.7Å; F1262-W1267 HydrophobicContact CE2-CZ3 4.21Å; F1262-W1267 HydrophobicContact CG-CD2 4.41Å; F1262-W1267 AromaticContact CG-CE2 3.45Å; F1262-W1267 VanDerWaalsContact CG-CE2 3.45Å; F1262-W1267 AromaticContact CG-CH2 3.89Å; F1262-W1267 HydrophobicContact CG-CH2 3.89Å; F1262-W1267 AromaticContact CG-CZ2 3.2Å; F1262-W1267 HydrophobicContact CG-CZ2 3.2Å; F1262-W1267 AromaticContact CG-NE1 3.7Å; F1262-W1267 HydrophobicContact CZ-CE3 4.34Å; F1262-W1267 AromaticContact CZ-CH2 3.53Å; F1262-W1267 HydrophobicContact CZ-CH2 3.53Å; F1262-W1267 AromaticContact CZ-CZ2 3.87Å; F1262-W1267 HydrophobicContact CZ-CZ2 3.87Å; F1262-W1267 AromaticContact CZ-CZ3 3.77Å; F1262-W1267 HydrophobicContact CZ-CZ3 3.77Å; S1264-W1267 PolarHBondContact O-NE1 3.2Å; R1265-W1267 VanDerWaalsContact C-N 3.3Å; R1265-W1267 PolarHBondContact O-N 3.31Å; W1267-R1269 VanDerWaalsContact C-N 3.27Å; W1267-R1269 PolarHBondContact O-N 3.12Å; W1267-C1270 CarbonylContact O-C 3.51Å; W1267-C1270 WeakPolarHBondContact O-CA 3.43Å; W1267-C1270 VanDerWaalsContact O-CB 3.3Å; W1267-C1270 WeakPolarHBondContact O-CB 3.31Å; W1267-C1270 PolarHBondContact O-N 3.17Å; W1267-A1271 HydrophobicContact CE3-CB 4.34Å; W1267-A1271 HydrophobicContact CZ3-CB 4.45Å; W1267-A1271 WeakPolarHBondContact O-CB 3.31Å; W1267-A1271 PolarHBondContact O-N 3.01Å
1268E43.2Very low37.8Very low96.8 Ų96.8100.2 Ų100.245%0.45248%0.476SS..Hα-helixtrans-66.3-23.4175.3-70.6177.3175.600112.6P466 R693 R696 V1044 R1265 I1266 C1270 A1271 S1272P466-E1268 HydrophobicContact CG-CG 4.43Å; P466-E1268 WeakPolarHBondContact CG-OE1 3.41Å; R693-E1268 IonicContact CZ-OE1 2.71Å; R693-E1268 IonicContact CZ-OE2 3.18Å; R693-E1268 IonicContact NE-OE2 3.85Å; R693-E1268 IonicContact NH2-OE1 4Å; R693-E1268 PolarHBondContact NH2-OE1 3.48Å; R693-E1268 IonicContact NH2-OE2 3.12Å; R693-E1268 PolarHBondContact NH2-OE2 3.09Å; R696-E1268 VanDerWaalsContact CZ-O 3.26Å; R696-E1268 PolarHBondContact NH1-O 2.98Å; V1044-E1268 HydrophobicContact CG1-CB 4.28Å; V1044-E1268 HydrophobicContact CG1-CG 4.4Å; V1044-E1268 HydrophobicContact CG2-CB 3.71Å; V1044-E1268 HydrophobicContact CG2-CG 3.83Å; R1265-E1268 WeakPolarHBondContact O-CB 3.4Å; R1265-E1268 PolarHBondContact O-N 2.94Å; I1266-E1268 VanDerWaalsContact C-N 3.32Å; I1266-E1268 PolarHBondContact O-N 3.24Å; I1266-E1268 VanDerWaalsContact O-N 3.15Å; E1268-C1270 PolarHBondContact O-N 2.91Å; E1268-A1271 CarbonylContact O-C 3.58Å; E1268-A1271 PolarHBondContact O-N 2.98Å; E1268-S1272 VanDerWaalsContact O-CB 3.24Å; E1268-S1272 WeakPolarHBondContact O-CB 3.36Å; E1268-S1272 PolarHBondContact O-N 3.14Å; E1268-S1272 PolarHBondContact O-OG 3.01Å
1269R41.9Very low37.6Very low135.6 Ų135.695.9 Ų95.951%0.51246%0.457SS..Hα-helixtrans-86.2-25.3166.7-80.1176.8177.4-175.3-1.8113.1Y735 R1265 I1266 W1267 A1271 S1272 Y1273Y735-R1269 HydrophobicContact CE1-CB 4.28Å; Y735-R1269 HydrophobicContact CE1-CG 3.89Å; Y735-R1269 WeakPolarHBondContact OH-CD 3.25Å; Y735-R1269 PolarHBondContact OH-NE 3.48Å; R1265-R1269 VanDerWaalsContact O-CB 3.25Å; R1265-R1269 WeakPolarHBondContact O-CB 3.45Å; R1265-R1269 WeakPolarHBondContact O-CD 3.25Å; R1265-R1269 VanDerWaalsContact O-CG 3.25Å; R1265-R1269 WeakPolarHBondContact O-CG 3.37Å; R1265-R1269 PolarHBondContact O-N 3.16Å; I1266-R1269 WeakPolarHBondContact O-CA 3.24Å; I1266-R1269 VanDerWaalsContact O-CB 3.3Å; I1266-R1269 WeakPolarHBondContact O-CB 3.44Å; I1266-R1269 PolarHBondContact O-N 3.19Å; I1266-R1269 VanDerWaalsContact O-N 3.12Å; W1267-R1269 VanDerWaalsContact C-N 3.27Å; W1267-R1269 PolarHBondContact O-N 3.12Å; R1269-A1271 VanDerWaalsContact C-N 3.32Å; R1269-A1271 PolarHBondContact O-N 3.19Å; R1269-S1272 VanDerWaalsContact CA-OG 3.32Å; R1269-S1272 WeakPolarHBondContact CA-OG 3.27Å; R1269-S1272 CarbonylContact O-C 3.53Å; R1269-S1272 WeakPolarHBondContact O-CA 3.17Å; R1269-S1272 PolarHBondContact O-N 3.05Å; R1269-S1272 PolarHBondContact O-OG 3.16Å; R1269-Y1273 HydrophobicContact CB-CE2 4.06Å; R1269-Y1273 WeakPolarHBondContact O-CD2 3.35Å; R1269-Y1273 WeakPolarHBondContact O-CE2 3.46Å; R1269-Y1273 PolarHBondContact O-N 3.06Å
1270C39.7Very low37.5Very low44.4 Ų44.493.7 Ų93.730%0.344%0.442SS..Hα-helixtrans-69.6-26.6172.6-63.70000112.2R1048 I1244 A1246 A1251 F1253 I1266 W1267 E1268 S1272 Y1273R1048-C1270 PolarHBondContact NH1-SG 2.93Å; R1048-C1270 PolarHBondContact NH2-SG 3.12Å; I1244-C1270 HydrophobicContact CG1-CB 4.44Å; A1246-C1270 HydrophobicContact CB-CB 3.82Å; A1251-C1270 HydrophobicContact CB-CB 3.86Å; A1251-C1270 WeakPolarHBondContact CB-O 3.16Å; F1253-C1270 HydrophobicContact CE2-CB 4.12Å; F1253-C1270 HydrophobicContact CZ-CB 4.13Å; I1266-C1270 WeakPolarHBondContact O-CB 3.45Å; I1266-C1270 PolarHBondContact O-N 3.32Å; I1266-C1270 VanDerWaalsContact O-N 3.1Å; I1266-C1270 PolarHBondContact O-SG 2.79Å; I1266-C1270 VanDerWaalsContact O-SG 3.37Å; W1267-C1270 CarbonylContact O-C 3.51Å; W1267-C1270 WeakPolarHBondContact O-CA 3.43Å; W1267-C1270 VanDerWaalsContact O-CB 3.3Å; W1267-C1270 WeakPolarHBondContact O-CB 3.31Å; W1267-C1270 PolarHBondContact O-N 3.17Å; E1268-C1270 PolarHBondContact O-N 2.91Å; C1270-S1272 PolarHBondContact O-N 3.31Å; C1270-Y1273 VanDerWaalsContact O-CB 3.24Å; C1270-Y1273 WeakPolarHBondContact O-CB 3.23Å; C1270-Y1273 WeakPolarHBondContact O-CD2 3.45Å; C1270-Y1273 PolarHBondContact O-N 3.18Å
1271A40.1Very low37.4Very low28.8 Ų28.890.5 Ų90.524%0.23843%0.43CS..THydrogen-bonded Turntrans-88.1-4.7-176.700000114.3R696 K742 P1242 A1246 A1247 A1251 W1267 E1268 R1269 Y1273R696-A1271 PolarHBondContact NH1-O 3.17Å; R696-A1271 VanDerWaalsContact NH2-CA 3.34Å; R696-A1271 PolarHBondContact NH2-O 2.87Å; K742-A1271 PolarHBondContact NZ-O 2.97Å; P1242-A1271 HydrophobicContact CB-CB 3.81Å; A1246-A1271 HydrophobicContact CB-CB 4.27Å; A1247-A1271 HydrophobicContact CB-CB 3.9Å; A1251-A1271 HydrophobicContact CB-CB 3.68Å; W1267-A1271 HydrophobicContact CE3-CB 4.34Å; W1267-A1271 HydrophobicContact CZ3-CB 4.45Å; W1267-A1271 WeakPolarHBondContact O-CB 3.31Å; W1267-A1271 PolarHBondContact O-N 3.01Å; E1268-A1271 CarbonylContact O-C 3.58Å; E1268-A1271 PolarHBondContact O-N 2.98Å; R1269-A1271 VanDerWaalsContact C-N 3.32Å; R1269-A1271 PolarHBondContact O-N 3.19Å; A1271-Y1273 VanDerWaalsContact C-N 3.32Å; A1271-Y1273 CarbonylContact C-O 3.52Å; A1271-Y1273 VanDerWaalsContact CA-CG 3.47Å; A1271-Y1273 HydrophobicContact CB-CD2 3.22Å; A1271-Y1273 HydrophobicContact CB-CE2 3.02Å; A1271-Y1273 HydrophobicContact CB-CG 4.2Å; A1271-Y1273 WeakPolarHBondContact O-CD2 3.43Å
1272S40.9Very low37.2Very low52.2 Ų52.284.2 Ų84.237%0.36541%0.409SS..SBendtrans-90.4-3.1165.762.30000112.3R696 T799 V803 D1142 E1268 R1269 C1270 L1274R696-S1272 VanDerWaalsContact NH1-N 3.16Å; T799-S1272 WeakPolarHBondContact CG2-OG 3.19Å; V803-S1272 WeakPolarHBondContact CG2-O 3.48Å; D1142-S1272 VanDerWaalsContact OD2-O 3.08Å; E1268-S1272 VanDerWaalsContact O-CB 3.24Å; E1268-S1272 WeakPolarHBondContact O-CB 3.36Å; E1268-S1272 PolarHBondContact O-N 3.14Å; E1268-S1272 PolarHBondContact O-OG 3.01Å; R1269-S1272 VanDerWaalsContact CA-OG 3.32Å; R1269-S1272 WeakPolarHBondContact CA-OG 3.27Å; R1269-S1272 CarbonylContact O-C 3.53Å; R1269-S1272 WeakPolarHBondContact O-CA 3.17Å; R1269-S1272 PolarHBondContact O-N 3.05Å; R1269-S1272 PolarHBondContact O-OG 3.16Å; C1270-S1272 PolarHBondContact O-N 3.31Å; S1272-L1274 PolarHBondContact O-N 3.35Å
1273Y37.1Very low37Very low100.2 Ų100.283.9 Ų83.939%0.39341%0.411SS..SBendtrans-67.7102.8159.6-87.5-66.3000109.9T799 T802 S879 I882 P1141 D1142 Y1249 D1250 A1251 R1269 C1270 A1271 N1275 N1631 I1634T799-Y1273 HydrophobicContact CG2-CD1 4.29Å; T799-Y1273 HydrophobicContact CG2-CE1 3.96Å; T802-Y1273 HydrophobicContact CG2-CD1 3.45Å; T802-Y1273 VanDerWaalsContact CG2-CD1 3.45Å; T802-Y1273 HydrophobicContact CG2-CE1 3.83Å; T802-Y1273 HydrophobicContact CG2-CG 4.41Å; S879-Y1273 VanDerWaalsContact CB-OH 3.3Å; S879-Y1273 WeakPolarHBondContact CB-OH 3.3Å; S879-Y1273 PolarHBondContact OG-OH 2.96Å; I882-Y1273 HydrophobicContact CD1-CE2 4.44Å; P1141-Y1273 HydrophobicContact CG-CD1 4.11Å; P1141-Y1273 HydrophobicContact CG-CE1 3.73Å; D1142-Y1273 VanDerWaalsContact OD2-C 3.28Å; D1142-Y1273 WeakPolarHBondContact OD2-CA 3.35Å; Y1249-Y1273 HydrophobicContact CE2-CD1 4.01Å; Y1249-Y1273 HydrophobicContact CE2-CG 4.26Å; Y1249-Y1273 AromaticContact CZ-CD1 3.65Å; Y1249-Y1273 WeakPolarHBondContact OH-CD1 3.32Å; Y1249-Y1273 WeakPolarHBondContact OH-CE1 3.35Å; D1250-Y1273 WeakPolarHBondContact CB-O 3.33Å; A1251-Y1273 HydrophobicContact CB-CD2 3.87Å; R1269-Y1273 HydrophobicContact CB-CE2 4.06Å; R1269-Y1273 WeakPolarHBondContact O-CD2 3.35Å; R1269-Y1273 WeakPolarHBondContact O-CE2 3.46Å; R1269-Y1273 PolarHBondContact O-N 3.06Å; C1270-Y1273 VanDerWaalsContact O-CB 3.24Å; C1270-Y1273 WeakPolarHBondContact O-CB 3.23Å; C1270-Y1273 WeakPolarHBondContact O-CD2 3.45Å; C1270-Y1273 PolarHBondContact O-N 3.18Å; A1271-Y1273 VanDerWaalsContact C-N 3.32Å; A1271-Y1273 CarbonylContact C-O 3.52Å; A1271-Y1273 VanDerWaalsContact CA-CG 3.47Å; A1271-Y1273 HydrophobicContact CB-CD2 3.22Å; A1271-Y1273 HydrophobicContact CB-CE2 3.02Å; A1271-Y1273 HydrophobicContact CB-CG 4.2Å; A1271-Y1273 WeakPolarHBondContact O-CD2 3.43Å; Y1273-N1275 VanDerWaalsContact C-N 3.26Å; Y1273-N1275 PolarHBondContact O-N 3.04Å; Y1273-N1631 WeakPolarHBondContact CE1-OD1 3.35Å; Y1273-N1631 WeakPolarHBondContact CE2-OD1 3.49Å; Y1273-N1631 PolarHBondContact OH-OD1 3.39Å; Y1273-I1634 HydrophobicContact CE1-CD1 4.42Å
1274L36.4Very low36.6Very low90 Ų9083 Ų8347%0.47140%0.401SS..  trans-101.1123.3161.1-97.9126.2000110.7K742 V803 K807 Y1051 D1142 D1250 S1272 T1276 N1631 T1635K742-L1274 HydrophobicContact CG-CG 4.38Å; V803-L1274 HydrophobicContact CB-CD1 3.97Å; V803-L1274 HydrophobicContact CG1-CD1 3.44Å; V803-L1274 VanDerWaalsContact CG1-CD1 3.44Å; V803-L1274 HydrophobicContact CG1-CG 4.48Å; V803-L1274 HydrophobicContact CG2-CD1 3.99Å; V803-L1274 HydrophobicContact CG2-CG 4.33Å; K807-L1274 HydrophobicContact CD-CD1 4.31Å; Y1051-L1274 HydrophobicContact CD1-CD1 3.61Å; Y1051-L1274 HydrophobicContact CD1-CD2 4.25Å; Y1051-L1274 HydrophobicContact CD1-CG 4.38Å; Y1051-L1274 HydrophobicContact CD2-CD1 4.31Å; Y1051-L1274 HydrophobicContact CE1-CB 4.04Å; Y1051-L1274 HydrophobicContact CE1-CD1 3.77Å; Y1051-L1274 HydrophobicContact CE1-CD2 3.74Å; Y1051-L1274 HydrophobicContact CE1-CG 4.05Å; Y1051-L1274 HydrophobicContact CE2-CB 4.23Å; Y1051-L1274 HydrophobicContact CE2-CD1 4.44Å; Y1051-L1274 HydrophobicContact CG-CD1 3.88Å; D1142-L1274 PolarHBondContact OD2-N 3.44Å; D1250-L1274 VanDerWaalsContact OD1-C 3.28Å; S1272-L1274 PolarHBondContact O-N 3.35Å; L1274-T1276 HydrophobicContact CB-CG2 4.04Å; L1274-T1276 HydrophobicContact CD2-CG2 3.51Å; L1274-T1276 VanDerWaalsContact CD2-CG2 3.46Å; L1274-T1276 PolarHBondContact O-N 3.24Å; L1274-T1276 PolarHBondContact O-OG1 3.35Å; L1274-N1631 HydrophobicContact CD1-CB 3.56Å; L1274-T1635 HydrophobicContact CD1-CG2 4.16Å; L1274-T1635 HydrophobicContact CD2-CG2 3.9Å
1275N34.5Very low36Very low91.8 Ų91.883.5 Ų83.549%0.49139%0.393SS..  trans-68.962157.2-83.9-22.9000110.4L1239 N1245 R1248 D1250 Y1273 Y1277L1239-N1275 HydrophobicContact CD2-CB 3.46Å; L1239-N1275 VanDerWaalsContact CD2-CB 3.46Å; L1239-N1275 WeakPolarHBondContact CD2-ND2 3.35Å; N1245-N1275 PolarHBondContact ND2-OD1 3.45Å; R1248-N1275 PolarHBondContact NH2-O 3.18Å; D1250-N1275 WeakPolarHBondContact OD1-CA 3.43Å; D1250-N1275 PolarHBondContact OD1-N 2.96Å; D1250-N1275 PolarHBondContact OD1-OD1 3.26Å; Y1273-N1275 VanDerWaalsContact C-N 3.26Å; Y1273-N1275 PolarHBondContact O-N 3.04Å; N1275-Y1277 PolarHBondContact O-N 3.27Å
1276T31.4Very low35.4Very low57.6 Ų57.678.2 Ų78.235%0.35338%0.377SS..  trans-56.7108.2169.947.10000110.5T802 L1274 F1278 T1635T802-T1276 HydrophobicContact CG2-CG2 3.91Å; T802-T1276 WeakPolarHBondContact O-CG2 3.14Å; L1274-T1276 HydrophobicContact CB-CG2 4.04Å; L1274-T1276 HydrophobicContact CD2-CG2 3.51Å; L1274-T1276 VanDerWaalsContact CD2-CG2 3.46Å; L1274-T1276 PolarHBondContact O-N 3.24Å; L1274-T1276 PolarHBondContact O-OG1 3.35Å; T1276-F1278 PolarHBondContact O-N 3.45Å; T1276-T1635 HydrophobicContact CG2-CG2 4.25Å
1277Y32.6Very low34.9Very low154.8 Ų154.876.1 Ų76.161%0.60737%0.368SS*.  trans28.590.2171.5-57.7-77.1000114.3D890 N1275 S1279 R1290 H1650D890-Y1277 WeakPolarHBondContact OD1-CD2 3.3Å; N1275-Y1277 PolarHBondContact O-N 3.27Å; Y1277-S1279 PolarHBondContact O-N 3.14Å; Y1277-S1279 VanDerWaalsContact O-N 3.15Å; Y1277-R1290 PolarHBondContact OH-NH1 3.12Å; Y1277-R1290 VanDerWaalsContact OH-NH1 3.17Å; Y1277-H1650 PolarHBondContact OH-NE2 2.95Å
1278F30.3Very low34.3Very low84 Ų8473.8 Ų73.837%0.36836%0.362SS..SBendtrans-59.4101.1159.9-101.6-87000108.3I882 Y1051 R1248 Y1249 A1252 T1276 E1280 T1282 R1285I882-F1278 HydrophobicContact CB-CZ 4.39Å; I882-F1278 HydrophobicContact CG1-CZ 4.29Å; I882-F1278 HydrophobicContact CG2-CE1 3.56Å; I882-F1278 HydrophobicContact CG2-CE2 4.18Å; I882-F1278 HydrophobicContact CG2-CZ 3.63Å; Y1051-F1278 HydrophobicContact CD1-CE1 4.39Å; Y1051-F1278 HydrophobicContact CE1-CD1 4.37Å; Y1051-F1278 AromaticContact CE1-CE1 3.64Å; Y1051-F1278 HydrophobicContact CE1-CE1 3.64Å; Y1051-F1278 HydrophobicContact CE1-CZ 4.38Å; R1248-F1278 VanDerWaalsContact CD-CE2 3.45Å; R1248-F1278 HydrophobicContact CG-CZ 4.33Å; R1248-F1278 VanDerWaalsContact CZ-CE2 3.42Å; R1248-F1278 VanDerWaalsContact NH1-CD2 3.35Å; Y1249-F1278 WeakPolarHBondContact O-CB 3.22Å; A1252-F1278 HydrophobicContact CB-CD1 3.91Å; A1252-F1278 HydrophobicContact CB-CD2 3.8Å; A1252-F1278 HydrophobicContact CB-CE1 3.37Å; A1252-F1278 HydrophobicContact CB-CE2 3.24Å; A1252-F1278 HydrophobicContact CB-CG 4.13Å; A1252-F1278 HydrophobicContact CB-CZ 3.01Å; T1276-F1278 PolarHBondContact O-N 3.45Å; F1278-E1280 PolarHBondContact O-N 3.31Å; F1278-T1282 HydrophobicContact CD1-CG2 3.91Å; F1278-T1282 HydrophobicContact CE1-CG2 3.22Å; F1278-T1282 HydrophobicContact CE2-CG2 4.34Å; F1278-T1282 HydrophobicContact CZ-CG2 3.43Å; F1278-T1282 VanDerWaalsContact CZ-CG2 3.43Å; F1278-T1282 PolarHBondContact O-OG1 3.31Å; F1278-R1285 HydrophobicContact CD1-CG 4.15Å; F1278-R1285 HydrophobicContact CE1-CB 4.35Å; F1278-R1285 HydrophobicContact CE1-CG 3.6Å; F1278-R1285 VanDerWaalsContact CZ-CD 3.4Å; F1278-R1285 HydrophobicContact CZ-CG 4.2Å
1279S33.8Very low33.8Very low42.8 Ų42.871.6 Ų71.630%0.29935%0.353SS..  trans-11.984.2171.158.40000112.1Y1277 W1281 T1282 D1283Y1277-S1279 PolarHBondContact O-N 3.14Å; Y1277-S1279 VanDerWaalsContact O-N 3.15Å; S1279-W1281 PolarHBondContact O-N 3.21Å; S1279-W1281 VanDerWaalsContact O-N 3.16Å; S1279-T1282 WeakPolarHBondContact CB-OG1 3.45Å; S1279-T1282 PolarHBondContact O-N 3.32Å; S1279-T1282 VanDerWaalsContact O-N 3.15Å; S1279-T1282 PolarHBondContact O-OG1 3.29Å; S1279-T1282 PolarHBondContact OG-OG1 3.01Å; S1279-D1283 PolarHBondContact O-N 3.42Å
1280E33.9Very low33.4Very low81.2 Ų81.271.2 Ų71.238%0.37935%0.352SS..THydrogen-bonded Turntrans-56.8-8.6170.7-67.8175.8151.800112.3K807 Y1249 F1278 T1282 D1283 M1284 R1285 N1631 F1642K807-E1280 PolarHBondContact NZ-O 3.38Å; Y1249-E1280 WeakPolarHBondContact OH-CB 3.35Å; Y1249-E1280 PolarHBondContact OH-OE2 3.2Å; F1278-E1280 PolarHBondContact O-N 3.31Å; E1280-T1282 PolarHBondContact O-N 3.13Å; E1280-D1283 WeakPolarHBondContact O-CB 3.42Å; E1280-D1283 PolarHBondContact O-N 3.46Å; E1280-M1284 WeakPolarHBondContact O-CG 3.48Å; E1280-M1284 PolarHBondContact O-N 3.13Å; E1280-R1285 WeakPolarHBondContact O-CB 3.27Å; E1280-R1285 WeakPolarHBondContact O-CD 3.21Å; E1280-R1285 WeakPolarHBondContact O-CG 3.41Å; E1280-R1285 PolarHBondContact O-N 3.21Å; E1280-R1285 IonicContact OE1-CZ 2.79Å; E1280-R1285 IonicContact OE1-NH1 3.2Å; E1280-R1285 IonicContact OE1-NH2 2.84Å; E1280-R1285 PolarHBondContact OE1-NH2 3.39Å; E1280-R1285 IonicContact OE2-CZ 2.84Å; E1280-R1285 VanDerWaalsContact OE2-CZ 3.25Å; E1280-R1285 IonicContact OE2-NH1 3.67Å; E1280-R1285 PolarHBondContact OE2-NH1 3.02Å; E1280-R1285 IonicContact OE2-NH2 3.2Å; E1280-R1285 PolarHBondContact OE2-NH2 2.84Å; E1280-N1631 VanDerWaalsContact OE2-CB 3.32Å; E1280-N1631 WeakPolarHBondContact OE2-CB 3.49Å; E1280-N1631 PolarHBondContact OE2-ND2 3.39Å; E1280-F1642 HydrophobicContact CB-CE2 4.4Å; E1280-F1642 HydrophobicContact CG-CD2 4.34Å; E1280-F1642 HydrophobicContact CG-CE2 4.1Å
1281W32.1Very low33.1Very low64 Ų6471.6 Ų71.624%0.24235%0.35CS..Hα-helixtrans-104.6-8.3-174.2-62.378.9000114.2V803 K807 F1213 Y1249 S1279 D1283 M1284 R1285 F1612 I1616 N1627 L1630 N1631 I1634V803-W1281 HydrophobicContact CG1-CE3 3.74Å; V803-W1281 HydrophobicContact CG1-CZ3 3.92Å; K807-W1281 HydrophobicContact CD-CE3 3.84Å; K807-W1281 HydrophobicContact CD-CH2 3.36Å; K807-W1281 HydrophobicContact CD-CZ2 4.19Å; K807-W1281 HydrophobicContact CD-CZ3 3.17Å; K807-W1281 VanDerWaalsContact CE-CH2 3.44Å; K807-W1281 VanDerWaalsContact CE-O 3.23Å; K807-W1281 WeakPolarHBondContact CE-O 3.42Å; K807-W1281 HydrophobicContact CG-CZ3 3.98Å; F1213-W1281 HydrophobicContact CD2-CZ2 4.29Å; F1213-W1281 HydrophobicContact CE2-CH2 4.47Å; F1213-W1281 AromaticContact CE2-CZ2 3.89Å; F1213-W1281 HydrophobicContact CE2-CZ2 3.89Å; Y1249-W1281 AromaticContact CD1-CD1 3.86Å; Y1249-W1281 AromaticContact CD1-NE1 3.53Å; Y1249-W1281 AromaticContact CE1-CD1 3.21Å; Y1249-W1281 AromaticContact CE1-CZ3 3.93Å; Y1249-W1281 HydrophobicContact CE1-CZ3 3.93Å; Y1249-W1281 AromaticContact CE1-NE1 2.91Å; Y1249-W1281 AromaticContact CZ-CD1 3.85Å; Y1249-W1281 AromaticContact CZ-CZ3 3.71Å; Y1249-W1281 AromaticContact CZ-NE1 3.16Å; Y1249-W1281 WeakPolarHBondContact OH-CH2 3.21Å; Y1249-W1281 WeakPolarHBondContact OH-CZ3 3.44Å; Y1249-W1281 PolarHBondContact OH-NE1 3.38Å; Y1249-W1281 VanDerWaalsContact OH-NE1 3.09Å; S1279-W1281 PolarHBondContact O-N 3.21Å; S1279-W1281 VanDerWaalsContact O-N 3.16Å; W1281-D1283 VanDerWaalsContact C-N 3.35Å; W1281-M1284 WeakPolarHBondContact O-CA 3.22Å; W1281-M1284 VanDerWaalsContact O-CB 3.3Å; W1281-M1284 WeakPolarHBondContact O-CB 3.19Å; W1281-M1284 PolarHBondContact O-N 2.9Å; W1281-M1284 VanDerWaalsContact O-N 3.08Å; W1281-R1285 HydrophobicContact CD2-CB 3.93Å; W1281-R1285 VanDerWaalsContact CE2-CD 3.42Å; W1281-R1285 HydrophobicContact CE3-CB 4.01Å; W1281-R1285 HydrophobicContact CG-CB 4.37Å; W1281-R1285 HydrophobicContact CZ3-CB 4.4Å; W1281-R1285 VanDerWaalsContact O-CG 3.32Å; W1281-R1285 WeakPolarHBondContact O-CG 3.04Å; W1281-R1285 PolarHBondContact O-N 3.02Å; W1281-R1285 VanDerWaalsContact O-N 3.12Å; W1281-F1612 AromaticContact CE3-CZ 3.99Å; W1281-F1612 HydrophobicContact CE3-CZ 3.99Å; W1281-F1612 HydrophobicContact CZ3-CE2 4.2Å; W1281-F1612 AromaticContact CZ3-CZ 3.86Å; W1281-F1612 HydrophobicContact CZ3-CZ 3.86Å; W1281-I1616 HydrophobicContact CZ3-CD1 4.3Å; W1281-I1616 HydrophobicContact CZ3-CG1 4.36Å; W1281-N1627 HydrophobicContact CZ2-CB 4.5Å; W1281-L1630 HydrophobicContact CH2-CD2 3.98Å; W1281-L1630 HydrophobicContact CZ3-CD2 4.43Å; W1281-N1631 WeakPolarHBondContact CZ2-OD1 3.15Å; W1281-N1631 PolarHBondContact NE1-ND2 3.1Å; W1281-N1631 PolarHBondContact NE1-OD1 2.94Å; W1281-I1634 HydrophobicContact CH2-CG2 4.21Å; W1281-I1634 HydrophobicContact CZ2-CG2 3.83Å
1282T31.6Very low33Very low35.6 Ų35.673.4 Ų73.422%0.21836%0.356CS..Hα-helixtrans-107.19.8171.751.40000111.8K807 H1210 F1278 S1279 E1280 M1284 R1285 I1286K807-T1282 HydrophobicContact CG-CG2 4.21Å; H1210-T1282 PolarHBondContact CD2-OG1 3.37Å; F1278-T1282 HydrophobicContact CD1-CG2 3.91Å; F1278-T1282 HydrophobicContact CE1-CG2 3.22Å; F1278-T1282 HydrophobicContact CE2-CG2 4.34Å; F1278-T1282 HydrophobicContact CZ-CG2 3.43Å; F1278-T1282 VanDerWaalsContact CZ-CG2 3.43Å; F1278-T1282 PolarHBondContact O-OG1 3.31Å; S1279-T1282 WeakPolarHBondContact CB-OG1 3.45Å; S1279-T1282 PolarHBondContact O-N 3.32Å; S1279-T1282 VanDerWaalsContact O-N 3.15Å; S1279-T1282 PolarHBondContact O-OG1 3.29Å; S1279-T1282 PolarHBondContact OG-OG1 3.01Å; E1280-T1282 PolarHBondContact O-N 3.13Å; T1282-M1284 HydrophobicContact CG2-CB 4.29Å; T1282-M1284 HydrophobicContact CG2-CG 4.25Å; T1282-M1284 PolarHBondContact O-N 3.07Å; T1282-M1284 VanDerWaalsContact O-N 3.11Å; T1282-R1285 PolarHBondContact O-N 3.07Å; T1282-I1286 VanDerWaalsContact O-CB 3.27Å; T1282-I1286 WeakPolarHBondContact O-CB 3.36Å; T1282-I1286 VanDerWaalsContact O-CD1 3.32Å; T1282-I1286 WeakPolarHBondContact O-CD1 3.33Å; T1282-I1286 WeakPolarHBondContact O-CG1 3.35Å; T1282-I1286 PolarHBondContact O-N 3.08Å
1283D30.8Very low32.8Very low78.6 Ų78.674.1 Ų74.142%0.4236%0.355SS..Hα-helixtrans-76.4-4.5155.3-81.3-16.3000112H1210 S1279 E1280 W1281 R1285 T1287 R1290 Y1313 S1314H1210-D1283 IonicContact CD2-OD1 3.51Å; H1210-D1283 IonicContact CE1-OD1 3.2Å; H1210-D1283 PolarHBondContact CE1-OD1 2.83Å; H1210-D1283 IonicContact NE2-OD1 3.46Å; H1210-D1283 PolarHBondContact NE2-OD1 3.17Å; H1210-D1283 IonicContact NE2-OD2 2.77Å; S1279-D1283 PolarHBondContact O-N 3.42Å; E1280-D1283 WeakPolarHBondContact O-CB 3.42Å; E1280-D1283 PolarHBondContact O-N 3.46Å; W1281-D1283 VanDerWaalsContact C-N 3.35Å; D1283-R1285 PolarHBondContact O-N 3.32Å; D1283-T1287 HydrophobicContact CB-CG2 4.46Å; D1283-T1287 WeakPolarHBondContact O-CB 3.33Å; D1283-T1287 WeakPolarHBondContact O-CG2 3.42Å; D1283-T1287 PolarHBondContact O-N 3.26Å; D1283-T1287 PolarHBondContact O-OG1 3.47Å; D1283-R1290 IonicContact OD2-NH2 3.51Å; D1283-R1290 PolarHBondContact OD2-NH2 2.71Å; D1283-Y1313 WeakPolarHBondContact CB-O 3.23Å; D1283-Y1313 WeakPolarHBondContact O-CB 3.12Å; D1283-Y1313 WeakPolarHBondContact O-CD1 3.26Å; D1283-Y1313 VanDerWaalsContact O-CG 3.27Å; D1283-S1314 VanDerWaalsContact OD2-CA 3.3Å; D1283-S1314 WeakPolarHBondContact OD2-CA 3.47Å
1284M30.1Very low32.8Very low60.2 Ų60.272.4 Ų72.430%0.29735%0.353SS..Hα-helixtrans-89.3-6.6170.8-77.7-79.3-6300113.2I882 E1280 W1281 T1282 I1286 T1287 H1288 Y1313 K1605 M1609 I1634 F1638I882-M1284 HydrophobicContact CG2-CE 4.34Å; E1280-M1284 WeakPolarHBondContact O-CG 3.48Å; E1280-M1284 PolarHBondContact O-N 3.13Å; W1281-M1284 WeakPolarHBondContact O-CA 3.22Å; W1281-M1284 VanDerWaalsContact O-CB 3.3Å; W1281-M1284 WeakPolarHBondContact O-CB 3.19Å; W1281-M1284 PolarHBondContact O-N 2.9Å; W1281-M1284 VanDerWaalsContact O-N 3.08Å; T1282-M1284 HydrophobicContact CG2-CB 4.29Å; T1282-M1284 HydrophobicContact CG2-CG 4.25Å; T1282-M1284 PolarHBondContact O-N 3.07Å; T1282-M1284 VanDerWaalsContact O-N 3.11Å; M1284-I1286 PolarHBondContact O-N 3.07Å; M1284-I1286 VanDerWaalsContact O-N 3.14Å; M1284-T1287 WeakPolarHBondContact CA-OG1 3.03Å; M1284-T1287 PolarHBondContact O-N 3.35Å; M1284-T1287 VanDerWaalsContact O-N 3.16Å; M1284-T1287 PolarHBondContact O-OG1 2.93Å; M1284-H1288 WeakPolarHBondContact O-CB 3.44Å; M1284-H1288 PolarHBondContact O-N 3.09Å; M1284-Y1313 VanDerWaalsContact CA-CD1 3.46Å; M1284-Y1313 HydrophobicContact CB-CD1 4.4Å; M1284-Y1313 HydrophobicContact CB-CD2 4.39Å; M1284-Y1313 HydrophobicContact CB-CE1 4.47Å; M1284-Y1313 HydrophobicContact CB-CG 4.25Å; M1284-Y1313 HydrophobicContact CE-CD2 3.65Å; M1284-Y1313 HydrophobicContact CE-CE2 3.16Å; M1284-Y1313 HydrophobicContact CG-CD1 4.45Å; M1284-Y1313 HydrophobicContact CG-CD2 3.76Å; M1284-Y1313 HydrophobicContact CG-CE2 4.21Å; M1284-Y1313 HydrophobicContact CG-CG 3.81Å; M1284-Y1313 HydrophobicContact SD-CD2 3Å; M1284-Y1313 WeakPolarHBondContact SD-CD2 3.36Å; M1284-Y1313 HydrophobicContact SD-CE2 3.28Å; M1284-Y1313 WeakPolarHBondContact SD-CE2 3.45Å; M1284-Y1313 HydrophobicContact SD-CG 3.72Å; M1284-K1605 HydrophobicContact CE-CG 4.29Å; M1284-K1605 HydrophobicContact SD-CD 3.76Å; M1284-K1605 WeakPolarHBondContact SD-CE 3.4Å; M1284-K1605 HydrophobicContact SD-CG 3.37Å; M1284-K1605 WeakPolarHBondContact SD-CG 3.48Å; M1284-M1609 HydrophobicContact CB-CE 3.97Å; M1284-M1609 HydrophobicContact CE-CB 4.19Å; M1284-M1609 HydrophobicContact CE-CE 3.31Å; M1284-M1609 HydrophobicContact CE-CG 4.43Å; M1284-M1609 HydrophobicContact CE-SD 3.84Å; M1284-M1609 HydrophobicContact SD-CE 4.44Å; M1284-I1634 HydrophobicContact CB-CG2 4.37Å; M1284-I1634 HydrophobicContact CE-CB 4.12Å; M1284-I1634 HydrophobicContact CE-CD1 4.41Å; M1284-I1634 HydrophobicContact CE-CG1 3.98Å; M1284-I1634 HydrophobicContact CE-CG2 3.25Å; M1284-I1634 HydrophobicContact CG-CG2 3.31Å; M1284-I1634 HydrophobicContact SD-CG2 3.47Å; M1284-I1634 WeakPolarHBondContact SD-CG2 3.07Å; M1284-F1638 HydrophobicContact CE-CD1 4.21Å; M1284-F1638 HydrophobicContact CE-CD2 3.33Å; M1284-F1638 HydrophobicContact CE-CE1 3.79Å; M1284-F1638 HydrophobicContact CE-CE2 2.93Å; M1284-F1638 HydrophobicContact CE-CG 3.96Å; M1284-F1638 HydrophobicContact CE-CZ 3.4Å; M1284-F1638 HydrophobicContact CG-CE1 4.31Å; M1284-F1638 HydrophobicContact SD-CB 3.9Å; M1284-F1638 HydrophobicContact SD-CD1 3.41Å; M1284-F1638 WeakPolarHBondContact SD-CD1 3.48Å; M1284-F1638 HydrophobicContact SD-CD2 3.24Å; M1284-F1638 WeakPolarHBondContact SD-CD2 3.39Å; M1284-F1638 HydrophobicContact SD-CE1 3.77Å; M1284-F1638 HydrophobicContact SD-CE2 3.45Å; M1284-F1638 WeakPolarHBondContact SD-CE2 3.36Å; M1284-F1638 HydrophobicContact SD-CG 3.21Å; M1284-F1638 WeakPolarHBondContact SD-CG 3.48Å; M1284-F1638 HydrophobicContact SD-CZ 4.02Å
1285R28.8Very low33.1Very low79.2 Ų79.269.2 Ų69.230%0.29934%0.336SS..Hα-helixtrans-8340.9170.1-82.6-172.4-178178.32.9112.4N1207 A1251 A1252 F1278 E1280 W1281 T1282 D1283 T1287 H1288 N1289N1207-R1285 PolarHBondContact OD1-NH2 3.49Å; A1251-R1285 VanDerWaalsContact C-NH2 3.28Å; A1251-R1285 PolarHBondContact O-NE 3.41Å; A1251-R1285 PolarHBondContact O-NH2 3Å; A1252-R1285 HydrophobicContact CB-CB 4.46Å; A1252-R1285 HydrophobicContact CB-CG 4.33Å; F1278-R1285 HydrophobicContact CD1-CG 4.15Å; F1278-R1285 HydrophobicContact CE1-CB 4.35Å; F1278-R1285 HydrophobicContact CE1-CG 3.6Å; F1278-R1285 VanDerWaalsContact CZ-CD 3.4Å; F1278-R1285 HydrophobicContact CZ-CG 4.2Å; E1280-R1285 WeakPolarHBondContact O-CB 3.27Å; E1280-R1285 WeakPolarHBondContact O-CD 3.21Å; E1280-R1285 WeakPolarHBondContact O-CG 3.41Å; E1280-R1285 PolarHBondContact O-N 3.21Å; E1280-R1285 IonicContact OE1-CZ 2.79Å; E1280-R1285 IonicContact OE1-NH1 3.2Å; E1280-R1285 IonicContact OE1-NH2 2.84Å; E1280-R1285 PolarHBondContact OE1-NH2 3.39Å; E1280-R1285 IonicContact OE2-CZ 2.84Å; E1280-R1285 VanDerWaalsContact OE2-CZ 3.25Å; E1280-R1285 IonicContact OE2-NH1 3.67Å; E1280-R1285 PolarHBondContact OE2-NH1 3.02Å; E1280-R1285 IonicContact OE2-NH2 3.2Å; E1280-R1285 PolarHBondContact OE2-NH2 2.84Å; W1281-R1285 HydrophobicContact CD2-CB 3.93Å; W1281-R1285 VanDerWaalsContact CE2-CD 3.42Å; W1281-R1285 HydrophobicContact CE3-CB 4.01Å; W1281-R1285 HydrophobicContact CG-CB 4.37Å; W1281-R1285 HydrophobicContact CZ3-CB 4.4Å; W1281-R1285 VanDerWaalsContact O-CG 3.32Å; W1281-R1285 WeakPolarHBondContact O-CG 3.04Å; W1281-R1285 PolarHBondContact O-N 3.02Å; W1281-R1285 VanDerWaalsContact O-N 3.12Å; T1282-R1285 PolarHBondContact O-N 3.07Å; D1283-R1285 PolarHBondContact O-N 3.32Å; R1285-T1287 VanDerWaalsContact C-N 3.25Å; R1285-T1287 PolarHBondContact O-N 2.92Å; R1285-H1288 PolarHBondContact O-N 2.89Å; R1285-N1289 VanDerWaalsContact O-CB 3.31Å; R1285-N1289 WeakPolarHBondContact O-CB 3.3Å; R1285-N1289 PolarHBondContact O-N 2.86Å
1286I30.6Very low33.4Very low65.6 Ų65.671.2 Ų71.234%0.33634%0.338SS..Hα-helixtrans-82.422.3152.7-56.8173.9000109.7T1282 M1284 H1288 R1290 Q1307T1282-I1286 VanDerWaalsContact O-CB 3.27Å; T1282-I1286 WeakPolarHBondContact O-CB 3.36Å; T1282-I1286 VanDerWaalsContact O-CD1 3.32Å; T1282-I1286 WeakPolarHBondContact O-CD1 3.33Å; T1282-I1286 WeakPolarHBondContact O-CG1 3.35Å; T1282-I1286 PolarHBondContact O-N 3.08Å; M1284-I1286 PolarHBondContact O-N 3.07Å; M1284-I1286 VanDerWaalsContact O-N 3.14Å; I1286-H1288 WeakPolarHBondContact CG2-O 3.23Å; I1286-H1288 PolarHBondContact O-N 2.92Å; I1286-R1290 VanDerWaalsContact CG2-CD 3.47Å; I1286-R1290 HydrophobicContact CG2-CG 3.87Å; I1286-R1290 WeakPolarHBondContact O-CA 3.02Å; I1286-R1290 WeakPolarHBondContact O-CB 3.49Å; I1286-R1290 WeakPolarHBondContact O-CG 3.37Å; I1286-R1290 PolarHBondContact O-N 3.41Å; I1286-Q1307 VanDerWaalsContact CD1-OE1 3.3Å
1287T30Very low34Very low43.4 Ų43.469.6 Ų69.627%0.26633%0.325SS..  trans-70.462.3159.357.60000110.1D1283 M1284 R1285 N1289 M1291 M1609D1283-T1287 HydrophobicContact CB-CG2 4.46Å; D1283-T1287 WeakPolarHBondContact O-CB 3.33Å; D1283-T1287 WeakPolarHBondContact O-CG2 3.42Å; D1283-T1287 PolarHBondContact O-N 3.26Å; D1283-T1287 PolarHBondContact O-OG1 3.47Å; M1284-T1287 WeakPolarHBondContact CA-OG1 3.03Å; M1284-T1287 PolarHBondContact O-N 3.35Å; M1284-T1287 VanDerWaalsContact O-N 3.16Å; M1284-T1287 PolarHBondContact O-OG1 2.93Å; R1285-T1287 VanDerWaalsContact C-N 3.25Å; R1285-T1287 PolarHBondContact O-N 2.92Å; T1287-N1289 PolarHBondContact O-N 3.09Å; T1287-M1291 WeakPolarHBondContact O-CB 3.5Å; T1287-M1291 WeakPolarHBondContact O-CG 3.41Å; T1287-M1291 PolarHBondContact O-N 3.08Å; T1287-M1609 WeakPolarHBondContact OG1-CE 3.39Å
1288H29.7Very low34.6Very low63.6 Ų63.663.5 Ų63.529%0.29430%0.303SS..Hα-helixtrans-44.521.5177.5-109.5-68.8000112.3N897 M1284 R1285 I1286 M1291 N1292 M1609N897-H1288 VanDerWaalsContact CG-O 3.25Å; N897-H1288 PolarHBondContact ND2-O 3.23Å; N897-H1288 WeakPolarHBondContact OD1-CB 3.38Å; N897-H1288 PolarHBondContact OD1-O 2.97Å; M1284-H1288 WeakPolarHBondContact O-CB 3.44Å; M1284-H1288 PolarHBondContact O-N 3.09Å; R1285-H1288 PolarHBondContact O-N 2.89Å; I1286-H1288 WeakPolarHBondContact CG2-O 3.23Å; I1286-H1288 PolarHBondContact O-N 2.92Å; H1288-M1291 PolarHBondContact O-N 3.02Å; H1288-N1292 PolarHBondContact O-N 3.29Å; H1288-M1609 HydrophobicContact CB-CE 3.83Å; H1288-M1609 HydrophobicContact CB-CG 3.67Å; H1288-M1609 HydrophobicContact CB-SD 3.36Å; H1288-M1609 WeakPolarHBondContact CB-SD 3.49Å; H1288-M1609 VanDerWaalsContact CD2-CG 3.44Å; H1288-M1609 WeakPolarHBondContact CD2-CG 3.39Å; H1288-M1609 PolarHBondContact CD2-SD 3.22Å; H1288-M1609 VanDerWaalsContact CG-SD 3.57Å; H1288-M1609 VanDerWaalsContact N-CE 3.25Å
1289N33.3Very low35.3Very low50 Ų5062.9 Ų62.927%0.26730%0.302SS..Hα-helixtrans-131.739.4166.3-77.7-22.9000114.8N893 N896 N897 R1285 T1287 M1291 N1293 N1294 Q1307 K1605N893-N1289 PolarHBondContact O-ND2 3.31Å; N896-N1289 VanDerWaalsContact C-ND2 3.31Å; N897-N1289 WeakPolarHBondContact CA-ND2 3.26Å; N897-N1289 VanDerWaalsContact CG-CG 3.45Å; N897-N1289 PolarHBondContact N-ND2 3.28Å; N897-N1289 PolarHBondContact ND2-ND2 3.15Å; N897-N1289 PolarHBondContact OD1-ND2 3.03Å; N897-N1289 PolarHBondContact OD1-OD1 3.34Å; R1285-N1289 VanDerWaalsContact O-CB 3.31Å; R1285-N1289 WeakPolarHBondContact O-CB 3.3Å; R1285-N1289 PolarHBondContact O-N 2.86Å; T1287-N1289 PolarHBondContact O-N 3.09Å; N1289-M1291 VanDerWaalsContact C-N 3.26Å; N1289-M1291 PolarHBondContact O-N 3.39Å; N1289-N1293 VanDerWaalsContact O-CB 3.26Å; N1289-N1293 WeakPolarHBondContact O-CB 3.5Å; N1289-N1293 PolarHBondContact O-N 3.19Å; N1289-N1293 PolarHBondContact O-ND2 3.46Å; N1289-N1294 PolarHBondContact O-N 3.23Å; N1289-Q1307 PolarHBondContact ND2-NE2 3.37Å; N1289-Q1307 PolarHBondContact ND2-OE1 3.49Å; N1289-K1605 PolarHBondContact O-NZ 3.48Å
1290R33.6Very low35.9Very low127.2 Ų127.262.8 Ų62.848%0.4830%0.303SS..Hα-helixtrans-71.740.7156.3-77.1-167.2-167.8167.66.3111.1Y1277 D1283 I1286 N1292 N1293 D1295 I1298Y1277-R1290 PolarHBondContact OH-NH1 3.12Å; Y1277-R1290 VanDerWaalsContact OH-NH1 3.17Å; D1283-R1290 IonicContact OD2-NH2 3.51Å; D1283-R1290 PolarHBondContact OD2-NH2 2.71Å; I1286-R1290 VanDerWaalsContact CG2-CD 3.47Å; I1286-R1290 HydrophobicContact CG2-CG 3.87Å; I1286-R1290 WeakPolarHBondContact O-CA 3.02Å; I1286-R1290 WeakPolarHBondContact O-CB 3.49Å; I1286-R1290 WeakPolarHBondContact O-CG 3.37Å; I1286-R1290 PolarHBondContact O-N 3.41Å; R1290-N1292 PolarHBondContact O-N 3.17Å; R1290-N1293 CarbonylContact C-O 3.55Å; R1290-N1293 VanDerWaalsContact C-O 3.26Å; R1290-D1295 WeakPolarHBondContact CA-OD1 3.33Å; R1290-D1295 HydrophobicContact CB-CB 3.78Å; R1290-D1295 VanDerWaalsContact CB-CG 3.45Å; R1290-D1295 WeakPolarHBondContact CB-OD2 3.45Å; R1290-D1295 WeakPolarHBondContact CD-OD2 3.38Å; R1290-D1295 HydrophobicContact CG-CB 4.23Å; R1290-D1295 VanDerWaalsContact CG-CG 3.41Å; R1290-D1295 WeakPolarHBondContact CG-OD2 3.47Å; R1290-D1295 IonicContact NE-OD2 3.2Å; R1290-D1295 PolarHBondContact NE-OD2 3.48Å; R1290-D1295 WeakPolarHBondContact O-CA 3.38Å; R1290-D1295 WeakPolarHBondContact O-CB 3.5Å; R1290-D1295 PolarHBondContact O-N 3.36Å; R1290-D1295 VanDerWaalsContact O-N 3.1Å; R1290-I1298 HydrophobicContact CB-CD1 4.33Å; R1290-I1298 HydrophobicContact CG-CD1 4.43Å
1291M34.3Very low36.8Very low52.4 Ų52.459.8 Ų59.826%0.25829%0.289SS..  trans-85.239.5169.9-77.6-89.9175.100110.4T1287 H1288 N1289 N1293 I1298 Q1299 W1304 I1583 H1603 K1605 I1606T1287-M1291 WeakPolarHBondContact O-CB 3.5Å; T1287-M1291 WeakPolarHBondContact O-CG 3.41Å; T1287-M1291 PolarHBondContact O-N 3.08Å; H1288-M1291 PolarHBondContact O-N 3.02Å; N1289-M1291 VanDerWaalsContact C-N 3.26Å; N1289-M1291 PolarHBondContact O-N 3.39Å; M1291-N1293 VanDerWaalsContact C-N 3.32Å; M1291-N1293 CarbonylContact C-O 3.56Å; M1291-N1293 PolarHBondContact O-N 3.19Å; M1291-I1298 HydrophobicContact CE-CB 4.32Å; M1291-I1298 HydrophobicContact CE-CG2 3.5Å; M1291-I1298 VanDerWaalsContact CE-CG2 3.4Å; M1291-I1298 HydrophobicContact SD-CB 3.79Å; M1291-I1298 HydrophobicContact SD-CD1 3.79Å; M1291-I1298 HydrophobicContact SD-CG1 4.4Å; M1291-I1298 HydrophobicContact SD-CG2 3.5Å; M1291-I1298 WeakPolarHBondContact SD-CG2 3.41Å; M1291-Q1299 HydrophobicContact CE-CG 4.31Å; M1291-Q1299 VanDerWaalsContact O-CD 3.29Å; M1291-Q1299 PolarHBondContact O-NE2 3.38Å; M1291-Q1299 HydrophobicContact SD-CG 3.32Å; M1291-Q1299 WeakPolarHBondContact SD-CG 3.44Å; M1291-Q1299 PolarHBondContact SD-NE2 3.41Å; M1291-W1304 HydrophobicContact CE-CB 3.93Å; M1291-W1304 HydrophobicContact CE-CG 4.15Å; M1291-I1583 HydrophobicContact CE-CD1 3.98Å; M1291-I1583 HydrophobicContact SD-CD1 4.06Å; M1291-H1603 WeakPolarHBondContact CE-NE2 3.26Å; M1291-K1605 HydrophobicContact CB-CD 4.05Å; M1291-K1605 HydrophobicContact CE-CD 4.25Å; M1291-K1605 HydrophobicContact CG-CD 4.13Å; M1291-I1606 HydrophobicContact CB-CD1 4.24Å; M1291-I1606 HydrophobicContact CB-CG1 4.35Å; M1291-I1606 HydrophobicContact CG-CD1 3.94Å; M1291-I1606 HydrophobicContact CG-CG1 4.5Å; M1291-I1606 HydrophobicContact SD-CD1 4.14Å
1292N36.7Very low37.8Very low67.4 Ų67.456.9 Ų56.936%0.3628%0.278SS..  trans-80.438.4172.7-92.4-1.5000110.2N896 H1288 R1290 N1294 D1295N896-N1292 PolarHBondContact ND2-OD1 3.04Å; H1288-N1292 PolarHBondContact O-N 3.29Å; R1290-N1292 PolarHBondContact O-N 3.17Å; N1292-N1294 PolarHBondContact O-N 3.12Å; N1292-D1295 HydrophobicContact CB-CB 4.36Å; N1292-D1295 WeakPolarHBondContact CB-OD1 3.4Å; N1292-D1295 PolarHBondContact ND2-OD1 2.82Å; N1292-D1295 PolarHBondContact ND2-OD2 3.05Å; N1292-D1295 PolarHBondContact O-N 3.3Å
1293N36.7Very low39.2Very low67 Ų6755.7 Ų55.736%0.35827%0.271SS..THydrogen-bonded Turntrans-87.422.4174.6-75.6-22.5000111.5I1066 N1289 R1290 M1291 D1295 Q1299I1066-N1293 HydrophobicContact CD1-CB 3.38Å; N1289-N1293 VanDerWaalsContact O-CB 3.26Å; N1289-N1293 WeakPolarHBondContact O-CB 3.5Å; N1289-N1293 PolarHBondContact O-N 3.19Å; N1289-N1293 PolarHBondContact O-ND2 3.46Å; R1290-N1293 CarbonylContact C-O 3.55Å; R1290-N1293 VanDerWaalsContact C-O 3.26Å; M1291-N1293 VanDerWaalsContact C-N 3.32Å; M1291-N1293 CarbonylContact C-O 3.56Å; M1291-N1293 PolarHBondContact O-N 3.19Å; N1293-D1295 PolarHBondContact O-N 3.21Å; N1293-Q1299 PolarHBondContact O-NE2 2.94Å
1294N37.9Very low40.7Very low64 Ų6453.2 Ų53.234%0.34226%0.255SS..THydrogen-bonded Turntrans-88.317.4-179.5-82.54.8000114.4N896 A1062 S1063 I1066 N1289 N1292 Y1296N896-N1294 VanDerWaalsContact CG-ND2 3.32Å; N896-N1294 PolarHBondContact OD1-ND2 3.02Å; A1062-N1294 WeakPolarHBondContact CB-O 3.4Å; S1063-N1294 VanDerWaalsContact CB-OD1 3.3Å; S1063-N1294 WeakPolarHBondContact CB-OD1 3.41Å; I1066-N1294 HydrophobicContact CD1-CB 3.65Å; I1066-N1294 WeakPolarHBondContact CD1-ND2 3.41Å; I1066-N1294 WeakPolarHBondContact CD1-OD1 3.46Å; I1066-N1294 HydrophobicContact CG1-CB 4.11Å; I1066-N1294 WeakPolarHBondContact CG1-ND2 3.34Å; I1066-N1294 WeakPolarHBondContact CG1-OD1 3.39Å; N1289-N1294 PolarHBondContact O-N 3.23Å; N1292-N1294 PolarHBondContact O-N 3.12Å; N1294-Y1296 PolarHBondContact O-N 3.2Å
1295D42.2Very low42.4Very low23.4 Ų23.451.2 Ų51.213%0.12525%0.245CC..  trans-83.267.4162.7-72.2-11000107.7Y1153 R1290 N1292 N1293 Y1297 I1298 Q1299Y1153-D1295 PolarHBondContact OH-OD1 3.22Å; R1290-D1295 WeakPolarHBondContact CA-OD1 3.33Å; R1290-D1295 HydrophobicContact CB-CB 3.78Å; R1290-D1295 VanDerWaalsContact CB-CG 3.45Å; R1290-D1295 WeakPolarHBondContact CB-OD2 3.45Å; R1290-D1295 WeakPolarHBondContact CD-OD2 3.38Å; R1290-D1295 HydrophobicContact CG-CB 4.23Å; R1290-D1295 VanDerWaalsContact CG-CG 3.41Å; R1290-D1295 WeakPolarHBondContact CG-OD2 3.47Å; R1290-D1295 IonicContact NE-OD2 3.2Å; R1290-D1295 PolarHBondContact NE-OD2 3.48Å; R1290-D1295 WeakPolarHBondContact O-CA 3.38Å; R1290-D1295 WeakPolarHBondContact O-CB 3.5Å; R1290-D1295 PolarHBondContact O-N 3.36Å; R1290-D1295 VanDerWaalsContact O-N 3.1Å; N1292-D1295 HydrophobicContact CB-CB 4.36Å; N1292-D1295 WeakPolarHBondContact CB-OD1 3.4Å; N1292-D1295 PolarHBondContact ND2-OD1 2.82Å; N1292-D1295 PolarHBondContact ND2-OD2 3.05Å; N1292-D1295 PolarHBondContact O-N 3.3Å; N1293-D1295 PolarHBondContact O-N 3.21Å; D1295-Y1297 CarbonylContact O-C 3.58Å; D1295-Y1297 PolarHBondContact O-N 3.14Å; D1295-I1298 HydrophobicContact CB-CB 4.03Å; D1295-I1298 HydrophobicContact CB-CD1 3.72Å; D1295-I1298 HydrophobicContact CB-CG1 3.78Å; D1295-I1298 VanDerWaalsContact CG-CD1 3.47Å; D1295-I1298 PolarHBondContact O-N 3.37Å; D1295-I1298 WeakPolarHBondContact OD2-CD1 3.36Å; D1295-Q1299 PolarHBondContact O-N 2.98Å; D1295-Q1299 VanDerWaalsContact O-N 3.12Å
1296Y41.7Very low44.3Very low134 Ų13447.4 Ų47.453%0.52523%0.231SC..Hα-helixtrans-46.3-31.2167.4-158.8-97.8000110N1294 Q1299 A1300N1294-Y1296 PolarHBondContact O-N 3.2Å; Y1296-Q1299 PolarHBondContact O-N 2.95Å; Y1296-A1300 HydrophobicContact CD1-CB 4.02Å; Y1296-A1300 HydrophobicContact CE1-CB 3.91Å; Y1296-A1300 HydrophobicContact CE2-CB 4.5Å; Y1296-A1300 HydrophobicContact CG-CB 4.34Å; Y1296-A1300 VanDerWaalsContact O-CA 3.24Å; Y1296-A1300 WeakPolarHBondContact O-CA 3.34Å; Y1296-A1300 WeakPolarHBondContact O-CB 3.29Å; Y1296-A1300 PolarHBondContact O-N 3.12Å
1297Y43.3Very low45.9Very low22.4 Ų22.446.2 Ų46.29%0.08822%0.224CC..Hα-helixtrans-60-57171.8-141.2-90.6000113.8Y1153 S1156 D1295 Q1299 A1300 F1301 D1303 S1320 I1324Y1153-Y1297 AromaticContact CD1-CD1 3.69Å; Y1153-Y1297 HydrophobicContact CD1-CD1 3.69Å; Y1153-Y1297 AromaticContact CD1-CD2 3.9Å; Y1153-Y1297 HydrophobicContact CD1-CD2 4.13Å; Y1153-Y1297 AromaticContact CD1-CE1 3.67Å; Y1153-Y1297 HydrophobicContact CD1-CE1 3.67Å; Y1153-Y1297 AromaticContact CD1-CE2 3.88Å; Y1153-Y1297 HydrophobicContact CD1-CE2 3.88Å; Y1153-Y1297 AromaticContact CD1-CG 3.82Å; Y1153-Y1297 HydrophobicContact CD1-CG 4Å; Y1153-Y1297 AromaticContact CD1-CZ 3.78Å; Y1153-Y1297 HydrophobicContact CD2-CD2 4.32Å; Y1153-Y1297 AromaticContact CE1-CD1 3.69Å; Y1153-Y1297 HydrophobicContact CE1-CD1 4.03Å; Y1153-Y1297 AromaticContact CE1-CD2 3.64Å; Y1153-Y1297 HydrophobicContact CE1-CD2 4.06Å; Y1153-Y1297 HydrophobicContact CE1-CE1 4.16Å; Y1153-Y1297 HydrophobicContact CE1-CE2 4.1Å; Y1153-Y1297 AromaticContact CE1-CG 3.53Å; Y1153-Y1297 HydrophobicContact CE1-CG 3.77Å; Y1153-Y1297 VanDerWaalsContact CE1-CG 3.43Å; Y1153-Y1297 HydrophobicContact CE2-CD1 4.49Å; Y1153-Y1297 HydrophobicContact CE2-CD2 4.09Å; Y1153-Y1297 HydrophobicContact CE2-CG 4.35Å; Y1153-Y1297 HydrophobicContact CG-CD2 4.44Å; Y1153-Y1297 VanDerWaalsContact CZ-CB 3.42Å; Y1153-Y1297 AromaticContact CZ-CD1 3.95Å; Y1153-Y1297 AromaticContact CZ-CD2 3.96Å; Y1153-Y1297 AromaticContact CZ-CG 3.81Å; Y1153-Y1297 WeakPolarHBondContact OH-CB 3.32Å; S1156-Y1297 WeakPolarHBondContact CB-OH 3.33Å; S1156-Y1297 WeakPolarHBondContact OG-CE1 3.13Å; S1156-Y1297 VanDerWaalsContact OG-CZ 3.29Å; S1156-Y1297 PolarHBondContact OG-OH 2.9Å; D1295-Y1297 CarbonylContact O-C 3.58Å; D1295-Y1297 PolarHBondContact O-N 3.14Å; Y1297-Q1299 VanDerWaalsContact C-N 3.29Å; Y1297-Q1299 PolarHBondContact O-N 3.01Å; Y1297-A1300 PolarHBondContact O-N 3.25Å; Y1297-A1300 VanDerWaalsContact O-N 3.16Å; Y1297-F1301 AromaticContact CD1-CD2 3.65Å; Y1297-F1301 HydrophobicContact CD1-CD2 3.93Å; Y1297-F1301 VanDerWaalsContact CD1-CD2 3.47Å; Y1297-F1301 AromaticContact CD1-CE2 3.6Å; Y1297-F1301 HydrophobicContact CD1-CE2 3.6Å; Y1297-F1301 AromaticContact CD2-CD2 3.32Å; Y1297-F1301 HydrophobicContact CD2-CD2 3.32Å; Y1297-F1301 VanDerWaalsContact CD2-CD2 3.43Å; Y1297-F1301 AromaticContact CD2-CE2 3.17Å; Y1297-F1301 HydrophobicContact CD2-CE2 3.4Å; Y1297-F1301 HydrophobicContact CD2-CG 4.34Å; Y1297-F1301 HydrophobicContact CD2-CZ 4.33Å; Y1297-F1301 AromaticContact CE1-CD2 3.52Å; Y1297-F1301 HydrophobicContact CE1-CD2 3.99Å; Y1297-F1301 AromaticContact CE1-CE2 3.31Å; Y1297-F1301 HydrophobicContact CE1-CE2 3.69Å; Y1297-F1301 HydrophobicContact CE1-CZ 4.21Å; Y1297-F1301 AromaticContact CE2-CD2 3.38Å; Y1297-F1301 HydrophobicContact CE2-CD2 3.38Å; Y1297-F1301 AromaticContact CE2-CE2 3.47Å; Y1297-F1301 HydrophobicContact CE2-CE2 3.47Å; Y1297-F1301 VanDerWaalsContact CE2-CE2 3.49Å; Y1297-F1301 HydrophobicContact CE2-CG 4.02Å; Y1297-F1301 HydrophobicContact CE2-CZ 4.26Å; Y1297-F1301 AromaticContact CG-CD2 3.61Å; Y1297-F1301 HydrophobicContact CG-CD2 3.72Å; Y1297-F1301 VanDerWaalsContact CG-CD2 3.5Å; Y1297-F1301 AromaticContact CG-CE2 3.89Å; Y1297-F1301 HydrophobicContact CG-CE2 3.89Å; Y1297-F1301 AromaticContact CZ-CD2 3.84Å; Y1297-F1301 AromaticContact CZ-CE2 3.43Å; Y1297-F1301 VanDerWaalsContact CZ-CE2 3.43Å; Y1297-F1301 VanDerWaalsContact O-CB 3.26Å; Y1297-F1301 WeakPolarHBondContact O-CB 3.41Å; Y1297-F1301 VanDerWaalsContact O-CD2 3.27Å; Y1297-F1301 WeakPolarHBondContact O-CD2 3.41Å; Y1297-F1301 WeakPolarHBondContact O-CG 3.47Å; Y1297-F1301 PolarHBondContact O-N 3.27Å; Y1297-D1303 WeakPolarHBondContact CE1-OD2 3.46Å; Y1297-S1320 PolarHBondContact OH-OG 3.26Å; Y1297-I1324 HydrophobicContact CE1-CG1 3.77Å; Y1297-I1324 HydrophobicContact CE2-CD1 4.3Å; Y1297-I1324 HydrophobicContact CE2-CG1 4.1Å; Y1297-I1324 WeakPolarHBondContact OH-CA 3.42Å; Y1297-I1324 WeakPolarHBondContact OH-CD1 3.34Å; Y1297-I1324 WeakPolarHBondContact OH-CG1 3.39Å
1298I46.1Very low47.4Very low27.6 Ų27.647 Ų4714%0.14223%0.228CC..Hα-helixtrans-62.7-37.8-178-61.1178000110.5R1290 M1291 D1295 G1302 D1303 W1304R1290-I1298 HydrophobicContact CB-CD1 4.33Å; R1290-I1298 HydrophobicContact CG-CD1 4.43Å; M1291-I1298 HydrophobicContact CE-CB 4.32Å; M1291-I1298 HydrophobicContact CE-CG2 3.5Å; M1291-I1298 VanDerWaalsContact CE-CG2 3.4Å; M1291-I1298 HydrophobicContact SD-CB 3.79Å; M1291-I1298 HydrophobicContact SD-CD1 3.79Å; M1291-I1298 HydrophobicContact SD-CG1 4.4Å; M1291-I1298 HydrophobicContact SD-CG2 3.5Å; M1291-I1298 WeakPolarHBondContact SD-CG2 3.41Å; D1295-I1298 HydrophobicContact CB-CB 4.03Å; D1295-I1298 HydrophobicContact CB-CD1 3.72Å; D1295-I1298 HydrophobicContact CB-CG1 3.78Å; D1295-I1298 VanDerWaalsContact CG-CD1 3.47Å; D1295-I1298 PolarHBondContact O-N 3.37Å; D1295-I1298 WeakPolarHBondContact OD2-CD1 3.36Å; I1298-G1302 PolarHBondContact O-N 3.28Å; I1298-D1303 HydrophobicContact CB-CB 4.45Å; I1298-D1303 HydrophobicContact CG2-CB 4.09Å; I1298-D1303 PolarHBondContact O-N 3.4Å; I1298-W1304 HydrophobicContact CG2-CB 3.95Å; I1298-W1304 VanDerWaalsContact CG2-CB 3.49Å; I1298-W1304 HydrophobicContact CG2-CG 4.29Å
1299Q44.1Very low49.1Very low71.2 Ų71.245 Ų4533%0.33322%0.221SC..Hα-helixtrans-74.2-39.5177.6-67.7-174.4-0.800113.3M1291 N1293 D1295 Y1296 Y1297 F1301M1291-Q1299 HydrophobicContact CE-CG 4.31Å; M1291-Q1299 VanDerWaalsContact O-CD 3.29Å; M1291-Q1299 PolarHBondContact O-NE2 3.38Å; M1291-Q1299 HydrophobicContact SD-CG 3.32Å; M1291-Q1299 WeakPolarHBondContact SD-CG 3.44Å; M1291-Q1299 PolarHBondContact SD-NE2 3.41Å; N1293-Q1299 PolarHBondContact O-NE2 2.94Å; D1295-Q1299 PolarHBondContact O-N 2.98Å; D1295-Q1299 VanDerWaalsContact O-N 3.12Å; Y1296-Q1299 PolarHBondContact O-N 2.95Å; Y1297-Q1299 VanDerWaalsContact C-N 3.29Å; Y1297-Q1299 PolarHBondContact O-N 3.01Å; Q1299-F1301 PolarHBondContact O-N 3.47Å
1300A46.2Very low50.5Low40 Ų4043.3 Ų43.333%0.33121%0.212SC..Hα-helixtrans-75.4-35-176.200000112.8Y1296 Y1297 P1586Y1296-A1300 HydrophobicContact CD1-CB 4.02Å; Y1296-A1300 HydrophobicContact CE1-CB 3.91Å; Y1296-A1300 HydrophobicContact CE2-CB 4.5Å; Y1296-A1300 HydrophobicContact CG-CB 4.34Å; Y1296-A1300 VanDerWaalsContact O-CA 3.24Å; Y1296-A1300 WeakPolarHBondContact O-CA 3.34Å; Y1296-A1300 WeakPolarHBondContact O-CB 3.29Å; Y1296-A1300 PolarHBondContact O-N 3.12Å; Y1297-A1300 PolarHBondContact O-N 3.25Å; Y1297-A1300 VanDerWaalsContact O-N 3.16Å; A1300-P1586 WeakPolarHBondContact O-CB 3.45Å
1301F52.2Low51.8Low19.8 Ų19.840.6 Ų40.69%0.08721%0.207CC..Hα-helixtrans-93.7-20.2-173.9-65.9-68.2000113.8Y1297 Q1299 D1303 Q1323 I1324 A1327Y1297-F1301 AromaticContact CD1-CD2 3.65Å; Y1297-F1301 HydrophobicContact CD1-CD2 3.93Å; Y1297-F1301 VanDerWaalsContact CD1-CD2 3.47Å; Y1297-F1301 AromaticContact CD1-CE2 3.6Å; Y1297-F1301 HydrophobicContact CD1-CE2 3.6Å; Y1297-F1301 AromaticContact CD2-CD2 3.32Å; Y1297-F1301 HydrophobicContact CD2-CD2 3.32Å; Y1297-F1301 VanDerWaalsContact CD2-CD2 3.43Å; Y1297-F1301 AromaticContact CD2-CE2 3.17Å; Y1297-F1301 HydrophobicContact CD2-CE2 3.4Å; Y1297-F1301 HydrophobicContact CD2-CG 4.34Å; Y1297-F1301 HydrophobicContact CD2-CZ 4.33Å; Y1297-F1301 AromaticContact CE1-CD2 3.52Å; Y1297-F1301 HydrophobicContact CE1-CD2 3.99Å; Y1297-F1301 AromaticContact CE1-CE2 3.31Å; Y1297-F1301 HydrophobicContact CE1-CE2 3.69Å; Y1297-F1301 HydrophobicContact CE1-CZ 4.21Å; Y1297-F1301 AromaticContact CE2-CD2 3.38Å; Y1297-F1301 HydrophobicContact CE2-CD2 3.38Å; Y1297-F1301 AromaticContact CE2-CE2 3.47Å; Y1297-F1301 HydrophobicContact CE2-CE2 3.47Å; Y1297-F1301 VanDerWaalsContact CE2-CE2 3.49Å; Y1297-F1301 HydrophobicContact CE2-CG 4.02Å; Y1297-F1301 HydrophobicContact CE2-CZ 4.26Å; Y1297-F1301 AromaticContact CG-CD2 3.61Å; Y1297-F1301 HydrophobicContact CG-CD2 3.72Å; Y1297-F1301 VanDerWaalsContact CG-CD2 3.5Å; Y1297-F1301 AromaticContact CG-CE2 3.89Å; Y1297-F1301 HydrophobicContact CG-CE2 3.89Å; Y1297-F1301 AromaticContact CZ-CD2 3.84Å; Y1297-F1301 AromaticContact CZ-CE2 3.43Å; Y1297-F1301 VanDerWaalsContact CZ-CE2 3.43Å; Y1297-F1301 VanDerWaalsContact O-CB 3.26Å; Y1297-F1301 WeakPolarHBondContact O-CB 3.41Å; Y1297-F1301 VanDerWaalsContact O-CD2 3.27Å; Y1297-F1301 WeakPolarHBondContact O-CD2 3.41Å; Y1297-F1301 WeakPolarHBondContact O-CG 3.47Å; Y1297-F1301 PolarHBondContact O-N 3.27Å; Q1299-F1301 PolarHBondContact O-N 3.47Å; F1301-D1303 VanDerWaalsContact C-N 3.33Å; F1301-Q1323 HydrophobicContact CB-CB 4.15Å; F1301-Q1323 HydrophobicContact CB-CG 4.36Å; F1301-Q1323 HydrophobicContact CD1-CB 4.08Å; F1301-Q1323 VanDerWaalsContact CD1-O 3.23Å; F1301-Q1323 WeakPolarHBondContact CD1-O 3.26Å; F1301-Q1323 VanDerWaalsContact CE1-C 3.43Å; F1301-Q1323 VanDerWaalsContact CE1-O 3.31Å; F1301-Q1323 WeakPolarHBondContact CE1-O 3.41Å; F1301-Q1323 HydrophobicContact CG-CB 4.21Å; F1301-Q1323 WeakPolarHBondContact O-CB 3.22Å; F1301-Q1323 VanDerWaalsContact O-CG 3.23Å; F1301-Q1323 WeakPolarHBondContact O-CG 3.35Å; F1301-Q1323 PolarHBondContact O-NE2 2.88Å; F1301-Q1323 PolarHBondContact O-OE1 3.22Å; F1301-I1324 HydrophobicContact CD1-CG1 4.32Å; F1301-I1324 VanDerWaalsContact CE1-CA 3.42Å; F1301-I1324 HydrophobicContact CE1-CB 4.35Å; F1301-I1324 HydrophobicContact CE1-CG1 4.22Å; F1301-I1324 HydrophobicContact CZ-CG1 4.43Å; F1301-A1327 HydrophobicContact CD1-CB 3.92Å; F1301-A1327 HydrophobicContact CE1-CB 3.37Å; F1301-A1327 VanDerWaalsContact CE1-CB 3.44Å; F1301-A1327 HydrophobicContact CE2-CB 4.47Å; F1301-A1327 HydrophobicContact CZ-CB 3.67Å; F1301-A1327 VanDerWaalsContact CZ-CB 3.41Å
1302G54.8Low52.8Low2 Ų239.1 Ų39.12%0.02120%0.201CC..  trans90.210.8175.100000115.6I1298 W1304 F1305 Y1306I1298-G1302 PolarHBondContact O-N 3.28Å; G1302-W1304 VanDerWaalsContact C-N 3.26Å; G1302-W1304 PolarHBondContact O-N 3.18Å; G1302-W1304 VanDerWaalsContact O-N 3.13Å; G1302-F1305 WeakPolarHBondContact O-CA 3.16Å; G1302-F1305 WeakPolarHBondContact O-CB 3.37Å; G1302-F1305 PolarHBondContact O-N 3.2Å; G1302-Y1306 PolarHBondContact O-N 3.04Å
1303D61Low53.6Low9.8 Ų9.841.4 Ų41.45%0.05221%0.205CC..Hα-helixtrans-48.2-41.5175.4-75.4-11.5000113.4Y1297 I1298 F1301 F1305 Y1306 Q1307 I1315 S1320 Q1323Y1297-D1303 WeakPolarHBondContact CE1-OD2 3.46Å; I1298-D1303 HydrophobicContact CB-CB 4.45Å; I1298-D1303 HydrophobicContact CG2-CB 4.09Å; I1298-D1303 PolarHBondContact O-N 3.4Å; F1301-D1303 VanDerWaalsContact C-N 3.33Å; D1303-F1305 VanDerWaalsContact C-N 3.29Å; D1303-F1305 PolarHBondContact O-N 3.22Å; D1303-F1305 VanDerWaalsContact O-N 3.15Å; D1303-Y1306 WeakPolarHBondContact O-CB 3.41Å; D1303-Y1306 PolarHBondContact O-N 3Å; D1303-Q1307 VanDerWaalsContact O-CG 3.32Å; D1303-Q1307 WeakPolarHBondContact O-CG 3.38Å; D1303-Q1307 PolarHBondContact O-N 2.95Å; D1303-Q1307 VanDerWaalsContact O-N 3.11Å; D1303-I1315 HydrophobicContact CB-CD1 3.49Å; D1303-I1315 VanDerWaalsContact CB-CD1 3.43Å; D1303-I1315 HydrophobicContact CB-CG1 4.16Å; D1303-I1315 VanDerWaalsContact OD2-CD1 3.28Å; D1303-I1315 WeakPolarHBondContact OD2-CD1 3.49Å; D1303-S1320 PolarHBondContact OD1-OG 2.81Å; D1303-Q1323 PolarHBondContact OD1-NE2 3Å; D1303-Q1323 PolarHBondContact OD1-OE1 3.03Å; D1303-Q1323 VanDerWaalsContact OD1-OE1 3.05Å
1304W61.1Low54.6Low26.8 Ų26.840.2 Ų40.210%0.10220%0.203CC..Hα-helixtrans-58.9-33.817874.6-89.3000112.3M1291 I1298 G1302 Y1306 Q1307 V1308 I1583 M1601 H1603M1291-W1304 HydrophobicContact CE-CB 3.93Å; M1291-W1304 HydrophobicContact CE-CG 4.15Å; I1298-W1304 HydrophobicContact CG2-CB 3.95Å; I1298-W1304 VanDerWaalsContact CG2-CB 3.49Å; I1298-W1304 HydrophobicContact CG2-CG 4.29Å; G1302-W1304 VanDerWaalsContact C-N 3.26Å; G1302-W1304 PolarHBondContact O-N 3.18Å; G1302-W1304 VanDerWaalsContact O-N 3.13Å; W1304-Y1306 VanDerWaalsContact C-N 3.34Å; W1304-Q1307 PolarHBondContact O-N 2.68Å; W1304-V1308 HydrophobicContact CE3-CB 4.43Å; W1304-V1308 HydrophobicContact CE3-CG2 4.03Å; W1304-V1308 HydrophobicContact CZ3-CG2 4.34Å; W1304-V1308 WeakPolarHBondContact O-CB 3.4Å; W1304-V1308 VanDerWaalsContact O-CG2 3.26Å; W1304-V1308 WeakPolarHBondContact O-CG2 3.33Å; W1304-V1308 PolarHBondContact O-N 3.01Å; W1304-V1308 VanDerWaalsContact O-N 3.08Å; W1304-I1583 HydrophobicContact CD2-CD1 4.47Å; W1304-I1583 HydrophobicContact CH2-CD1 4.44Å; W1304-I1583 HydrophobicContact CZ2-CB 4.04Å; W1304-I1583 HydrophobicContact CZ2-CD1 4.1Å; W1304-I1583 HydrophobicContact CZ2-CG1 4.38Å; W1304-I1583 HydrophobicContact CZ2-CG2 4.16Å; W1304-M1601 HydrophobicContact CH2-CB 3.85Å; W1304-M1601 HydrophobicContact CZ2-CB 4.35Å; W1304-H1603 AromaticContact CD2-CD2 3.54Å; W1304-H1603 AromaticContact CD2-NE2 3.82Å; W1304-H1603 AromaticContact CE2-CD2 3.94Å; W1304-H1603 AromaticContact CE3-CD2 3.32Å; W1304-H1603 VanDerWaalsContact CE3-CD2 3.41Å; W1304-H1603 AromaticContact CE3-NE2 3.7Å; W1304-H1603 AromaticContact CG-CD2 3.77Å; W1304-H1603 AromaticContact CG-NE2 3.94Å; W1304-H1603 HydrophobicContact CH2-CB 4.38Å; W1304-H1603 HydrophobicContact CZ3-CB 4.23Å; W1304-H1603 AromaticContact CZ3-CD2 3.82Å
1305F66.7Low56Low18.2 Ų18.238.4 Ų38.48%0.0819%0.193CC..Hα-helixtrans-71.3-40.1-177.7-172.3-106.8000110.2G1302 D1303 Q1307 V1308 T1309 W1399 P1586 L1587 M1601 L1693G1302-F1305 WeakPolarHBondContact O-CA 3.16Å; G1302-F1305 WeakPolarHBondContact O-CB 3.37Å; G1302-F1305 PolarHBondContact O-N 3.2Å; D1303-F1305 VanDerWaalsContact C-N 3.29Å; D1303-F1305 PolarHBondContact O-N 3.22Å; D1303-F1305 VanDerWaalsContact O-N 3.15Å; F1305-Q1307 PolarHBondContact O-N 2.9Å; F1305-V1308 PolarHBondContact O-N 3.02Å; F1305-T1309 HydrophobicContact CD1-CG2 4.18Å; F1305-T1309 HydrophobicContact CD2-CG2 4.35Å; F1305-T1309 HydrophobicContact CE1-CG2 3.74Å; F1305-T1309 HydrophobicContact CE2-CG2 3.94Å; F1305-T1309 HydrophobicContact CG-CG2 4.42Å; F1305-T1309 HydrophobicContact CZ-CG2 3.66Å; F1305-T1309 VanDerWaalsContact O-CB 3.27Å; F1305-T1309 WeakPolarHBondContact O-CB 3.43Å; F1305-T1309 VanDerWaalsContact O-CG2 3.29Å; F1305-T1309 WeakPolarHBondContact O-CG2 3.2Å; F1305-T1309 PolarHBondContact O-N 3.27Å; F1305-T1309 PolarHBondContact O-OG1 3.23Å; F1305-T1309 VanDerWaalsContact O-OG1 3.05Å; F1305-W1399 HydrophobicContact CB-CH2 4.23Å; F1305-W1399 AromaticContact CD1-CH2 3.43Å; F1305-W1399 HydrophobicContact CD1-CH2 3.43Å; F1305-W1399 VanDerWaalsContact CD1-CH2 3.47Å; F1305-W1399 AromaticContact CD1-CZ2 3.93Å; F1305-W1399 HydrophobicContact CD1-CZ2 4.01Å; F1305-W1399 AromaticContact CD1-CZ3 3.72Å; F1305-W1399 HydrophobicContact CD1-CZ3 3.91Å; F1305-W1399 AromaticContact CE1-CH2 3.86Å; F1305-W1399 HydrophobicContact CE1-CH2 3.96Å; F1305-W1399 AromaticContact CE1-CZ3 3.96Å; F1305-W1399 HydrophobicContact CE1-CZ3 4.21Å; F1305-W1399 HydrophobicContact CG-CH2 4.13Å; F1305-P1586 HydrophobicContact CB-CG 4.3Å; F1305-P1586 HydrophobicContact CD1-CG 4.49Å; F1305-L1587 HydrophobicContact CD1-CD1 4.12Å; F1305-L1587 HydrophobicContact CE1-CD1 3.96Å; F1305-M1601 HydrophobicContact CE2-CG 4.17Å; F1305-L1693 HydrophobicContact CE1-CD1 3.49Å; F1305-L1693 VanDerWaalsContact CE1-CD1 3.46Å; F1305-L1693 HydrophobicContact CE1-CD2 4.3Å; F1305-L1693 HydrophobicContact CE2-CD1 4.23Å; F1305-L1693 HydrophobicContact CZ-CD1 3.4Å; F1305-L1693 VanDerWaalsContact CZ-CD1 3.44Å; F1305-L1693 HydrophobicContact CZ-CD2 4.1Å; F1305-L1693 HydrophobicContact CZ-CG 4.28Å
1306Y68.7Low57.5Low0.6 Ų0.637.9 Ų37.90%0.00219%0.19CC..Hα-helixtrans-59.6-50.7173179.1-91.6000110.9G1302 D1303 W1304 V1308 T1309 V1310 T1312 I1315 P1316 I1319 T1396 W1399G1302-Y1306 PolarHBondContact O-N 3.04Å; D1303-Y1306 WeakPolarHBondContact O-CB 3.41Å; D1303-Y1306 PolarHBondContact O-N 3Å; W1304-Y1306 VanDerWaalsContact C-N 3.34Å; Y1306-V1308 VanDerWaalsContact C-N 3.31Å; Y1306-V1308 PolarHBondContact O-N 3.09Å; Y1306-T1309 WeakPolarHBondContact CA-OG1 3.41Å; Y1306-T1309 PolarHBondContact O-N 3.17Å; Y1306-T1309 VanDerWaalsContact O-N 3.12Å; Y1306-T1309 PolarHBondContact O-OG1 3.1Å; Y1306-V1310 HydrophobicContact CD1-CG2 4.45Å; Y1306-V1310 HydrophobicContact CD2-CG2 4.02Å; Y1306-V1310 HydrophobicContact CE1-CB 4.27Å; Y1306-V1310 HydrophobicContact CE1-CG2 4.12Å; Y1306-V1310 HydrophobicContact CE2-CB 4.48Å; Y1306-V1310 HydrophobicContact CE2-CG2 3.6Å; Y1306-V1310 HydrophobicContact CG-CG2 4.44Å; Y1306-V1310 WeakPolarHBondContact O-CG2 3.48Å; Y1306-V1310 PolarHBondContact O-N 3Å; Y1306-T1312 WeakPolarHBondContact CE1-OG1 3.43Å; Y1306-I1315 HydrophobicContact CD1-CG1 4.47Å; Y1306-I1315 HydrophobicContact CD1-CG2 4.38Å; Y1306-P1316 VanDerWaalsContact CE1-CD 3.46Å; Y1306-P1316 HydrophobicContact CE1-CG 4.08Å; Y1306-P1316 WeakPolarHBondContact OH-CG 3.4Å; Y1306-I1319 HydrophobicContact CD2-CD1 3.51Å; Y1306-I1319 VanDerWaalsContact CD2-CD1 3.43Å; Y1306-I1319 HydrophobicContact CE2-CD1 3.42Å; Y1306-I1319 HydrophobicContact CG-CD1 4.19Å; Y1306-T1396 HydrophobicContact CE2-CG2 3.96Å; Y1306-T1396 WeakPolarHBondContact OH-CG2 3.42Å; Y1306-T1396 PolarHBondContact OH-OG1 3.14Å; Y1306-W1399 VanDerWaalsContact CA-CH2 3.48Å; Y1306-W1399 AromaticContact CD2-CD2 3.93Å; Y1306-W1399 HydrophobicContact CD2-CD2 3.99Å; Y1306-W1399 AromaticContact CD2-CE3 3.79Å; Y1306-W1399 HydrophobicContact CD2-CE3 3.84Å; Y1306-W1399 HydrophobicContact CD2-CG 4.37Å; Y1306-W1399 HydrophobicContact CD2-CH2 4.39Å; Y1306-W1399 HydrophobicContact CD2-CZ2 4.49Å; Y1306-W1399 AromaticContact CD2-CZ3 3.94Å; Y1306-W1399 HydrophobicContact CD2-CZ3 4.14Å; Y1306-W1399 HydrophobicContact CG-CE3 4.46Å; Y1306-W1399 HydrophobicContact CG-CZ3 4.47Å
1307Q62.9Low59.3Low40.2 Ų40.232.4 Ų32.419%0.18817%0.17CC..Hα-helixtrans-56.7-43.4178.8-68.7176.7-19.400112.6I1286 N1289 D1303 W1304 F1305 N1311 T1312 Y1313 I1315I1286-Q1307 VanDerWaalsContact CD1-OE1 3.3Å; N1289-Q1307 PolarHBondContact ND2-NE2 3.37Å; N1289-Q1307 PolarHBondContact ND2-OE1 3.49Å; D1303-Q1307 VanDerWaalsContact O-CG 3.32Å; D1303-Q1307 WeakPolarHBondContact O-CG 3.38Å; D1303-Q1307 PolarHBondContact O-N 2.95Å; D1303-Q1307 VanDerWaalsContact O-N 3.11Å; W1304-Q1307 PolarHBondContact O-N 2.68Å; F1305-Q1307 PolarHBondContact O-N 2.9Å; Q1307-N1311 CarbonylContact O-C 3.45Å; Q1307-N1311 VanDerWaalsContact O-CA 3.24Å; Q1307-N1311 WeakPolarHBondContact O-CA 3.33Å; Q1307-N1311 PolarHBondContact O-N 3.36Å; Q1307-T1312 VanDerWaalsContact CA-O 3.27Å; Q1307-T1312 WeakPolarHBondContact CA-O 3.32Å; Q1307-T1312 VanDerWaalsContact CB-O 3.27Å; Q1307-T1312 WeakPolarHBondContact CB-O 3.34Å; Q1307-T1312 VanDerWaalsContact CG-O 3.3Å; Q1307-T1312 WeakPolarHBondContact CG-O 3.25Å; Q1307-T1312 PolarHBondContact O-N 3.23Å; Q1307-T1312 VanDerWaalsContact O-N 3.08Å; Q1307-Y1313 PolarHBondContact NE2-O 2.99Å; Q1307-I1315 HydrophobicContact CG-CD1 4.19Å; Q1307-I1315 HydrophobicContact CG-CG1 3.98Å; Q1307-I1315 VanDerWaalsContact NE2-CD1 3.34Å
1308V62.5Low61.2Low59.8 Ų59.831.4 Ų31.436%0.36217%0.166SC..Hα-helixtrans-69.6-34.8178170.60000112.1W1304 F1305 Y1306 R1460W1304-V1308 HydrophobicContact CE3-CB 4.43Å; W1304-V1308 HydrophobicContact CE3-CG2 4.03Å; W1304-V1308 HydrophobicContact CZ3-CG2 4.34Å; W1304-V1308 WeakPolarHBondContact O-CB 3.4Å; W1304-V1308 VanDerWaalsContact O-CG2 3.26Å; W1304-V1308 WeakPolarHBondContact O-CG2 3.33Å; W1304-V1308 PolarHBondContact O-N 3.01Å; W1304-V1308 VanDerWaalsContact O-N 3.08Å; F1305-V1308 PolarHBondContact O-N 3.02Å; Y1306-V1308 VanDerWaalsContact C-N 3.31Å; Y1306-V1308 PolarHBondContact O-N 3.09Å; V1308-R1460 PolarHBondContact O-NH2 2.91Å
1309T64.2Low62.9Low22 Ų2230.1 Ų30.114%0.13516%0.16CC..Hα-helixtrans-76.3-38.4-179.853.30000113.4F1305 Y1306 F1391 W1399 V1464F1305-T1309 HydrophobicContact CD1-CG2 4.18Å; F1305-T1309 HydrophobicContact CD2-CG2 4.35Å; F1305-T1309 HydrophobicContact CE1-CG2 3.74Å; F1305-T1309 HydrophobicContact CE2-CG2 3.94Å; F1305-T1309 HydrophobicContact CG-CG2 4.42Å; F1305-T1309 HydrophobicContact CZ-CG2 3.66Å; F1305-T1309 VanDerWaalsContact O-CB 3.27Å; F1305-T1309 WeakPolarHBondContact O-CB 3.43Å; F1305-T1309 VanDerWaalsContact O-CG2 3.29Å; F1305-T1309 WeakPolarHBondContact O-CG2 3.2Å; F1305-T1309 PolarHBondContact O-N 3.27Å; F1305-T1309 PolarHBondContact O-OG1 3.23Å; F1305-T1309 VanDerWaalsContact O-OG1 3.05Å; Y1306-T1309 WeakPolarHBondContact CA-OG1 3.41Å; Y1306-T1309 PolarHBondContact O-N 3.17Å; Y1306-T1309 VanDerWaalsContact O-N 3.12Å; Y1306-T1309 PolarHBondContact O-OG1 3.1Å; T1309-F1391 WeakPolarHBondContact O-CE1 3.38Å; T1309-W1399 HydrophobicContact CG2-CZ3 4.29Å; T1309-W1399 WeakPolarHBondContact OG1-CZ3 3.24Å; T1309-V1464 HydrophobicContact CG2-CG1 4.13Å; T1309-V1464 HydrophobicContact CG2-CG2 4.12Å
1310V63.9Low64.6Low14.4 Ų14.427.4 Ų27.49%0.08715%0.149CC..Hα-helixtrans-92.7-13.2-178.2-169.80000112Y1306 T1312 F1391 E1392 C1395Y1306-V1310 HydrophobicContact CD1-CG2 4.45Å; Y1306-V1310 HydrophobicContact CD2-CG2 4.02Å; Y1306-V1310 HydrophobicContact CE1-CB 4.27Å; Y1306-V1310 HydrophobicContact CE1-CG2 4.12Å; Y1306-V1310 HydrophobicContact CE2-CB 4.48Å; Y1306-V1310 HydrophobicContact CE2-CG2 3.6Å; Y1306-V1310 HydrophobicContact CG-CG2 4.44Å; Y1306-V1310 WeakPolarHBondContact O-CG2 3.48Å; Y1306-V1310 PolarHBondContact O-N 3Å; V1310-T1312 VanDerWaalsContact C-N 3.32Å; V1310-T1312 HydrophobicContact CB-CG2 4.29Å; V1310-T1312 WeakPolarHBondContact CB-OG1 3.37Å; V1310-T1312 HydrophobicContact CG1-CG2 3.66Å; V1310-T1312 VanDerWaalsContact CG1-OG1 3.25Å; V1310-T1312 WeakPolarHBondContact CG1-OG1 3.33Å; V1310-T1312 PolarHBondContact O-N 2.97Å; V1310-F1391 HydrophobicContact CG1-CE1 4.4Å; V1310-F1391 HydrophobicContact CG2-CE1 4.39Å; V1310-E1392 HydrophobicContact CG1-CB 3.81Å; V1310-E1392 HydrophobicContact CG1-CG 3.7Å; V1310-C1395 HydrophobicContact CG2-CB 4.11Å; V1310-C1395 VanDerWaalsContact CG2-SG 3.57Å
1311N60Low66.5Low70.2 Ų70.225.6 Ų25.638%0.37513%0.133SC..THydrogen-bonded Turntrans5839.3-172.6-156.436.2000112.1S1237 Q1307 I1644 N1645S1237-N1311 PolarHBondContact OG-O 3.13Å; Q1307-N1311 CarbonylContact O-C 3.45Å; Q1307-N1311 VanDerWaalsContact O-CA 3.24Å; Q1307-N1311 WeakPolarHBondContact O-CA 3.33Å; Q1307-N1311 PolarHBondContact O-N 3.36Å; N1311-I1644 HydrophobicContact CB-CD1 4.22Å; N1311-I1644 VanDerWaalsContact ND2-CB 3.3Å; N1311-I1644 WeakPolarHBondContact ND2-CB 3.48Å; N1311-I1644 WeakPolarHBondContact ND2-CG2 3.11Å; N1311-I1644 WeakPolarHBondContact OD1-CB 3.4Å; N1311-I1644 WeakPolarHBondContact OD1-CD1 3.19Å; N1311-N1645 VanDerWaalsContact ND2-CB 3.26Å; N1311-N1645 WeakPolarHBondContact ND2-CB 3.3Å; N1311-N1645 PolarHBondContact ND2-ND2 3.31Å; N1311-N1645 PolarHBondContact ND2-OD1 3.42Å; N1311-N1645 PolarHBondContact OD1-ND2 2.87Å
1312T55Low68.2Low19.6 Ų19.624.6 Ų24.612%0.1213%0.129CC..  trans-118.6146.3179.156.20000110.6S1236 S1237 Y1306 Q1307 V1310 S1314 E1392S1236-T1312 WeakPolarHBondContact OG-CG2 3.36Å; S1237-T1312 WeakPolarHBondContact OG-CG2 3.45Å; Y1306-T1312 WeakPolarHBondContact CE1-OG1 3.43Å; Q1307-T1312 VanDerWaalsContact CA-O 3.27Å; Q1307-T1312 WeakPolarHBondContact CA-O 3.32Å; Q1307-T1312 VanDerWaalsContact CB-O 3.27Å; Q1307-T1312 WeakPolarHBondContact CB-O 3.34Å; Q1307-T1312 VanDerWaalsContact CG-O 3.3Å; Q1307-T1312 WeakPolarHBondContact CG-O 3.25Å; Q1307-T1312 PolarHBondContact O-N 3.23Å; Q1307-T1312 VanDerWaalsContact O-N 3.08Å; V1310-T1312 VanDerWaalsContact C-N 3.32Å; V1310-T1312 HydrophobicContact CB-CG2 4.29Å; V1310-T1312 WeakPolarHBondContact CB-OG1 3.37Å; V1310-T1312 HydrophobicContact CG1-CG2 3.66Å; V1310-T1312 VanDerWaalsContact CG1-OG1 3.25Å; V1310-T1312 WeakPolarHBondContact CG1-OG1 3.33Å; V1310-T1312 PolarHBondContact O-N 2.97Å; T1312-S1314 VanDerWaalsContact C-N 3.32Å; T1312-S1314 PolarHBondContact OG1-O 3.11Å; T1312-E1392 WeakPolarHBondContact CG2-OE1 3.28Å
1313Y53.1Low69.5Low115.8 Ų115.824.8 Ų24.845%0.45413%0.129SC..SBendtrans-83.4-28.1179.1-65.2-70.2000112.2D1283 M1284 Q1307 F1642D1283-Y1313 WeakPolarHBondContact CB-O 3.23Å; D1283-Y1313 WeakPolarHBondContact O-CB 3.12Å; D1283-Y1313 WeakPolarHBondContact O-CD1 3.26Å; D1283-Y1313 VanDerWaalsContact O-CG 3.27Å; M1284-Y1313 VanDerWaalsContact CA-CD1 3.46Å; M1284-Y1313 HydrophobicContact CB-CD1 4.4Å; M1284-Y1313 HydrophobicContact CB-CD2 4.39Å; M1284-Y1313 HydrophobicContact CB-CE1 4.47Å; M1284-Y1313 HydrophobicContact CB-CG 4.25Å; M1284-Y1313 HydrophobicContact CE-CD2 3.65Å; M1284-Y1313 HydrophobicContact CE-CE2 3.16Å; M1284-Y1313 HydrophobicContact CG-CD1 4.45Å; M1284-Y1313 HydrophobicContact CG-CD2 3.76Å; M1284-Y1313 HydrophobicContact CG-CE2 4.21Å; M1284-Y1313 HydrophobicContact CG-CG 3.81Å; M1284-Y1313 HydrophobicContact SD-CD2 3Å; M1284-Y1313 WeakPolarHBondContact SD-CD2 3.36Å; M1284-Y1313 HydrophobicContact SD-CE2 3.28Å; M1284-Y1313 WeakPolarHBondContact SD-CE2 3.45Å; M1284-Y1313 HydrophobicContact SD-CG 3.72Å; Q1307-Y1313 PolarHBondContact NE2-O 2.99Å; Y1313-F1642 HydrophobicContact CE1-CD1 4.19Å; Y1313-F1642 PolarHBondContact OH-O 3.12Å; Y1313-F1642 VanDerWaalsContact OH-O 3.09Å
1314S57.7Low70.7Confident43.2 Ų43.224.5 Ų24.530%0.30213%0.128SC..PPolyproline II helixtrans-97.7132.2-177.154.50000111.8F1235 S1236 S1237 D1283 T1312F1235-S1314 PolarHBondContact O-OG 2.95Å; S1236-S1314 WeakPolarHBondContact OG-CB 3.19Å; S1236-S1314 PolarHBondContact OG-OG 2.84Å; S1237-S1314 WeakPolarHBondContact O-CB 3.23Å; D1283-S1314 VanDerWaalsContact OD2-CA 3.3Å; D1283-S1314 WeakPolarHBondContact OD2-CA 3.47Å; T1312-S1314 VanDerWaalsContact C-N 3.32Å; T1312-S1314 PolarHBondContact OG1-O 3.11Å
1315I68.1Low71.9Confident25.8 Ų25.823.4 Ų23.413%0.13212%0.124CC..PPolyproline II helixtrans-90.5131.3172.4-56.5142.2000108.1D1303 Y1306 Q1307 I1317 I1319 S1320D1303-I1315 HydrophobicContact CB-CD1 3.49Å; D1303-I1315 VanDerWaalsContact CB-CD1 3.43Å; D1303-I1315 HydrophobicContact CB-CG1 4.16Å; D1303-I1315 VanDerWaalsContact OD2-CD1 3.28Å; D1303-I1315 WeakPolarHBondContact OD2-CD1 3.49Å; Y1306-I1315 HydrophobicContact CD1-CG1 4.47Å; Y1306-I1315 HydrophobicContact CD1-CG2 4.38Å; Q1307-I1315 HydrophobicContact CG-CD1 4.19Å; Q1307-I1315 HydrophobicContact CG-CG1 3.98Å; Q1307-I1315 VanDerWaalsContact NE2-CD1 3.34Å; I1315-I1317 PolarHBondContact O-N 3.2Å; I1315-I1319 HydrophobicContact CG2-CB 4.11Å; I1315-I1319 HydrophobicContact CG2-CG2 3.98Å; I1315-S1320 VanDerWaalsContact CG2-OG 3.24Å; I1315-S1320 WeakPolarHBondContact CG2-OG 3.15Å
1316P74.4Confident72.8Confident12.4 Ų12.423.4 Ų23.48%0.08112%0.124CC..PPolyproline II helixtrans-58.5135.5173.6-17.324.1000111.4T1234 Y1306 S1318 I1319 S1320 T1396T1234-P1316 HydrophobicContact CG2-CG 4.1Å; T1234-P1316 WeakPolarHBondContact O-CA 2.91Å; T1234-P1316 WeakPolarHBondContact O-CB 3.43Å; Y1306-P1316 VanDerWaalsContact CE1-CD 3.46Å; Y1306-P1316 HydrophobicContact CE1-CG 4.08Å; Y1306-P1316 WeakPolarHBondContact OH-CG 3.4Å; P1316-S1318 PolarHBondContact O-N 3.11Å; P1316-S1318 VanDerWaalsContact O-N 3.13Å; P1316-I1319 HydrophobicContact CB-CB 4.46Å; P1316-I1319 HydrophobicContact CB-CD1 4.37Å; P1316-I1319 HydrophobicContact CB-CG1 4.3Å; P1316-I1319 HydrophobicContact CG-CB 3.99Å; P1316-I1319 HydrophobicContact CG-CD1 4Å; P1316-I1319 HydrophobicContact CG-CG1 4.11Å; P1316-I1319 WeakPolarHBondContact O-CB 3.46Å; P1316-I1319 PolarHBondContact O-N 2.93Å; P1316-S1320 PolarHBondContact O-N 3.22Å; P1316-S1320 VanDerWaalsContact O-N 3.14Å; P1316-T1396 HydrophobicContact CB-CG2 4.02Å; P1316-T1396 HydrophobicContact CG-CG2 3.73Å
1317I79Confident73.5Confident17.8 Ų17.824.3 Ų24.39%0.09113%0.132CC..Hα-helixtrans-56.7-34.7-176.3-61.9162.3000111.6P1141 T1144 V1148 L1185 T1234 F1235 I1315 I1319 S1320 F1321P1141-I1317 HydrophobicContact CB-CD1 4.17Å; P1141-I1317 WeakPolarHBondContact O-CD1 3.49Å; T1144-I1317 HydrophobicContact CG2-CD1 3.98Å; T1144-I1317 HydrophobicContact CG2-CG2 4.13Å; T1144-I1317 WeakPolarHBondContact OG1-CD1 3.14Å; V1148-I1317 HydrophobicContact CG2-CG2 4.02Å; L1185-I1317 HydrophobicContact CB-CG2 4.47Å; L1185-I1317 HydrophobicContact CD1-CG2 4.41Å; L1185-I1317 HydrophobicContact CD2-CG2 3.98Å; L1185-I1317 HydrophobicContact CG-CG2 4.49Å; T1234-I1317 PolarHBondContact O-N 3.37Å; F1235-I1317 HydrophobicContact CB-CB 4.31Å; F1235-I1317 HydrophobicContact CB-CD1 4.03Å; F1235-I1317 HydrophobicContact CB-CG1 4.24Å; F1235-I1317 HydrophobicContact CE2-CD1 4.3Å; F1235-I1317 WeakPolarHBondContact O-CD1 3.4Å; F1235-I1317 VanDerWaalsContact O-CG1 3.25Å; F1235-I1317 WeakPolarHBondContact O-CG1 3.45Å; I1315-I1317 PolarHBondContact O-N 3.2Å; I1317-I1319 PolarHBondContact O-N 3.49Å; I1317-S1320 PolarHBondContact O-N 3.09Å; I1317-F1321 VanDerWaalsContact O-CB 3.29Å; I1317-F1321 WeakPolarHBondContact O-CB 3.43Å; I1317-F1321 PolarHBondContact O-N 3.11Å
1318S83.8Confident74.6Confident2.6 Ų2.622.6 Ų22.62%0.01812%0.124CC..Hα-helixtrans-62.5-43.5176.2550000112.6L1185 W1188 P1316 F1321 L1322 N1400L1185-S1318 WeakPolarHBondContact O-CA 3.43Å; L1185-S1318 WeakPolarHBondContact O-CB 3.09Å; W1188-S1318 WeakPolarHBondContact CZ3-OG 3.39Å; P1316-S1318 PolarHBondContact O-N 3.11Å; P1316-S1318 VanDerWaalsContact O-N 3.13Å; S1318-F1321 PolarHBondContact O-N 3.26Å; S1318-L1322 VanDerWaalsContact O-CB 3.32Å; S1318-L1322 WeakPolarHBondContact O-CB 3.4Å; S1318-L1322 VanDerWaalsContact O-CG 3.24Å; S1318-L1322 WeakPolarHBondContact O-CG 3.34Å; S1318-L1322 PolarHBondContact O-N 3.08Å; S1318-N1400 VanDerWaalsContact OG-CG 3.3Å; S1318-N1400 PolarHBondContact OG-ND2 3.15Å; S1318-N1400 PolarHBondContact OG-OD1 3.39Å
1319I80.8Confident75.6Confident0.2 Ų0.221.1 Ų21.10%0.00111%0.114CC..Hα-helixtrans-64-51177.4-70-179.5000109.7Y1306 I1315 P1316 I1317 F1321 L1322 Q1323 T1396 W1399 N1400 L1403Y1306-I1319 HydrophobicContact CD2-CD1 3.51Å; Y1306-I1319 VanDerWaalsContact CD2-CD1 3.43Å; Y1306-I1319 HydrophobicContact CE2-CD1 3.42Å; Y1306-I1319 HydrophobicContact CG-CD1 4.19Å; I1315-I1319 HydrophobicContact CG2-CB 4.11Å; I1315-I1319 HydrophobicContact CG2-CG2 3.98Å; P1316-I1319 HydrophobicContact CB-CB 4.46Å; P1316-I1319 HydrophobicContact CB-CD1 4.37Å; P1316-I1319 HydrophobicContact CB-CG1 4.3Å; P1316-I1319 HydrophobicContact CG-CB 3.99Å; P1316-I1319 HydrophobicContact CG-CD1 4Å; P1316-I1319 HydrophobicContact CG-CG1 4.11Å; P1316-I1319 WeakPolarHBondContact O-CB 3.46Å; P1316-I1319 PolarHBondContact O-N 2.93Å; I1317-I1319 PolarHBondContact O-N 3.49Å; I1319-F1321 VanDerWaalsContact C-N 3.29Å; I1319-F1321 PolarHBondContact O-N 3.29Å; I1319-L1322 PolarHBondContact O-N 3.3Å; I1319-L1322 VanDerWaalsContact O-N 3.16Å; I1319-Q1323 VanDerWaalsContact C-OE1 3.26Å; I1319-Q1323 HydrophobicContact CG2-CG 4.28Å; I1319-Q1323 VanDerWaalsContact CG2-NE2 3.27Å; I1319-Q1323 VanDerWaalsContact CG2-OE1 3.27Å; I1319-Q1323 WeakPolarHBondContact O-CB 3.27Å; I1319-Q1323 VanDerWaalsContact O-CG 3.27Å; I1319-Q1323 WeakPolarHBondContact O-CG 3.21Å; I1319-Q1323 PolarHBondContact O-N 2.96Å; I1319-Q1323 PolarHBondContact O-OE1 3.32Å; I1319-Q1323 VanDerWaalsContact O-OE1 3.1Å; I1319-T1396 HydrophobicContact CD1-CG2 3.83Å; I1319-T1396 VanDerWaalsContact CD1-CG2 3.45Å; I1319-T1396 HydrophobicContact CG1-CG2 4.06Å; I1319-W1399 HydrophobicContact CD1-CB 3.98Å; I1319-W1399 VanDerWaalsContact CD1-CD1 3.5Å; I1319-W1399 HydrophobicContact CD1-CD2 4.38Å; I1319-W1399 HydrophobicContact CD1-CG 3.81Å; I1319-W1399 HydrophobicContact CG1-CG 4.39Å; I1319-N1400 WeakPolarHBondContact CG1-OD1 3.38Å; I1319-N1400 PolarHBondContact N-OD1 3.21Å; I1319-L1403 HydrophobicContact CG2-CD1 4.38Å
1320S79.2Confident76.3Confident14.8 Ų14.826.1 Ų26.110%0.10314%0.136CC..Hα-helixtrans-57.6-43.6179.4-137.50000111.5Y1297 D1303 I1315 P1316 I1317 Q1323 I1324Y1297-S1320 PolarHBondContact OH-OG 3.26Å; D1303-S1320 PolarHBondContact OD1-OG 2.81Å; I1315-S1320 VanDerWaalsContact CG2-OG 3.24Å; I1315-S1320 WeakPolarHBondContact CG2-OG 3.15Å; P1316-S1320 PolarHBondContact O-N 3.22Å; P1316-S1320 VanDerWaalsContact O-N 3.14Å; I1317-S1320 PolarHBondContact O-N 3.09Å; S1320-Q1323 VanDerWaalsContact CA-OE1 3.25Å; S1320-Q1323 PolarHBondContact O-N 3.05Å; S1320-I1324 WeakPolarHBondContact O-CD1 3.37Å; S1320-I1324 VanDerWaalsContact O-CG1 3.28Å; S1320-I1324 WeakPolarHBondContact O-CG1 3.38Å; S1320-I1324 PolarHBondContact O-N 3.01Å
1321F87Confident77.3Confident1.4 Ų1.427.3 Ų27.31%0.00614%0.14CC..Hα-helixtrans-67.3-42.3178.4-174.5-107.8000113.1V1148 L1151 F1182 L1185 I1186 I1317 S1318 I1319 Q1323 I1324 L1325 L1340V1148-F1321 HydrophobicContact CG1-CB 4.17Å; V1148-F1321 HydrophobicContact CG1-CD2 4.36Å; V1148-F1321 HydrophobicContact CG2-CD2 4.45Å; L1151-F1321 HydrophobicContact CD2-CD2 4.37Å; L1151-F1321 HydrophobicContact CD2-CE2 3.97Å; F1182-F1321 HydrophobicContact CB-CE1 4.29Å; F1182-F1321 HydrophobicContact CB-CE2 4.28Å; F1182-F1321 HydrophobicContact CB-CZ 3.67Å; F1182-F1321 HydrophobicContact CD1-CD2 4.39Å; F1182-F1321 AromaticContact CD1-CE2 3.63Å; F1182-F1321 HydrophobicContact CD1-CE2 3.63Å; F1182-F1321 VanDerWaalsContact CD1-CE2 3.41Å; F1182-F1321 AromaticContact CD1-CZ 3.88Å; F1182-F1321 HydrophobicContact CD1-CZ 3.92Å; F1182-F1321 AromaticContact CE1-CE2 3.95Å; F1182-F1321 HydrophobicContact CE1-CE2 4.23Å; F1182-F1321 HydrophobicContact CG-CE2 4.08Å; F1182-F1321 AromaticContact CG-CZ 3.92Å; F1182-F1321 HydrophobicContact CG-CZ 3.92Å; L1185-F1321 HydrophobicContact CB-CD1 4.3Å; L1185-F1321 HydrophobicContact CB-CG 4.4Å; L1185-F1321 HydrophobicContact CD1-CB 4.4Å; L1185-F1321 HydrophobicContact CD1-CD1 4.46Å; L1185-F1321 HydrophobicContact CD1-CD2 4Å; L1185-F1321 HydrophobicContact CD1-CE2 4.36Å; L1185-F1321 HydrophobicContact CD1-CG 4.12Å; I1186-F1321 HydrophobicContact CD1-CD1 4.13Å; I1186-F1321 HydrophobicContact CD1-CE1 3.91Å; I1186-F1321 HydrophobicContact CG1-CD1 3.77Å; I1186-F1321 HydrophobicContact CG1-CE1 3.99Å; I1317-F1321 VanDerWaalsContact O-CB 3.29Å; I1317-F1321 WeakPolarHBondContact O-CB 3.43Å; I1317-F1321 PolarHBondContact O-N 3.11Å; S1318-F1321 PolarHBondContact O-N 3.26Å; I1319-F1321 VanDerWaalsContact C-N 3.29Å; I1319-F1321 PolarHBondContact O-N 3.29Å; F1321-Q1323 VanDerWaalsContact C-N 3.34Å; F1321-Q1323 PolarHBondContact O-N 3.32Å; F1321-I1324 WeakPolarHBondContact O-CB 3.27Å; F1321-I1324 PolarHBondContact O-N 3.31Å; F1321-L1325 HydrophobicContact CE1-CD1 4.46Å; F1321-L1325 WeakPolarHBondContact O-CB 3.35Å; F1321-L1325 PolarHBondContact O-N 2.95Å; F1321-L1340 HydrophobicContact CE2-CD1 4.47Å; F1321-L1340 HydrophobicContact CZ-CD1 3.96Å; F1321-L1340 HydrophobicContact CZ-CD2 4.49Å
1322L87.3Confident78.4Confident0 Ų028.3 Ų28.30%015%0.151CC..Hα-helixtrans-65.5-38.2176.7-72.8172.4000112.1I1186 S1318 I1319 L1325 L1326 M1372 M1375 N1400 L1403 I1404 I1407I1186-L1322 HydrophobicContact CD1-CD2 4.05Å; I1186-L1322 HydrophobicContact CG1-CD2 4.23Å; S1318-L1322 VanDerWaalsContact O-CB 3.32Å; S1318-L1322 WeakPolarHBondContact O-CB 3.4Å; S1318-L1322 VanDerWaalsContact O-CG 3.24Å; S1318-L1322 WeakPolarHBondContact O-CG 3.34Å; S1318-L1322 PolarHBondContact O-N 3.08Å; I1319-L1322 PolarHBondContact O-N 3.3Å; I1319-L1322 VanDerWaalsContact O-N 3.16Å; L1322-L1325 PolarHBondContact O-N 3.19Å; L1322-L1326 WeakPolarHBondContact O-CB 3.38Å; L1322-L1326 PolarHBondContact O-N 3.18Å; L1322-M1372 HydrophobicContact CD2-CE 3.69Å; L1322-M1372 HydrophobicContact CD2-CG 4.46Å; L1322-M1375 HydrophobicContact CD1-CE 4.06Å; L1322-N1400 HydrophobicContact CD1-CB 4.06Å; L1322-N1400 WeakPolarHBondContact CD1-OD1 3.37Å; L1322-L1403 HydrophobicContact CB-CB 4.14Å; L1322-L1403 HydrophobicContact CB-CD1 3.79Å; L1322-L1403 HydrophobicContact CD1-CB 4.3Å; L1322-L1403 HydrophobicContact CD1-CD1 4.46Å; L1322-I1404 HydrophobicContact CD1-CD1 4.36Å; L1322-I1404 HydrophobicContact CD1-CG1 3.93Å; L1322-I1404 HydrophobicContact CD2-CD1 4.44Å; L1322-I1404 HydrophobicContact CD2-CG1 3.86Å; L1322-I1407 HydrophobicContact CB-CD1 4.44Å; L1322-I1407 HydrophobicContact CD2-CD1 3.82Å
1323Q83.8Confident79.8Confident4.8 Ų4.828.8 Ų28.82%0.02216%0.157CC..Hα-helixtrans-63.9-44.1174-73.7170.4-20.300111.5F1301 D1303 I1319 S1320 F1321 L1325 L1326 A1327 L1403F1301-Q1323 HydrophobicContact CB-CB 4.15Å; F1301-Q1323 HydrophobicContact CB-CG 4.36Å; F1301-Q1323 HydrophobicContact CD1-CB 4.08Å; F1301-Q1323 VanDerWaalsContact CD1-O 3.23Å; F1301-Q1323 WeakPolarHBondContact CD1-O 3.26Å; F1301-Q1323 VanDerWaalsContact CE1-C 3.43Å; F1301-Q1323 VanDerWaalsContact CE1-O 3.31Å; F1301-Q1323 WeakPolarHBondContact CE1-O 3.41Å; F1301-Q1323 HydrophobicContact CG-CB 4.21Å; F1301-Q1323 WeakPolarHBondContact O-CB 3.22Å; F1301-Q1323 VanDerWaalsContact O-CG 3.23Å; F1301-Q1323 WeakPolarHBondContact O-CG 3.35Å; F1301-Q1323 PolarHBondContact O-NE2 2.88Å; F1301-Q1323 PolarHBondContact O-OE1 3.22Å; D1303-Q1323 PolarHBondContact OD1-NE2 3Å; D1303-Q1323 PolarHBondContact OD1-OE1 3.03Å; D1303-Q1323 VanDerWaalsContact OD1-OE1 3.05Å; I1319-Q1323 VanDerWaalsContact C-OE1 3.26Å; I1319-Q1323 HydrophobicContact CG2-CG 4.28Å; I1319-Q1323 VanDerWaalsContact CG2-NE2 3.27Å; I1319-Q1323 VanDerWaalsContact CG2-OE1 3.27Å; I1319-Q1323 WeakPolarHBondContact O-CB 3.27Å; I1319-Q1323 VanDerWaalsContact O-CG 3.27Å; I1319-Q1323 WeakPolarHBondContact O-CG 3.21Å; I1319-Q1323 PolarHBondContact O-N 2.96Å; I1319-Q1323 PolarHBondContact O-OE1 3.32Å; I1319-Q1323 VanDerWaalsContact O-OE1 3.1Å; S1320-Q1323 VanDerWaalsContact CA-OE1 3.25Å; S1320-Q1323 PolarHBondContact O-N 3.05Å; F1321-Q1323 VanDerWaalsContact C-N 3.34Å; F1321-Q1323 PolarHBondContact O-N 3.32Å; Q1323-L1325 VanDerWaalsContact C-N 3.31Å; Q1323-L1325 PolarHBondContact O-N 3.14Å; Q1323-L1326 WeakPolarHBondContact O-CB 3.39Å; Q1323-L1326 PolarHBondContact O-N 3.36Å; Q1323-L1326 VanDerWaalsContact O-N 3.11Å; Q1323-A1327 WeakPolarHBondContact O-CB 3.34Å; Q1323-A1327 PolarHBondContact O-N 3.28Å; Q1323-A1327 VanDerWaalsContact O-N 3.14Å; Q1323-L1403 HydrophobicContact CG-CD1 3.86Å; Q1323-L1403 HydrophobicContact CG-CD2 4.34Å
1324I84.4Confident81.4Confident4.8 Ų4.824.8 Ų24.83%0.02515%0.145CC..Hα-helixtrans-56.7-48.6172.9-69.1162.1000110.2V1148 Y1297 F1301 S1320 F1321 L1326 A1327 V1328V1148-I1324 HydrophobicContact CG1-CD1 3.59Å; V1148-I1324 VanDerWaalsContact CG1-CD1 3.48Å; V1148-I1324 WeakPolarHBondContact O-CD1 3.35Å; Y1297-I1324 HydrophobicContact CE1-CG1 3.77Å; Y1297-I1324 HydrophobicContact CE2-CD1 4.3Å; Y1297-I1324 HydrophobicContact CE2-CG1 4.1Å; Y1297-I1324 WeakPolarHBondContact OH-CA 3.42Å; Y1297-I1324 WeakPolarHBondContact OH-CD1 3.34Å; Y1297-I1324 WeakPolarHBondContact OH-CG1 3.39Å; F1301-I1324 HydrophobicContact CD1-CG1 4.32Å; F1301-I1324 VanDerWaalsContact CE1-CA 3.42Å; F1301-I1324 HydrophobicContact CE1-CB 4.35Å; F1301-I1324 HydrophobicContact CE1-CG1 4.22Å; F1301-I1324 HydrophobicContact CZ-CG1 4.43Å; S1320-I1324 WeakPolarHBondContact O-CD1 3.37Å; S1320-I1324 VanDerWaalsContact O-CG1 3.28Å; S1320-I1324 WeakPolarHBondContact O-CG1 3.38Å; S1320-I1324 PolarHBondContact O-N 3.01Å; F1321-I1324 WeakPolarHBondContact O-CB 3.27Å; F1321-I1324 PolarHBondContact O-N 3.31Å; I1324-L1326 VanDerWaalsContact C-N 3.3Å; I1324-L1326 PolarHBondContact O-N 3.26Å; I1324-A1327 PolarHBondContact O-N 3.3Å; I1324-V1328 HydrophobicContact CG2-CG2 4.15Å; I1324-V1328 WeakPolarHBondContact O-CB 3.37Å; I1324-V1328 VanDerWaalsContact O-CG2 3.25Å; I1324-V1328 WeakPolarHBondContact O-CG2 3.31Å; I1324-V1328 PolarHBondContact O-N 3.16Å
1325L87.7Confident82.9Confident2 Ų222.8 Ų22.81%0.0113%0.131CC..Hα-helixtrans-60-42.7-179.7-166150.1000111.3F1321 L1322 Q1323 A1327 V1328 M1329 A1337 L1340 C1368 M1372 I1407F1321-L1325 HydrophobicContact CE1-CD1 4.46Å; F1321-L1325 WeakPolarHBondContact O-CB 3.35Å; F1321-L1325 PolarHBondContact O-N 2.95Å; L1322-L1325 PolarHBondContact O-N 3.19Å; Q1323-L1325 VanDerWaalsContact C-N 3.31Å; Q1323-L1325 PolarHBondContact O-N 3.14Å; L1325-A1327 PolarHBondContact O-N 2.64Å; L1325-V1328 PolarHBondContact O-N 3.11Å; L1325-M1329 HydrophobicContact CD2-CG 4.38Å; L1325-M1329 HydrophobicContact CD2-SD 4.06Å; L1325-M1329 VanDerWaalsContact O-CG 3.32Å; L1325-M1329 WeakPolarHBondContact O-CG 3.35Å; L1325-M1329 PolarHBondContact O-N 3.06Å; L1325-A1337 HydrophobicContact CD2-CB 4.22Å; L1325-A1337 HydrophobicContact CG-CB 4.22Å; L1325-L1340 HydrophobicContact CD1-CB 4.25Å; L1325-L1340 HydrophobicContact CD1-CD1 4.19Å; L1325-C1368 HydrophobicContact CD1-CB 4.34Å; L1325-M1372 HydrophobicContact CD1-CE 3.67Å; L1325-M1372 HydrophobicContact CD2-CE 4.07Å; L1325-M1372 HydrophobicContact CG-CE 4.45Å; L1325-I1407 HydrophobicContact CB-CD1 4.5Å; L1325-I1407 HydrophobicContact CD2-CB 4.43Å; L1325-I1407 HydrophobicContact CD2-CD1 3.83Å; L1325-I1407 HydrophobicContact CD2-CG1 3.92Å; L1325-I1407 HydrophobicContact CD2-CG2 3.64Å
1326L86.2Confident83.9Confident18.4 Ų18.421.7 Ų21.710%0.09613%0.125CC..Hα-helixtrans-62.2-43.8177.6-178.468.5000112.9L1322 Q1323 I1324 M1329 L1403 Q1406 I1407 K1410L1322-L1326 WeakPolarHBondContact O-CB 3.38Å; L1322-L1326 PolarHBondContact O-N 3.18Å; Q1323-L1326 WeakPolarHBondContact O-CB 3.39Å; Q1323-L1326 PolarHBondContact O-N 3.36Å; Q1323-L1326 VanDerWaalsContact O-N 3.11Å; I1324-L1326 VanDerWaalsContact C-N 3.3Å; I1324-L1326 PolarHBondContact O-N 3.26Å; L1326-M1329 WeakPolarHBondContact O-CB 3.42Å; L1326-M1329 PolarHBondContact O-N 3.11Å; L1326-L1403 HydrophobicContact CD2-CD2 4.14Å; L1326-Q1406 HydrophobicContact CD1-CB 4.43Å; L1326-Q1406 HydrophobicContact CD1-CG 3.82Å; L1326-Q1406 HydrophobicContact CD2-CG 4.41Å; L1326-Q1406 VanDerWaalsContact CD2-OE1 3.31Å; L1326-I1407 HydrophobicContact CB-CG1 4.3Å; L1326-I1407 HydrophobicContact CD1-CG1 4.09Å; L1326-K1410 HydrophobicContact CD1-CD 3.75Å; L1326-K1410 HydrophobicContact CD1-CG 4.44Å; L1326-K1410 PolarHBondContact O-NZ 3.18Å
1327A81.4Confident84.7Confident20.2 Ų20.221.2 Ų21.217%0.16712%0.122CC..Hα-helixtrans-70.6-37.2178.400000112.1F1301 Q1323 I1324 L1325 M1329 E1330F1301-A1327 HydrophobicContact CD1-CB 3.92Å; F1301-A1327 HydrophobicContact CE1-CB 3.37Å; F1301-A1327 VanDerWaalsContact CE1-CB 3.44Å; F1301-A1327 HydrophobicContact CE2-CB 4.47Å; F1301-A1327 HydrophobicContact CZ-CB 3.67Å; F1301-A1327 VanDerWaalsContact CZ-CB 3.41Å; Q1323-A1327 WeakPolarHBondContact O-CB 3.34Å; Q1323-A1327 PolarHBondContact O-N 3.28Å; Q1323-A1327 VanDerWaalsContact O-N 3.14Å; I1324-A1327 PolarHBondContact O-N 3.3Å; L1325-A1327 PolarHBondContact O-N 2.64Å; A1327-M1329 PolarHBondContact O-N 3.06Å; A1327-M1329 VanDerWaalsContact O-N 3.15Å; A1327-E1330 WeakPolarHBondContact O-CB 3.28Å; A1327-E1330 PolarHBondContact O-N 3.25Å
1328V86Confident85.3Confident3.4 Ų3.420.6 Ų20.62%0.02112%0.119CC..Hα-helixtrans-59.8-28.6177.3165.40000112.2A1155 I1324 L1325 E1330 H1331 N1335 L1336 A1337A1155-V1328 HydrophobicContact CB-CG2 3.74Å; I1324-V1328 HydrophobicContact CG2-CG2 4.15Å; I1324-V1328 WeakPolarHBondContact O-CB 3.37Å; I1324-V1328 VanDerWaalsContact O-CG2 3.25Å; I1324-V1328 WeakPolarHBondContact O-CG2 3.31Å; I1324-V1328 PolarHBondContact O-N 3.16Å; L1325-V1328 PolarHBondContact O-N 3.11Å; V1328-E1330 VanDerWaalsContact C-N 3.27Å; V1328-E1330 PolarHBondContact O-N 2.92Å; V1328-H1331 WeakPolarHBondContact O-CB 3.38Å; V1328-H1331 PolarHBondContact O-N 3.12Å; V1328-H1331 VanDerWaalsContact O-N 3.14Å; V1328-N1335 HydrophobicContact CG1-CB 4.28Å; V1328-N1335 PolarHBondContact O-ND2 3.21Å; V1328-N1335 VanDerWaalsContact O-ND2 3.13Å; V1328-L1336 HydrophobicContact CG1-CB 3.69Å; V1328-L1336 HydrophobicContact CG2-CD2 4.48Å; V1328-A1337 HydrophobicContact CB-CB 4.46Å; V1328-A1337 HydrophobicContact CG1-CB 3.98Å; V1328-A1337 VanDerWaalsContact CG1-N 3.3Å
1329M84Confident85.6Confident29.2 Ų29.221.4 Ų21.414%0.14412%0.121CC..THydrogen-bonded Turntrans-66.6-18.2177.2-69.5177.271.200114.3L1325 L1326 A1327 H1331 A1337 I1407 K1410 L1411L1325-M1329 HydrophobicContact CD2-CG 4.38Å; L1325-M1329 HydrophobicContact CD2-SD 4.06Å; L1325-M1329 VanDerWaalsContact O-CG 3.32Å; L1325-M1329 WeakPolarHBondContact O-CG 3.35Å; L1325-M1329 PolarHBondContact O-N 3.06Å; L1326-M1329 WeakPolarHBondContact O-CB 3.42Å; L1326-M1329 PolarHBondContact O-N 3.11Å; A1327-M1329 PolarHBondContact O-N 3.06Å; A1327-M1329 VanDerWaalsContact O-N 3.15Å; M1329-H1331 VanDerWaalsContact C-N 3.31Å; M1329-A1337 HydrophobicContact CG-CB 3.5Å; M1329-A1337 VanDerWaalsContact CG-CB 3.48Å; M1329-I1407 HydrophobicContact SD-CB 4.43Å; M1329-I1407 HydrophobicContact SD-CG1 4.36Å; M1329-I1407 HydrophobicContact SD-CG2 3.97Å; M1329-K1410 HydrophobicContact CB-CD 4.46Å; M1329-K1410 HydrophobicContact CE-CB 3.37Å; M1329-K1410 HydrophobicContact CE-CD 4.44Å; M1329-K1410 HydrophobicContact SD-CB 4.14Å; M1329-K1410 HydrophobicContact SD-CD 4.36Å; M1329-L1411 HydrophobicContact CE-CB 4.33Å; M1329-L1411 HydrophobicContact CE-CD2 3.58Å; M1329-L1411 HydrophobicContact CE-CG 3.51Å; M1329-L1411 HydrophobicContact SD-CG 4.42Å
1330E80.3Confident86.1Confident126.8 Ų126.821.5 Ų21.559%0.59312%0.122SC*.THydrogen-bonded Turntrans-80.2-14177.8-56.7-165.6155.900112.7A1327 V1328 K1410A1327-E1330 WeakPolarHBondContact O-CB 3.28Å; A1327-E1330 PolarHBondContact O-N 3.25Å; V1328-E1330 VanDerWaalsContact C-N 3.27Å; V1328-E1330 PolarHBondContact O-N 2.92Å; E1330-K1410 IonicContact OE1-NZ 3.19Å; E1330-K1410 PolarHBondContact OE1-NZ 3.08Å
1331H83.1Confident86.6Confident40.2 Ų40.220.8 Ų20.819%0.18612%0.117CC..SBendtrans-79.1152.5175.8-66.1-56.7000112.7Q1159 H1161 V1328 M1329 N1335Q1159-H1331 PolarHBondContact NE2-CE1 3.34Å; H1161-H1331 AromaticContact CE1-CD2 3.41Å; H1161-H1331 PolarHBondContact CE1-CD2 3.25Å; H1161-H1331 AromaticContact CE1-CG 3.83Å; H1161-H1331 AromaticContact NE2-CD2 3.46Å; H1161-H1331 PolarHBondContact NE2-CD2 3.37Å; H1161-H1331 VanDerWaalsContact NE2-CD2 3.29Å; H1161-H1331 AromaticContact NE2-CG 3.79Å; H1161-H1331 AromaticContact NE2-NE2 3.96Å; V1328-H1331 WeakPolarHBondContact O-CB 3.38Å; V1328-H1331 PolarHBondContact O-N 3.12Å; V1328-H1331 VanDerWaalsContact O-N 3.14Å; M1329-H1331 VanDerWaalsContact C-N 3.31Å; H1331-N1335 HydrophobicContact CB-CB 4.44Å; H1331-N1335 PolarHBondContact O-ND2 3.09Å
1332P84.8Confident86.7Confident91.6 Ų91.621.5 Ų21.560%0.59513%0.125SC*.PPolyproline II helixtrans-58.6143.1-178.124.5-35.4000112.6P1334P1332-P1334 CarbonylContact O-C 3.57Å
1333A84.1Confident86.8Confident29.6 Ų29.621.8 Ų21.825%0.24513%0.126CC..SBendtrans-74.5145.6177.300000111.7C1348 I1351 L1416A1333-C1348 PolarHBondContact O-SG 2.95Å; A1333-C1348 VanDerWaalsContact O-SG 3.37Å; A1333-I1351 HydrophobicContact CB-CD1 3.99Å; A1333-L1416 HydrophobicContact CB-CD1 3.92Å
1334P86.4Confident86.9Confident31 Ų3124.3 Ų24.320%0.20114%0.144CC..SBendcis-72.4136.8-6.227.8-32000112.8L1165 P1332 V1345 I1351L1165-P1334 HydrophobicContact CD1-CB 4.33Å; L1165-P1334 HydrophobicContact CD2-CB 4.26Å; P1332-P1334 CarbonylContact O-C 3.57Å; P1334-V1345 HydrophobicContact CB-CB 4.25Å; P1334-V1345 HydrophobicContact CB-CG1 3.64Å; P1334-V1345 HydrophobicContact CG-CG1 4.31Å; P1334-I1351 HydrophobicContact CB-CD1 4.18Å
1335N88.7Confident86.8Confident2.8 Ų2.825.4 Ų25.42%0.01515%0.15CC..  trans-123.6168.517769.432.1000111.3H1161 V1328 H1331 A1337 H1338H1161-N1335 HydrophobicContact CB-CB 4.41Å; H1161-N1335 WeakPolarHBondContact ND1-CB 3.29Å; V1328-N1335 HydrophobicContact CG1-CB 4.28Å; V1328-N1335 PolarHBondContact O-ND2 3.21Å; V1328-N1335 VanDerWaalsContact O-ND2 3.13Å; H1331-N1335 HydrophobicContact CB-CB 4.44Å; H1331-N1335 PolarHBondContact O-ND2 3.09Å; N1335-A1337 VanDerWaalsContact C-N 3.26Å; N1335-A1337 PolarHBondContact O-N 3.19Å; N1335-A1337 WeakPolarHBondContact OD1-CB 3.26Å; N1335-A1337 PolarHBondContact OD1-N 3.09Å; N1335-A1337 VanDerWaalsContact OD1-N 3.13Å; N1335-H1338 PolarHBondContact N-ND1 3.21Å; N1335-H1338 PolarHBondContact ND2-CE1 3.13Å; N1335-H1338 VanDerWaalsContact ND2-CE1 3.33Å; N1335-H1338 PolarHBondContact ND2-ND1 3.36Å; N1335-H1338 WeakPolarHBondContact O-CB 3.39Å; N1335-H1338 PolarHBondContact O-N 3.19Å; N1335-H1338 VanDerWaalsContact O-N 3.14Å; N1335-H1338 PolarHBondContact OD1-CE1 3.25Å; N1335-H1338 PolarHBondContact OD1-N 3.15Å; N1335-H1338 VanDerWaalsContact OD1-N 3.11Å; N1335-H1338 PolarHBondContact OD1-ND1 3.11Å
1336L89.8Confident86.5Confident1.6 Ų1.631.9 Ų31.91%0.00819%0.185CC..Hα-helixtrans-57.7-33.9-177.5-179.775.7000112.9L1151 H1161 L1165 L1168 V1328 H1338 W1339 L1340L1151-L1336 HydrophobicContact CD1-CD2 3.94Å; L1151-L1336 HydrophobicContact CD2-CD2 4.41Å; L1151-L1336 HydrophobicContact CG-CD2 4.33Å; H1161-L1336 PolarHBondContact ND1-N 3.01Å; L1165-L1336 HydrophobicContact CD2-CD1 4.28Å; L1168-L1336 HydrophobicContact CD1-CD1 3.62Å; L1168-L1336 VanDerWaalsContact CD1-CD1 3.42Å; V1328-L1336 HydrophobicContact CG1-CB 3.69Å; V1328-L1336 HydrophobicContact CG2-CD2 4.48Å; L1336-H1338 VanDerWaalsContact C-N 3.34Å; L1336-H1338 PolarHBondContact O-N 3.01Å; L1336-W1339 HydrophobicContact CD1-CE3 3.72Å; L1336-W1339 HydrophobicContact CD1-CZ3 4.1Å; L1336-W1339 PolarHBondContact O-N 3.17Å; L1336-L1340 HydrophobicContact CD1-CD1 4.41Å; L1336-L1340 HydrophobicContact CD1-CG 4.35Å; L1336-L1340 HydrophobicContact CD2-CD1 4.16Å; L1336-L1340 HydrophobicContact CG-CD1 3.85Å; L1336-L1340 HydrophobicContact CG-CG 4.21Å; L1336-L1340 WeakPolarHBondContact O-CB 3.46Å; L1336-L1340 WeakPolarHBondContact O-CG 3.32Å; L1336-L1340 PolarHBondContact O-N 3.05Å
1337A90.3Very high86.3Confident1.2 Ų1.235.5 Ų35.51%0.0120%0.204CC..Hα-helixtrans-65.2-36.9178.700000112.4L1325 V1328 M1329 N1335 W1339 L1340 C1341L1325-A1337 HydrophobicContact CD2-CB 4.22Å; L1325-A1337 HydrophobicContact CG-CB 4.22Å; V1328-A1337 HydrophobicContact CB-CB 4.46Å; V1328-A1337 HydrophobicContact CG1-CB 3.98Å; V1328-A1337 VanDerWaalsContact CG1-N 3.3Å; M1329-A1337 HydrophobicContact CG-CB 3.5Å; M1329-A1337 VanDerWaalsContact CG-CB 3.48Å; N1335-A1337 VanDerWaalsContact C-N 3.26Å; N1335-A1337 PolarHBondContact O-N 3.19Å; N1335-A1337 WeakPolarHBondContact OD1-CB 3.26Å; N1335-A1337 PolarHBondContact OD1-N 3.09Å; N1335-A1337 VanDerWaalsContact OD1-N 3.13Å; A1337-W1339 VanDerWaalsContact C-N 3.31Å; A1337-W1339 PolarHBondContact O-N 3.28Å; A1337-L1340 PolarHBondContact O-N 3.01Å; A1337-C1341 WeakPolarHBondContact O-CB 3.22Å; A1337-C1341 PolarHBondContact O-N 3.07Å; A1337-C1341 PolarHBondContact O-SG 3.04Å; A1337-C1341 VanDerWaalsContact O-SG 3.39Å
1338H91.4Very high86.4Confident5.2 Ų5.237 Ų372%0.02421%0.213CC..Hα-helixtrans-59.8-45.3174.2-64.997.6000111.2N1335 L1336 C1341 G1342 F1343 V1345 I1351 T1417N1335-H1338 PolarHBondContact N-ND1 3.21Å; N1335-H1338 PolarHBondContact ND2-CE1 3.13Å; N1335-H1338 VanDerWaalsContact ND2-CE1 3.33Å; N1335-H1338 PolarHBondContact ND2-ND1 3.36Å; N1335-H1338 WeakPolarHBondContact O-CB 3.39Å; N1335-H1338 PolarHBondContact O-N 3.19Å; N1335-H1338 VanDerWaalsContact O-N 3.14Å; N1335-H1338 PolarHBondContact OD1-CE1 3.25Å; N1335-H1338 PolarHBondContact OD1-N 3.15Å; N1335-H1338 VanDerWaalsContact OD1-N 3.11Å; N1335-H1338 PolarHBondContact OD1-ND1 3.11Å; L1336-H1338 VanDerWaalsContact C-N 3.34Å; L1336-H1338 PolarHBondContact O-N 3.01Å; H1338-C1341 PolarHBondContact O-N 3.44Å; H1338-G1342 PolarHBondContact O-N 3.08Å; H1338-F1343 HydrophobicContact CB-CB 4.13Å; H1338-F1343 HydrophobicContact CB-CD2 4.46Å; H1338-F1343 WeakPolarHBondContact O-CB 3.27Å; H1338-F1343 WeakPolarHBondContact O-CD2 3.29Å; H1338-F1343 PolarHBondContact O-N 3.17Å; H1338-V1345 HydrophobicContact CB-CG1 3.8Å; H1338-I1351 HydrophobicContact CB-CD1 4.46Å; H1338-T1417 VanDerWaalsContact CD2-CG2 3.46Å; H1338-T1417 WeakPolarHBondContact CD2-CG2 3.44Å; H1338-T1417 WeakPolarHBondContact NE2-CG2 3.35Å
1339W90.8Very high86.3Confident19.2 Ų19.244.2 Ų44.27%0.07324%0.244CC..Hα-helixtrans-63.8-50.1176.7175.962.7000112L1165 L1168 T1169 R1175 L1178 L1179 F1182 L1336 A1337 C1341 G1342 V1345L1165-W1339 HydrophobicContact CD1-CB 3.65Å; L1165-W1339 HydrophobicContact CD1-CD2 4.44Å; L1165-W1339 HydrophobicContact CD1-CG 3.83Å; L1165-W1339 HydrophobicContact CD2-CB 3.57Å; L1165-W1339 HydrophobicContact CD2-CD2 4.38Å; L1165-W1339 HydrophobicContact CD2-CG 3.97Å; L1168-W1339 HydrophobicContact CD1-CZ3 4.37Å; T1169-W1339 HydrophobicContact CG2-CD2 4.37Å; T1169-W1339 HydrophobicContact CG2-CG 4.41Å; T1169-W1339 HydrophobicContact CG2-CZ2 4.47Å; R1175-W1339 HydrophobicContact CB-CZ2 4.48Å; R1175-W1339 HydrophobicContact CG-CZ2 3.7Å; L1178-W1339 HydrophobicContact CB-CH2 4.24Å; L1179-W1339 HydrophobicContact CB-CH2 4.49Å; L1179-W1339 HydrophobicContact CB-CZ2 4.32Å; L1179-W1339 HydrophobicContact CD1-CZ2 4.47Å; F1182-W1339 HydrophobicContact CD2-CH2 4.33Å; F1182-W1339 HydrophobicContact CD2-CZ3 4.16Å; F1182-W1339 HydrophobicContact CE2-CH2 4.29Å; F1182-W1339 AromaticContact CE2-CZ3 3.93Å; F1182-W1339 HydrophobicContact CE2-CZ3 4.03Å; L1336-W1339 HydrophobicContact CD1-CE3 3.72Å; L1336-W1339 HydrophobicContact CD1-CZ3 4.1Å; L1336-W1339 PolarHBondContact O-N 3.17Å; A1337-W1339 VanDerWaalsContact C-N 3.31Å; A1337-W1339 PolarHBondContact O-N 3.28Å; W1339-C1341 VanDerWaalsContact C-N 3.27Å; W1339-C1341 PolarHBondContact O-N 3.03Å; W1339-G1342 PolarHBondContact O-N 3.11Å; W1339-V1345 HydrophobicContact CB-CG1 3.83Å; W1339-V1345 HydrophobicContact CB-CG2 3.89Å; W1339-V1345 HydrophobicContact CG-CG2 4.34Å
1340L90.9Very high86.3Confident2.6 Ų2.643.8 Ų43.81%0.01425%0.245CC..Hα-helixtrans-61-32.8-178.4-71.8174.2000113.1L1179 F1182 F1321 L1325 L1336 A1337 G1342 T1367 C1368L1179-L1340 HydrophobicContact CD1-CD2 4.5Å; F1182-L1340 HydrophobicContact CB-CD2 4.01Å; F1182-L1340 HydrophobicContact CD2-CD2 3.41Å; F1182-L1340 VanDerWaalsContact CD2-CD2 3.43Å; F1182-L1340 HydrophobicContact CE2-CD2 4.15Å; F1182-L1340 HydrophobicContact CG-CD2 3.96Å; F1321-L1340 HydrophobicContact CE2-CD1 4.47Å; F1321-L1340 HydrophobicContact CZ-CD1 3.96Å; F1321-L1340 HydrophobicContact CZ-CD2 4.49Å; L1325-L1340 HydrophobicContact CD1-CB 4.25Å; L1325-L1340 HydrophobicContact CD1-CD1 4.19Å; L1336-L1340 HydrophobicContact CD1-CD1 4.41Å; L1336-L1340 HydrophobicContact CD1-CG 4.35Å; L1336-L1340 HydrophobicContact CD2-CD1 4.16Å; L1336-L1340 HydrophobicContact CG-CD1 3.85Å; L1336-L1340 HydrophobicContact CG-CG 4.21Å; L1336-L1340 WeakPolarHBondContact O-CB 3.46Å; L1336-L1340 WeakPolarHBondContact O-CG 3.32Å; L1336-L1340 PolarHBondContact O-N 3.05Å; A1337-L1340 PolarHBondContact O-N 3.01Å; L1340-G1342 VanDerWaalsContact C-N 3.32Å; L1340-T1367 WeakPolarHBondContact O-CB 3.37Å; L1340-C1368 HydrophobicContact CB-CB 4.32Å; L1340-C1368 VanDerWaalsContact O-CB 3.3Å; L1340-C1368 WeakPolarHBondContact O-CB 3.33Å; L1340-C1368 PolarHBondContact O-N 3.22Å
1341C90.2Very high86.6Confident0.2 Ų0.237.7 Ų37.70%0.00122%0.217CC..Hα-helixtrans-82.6-8.1176.4-660000113.7A1337 H1338 W1339 F1343 T1367 L1369 L1411A1337-C1341 WeakPolarHBondContact O-CB 3.22Å; A1337-C1341 PolarHBondContact O-N 3.07Å; A1337-C1341 PolarHBondContact O-SG 3.04Å; A1337-C1341 VanDerWaalsContact O-SG 3.39Å; H1338-C1341 PolarHBondContact O-N 3.44Å; W1339-C1341 VanDerWaalsContact C-N 3.27Å; W1339-C1341 PolarHBondContact O-N 3.03Å; C1341-F1343 HydrophobicContact CB-CD2 3.82Å; C1341-F1343 HydrophobicContact CB-CE2 3.72Å; C1341-T1367 PolarHBondContact O-OG1 3.03Å; C1341-L1369 HydrophobicContact CB-CB 4.32Å; C1341-L1369 HydrophobicContact CB-CD1 4.35Å; C1341-L1369 WeakPolarHBondContact O-CB 3.36Å; C1341-L1411 HydrophobicContact CB-CD1 4.39Å
1342G87.9Confident86.7Confident16.2 Ų16.238.2 Ų38.217%0.16723%0.225CC..THydrogen-bonded Turntrans96.313176.200000116.1H1338 W1339 L1340 L1356H1338-G1342 PolarHBondContact O-N 3.08Å; W1339-G1342 PolarHBondContact O-N 3.11Å; L1340-G1342 VanDerWaalsContact C-N 3.32Å; G1342-L1356 WeakPolarHBondContact O-CD2 3.35Å
1343F89.5Confident86.8Confident6.4 Ų6.443.5 Ų43.53%0.02823%0.233CC..  trans-73.4149.9173.9-64-93.7000111H1338 C1341 V1345 I1351 S1354 L1356 L1411 T1417 P1420 L1421H1338-F1343 HydrophobicContact CB-CB 4.13Å; H1338-F1343 HydrophobicContact CB-CD2 4.46Å; H1338-F1343 WeakPolarHBondContact O-CB 3.27Å; H1338-F1343 WeakPolarHBondContact O-CD2 3.29Å; H1338-F1343 PolarHBondContact O-N 3.17Å; C1341-F1343 HydrophobicContact CB-CD2 3.82Å; C1341-F1343 HydrophobicContact CB-CE2 3.72Å; F1343-V1345 WeakPolarHBondContact O-CG2 3.37Å; F1343-V1345 PolarHBondContact O-N 3.14Å; F1343-I1351 HydrophobicContact CB-CG2 4.3Å; F1343-I1351 HydrophobicContact CD1-CG2 3.93Å; F1343-I1351 HydrophobicContact CG-CG2 4.32Å; F1343-S1354 VanDerWaalsContact CD1-OG 3.29Å; F1343-S1354 WeakPolarHBondContact CD1-OG 3.35Å; F1343-L1356 HydrophobicContact CE1-CD1 4.05Å; F1343-L1356 HydrophobicContact CZ-CD1 3.99Å; F1343-L1411 HydrophobicContact CE2-CD1 4.33Å; F1343-L1411 HydrophobicContact CE2-CD2 3.94Å; F1343-L1411 HydrophobicContact CZ-CD2 4.26Å; F1343-T1417 HydrophobicContact CD1-CG2 4.06Å; F1343-T1417 HydrophobicContact CE1-CG2 3.69Å; F1343-T1417 HydrophobicContact CE2-CG2 4.25Å; F1343-T1417 HydrophobicContact CG-CG2 4.43Å; F1343-T1417 HydrophobicContact CZ-CG2 3.8Å; F1343-P1420 HydrophobicContact CD1-CG 4.41Å; F1343-P1420 HydrophobicContact CE1-CB 4.27Å; F1343-P1420 HydrophobicContact CE1-CG 4.03Å; F1343-L1421 HydrophobicContact CZ-CB 4.45Å
1344C85.9Confident87Confident58.6 Ų58.642.2 Ų42.240%0.39622%0.222SC..  trans-72.6119.5173.8-56.60000110.2A1350 I1351C1344-A1350 HydrophobicContact CB-CB 3.98Å; C1344-A1350 CarbonylContact O-C 3.52Å; C1344-I1351 VanDerWaalsContact O-CG1 3.27Å; C1344-I1351 WeakPolarHBondContact O-CG1 3.35Å; C1344-I1351 PolarHBondContact O-N 3.28Å
1345V83.6Confident87Confident27 Ų2745.7 Ų45.716%0.16424%0.239CC..  trans-98.41.4-165.9-144.40000113.8L1165 P1334 H1338 W1339 F1343 N1347L1165-V1345 HydrophobicContact CD1-CB 4.34Å; L1165-V1345 HydrophobicContact CD1-CG1 3.9Å; L1165-V1345 VanDerWaalsContact CD1-CG1 3.45Å; L1165-V1345 HydrophobicContact CD1-CG2 4.46Å; L1165-V1345 HydrophobicContact CD2-CB 3.9Å; L1165-V1345 HydrophobicContact CD2-CG1 4.04Å; L1165-V1345 HydrophobicContact CG-CG1 4.41Å; P1334-V1345 HydrophobicContact CB-CB 4.25Å; P1334-V1345 HydrophobicContact CB-CG1 3.64Å; P1334-V1345 HydrophobicContact CG-CG1 4.31Å; H1338-V1345 HydrophobicContact CB-CG1 3.8Å; W1339-V1345 HydrophobicContact CB-CG1 3.83Å; W1339-V1345 HydrophobicContact CB-CG2 3.89Å; W1339-V1345 HydrophobicContact CG-CG2 4.34Å; F1343-V1345 WeakPolarHBondContact O-CG2 3.37Å; F1343-V1345 PolarHBondContact O-N 3.14Å; V1345-N1347 VanDerWaalsContact C-N 3.31Å; V1345-N1347 PolarHBondContact O-N 3.2Å; V1345-N1347 VanDerWaalsContact O-N 3.09Å
1346D80.9Confident87Confident139.2 Ų139.246.2 Ų46.274%0.74424%0.242SC*.SBendtrans-58.8-37.5-175-52-39.2000113.2A1350D1346-A1350 HydrophobicContact CB-CB 4.3Å
1347N81.6Confident86.9Confident92.8 Ų92.848.5 Ų48.550%0.49625%0.252SS..SBendtrans-162.4163.7177.714.613.1000110.6V1345 K1349 A1350 I1351V1345-N1347 VanDerWaalsContact C-N 3.31Å; V1345-N1347 PolarHBondContact O-N 3.2Å; V1345-N1347 VanDerWaalsContact O-N 3.09Å; N1347-K1349 PolarHBondContact O-N 3.09Å; N1347-K1349 VanDerWaalsContact O-N 3.14Å; N1347-K1349 WeakPolarHBondContact OD1-CA 3.19Å; N1347-K1349 WeakPolarHBondContact OD1-CB 3.32Å; N1347-K1349 PolarHBondContact OD1-N 3.1Å; N1347-K1349 VanDerWaalsContact OD1-N 3.15Å; N1347-A1350 HydrophobicContact CB-CB 4.36Å; N1347-A1350 WeakPolarHBondContact O-CA 3.38Å; N1347-A1350 VanDerWaalsContact O-CB 3.26Å; N1347-A1350 WeakPolarHBondContact O-CB 3.43Å; N1347-A1350 PolarHBondContact O-N 3.22Å; N1347-A1350 WeakPolarHBondContact OD1-CB 3.35Å; N1347-A1350 PolarHBondContact OD1-N 3.17Å; N1347-I1351 PolarHBondContact O-N 3.2Å; N1347-I1351 VanDerWaalsContact O-N 3.15Å
1348C83Confident86.7Confident52.6 Ų52.650.7 Ų50.736%0.35526%0.264SS..Hα-helixtrans-57.8-31177.5-58.10000113.5A1333 A1350 I1351 S1352 L1416A1333-C1348 PolarHBondContact O-SG 2.95Å; A1333-C1348 VanDerWaalsContact O-SG 3.37Å; C1348-A1350 VanDerWaalsContact C-N 3.33Å; C1348-I1351 PolarHBondContact O-N 3.18Å; C1348-S1352 PolarHBondContact O-N 3.19Å; C1348-L1416 HydrophobicContact CB-CD1 4.41Å; C1348-L1416 HydrophobicContact CB-CD2 4.38Å
1349K84.6Confident86.2Confident155 Ų15552.7 Ų52.767%0.67428%0.281SS*.Hα-helixtrans-70.1-34.2175.2-66-179.7-179.7175.40111.9N1347 I1351 S1352 R1353N1347-K1349 PolarHBondContact O-N 3.09Å; N1347-K1349 VanDerWaalsContact O-N 3.14Å; N1347-K1349 WeakPolarHBondContact OD1-CA 3.19Å; N1347-K1349 WeakPolarHBondContact OD1-CB 3.32Å; N1347-K1349 PolarHBondContact OD1-N 3.1Å; N1347-K1349 VanDerWaalsContact OD1-N 3.15Å; K1349-I1351 VanDerWaalsContact C-N 3.34Å; K1349-S1352 PolarHBondContact O-N 3.13Å; K1349-S1352 PolarHBondContact O-OG 3.1Å; K1349-R1353 WeakPolarHBondContact O-CB 3.45Å; K1349-R1353 WeakPolarHBondContact O-CG 3.37Å; K1349-R1353 PolarHBondContact O-N 3.12Å
1350A84.3Confident85.8Confident19.6 Ų19.654.9 Ų54.916%0.16231%0.309CS..Hα-helixtrans-66.7-38.7175.900000110.9C1344 D1346 N1347 C1348 S1352 R1353 S1354C1344-A1350 HydrophobicContact CB-CB 3.98Å; C1344-A1350 CarbonylContact O-C 3.52Å; D1346-A1350 HydrophobicContact CB-CB 4.3Å; N1347-A1350 HydrophobicContact CB-CB 4.36Å; N1347-A1350 WeakPolarHBondContact O-CA 3.38Å; N1347-A1350 VanDerWaalsContact O-CB 3.26Å; N1347-A1350 WeakPolarHBondContact O-CB 3.43Å; N1347-A1350 PolarHBondContact O-N 3.22Å; N1347-A1350 WeakPolarHBondContact OD1-CB 3.35Å; N1347-A1350 PolarHBondContact OD1-N 3.17Å; C1348-A1350 VanDerWaalsContact C-N 3.33Å; A1350-S1352 PolarHBondContact O-N 3.04Å; A1350-R1353 CarbonylContact O-C 3.57Å; A1350-R1353 WeakPolarHBondContact O-CA 3.22Å; A1350-R1353 PolarHBondContact O-N 2.89Å; A1350-R1353 VanDerWaalsContact O-N 3.13Å; A1350-S1354 PolarHBondContact O-N 2.93Å
1351I86.7Confident85.3Confident0 Ų058.8 Ų58.80%033%0.33CS..Hα-helixtrans-56.8-50.6173.7-59.5172.6000110.4A1333 P1334 H1338 F1343 C1344 N1347 C1348 K1349 R1353 S1354 L1416 T1417A1333-I1351 HydrophobicContact CB-CD1 3.99Å; P1334-I1351 HydrophobicContact CB-CD1 4.18Å; H1338-I1351 HydrophobicContact CB-CD1 4.46Å; F1343-I1351 HydrophobicContact CB-CG2 4.3Å; F1343-I1351 HydrophobicContact CD1-CG2 3.93Å; F1343-I1351 HydrophobicContact CG-CG2 4.32Å; C1344-I1351 VanDerWaalsContact O-CG1 3.27Å; C1344-I1351 WeakPolarHBondContact O-CG1 3.35Å; C1344-I1351 PolarHBondContact O-N 3.28Å; N1347-I1351 PolarHBondContact O-N 3.2Å; N1347-I1351 VanDerWaalsContact O-N 3.15Å; C1348-I1351 PolarHBondContact O-N 3.18Å; K1349-I1351 VanDerWaalsContact C-N 3.34Å; I1351-R1353 PolarHBondContact O-N 3.07Å; I1351-R1353 VanDerWaalsContact O-N 3.12Å; I1351-S1354 WeakPolarHBondContact O-CB 3.33Å; I1351-S1354 PolarHBondContact O-N 3.24Å; I1351-S1354 VanDerWaalsContact O-N 3.17Å; I1351-S1354 PolarHBondContact O-OG 3.15Å; I1351-S1354 VanDerWaalsContact O-OG 3.05Å; I1351-L1416 HydrophobicContact CG2-CB 4.31Å; I1351-T1417 HydrophobicContact CG2-CG2 3.69Å
1352S85.7Confident84.5Confident49 Ų4962.7 Ų62.734%0.34336%0.362SS..Hα-helixtrans-64.4-17.7179.168.10000114.8C1348 K1349 A1350 L1416C1348-S1352 PolarHBondContact O-N 3.19Å; K1349-S1352 PolarHBondContact O-N 3.13Å; K1349-S1352 PolarHBondContact O-OG 3.1Å; A1350-S1352 PolarHBondContact O-N 3.04Å; S1352-L1416 VanDerWaalsContact CA-O 3.23Å; S1352-L1416 WeakPolarHBondContact CA-O 3.3Å; S1352-L1416 PolarHBondContact N-O 3.36Å
1353R86.5Confident83.9Confident203.6 Ų203.669.2 Ų69.277%0.76839%0.393SS*.THydrogen-bonded Turntrans-109.85.9-178.5-68.2178.9176.9179.7-3113K1349 A1350 I1351 N1355K1349-R1353 WeakPolarHBondContact O-CB 3.45Å; K1349-R1353 WeakPolarHBondContact O-CG 3.37Å; K1349-R1353 PolarHBondContact O-N 3.12Å; A1350-R1353 CarbonylContact O-C 3.57Å; A1350-R1353 WeakPolarHBondContact O-CA 3.22Å; A1350-R1353 PolarHBondContact O-N 2.89Å; A1350-R1353 VanDerWaalsContact O-N 3.13Å; I1351-R1353 PolarHBondContact O-N 3.07Å; I1351-R1353 VanDerWaalsContact O-N 3.12Å; R1353-N1355 PolarHBondContact O-N 3.22Å
1354S88Confident83.5Confident2.4 Ų2.471.3 Ų71.32%0.01740%0.403CS..  trans-62.6136.3179.862.20000110.3F1343 A1350 I1351 P1420F1343-S1354 VanDerWaalsContact CD1-OG 3.29Å; F1343-S1354 WeakPolarHBondContact CD1-OG 3.35Å; A1350-S1354 PolarHBondContact O-N 2.93Å; I1351-S1354 WeakPolarHBondContact O-CB 3.33Å; I1351-S1354 PolarHBondContact O-N 3.24Å; I1351-S1354 VanDerWaalsContact O-N 3.17Å; I1351-S1354 PolarHBondContact O-OG 3.15Å; I1351-S1354 VanDerWaalsContact O-OG 3.05Å; S1354-P1420 WeakPolarHBondContact O-CB 3.09Å; S1354-P1420 VanDerWaalsContact OG-CB 3.31Å; S1354-P1420 WeakPolarHBondContact OG-CB 3.4Å
1355N87Confident83.4Confident104.8 Ų104.871.5 Ų71.556%0.5640%0.398SS*.  trans-10396.2173-153.111.1000108.6R1353 Q1357R1353-N1355 PolarHBondContact O-N 3.22Å; N1355-Q1357 PolarHBondContact ND2-NE2 3.1Å; N1355-Q1357 VanDerWaalsContact ND2-NE2 3.15Å
1356L88.3Confident83.5Confident13.2 Ų13.274.3 Ų74.37%0.06941%0.405CS..  trans-74.3133.4175.7-58.6173.6000108.9G1342 F1343 L1369 L1421 F1424G1342-L1356 WeakPolarHBondContact O-CD2 3.35Å; F1343-L1356 HydrophobicContact CE1-CD1 4.05Å; F1343-L1356 HydrophobicContact CZ-CD1 3.99Å; L1356-L1369 HydrophobicContact CD1-CD1 4.45Å; L1356-L1369 HydrophobicContact CD1-CD2 4.03Å; L1356-L1421 HydrophobicContact CD1-CD1 4.48Å; L1356-F1424 HydrophobicContact CB-CB 3.85Å; L1356-F1424 HydrophobicContact CB-CD1 4.32Å; L1356-F1424 HydrophobicContact CB-CD2 3.86Å; L1356-F1424 HydrophobicContact CB-CE2 4.42Å; L1356-F1424 HydrophobicContact CB-CG 3.76Å; L1356-F1424 HydrophobicContact CD1-CB 4.34Å; L1356-F1424 HydrophobicContact CD1-CG 4.49Å; L1356-F1424 VanDerWaalsContact O-CD2 3.31Å; L1356-F1424 WeakPolarHBondContact O-CD2 3.34Å
1357Q86.9Confident84Confident50 Ų5067.9 Ų67.923%0.23437%0.371CS..  trans-139.1160.8-179.9-58.9-175.9100109.4N1355 I1361 A1362 Q1364 H1370 F1424N1355-Q1357 PolarHBondContact ND2-NE2 3.1Å; N1355-Q1357 VanDerWaalsContact ND2-NE2 3.15Å; Q1357-I1361 HydrophobicContact CB-CB 4.36Å; Q1357-I1361 VanDerWaalsContact OE1-CG2 3.27Å; Q1357-I1361 PolarHBondContact OE1-O 3.03Å; Q1357-A1362 VanDerWaalsContact OE1-CB 3.29Å; Q1357-Q1364 HydrophobicContact CB-CB 4.39Å; Q1357-Q1364 HydrophobicContact CB-CG 4.42Å; Q1357-H1370 PolarHBondContact O-CE1 2.9Å; Q1357-H1370 PolarHBondContact O-NE2 3.02Å; Q1357-F1424 VanDerWaalsContact C-CE2 3.48Å
1358D86.2Confident84.5Confident47.4 Ų47.463.4 Ų63.425%0.25335%0.347SS..  trans-65.4151.6178.3-56-28.7000111.1G1360 I1361 H1370 F1424 N1428 H1429D1358-G1360 PolarHBondContact O-N 3.18Å; D1358-I1361 HydrophobicContact CB-CD1 3.79Å; D1358-I1361 HydrophobicContact CB-CG1 4.31Å; D1358-I1361 WeakPolarHBondContact O-CB 3.39Å; D1358-I1361 PolarHBondContact O-N 3.19Å; D1358-I1361 VanDerWaalsContact O-N 3.13Å; D1358-H1370 WeakPolarHBondContact CA-NE2 3.3Å; D1358-F1424 VanDerWaalsContact OD1-CE2 3.27Å; D1358-F1424 WeakPolarHBondContact OD1-CE2 3.46Å; D1358-F1424 WeakPolarHBondContact OD1-CZ 3.35Å; D1358-N1428 VanDerWaalsContact CG-ND2 3.31Å; D1358-N1428 WeakPolarHBondContact OD1-CB 3.47Å; D1358-N1428 PolarHBondContact OD1-ND2 3.1Å; D1358-N1428 PolarHBondContact OD2-ND2 3.28Å; D1358-H1429 IonicContact OD1-NE2 3.21Å
1359A82.1Confident84.9Confident47.4 Ų47.461 Ų6139%0.39233%0.331SS..THydrogen-bonded Turntrans-56.4127.6-179.900000111.7R1366 H1370A1359-R1366 HydrophobicContact CB-CB 3.97Å; A1359-R1366 HydrophobicContact CB-CG 4.24Å; A1359-H1370 PolarHBondContact N-NE2 3.05Å; A1359-H1370 VanDerWaalsContact N-NE2 3.19Å
1360G81.9Confident85.2Confident64 Ų6454.2 Ų54.266%0.6630%0.301SS*.THydrogen-bonded Turntrans94-11.8-179.300000115D1358 Q1364D1358-G1360 PolarHBondContact O-N 3.18Å; G1360-Q1364 PolarHBondContact N-O 3.21Å
1361I80.1Confident85.4Confident85.8 Ų85.853.4 Ų53.444%0.4429%0.294SS..G310 helixtrans-83.7130.3173.6-52.6-179.4000108.8Q1357 D1358 D1363 Q1364Q1357-I1361 HydrophobicContact CB-CB 4.36Å; Q1357-I1361 VanDerWaalsContact OE1-CG2 3.27Å; Q1357-I1361 PolarHBondContact OE1-O 3.03Å; D1358-I1361 HydrophobicContact CB-CD1 3.79Å; D1358-I1361 HydrophobicContact CB-CG1 4.31Å; D1358-I1361 WeakPolarHBondContact O-CB 3.39Å; D1358-I1361 PolarHBondContact O-N 3.19Å; D1358-I1361 VanDerWaalsContact O-N 3.13Å; I1361-D1363 VanDerWaalsContact C-N 3.25Å; I1361-D1363 PolarHBondContact O-N 2.93Å; I1361-Q1364 WeakPolarHBondContact O-CB 3.37Å; I1361-Q1364 PolarHBondContact O-N 3.21Å
1362A74.7Confident85.7Confident81.4 Ų81.453.4 Ų53.467%0.67329%0.294SS*.G310 helixtrans50.838.8-179.200000114.2Q1357 Q1364Q1357-A1362 VanDerWaalsContact OE1-CB 3.29Å; A1362-Q1364 PolarHBondContact O-N 3.32Å; A1362-Q1364 VanDerWaalsContact O-N 3.15Å
1363D75.2Confident85.9Confident153.8 Ų153.851.2 Ų51.282%0.82228%0.279SS*.G310 helixtrans59.217.7-175.5-57.2-36.3000114.6I1361 Q1365I1361-D1363 VanDerWaalsContact C-N 3.25Å; I1361-D1363 PolarHBondContact O-N 2.93Å; D1363-Q1365 PolarHBondContact O-N 3.16Å
1364Q80.2Confident85.9Confident49.8 Ų49.844.5 Ų44.523%0.23326%0.258CS..PPolyproline II helixtrans-65.5119.8174.8-17280.96.200109.9Q1357 G1360 I1361 A1362Q1357-Q1364 HydrophobicContact CB-CB 4.39Å; Q1357-Q1364 HydrophobicContact CB-CG 4.42Å; G1360-Q1364 PolarHBondContact N-O 3.21Å; I1361-Q1364 WeakPolarHBondContact O-CB 3.37Å; I1361-Q1364 PolarHBondContact O-N 3.21Å; A1362-Q1364 PolarHBondContact O-N 3.32Å; A1362-Q1364 VanDerWaalsContact O-N 3.15Å
1365Q83.5Confident85.7Confident62 Ų6244.6 Ų44.629%0.2926%0.259SS..PPolyproline II helixtrans-73.1156.2179.7-67.7177.814.200111.3N1176 L1179 D1363 T1367 H1370N1176-Q1365 VanDerWaalsContact CG-CD 3.46Å; N1176-Q1365 VanDerWaalsContact CG-OE1 3.27Å; N1176-Q1365 PolarHBondContact ND2-NE2 3.23Å; N1176-Q1365 VanDerWaalsContact ND2-NE2 3.18Å; N1176-Q1365 VanDerWaalsContact OD1-CD 3.29Å; N1176-Q1365 PolarHBondContact OD1-NE2 3.2Å; N1176-Q1365 VanDerWaalsContact OD1-NE2 3.1Å; N1176-Q1365 PolarHBondContact OD1-OE1 2.89Å; N1176-Q1365 VanDerWaalsContact OD1-OE1 3.06Å; L1179-Q1365 HydrophobicContact CD2-CB 3.95Å; D1363-Q1365 PolarHBondContact O-N 3.16Å; Q1365-T1367 VanDerWaalsContact O-CG2 3.29Å; Q1365-T1367 WeakPolarHBondContact O-CG2 3.44Å; Q1365-T1367 PolarHBondContact O-N 3.06Å; Q1365-H1370 PolarHBondContact O-ND1 3.4Å
1366R86.4Confident85.7Confident87.4 Ų87.439.7 Ų39.733%0.3323%0.232SC..PPolyproline II helixtrans-64.6125.3171.2-167.2179.1171.5111.69.4109.1L1179 T1183 K1187 A1359 H1370 S1371 D1374L1179-R1366 WeakPolarHBondContact CD2-O 3.49Å; L1179-R1366 WeakPolarHBondContact CG-O 3.23Å; T1183-R1366 HydrophobicContact CG2-CB 4.26Å; T1183-R1366 HydrophobicContact CG2-CG 3.92Å; T1183-R1366 VanDerWaalsContact CG2-NE 3.3Å; T1183-R1366 VanDerWaalsContact CG2-O 3.23Å; T1183-R1366 WeakPolarHBondContact CG2-O 3.27Å; T1183-R1366 PolarHBondContact OG1-O 3.34Å; T1183-R1366 VanDerWaalsContact OG1-O 3.14Å; K1187-R1366 VanDerWaalsContact CE-NH1 3.32Å; K1187-R1366 VanDerWaalsContact NZ-NH1 3.18Å; A1359-R1366 HydrophobicContact CB-CB 3.97Å; A1359-R1366 HydrophobicContact CB-CG 4.24Å; R1366-H1370 HydrophobicContact CG-CB 4.04Å; R1366-H1370 PolarHBondContact NH2-O 3.28Å; R1366-S1371 PolarHBondContact NE-OG 3.45Å; R1366-S1371 VanDerWaalsContact NE-OG 3.08Å; R1366-S1371 VanDerWaalsContact NH2-CA 3.3Å; R1366-S1371 PolarHBondContact NH2-OG 3.13Å; R1366-D1374 IonicContact CZ-OD2 3.18Å; R1366-D1374 VanDerWaalsContact CZ-OD2 3.27Å; R1366-D1374 IonicContact NE-OD2 3.37Å; R1366-D1374 IonicContact NH1-OD2 3.33Å; R1366-D1374 PolarHBondContact NH1-OD2 3.22Å; R1366-D1374 IonicContact NH2-OD1 3.22Å; R1366-D1374 IonicContact NH2-OD2 3.03Å; R1366-D1374 PolarHBondContact NH2-OD2 3.17Å
1367T90.6Very high85.4Confident3 Ų341.4 Ų41.42%0.01824%0.242CC..  trans-112.5171.1-177.669.30000111.2L1179 T1183 L1340 C1341 Q1365 L1369 H1370 S1371L1179-T1367 HydrophobicContact CD1-CG2 4.49Å; L1179-T1367 HydrophobicContact CD2-CG2 4.28Å; T1183-T1367 VanDerWaalsContact CG2-CA 3.49Å; T1183-T1367 WeakPolarHBondContact CG2-O 3.36Å; T1183-T1367 WeakPolarHBondContact OG1-CA 3.1Å; T1183-T1367 PolarHBondContact OG1-O 3.24Å; L1340-T1367 WeakPolarHBondContact O-CB 3.37Å; C1341-T1367 PolarHBondContact O-OG1 3.03Å; Q1365-T1367 VanDerWaalsContact O-CG2 3.29Å; Q1365-T1367 WeakPolarHBondContact O-CG2 3.44Å; Q1365-T1367 PolarHBondContact O-N 3.06Å; T1367-L1369 PolarHBondContact O-N 3.03Å; T1367-L1369 WeakPolarHBondContact OG1-CB 3.46Å; T1367-L1369 PolarHBondContact OG1-N 3.3Å; T1367-H1370 PolarHBondContact N-ND1 3.09Å; T1367-H1370 VanDerWaalsContact N-ND1 3.11Å; T1367-H1370 WeakPolarHBondContact O-CB 3.38Å; T1367-H1370 PolarHBondContact O-N 2.97Å; T1367-H1370 VanDerWaalsContact O-N 3.1Å; T1367-H1370 PolarHBondContact OG1-CE1 3.28Å; T1367-H1370 PolarHBondContact OG1-N 3.03Å; T1367-H1370 PolarHBondContact OG1-ND1 3.06Å; T1367-S1371 PolarHBondContact O-N 3.13Å; T1367-S1371 VanDerWaalsContact O-N 3.09Å
1368C91.7Very high85Confident0 Ų040.8 Ų40.80%024%0.243CC..Hα-helixtrans-60.1-32.5175-66.80000111.7T1183 I1186 L1325 L1340 H1370 S1371 M1372T1183-C1368 PolarHBondContact OG1-N 3.11Å; I1186-C1368 HydrophobicContact CD1-CB 3.74Å; L1325-C1368 HydrophobicContact CD1-CB 4.34Å; L1340-C1368 HydrophobicContact CB-CB 4.32Å; L1340-C1368 VanDerWaalsContact O-CB 3.3Å; L1340-C1368 WeakPolarHBondContact O-CB 3.33Å; L1340-C1368 PolarHBondContact O-N 3.22Å; C1368-H1370 VanDerWaalsContact C-N 3.32Å; C1368-H1370 PolarHBondContact O-N 3.04Å; C1368-S1371 WeakPolarHBondContact CA-OG 3.47Å; C1368-S1371 PolarHBondContact O-N 3.16Å; C1368-S1371 PolarHBondContact O-OG 3.19Å; C1368-M1372 HydrophobicContact CB-CE 4.37Å; C1368-M1372 WeakPolarHBondContact O-CB 3.34Å; C1368-M1372 VanDerWaalsContact O-CG 3.25Å; C1368-M1372 WeakPolarHBondContact O-CG 3.34Å; C1368-M1372 PolarHBondContact O-N 3.16Å
1369L92Very high84.5Confident1.2 Ų1.238.7 Ų38.71%0.00623%0.231CC..Hα-helixtrans-59.4-43.9174.5-17779.9000111.3C1341 L1356 T1367 S1371 M1372 L1373 L1408 L1421 F1424C1341-L1369 HydrophobicContact CB-CB 4.32Å; C1341-L1369 HydrophobicContact CB-CD1 4.35Å; C1341-L1369 WeakPolarHBondContact O-CB 3.36Å; L1356-L1369 HydrophobicContact CD1-CD1 4.45Å; L1356-L1369 HydrophobicContact CD1-CD2 4.03Å; T1367-L1369 PolarHBondContact O-N 3.03Å; T1367-L1369 WeakPolarHBondContact OG1-CB 3.46Å; T1367-L1369 PolarHBondContact OG1-N 3.3Å; L1369-S1371 PolarHBondContact O-N 3.17Å; L1369-M1372 WeakPolarHBondContact O-CB 3.36Å; L1369-M1372 PolarHBondContact O-N 3.13Å; L1369-L1373 HydrophobicContact CD2-CD1 3.83Å; L1369-L1373 HydrophobicContact CD2-CG 4.27Å; L1369-L1373 HydrophobicContact CG-CD1 4.31Å; L1369-L1373 VanDerWaalsContact O-CG 3.27Å; L1369-L1373 WeakPolarHBondContact O-CG 3.24Å; L1369-L1373 PolarHBondContact O-N 3.22Å; L1369-L1373 VanDerWaalsContact O-N 3.09Å; L1369-L1408 HydrophobicContact CD1-CD2 3.6Å; L1369-L1421 HydrophobicContact CD1-CD1 3.94Å; L1369-L1421 HydrophobicContact CD2-CD1 4.12Å; L1369-F1424 HydrophobicContact CD2-CD1 3.89Å; L1369-F1424 HydrophobicContact CD2-CE1 3.61Å; L1369-F1424 VanDerWaalsContact CD2-CE1 3.45Å; L1369-F1424 HydrophobicContact CD2-CZ 4.24Å; L1369-F1424 HydrophobicContact CG-CE1 4.22Å
1370H91.3Very high84Confident13.2 Ų13.238.7 Ų38.76%0.06123%0.227CC..Hα-helixtrans-63.8-44.7177.1-61.5106.6000112.2Q1357 D1358 A1359 Q1365 R1366 T1367 C1368 M1372 L1373 D1374 F1424Q1357-H1370 PolarHBondContact O-CE1 2.9Å; Q1357-H1370 PolarHBondContact O-NE2 3.02Å; D1358-H1370 WeakPolarHBondContact CA-NE2 3.3Å; A1359-H1370 PolarHBondContact N-NE2 3.05Å; A1359-H1370 VanDerWaalsContact N-NE2 3.19Å; Q1365-H1370 PolarHBondContact O-ND1 3.4Å; R1366-H1370 HydrophobicContact CG-CB 4.04Å; R1366-H1370 PolarHBondContact NH2-O 3.28Å; T1367-H1370 PolarHBondContact N-ND1 3.09Å; T1367-H1370 VanDerWaalsContact N-ND1 3.11Å; T1367-H1370 WeakPolarHBondContact O-CB 3.38Å; T1367-H1370 PolarHBondContact O-N 2.97Å; T1367-H1370 VanDerWaalsContact O-N 3.1Å; T1367-H1370 PolarHBondContact OG1-CE1 3.28Å; T1367-H1370 PolarHBondContact OG1-N 3.03Å; T1367-H1370 PolarHBondContact OG1-ND1 3.06Å; C1368-H1370 VanDerWaalsContact C-N 3.32Å; C1368-H1370 PolarHBondContact O-N 3.04Å; H1370-M1372 VanDerWaalsContact C-N 3.3Å; H1370-M1372 PolarHBondContact O-N 3.06Å; H1370-L1373 WeakPolarHBondContact O-CB 3.14Å; H1370-L1373 PolarHBondContact O-N 3.13Å; H1370-L1373 VanDerWaalsContact O-N 3.14Å; H1370-D1374 WeakPolarHBondContact O-CB 3.36Å; H1370-D1374 VanDerWaalsContact O-CG 3.27Å; H1370-D1374 PolarHBondContact O-N 3.1Å; H1370-D1374 VanDerWaalsContact O-OD2 3.09Å; H1370-F1424 AromaticContact NE2-CZ 3.83Å
1371S89.2Confident83.5Confident1.6 Ų1.641.4 Ų41.41%0.01122%0.222CC..Hα-helixtrans-65.5-32.3176.4-65.30000113.2T1183 R1366 T1367 C1368 L1369 M1375T1183-S1371 WeakPolarHBondContact CB-OG 3.38Å; T1183-S1371 WeakPolarHBondContact CG2-OG 3.33Å; T1183-S1371 VanDerWaalsContact O-CB 3.31Å; T1183-S1371 WeakPolarHBondContact O-CB 3.35Å; T1183-S1371 PolarHBondContact O-OG 3.2Å; R1366-S1371 PolarHBondContact NE-OG 3.45Å; R1366-S1371 VanDerWaalsContact NE-OG 3.08Å; R1366-S1371 VanDerWaalsContact NH2-CA 3.3Å; R1366-S1371 PolarHBondContact NH2-OG 3.13Å; T1367-S1371 PolarHBondContact O-N 3.13Å; T1367-S1371 VanDerWaalsContact O-N 3.09Å; C1368-S1371 WeakPolarHBondContact CA-OG 3.47Å; C1368-S1371 PolarHBondContact O-N 3.16Å; C1368-S1371 PolarHBondContact O-OG 3.19Å; L1369-S1371 PolarHBondContact O-N 3.17Å; S1371-M1375 WeakPolarHBondContact O-CB 3.37Å; S1371-M1375 PolarHBondContact O-N 3.12Å; S1371-M1375 VanDerWaalsContact O-N 3.08Å
1372M91.5Very high83Confident0.2 Ų0.239.2 Ų39.20%0.00121%0.208CC..Hα-helixtrans-63.7-45.2172.5-71.9173.7-171.300111.5I1186 L1322 L1325 C1368 L1369 H1370 M1375 I1376 I1404 I1407I1186-M1372 HydrophobicContact CD1-CE 3.84Å; I1186-M1372 HydrophobicContact CD1-CG 4.05Å; I1186-M1372 HydrophobicContact CG2-CG 4.25Å; L1322-M1372 HydrophobicContact CD2-CE 3.69Å; L1322-M1372 HydrophobicContact CD2-CG 4.46Å; L1325-M1372 HydrophobicContact CD1-CE 3.67Å; L1325-M1372 HydrophobicContact CD2-CE 4.07Å; L1325-M1372 HydrophobicContact CG-CE 4.45Å; C1368-M1372 HydrophobicContact CB-CE 4.37Å; C1368-M1372 WeakPolarHBondContact O-CB 3.34Å; C1368-M1372 VanDerWaalsContact O-CG 3.25Å; C1368-M1372 WeakPolarHBondContact O-CG 3.34Å; C1368-M1372 PolarHBondContact O-N 3.16Å; L1369-M1372 WeakPolarHBondContact O-CB 3.36Å; L1369-M1372 PolarHBondContact O-N 3.13Å; H1370-M1372 VanDerWaalsContact C-N 3.3Å; H1370-M1372 PolarHBondContact O-N 3.06Å; M1372-M1375 WeakPolarHBondContact O-CA 3.21Å; M1372-M1375 VanDerWaalsContact O-CB 3.26Å; M1372-M1375 WeakPolarHBondContact O-CB 3.32Å; M1372-M1375 PolarHBondContact O-N 3.21Å; M1372-M1375 VanDerWaalsContact O-N 3.17Å; M1372-I1376 VanDerWaalsContact O-CG1 3.27Å; M1372-I1376 WeakPolarHBondContact O-CG1 3.3Å; M1372-I1376 PolarHBondContact O-N 3.24Å; M1372-I1404 HydrophobicContact CB-CD1 3.94Å; M1372-I1404 HydrophobicContact CB-CG1 4.26Å; M1372-I1404 HydrophobicContact CB-CG2 3.75Å; M1372-I1404 HydrophobicContact CG-CD1 3.86Å; M1372-I1404 HydrophobicContact CG-CG1 3.87Å; M1372-I1404 HydrophobicContact CG-CG2 4.11Å; M1372-I1404 HydrophobicContact SD-CG1 4.49Å; M1372-I1404 HydrophobicContact SD-CG2 4.37Å; M1372-I1407 HydrophobicContact CE-CD1 3.92Å; M1372-I1407 HydrophobicContact CE-CG2 4.15Å; M1372-I1407 HydrophobicContact SD-CG2 4.05Å
1373L89.8Confident82.9Confident2 Ų236.4 Ų36.41%0.0118%0.182CC..Hα-helixtrans-65.4-42.9178.6-66.2177.4000112.3L1369 H1370 M1375 I1376 D1377 L1408 F1424 L1425 H1429 L1431L1369-L1373 HydrophobicContact CD2-CD1 3.83Å; L1369-L1373 HydrophobicContact CD2-CG 4.27Å; L1369-L1373 HydrophobicContact CG-CD1 4.31Å; L1369-L1373 VanDerWaalsContact O-CG 3.27Å; L1369-L1373 WeakPolarHBondContact O-CG 3.24Å; L1369-L1373 PolarHBondContact O-N 3.22Å; L1369-L1373 VanDerWaalsContact O-N 3.09Å; H1370-L1373 WeakPolarHBondContact O-CB 3.14Å; H1370-L1373 PolarHBondContact O-N 3.13Å; H1370-L1373 VanDerWaalsContact O-N 3.14Å; L1373-M1375 VanDerWaalsContact C-N 3.27Å; L1373-M1375 PolarHBondContact O-N 3.17Å; L1373-I1376 HydrophobicContact CD2-CD1 4.22Å; L1373-I1376 WeakPolarHBondContact O-CB 3.21Å; L1373-I1376 PolarHBondContact O-N 3.13Å; L1373-I1376 VanDerWaalsContact O-N 3.13Å; L1373-D1377 PolarHBondContact O-N 3.05Å; L1373-L1408 HydrophobicContact CD2-CD1 4.44Å; L1373-F1424 HydrophobicContact CD1-CE1 3.7Å; L1373-F1424 HydrophobicContact CD1-CZ 4.34Å; L1373-L1425 HydrophobicContact CD1-CD2 4.15Å; L1373-L1425 HydrophobicContact CD2-CD2 4.05Å; L1373-H1429 WeakPolarHBondContact CD1-NE2 3.35Å; L1373-L1431 HydrophobicContact CD1-CD1 4.27Å; L1373-L1431 HydrophobicContact CD2-CD1 3.29Å; L1373-L1431 HydrophobicContact CD2-CD2 4.35Å
1374D86.5Confident82.6Confident64 Ų6436.3 Ų36.334%0.34218%0.176SC..Hα-helixtrans-59.5-37.8172.8-72.4-1.4000111.6K1187 R1366 H1370 D1377 S1378K1187-D1374 VanDerWaalsContact CE-OD2 3.29Å; K1187-D1374 WeakPolarHBondContact CE-OD2 3.06Å; K1187-D1374 IonicContact NZ-OD2 2.68Å; K1187-D1374 PolarHBondContact NZ-OD2 2.96Å; R1366-D1374 IonicContact CZ-OD2 3.18Å; R1366-D1374 VanDerWaalsContact CZ-OD2 3.27Å; R1366-D1374 IonicContact NE-OD2 3.37Å; R1366-D1374 IonicContact NH1-OD2 3.33Å; R1366-D1374 PolarHBondContact NH1-OD2 3.22Å; R1366-D1374 IonicContact NH2-OD1 3.22Å; R1366-D1374 IonicContact NH2-OD2 3.03Å; R1366-D1374 PolarHBondContact NH2-OD2 3.17Å; H1370-D1374 WeakPolarHBondContact O-CB 3.36Å; H1370-D1374 VanDerWaalsContact O-CG 3.27Å; H1370-D1374 PolarHBondContact O-N 3.1Å; H1370-D1374 VanDerWaalsContact O-OD2 3.09Å; D1374-D1377 PolarHBondContact O-N 3.26Å; D1374-S1378 VanDerWaalsContact O-CB 3.27Å; D1374-S1378 WeakPolarHBondContact O-CB 3.34Å; D1374-S1378 PolarHBondContact O-N 3.05Å; D1374-S1378 PolarHBondContact O-OG 2.93Å
1375M85.1Confident82Confident5.2 Ų5.235.5 Ų35.53%0.02618%0.176CC..Hα-helixtrans-66.1-44.1175.2-161-175.483.900110.9I1186 W1188 L1322 S1371 M1372 L1373 D1377 S1378 T1379 N1400 L1401 I1404I1186-M1375 HydrophobicContact CG2-CE 3.89Å; I1186-M1375 HydrophobicContact CG2-SD 4.42Å; W1188-M1375 HydrophobicContact CB-CG 4.17Å; L1322-M1375 HydrophobicContact CD1-CE 4.06Å; S1371-M1375 WeakPolarHBondContact O-CB 3.37Å; S1371-M1375 PolarHBondContact O-N 3.12Å; S1371-M1375 VanDerWaalsContact O-N 3.08Å; M1372-M1375 WeakPolarHBondContact O-CA 3.21Å; M1372-M1375 VanDerWaalsContact O-CB 3.26Å; M1372-M1375 WeakPolarHBondContact O-CB 3.32Å; M1372-M1375 PolarHBondContact O-N 3.21Å; M1372-M1375 VanDerWaalsContact O-N 3.17Å; L1373-M1375 VanDerWaalsContact C-N 3.27Å; L1373-M1375 PolarHBondContact O-N 3.17Å; M1375-D1377 VanDerWaalsContact C-N 3.34Å; M1375-D1377 PolarHBondContact O-N 2.82Å; M1375-S1378 WeakPolarHBondContact CA-OG 3.4Å; M1375-S1378 PolarHBondContact O-N 2.98Å; M1375-S1378 PolarHBondContact O-OG 3.08Å; M1375-S1378 VanDerWaalsContact O-OG 3.08Å; M1375-T1379 HydrophobicContact CE-CG2 4.16Å; M1375-T1379 HydrophobicContact CG-CG2 4.3Å; M1375-T1379 WeakPolarHBondContact O-CB 3.27Å; M1375-T1379 WeakPolarHBondContact O-CG2 3.33Å; M1375-T1379 PolarHBondContact O-N 3.12Å; M1375-T1379 VanDerWaalsContact O-N 3.12Å; M1375-T1379 PolarHBondContact O-OG1 3.22Å; M1375-N1400 HydrophobicContact CE-CB 3.48Å; M1375-N1400 HydrophobicContact SD-CB 3.87Å; M1375-L1401 HydrophobicContact CE-CB 4.45Å; M1375-L1401 HydrophobicContact CE-CD2 3.73Å; M1375-L1401 HydrophobicContact CE-CG 3.89Å; M1375-I1404 HydrophobicContact CB-CD1 4.1Å; M1375-I1404 HydrophobicContact CE-CD1 3.24Å; M1375-I1404 HydrophobicContact CE-CG1 4.16Å; M1375-I1404 HydrophobicContact CG-CD1 4.41Å; M1375-I1404 HydrophobicContact SD-CD1 3.61Å; M1375-I1404 VanDerWaalsContact SD-CD1 3.58Å
1376I86Confident81.2Confident1.6 Ų1.632.7 Ų32.71%0.00816%0.163CC..Hα-helixtrans-60.5-47.9175.9-59.5168000110.4M1372 L1373 S1378 T1379 T1380 L1401 I1404 W1405 L1408 Y1435M1372-I1376 VanDerWaalsContact O-CG1 3.27Å; M1372-I1376 WeakPolarHBondContact O-CG1 3.3Å; M1372-I1376 PolarHBondContact O-N 3.24Å; L1373-I1376 HydrophobicContact CD2-CD1 4.22Å; L1373-I1376 WeakPolarHBondContact O-CB 3.21Å; L1373-I1376 PolarHBondContact O-N 3.13Å; L1373-I1376 VanDerWaalsContact O-N 3.13Å; I1376-S1378 PolarHBondContact O-N 2.99Å; I1376-T1379 PolarHBondContact O-N 3.13Å; I1376-T1379 VanDerWaalsContact O-N 3.12Å; I1376-T1379 PolarHBondContact O-OG1 3.17Å; I1376-T1379 VanDerWaalsContact O-OG1 3.05Å; I1376-T1380 PolarHBondContact O-N 3.18Å; I1376-L1401 HydrophobicContact CB-CD2 4.39Å; I1376-L1401 HydrophobicContact CG1-CD2 4.23Å; I1376-L1401 HydrophobicContact CG2-CD2 4.01Å; I1376-I1404 HydrophobicContact CD1-CG2 3.62Å; I1376-I1404 VanDerWaalsContact CD1-CG2 3.47Å; I1376-I1404 HydrophobicContact CG1-CG2 3.92Å; I1376-W1405 HydrophobicContact CD1-CD2 4.45Å; I1376-W1405 HydrophobicContact CD1-CZ2 4.24Å; I1376-W1405 HydrophobicContact CG2-CZ2 4.01Å; I1376-L1408 HydrophobicContact CD1-CD1 3.7Å; I1376-Y1435 VanDerWaalsContact C-OH 3.24Å; I1376-Y1435 HydrophobicContact CG2-CD1 4.32Å; I1376-Y1435 HydrophobicContact CG2-CD2 4.32Å; I1376-Y1435 HydrophobicContact CG2-CE1 3.63Å; I1376-Y1435 HydrophobicContact CG2-CE2 3.66Å; I1376-Y1435 VanDerWaalsContact CG2-OH 3.25Å; I1376-Y1435 WeakPolarHBondContact CG2-OH 3.33Å; I1376-Y1435 PolarHBondContact O-OH 3.28Å; I1376-Y1435 VanDerWaalsContact O-OH 3.13Å
1377D83.2Confident80.2Confident48.8 Ų48.830.2 Ų30.226%0.26116%0.157SC..Hα-helixtrans-64.5-44.6-177.9-78.4-21.7000112.7L1373 D1374 M1375 T1379 T1380 K1434 Y1435L1373-D1377 PolarHBondContact O-N 3.05Å; D1374-D1377 PolarHBondContact O-N 3.26Å; M1375-D1377 VanDerWaalsContact C-N 3.34Å; M1375-D1377 PolarHBondContact O-N 2.82Å; D1377-T1379 VanDerWaalsContact C-N 3.3Å; D1377-T1379 PolarHBondContact O-N 3.18Å; D1377-T1380 PolarHBondContact O-N 3.08Å; D1377-T1380 PolarHBondContact O-OG1 3.14Å; D1377-K1434 VanDerWaalsContact CG-NZ 3.29Å; D1377-K1434 IonicContact OD1-NZ 3.23Å; D1377-K1434 PolarHBondContact OD1-NZ 2.97Å; D1377-K1434 IonicContact OD2-NZ 3.67Å; D1377-Y1435 VanDerWaalsContact CA-OH 3.24Å; D1377-Y1435 WeakPolarHBondContact CA-OH 3.25Å; D1377-Y1435 PolarHBondContact N-OH 2.97Å; D1377-Y1435 PolarHBondContact OD1-OH 3.26Å
1378S77.5Confident78.9Confident37.8 Ų37.834.5 Ų34.526%0.26418%0.184SC..Hα-helixtrans-66.8-33177.556.20000113.7M1190 D1374 M1375 I1376 T1380 H1381 W1382M1190-S1378 VanDerWaalsContact CE-OG 3.31Å; M1190-S1378 WeakPolarHBondContact CE-OG 3.31Å; M1190-S1378 WeakPolarHBondContact SD-CB 3.33Å; D1374-S1378 VanDerWaalsContact O-CB 3.27Å; D1374-S1378 WeakPolarHBondContact O-CB 3.34Å; D1374-S1378 PolarHBondContact O-N 3.05Å; D1374-S1378 PolarHBondContact O-OG 2.93Å; M1375-S1378 WeakPolarHBondContact CA-OG 3.4Å; M1375-S1378 PolarHBondContact O-N 2.98Å; M1375-S1378 PolarHBondContact O-OG 3.08Å; M1375-S1378 VanDerWaalsContact O-OG 3.08Å; I1376-S1378 PolarHBondContact O-N 2.99Å; S1378-T1380 VanDerWaalsContact C-N 3.29Å; S1378-T1380 PolarHBondContact O-N 3.05Å; S1378-H1381 PolarHBondContact O-N 2.99Å; S1378-W1382 VanDerWaalsContact O-CD1 3.25Å
1379T75.4Confident77.8Confident2 Ų235 Ų351%0.01219%0.187CC..Hα-helixtrans-69-24.1-178.416.70000112.9M1375 I1376 D1377 H1381 W1382 L1383 L1397 L1401M1375-T1379 HydrophobicContact CE-CG2 4.16Å; M1375-T1379 HydrophobicContact CG-CG2 4.3Å; M1375-T1379 WeakPolarHBondContact O-CB 3.27Å; M1375-T1379 WeakPolarHBondContact O-CG2 3.33Å; M1375-T1379 PolarHBondContact O-N 3.12Å; M1375-T1379 VanDerWaalsContact O-N 3.12Å; M1375-T1379 PolarHBondContact O-OG1 3.22Å; I1376-T1379 PolarHBondContact O-N 3.13Å; I1376-T1379 VanDerWaalsContact O-N 3.12Å; I1376-T1379 PolarHBondContact O-OG1 3.17Å; I1376-T1379 VanDerWaalsContact O-OG1 3.05Å; D1377-T1379 VanDerWaalsContact C-N 3.3Å; D1377-T1379 PolarHBondContact O-N 3.18Å; T1379-H1381 PolarHBondContact O-N 3.18Å; T1379-H1381 VanDerWaalsContact O-N 3.14Å; T1379-W1382 CarbonylContact O-C 3.55Å; T1379-W1382 WeakPolarHBondContact O-CB 3.32Å; T1379-W1382 PolarHBondContact O-N 3.12Å; T1379-W1382 VanDerWaalsContact O-N 3.09Å; T1379-L1383 HydrophobicContact CG2-CD1 3.83Å; T1379-L1383 WeakPolarHBondContact O-CB 3.2Å; T1379-L1383 VanDerWaalsContact O-CD1 3.28Å; T1379-L1383 WeakPolarHBondContact O-CD1 3.21Å; T1379-L1383 WeakPolarHBondContact O-CG 3.46Å; T1379-L1383 PolarHBondContact O-N 3.3Å; T1379-L1397 HydrophobicContact CG2-CD1 3.48Å; T1379-L1397 HydrophobicContact CG2-CD2 4.06Å; T1379-L1397 HydrophobicContact CG2-CG 3.89Å; T1379-L1397 VanDerWaalsContact OG1-CD1 3.32Å; T1379-L1397 WeakPolarHBondContact OG1-CD1 3.35Å; T1379-L1401 HydrophobicContact CG2-CD1 3.94Å; T1379-L1401 HydrophobicContact CG2-CD2 4.17Å; T1379-L1401 HydrophobicContact CG2-CG 4.13Å; T1379-L1401 VanDerWaalsContact OG1-CD2 3.27Å; T1379-L1401 WeakPolarHBondContact OG1-CD2 3.38Å
1380T73Confident76.9Confident47.8 Ų47.837 Ų3729%0.29320%0.2SC..Hα-helixtrans-55-34.9177.2600000113.1I1376 D1377 S1378 Y1435I1376-T1380 PolarHBondContact O-N 3.18Å; D1377-T1380 PolarHBondContact O-N 3.08Å; D1377-T1380 PolarHBondContact O-OG1 3.14Å; S1378-T1380 VanDerWaalsContact C-N 3.29Å; S1378-T1380 PolarHBondContact O-N 3.05Å; T1380-Y1435 HydrophobicContact CG2-CD1 4.5Å; T1380-Y1435 HydrophobicContact CG2-CE1 3.6Å; T1380-Y1435 VanDerWaalsContact CG2-CE1 3.45Å; T1380-Y1435 WeakPolarHBondContact CG2-OH 3.47Å
1381H70.4Confident76.1Confident119.8 Ų119.837.5 Ų37.556%0.55520%0.202SC*.Hα-helixtrans-70-47.3174.9-178.8-89.9000111.8S1378 T1379 L1383 Q1384S1378-H1381 PolarHBondContact O-N 2.99Å; T1379-H1381 PolarHBondContact O-N 3.18Å; T1379-H1381 VanDerWaalsContact O-N 3.14Å; H1381-L1383 VanDerWaalsContact C-N 3.31Å; H1381-L1383 PolarHBondContact O-N 3.15Å; H1381-Q1384 WeakPolarHBondContact O-CB 3.1Å; H1381-Q1384 PolarHBondContact O-N 3.19Å
1382W69.9Low75.2Confident39.8 Ų39.840 Ų4015%0.15121%0.214CC..Hα-helixtrans-67.4-30.9-179.6-64.4106.1000113.5M1190 V1192 I1194 L1229 S1378 T1379 Q1384 S1385 I1386 L1389 F1393 L1397M1190-W1382 HydrophobicContact CE-CZ2 4.45Å; M1190-W1382 HydrophobicContact SD-CZ2 4.35Å; V1192-W1382 HydrophobicContact CB-CH2 4.06Å; V1192-W1382 HydrophobicContact CB-CZ2 4.37Å; V1192-W1382 HydrophobicContact CG1-CH2 4.45Å; I1194-W1382 HydrophobicContact CB-CH2 4.1Å; I1194-W1382 HydrophobicContact CD1-CD2 4.38Å; I1194-W1382 HydrophobicContact CD1-CE3 3.88Å; I1194-W1382 HydrophobicContact CD1-CH2 3.45Å; I1194-W1382 VanDerWaalsContact CD1-CH2 3.5Å; I1194-W1382 HydrophobicContact CD1-CZ2 4Å; I1194-W1382 HydrophobicContact CD1-CZ3 3.27Å; I1194-W1382 HydrophobicContact CG1-CE3 4.37Å; I1194-W1382 HydrophobicContact CG1-CH2 3.74Å; I1194-W1382 HydrophobicContact CG1-CZ2 4.35Å; I1194-W1382 HydrophobicContact CG1-CZ3 3.53Å; I1194-W1382 VanDerWaalsContact CG1-CZ3 3.44Å; I1194-W1382 HydrophobicContact CG2-CH2 4.13Å; I1194-W1382 HydrophobicContact CG2-CZ3 4.09Å; L1229-W1382 HydrophobicContact CD2-CH2 4Å; L1229-W1382 HydrophobicContact CD2-CZ3 3.93Å; S1378-W1382 VanDerWaalsContact O-CD1 3.25Å; T1379-W1382 CarbonylContact O-C 3.55Å; T1379-W1382 WeakPolarHBondContact O-CB 3.32Å; T1379-W1382 PolarHBondContact O-N 3.12Å; T1379-W1382 VanDerWaalsContact O-N 3.09Å; W1382-Q1384 VanDerWaalsContact C-N 3.27Å; W1382-Q1384 PolarHBondContact O-N 3.06Å; W1382-S1385 CarbonylContact O-C 3.37Å; W1382-S1385 PolarHBondContact O-N 3.18Å; W1382-S1385 VanDerWaalsContact O-N 3.17Å; W1382-S1385 PolarHBondContact O-OG 3.21Å; W1382-I1386 PolarHBondContact O-N 3.19Å; W1382-I1386 VanDerWaalsContact O-N 3.11Å; W1382-L1389 HydrophobicContact CB-CD1 4.46Å; W1382-L1389 HydrophobicContact CE3-CD1 3.96Å; W1382-L1389 HydrophobicContact CE3-CD2 3.84Å; W1382-L1389 HydrophobicContact CE3-CG 4.4Å; W1382-L1389 HydrophobicContact CZ3-CD1 4.43Å; W1382-L1389 HydrophobicContact CZ3-CD2 3.78Å; W1382-F1393 HydrophobicContact CB-CE1 4.5Å; W1382-F1393 HydrophobicContact CD2-CE1 4.26Å; W1382-F1393 AromaticContact CD2-CZ 3.99Å; W1382-F1393 HydrophobicContact CD2-CZ 4.13Å; W1382-F1393 AromaticContact CE3-CE1 3.81Å; W1382-F1393 HydrophobicContact CE3-CE1 3.95Å; W1382-F1393 AromaticContact CE3-CZ 3.9Å; W1382-F1393 HydrophobicContact CE3-CZ 4.01Å; W1382-F1393 HydrophobicContact CG-CZ 4.42Å; W1382-F1393 HydrophobicContact CH2-CZ 4.4Å; W1382-F1393 HydrophobicContact CZ3-CE1 4.24Å; W1382-F1393 HydrophobicContact CZ3-CZ 4.04Å; W1382-L1397 HydrophobicContact CB-CD2 3.81Å
1383L71.4Confident74.4Confident22.8 Ų22.840.6 Ų40.612%0.11922%0.216CC..Hα-helixtrans-61.4-32.7178.2-118.5107000112.4T1379 H1381 S1385 I1386 L1397 Q1398 L1401 D1439 L1444T1379-L1383 HydrophobicContact CG2-CD1 3.83Å; T1379-L1383 WeakPolarHBondContact O-CB 3.2Å; T1379-L1383 VanDerWaalsContact O-CD1 3.28Å; T1379-L1383 WeakPolarHBondContact O-CD1 3.21Å; T1379-L1383 WeakPolarHBondContact O-CG 3.46Å; T1379-L1383 PolarHBondContact O-N 3.3Å; H1381-L1383 VanDerWaalsContact C-N 3.31Å; H1381-L1383 PolarHBondContact O-N 3.15Å; L1383-S1385 PolarHBondContact O-N 3.28Å; L1383-I1386 HydrophobicContact CD1-CD1 3.95Å; L1383-I1386 HydrophobicContact CG-CD1 4.09Å; L1383-I1386 PolarHBondContact O-N 2.85Å; L1383-L1397 HydrophobicContact CD1-CD2 4.37Å; L1383-Q1398 VanDerWaalsContact CD1-NE2 3.25Å; L1383-L1401 HydrophobicContact CD1-CD1 4Å; L1383-D1439 VanDerWaalsContact CD2-OD1 3.23Å; L1383-D1439 WeakPolarHBondContact CD2-OD1 3.3Å; L1383-L1444 HydrophobicContact CD1-CD1 4.03Å; L1383-L1444 HydrophobicContact CD2-CD1 3.76Å; L1383-L1444 HydrophobicContact CD2-CD2 4.41Å; L1383-L1444 HydrophobicContact CD2-CG 4.49Å; L1383-L1444 HydrophobicContact CG-CD1 3.73Å
1384Q69.2Low73.8Confident152 Ų15240.5 Ų40.571%0.7122%0.216SC*.Hα-helixtrans-72.1-24.1177.9-65.1178.4-4.600112.5H1381 W1382H1381-Q1384 WeakPolarHBondContact O-CB 3.1Å; H1381-Q1384 PolarHBondContact O-N 3.19Å; W1382-Q1384 VanDerWaalsContact C-N 3.27Å; W1382-Q1384 PolarHBondContact O-N 3.06Å
1385S67.4Low73.4Confident33.4 Ų33.437.5 Ų37.523%0.23420%0.199CC..THydrogen-bonded Turntrans-110.516.9-179.1460000113.6W1382 L1383 T1387 T1388 L1389W1382-S1385 CarbonylContact O-C 3.37Å; W1382-S1385 PolarHBondContact O-N 3.18Å; W1382-S1385 VanDerWaalsContact O-N 3.17Å; W1382-S1385 PolarHBondContact O-OG 3.21Å; L1383-S1385 PolarHBondContact O-N 3.28Å; S1385-T1387 PolarHBondContact O-N 3.27Å; S1385-T1387 VanDerWaalsContact O-N 3.13Å; S1385-T1388 PolarHBondContact O-N 3Å; S1385-T1388 PolarHBondContact O-OG1 3.09Å; S1385-L1389 WeakPolarHBondContact O-CG 3.3Å; S1385-L1389 PolarHBondContact O-N 3.18Å
1386I68.5Low73.1Confident3.8 Ų3.837.4 Ų37.42%0.01920%0.199CC..G310 helixtrans-58.9-28.7-171.9-140.4164000114.1W1382 L1383 T1388 L1389 S1394 L1397 Q1398 L1444 I1465W1382-I1386 PolarHBondContact O-N 3.19Å; W1382-I1386 VanDerWaalsContact O-N 3.11Å; L1383-I1386 HydrophobicContact CD1-CD1 3.95Å; L1383-I1386 HydrophobicContact CG-CD1 4.09Å; L1383-I1386 PolarHBondContact O-N 2.85Å; I1386-T1388 VanDerWaalsContact C-N 3.3Å; I1386-T1388 PolarHBondContact O-N 3.03Å; I1386-L1389 PolarHBondContact O-N 3.19Å; I1386-S1394 VanDerWaalsContact CG1-OG 3.31Å; I1386-S1394 WeakPolarHBondContact CG1-OG 3.34Å; I1386-S1394 PolarHBondContact O-OG 3Å; I1386-S1394 VanDerWaalsContact O-OG 3.1Å; I1386-L1397 HydrophobicContact CD1-CD2 4.43Å; I1386-Q1398 HydrophobicContact CD1-CG 4.12Å; I1386-Q1398 VanDerWaalsContact CD1-NE2 3.35Å; I1386-L1444 HydrophobicContact CB-CD2 4.32Å; I1386-L1444 HydrophobicContact CD1-CD1 4.27Å; I1386-L1444 HydrophobicContact CD1-CD2 3.77Å; I1386-L1444 VanDerWaalsContact CD1-CD2 3.47Å; I1386-L1444 HydrophobicContact CD1-CG 4.16Å; I1386-L1444 HydrophobicContact CG1-CD2 4.37Å; I1386-L1444 HydrophobicContact CG2-CD1 4.06Å; I1386-L1444 HydrophobicContact CG2-CD2 3.75Å; I1386-L1444 HydrophobicContact CG2-CG 4.12Å; I1386-I1465 HydrophobicContact CD1-CG2 4.35Å
1387T64.3Low72.9Confident33.2 Ų33.237.5 Ų37.520%0.20420%0.2CC..G310 helixtrans-72.3-20.7178.952.30000113.4S1385 L1445 V1453 C1454S1385-T1387 PolarHBondContact O-N 3.27Å; S1385-T1387 VanDerWaalsContact O-N 3.13Å; T1387-L1445 HydrophobicContact CG2-CD2 3.9Å; T1387-V1453 VanDerWaalsContact OG1-CG1 3.32Å; T1387-V1453 WeakPolarHBondContact OG1-CG1 3.27Å; T1387-C1454 VanDerWaalsContact CG2-SG 3.59Å
1388T64.3Low72.9Confident94.2 Ų94.235.2 Ų35.258%0.57819%0.187SC*.G310 helixtrans-93.2-6.417764.60000113S1385 I1386 V1453S1385-T1388 PolarHBondContact O-N 3Å; S1385-T1388 PolarHBondContact O-OG1 3.09Å; I1386-T1388 VanDerWaalsContact C-N 3.3Å; I1386-T1388 PolarHBondContact O-N 3.03Å; T1388-V1453 HydrophobicContact CG2-CG1 4.17Å
1389L68.6Low73.2Confident10 Ų1033.5 Ų33.55%0.05218%0.175CC..SBendtrans-93.2151.7-175.3-66.8165.8000111.5I1194 L1229 W1382 S1385 I1386 F1393 S1394 F1457I1194-L1389 HydrophobicContact CD1-CD2 4.27Å; L1229-L1389 HydrophobicContact CD1-CD2 4.02Å; W1382-L1389 HydrophobicContact CB-CD1 4.46Å; W1382-L1389 HydrophobicContact CE3-CD1 3.96Å; W1382-L1389 HydrophobicContact CE3-CD2 3.84Å; W1382-L1389 HydrophobicContact CE3-CG 4.4Å; W1382-L1389 HydrophobicContact CZ3-CD1 4.43Å; W1382-L1389 HydrophobicContact CZ3-CD2 3.78Å; S1385-L1389 WeakPolarHBondContact O-CG 3.3Å; S1385-L1389 PolarHBondContact O-N 3.18Å; I1386-L1389 PolarHBondContact O-N 3.19Å; L1389-F1393 HydrophobicContact CB-CD1 4.05Å; L1389-F1393 HydrophobicContact CB-CE1 4.47Å; L1389-F1393 HydrophobicContact CD1-CD1 3.77Å; L1389-F1393 HydrophobicContact CD1-CE1 3.67Å; L1389-F1393 VanDerWaalsContact CD1-CE1 3.44Å; L1389-F1393 HydrophobicContact CD2-CD1 4.04Å; L1389-F1393 HydrophobicContact CD2-CE1 4.07Å; L1389-F1393 HydrophobicContact CD2-CG 4.43Å; L1389-F1393 HydrophobicContact CD2-CZ 4.45Å; L1389-F1393 HydrophobicContact CG-CD1 4.16Å; L1389-F1393 HydrophobicContact CG-CE1 4.22Å; L1389-S1394 WeakPolarHBondContact CB-OG 3.41Å; L1389-F1457 WeakPolarHBondContact O-CE1 3.45Å; L1389-F1457 VanDerWaalsContact O-CZ 3.26Å; L1389-F1457 WeakPolarHBondContact O-CZ 3.21Å
1390P72Confident73.7Confident44.4 Ų44.433.4 Ų33.429%0.28818%0.175SC..  trans-57.7146.5172.4-22.432.5000112.3I1194 L1229 H1230 E1392 F1393 S1394I1194-P1390 HydrophobicContact CG2-CG 3.76Å; L1229-P1390 HydrophobicContact CB-CG 4.13Å; H1230-P1390 VanDerWaalsContact NE2-CB 3.29Å; H1230-P1390 WeakPolarHBondContact NE2-CB 3.29Å; P1390-E1392 PolarHBondContact O-N 3.13Å; P1390-E1392 VanDerWaalsContact O-N 3.09Å; P1390-F1393 HydrophobicContact CB-CB 4.39Å; P1390-F1393 HydrophobicContact CG-CB 4.5Å; P1390-F1393 WeakPolarHBondContact O-CB 3.33Å; P1390-F1393 PolarHBondContact O-N 3.19Å; P1390-F1393 VanDerWaalsContact O-N 3.11Å; P1390-S1394 PolarHBondContact O-N 3.17Å; P1390-S1394 PolarHBondContact O-OG 3.2Å; P1390-S1394 VanDerWaalsContact O-OG 3.05Å
1391F74.9Confident74.5Confident23.4 Ų23.431.2 Ų31.210%0.10316%0.161CC..Hα-helixtrans-56.6-45.8-176.2172.1-108.2000112.6T1309 V1310 F1393 S1394 C1395 F1457 Q1461 I1465T1309-F1391 WeakPolarHBondContact O-CE1 3.38Å; V1310-F1391 HydrophobicContact CG1-CE1 4.4Å; V1310-F1391 HydrophobicContact CG2-CE1 4.39Å; F1391-F1393 VanDerWaalsContact C-N 3.3Å; F1391-F1393 PolarHBondContact O-N 3.19Å; F1391-S1394 PolarHBondContact O-N 3.23Å; F1391-C1395 HydrophobicContact CE1-CB 4.38Å; F1391-C1395 HydrophobicContact CE2-CB 4.29Å; F1391-C1395 HydrophobicContact CZ-CB 4.09Å; F1391-C1395 VanDerWaalsContact O-CB 3.26Å; F1391-C1395 WeakPolarHBondContact O-CB 3.27Å; F1391-C1395 PolarHBondContact O-N 2.99Å; F1391-F1457 VanDerWaalsContact CA-CE1 3.48Å; F1391-F1457 HydrophobicContact CB-CD1 3.96Å; F1391-F1457 HydrophobicContact CB-CE1 3.69Å; F1391-F1457 AromaticContact CD2-CD1 3.95Å; F1391-F1457 HydrophobicContact CD2-CD1 4.22Å; F1391-F1457 HydrophobicContact CD2-CE1 4.34Å; F1391-F1457 HydrophobicContact CG-CD1 4.38Å; F1391-F1457 HydrophobicContact CG-CE1 4.39Å; F1391-Q1461 HydrophobicContact CD1-CG 4Å; F1391-Q1461 HydrophobicContact CD2-CB 3.54Å; F1391-Q1461 VanDerWaalsContact CD2-CB 3.48Å; F1391-Q1461 HydrophobicContact CD2-CG 3.59Å; F1391-Q1461 HydrophobicContact CE1-CG 3.88Å; F1391-Q1461 HydrophobicContact CE2-CB 3.38Å; F1391-Q1461 VanDerWaalsContact CE2-CB 3.42Å; F1391-Q1461 HydrophobicContact CE2-CG 3.48Å; F1391-Q1461 VanDerWaalsContact CE2-CG 3.48Å; F1391-Q1461 HydrophobicContact CG-CB 4.29Å; F1391-Q1461 HydrophobicContact CG-CG 3.86Å; F1391-Q1461 HydrophobicContact CZ-CB 4.01Å; F1391-Q1461 HydrophobicContact CZ-CG 3.63Å; F1391-I1465 HydrophobicContact CD2-CD1 3.78Å; F1391-I1465 HydrophobicContact CD2-CG1 4.37Å; F1391-I1465 HydrophobicContact CE2-CD1 3.82Å; F1391-I1465 HydrophobicContact CE2-CG1 3.99Å
1392E70.7Confident75.3Confident54.4 Ų54.425.5 Ų25.525%0.25414%0.135SC..Hα-helixtrans-59.5-43.8179.8-175.4166.9-163.500111.4H1230 T1234 S1236 V1310 T1312 P1390 S1394 C1395 T1396H1230-E1392 IonicContact CE1-OE2 2.95Å; H1230-E1392 IonicContact CG-OE2 3.92Å; H1230-E1392 IonicContact ND1-OE2 3.39Å; H1230-E1392 PolarHBondContact ND1-OE2 3.21Å; T1234-E1392 HydrophobicContact CG2-CG 4.47Å; S1236-E1392 VanDerWaalsContact CB-OE1 3.26Å; S1236-E1392 WeakPolarHBondContact CB-OE1 3.07Å; S1236-E1392 WeakPolarHBondContact CB-OE2 2.9Å; S1236-E1392 PolarHBondContact OG-OE1 2.93Å; S1236-E1392 PolarHBondContact OG-OE2 2.94Å; V1310-E1392 HydrophobicContact CG1-CB 3.81Å; V1310-E1392 HydrophobicContact CG1-CG 3.7Å; T1312-E1392 WeakPolarHBondContact CG2-OE1 3.28Å; P1390-E1392 PolarHBondContact O-N 3.13Å; P1390-E1392 VanDerWaalsContact O-N 3.09Å; E1392-S1394 VanDerWaalsContact C-N 3.34Å; E1392-S1394 PolarHBondContact O-N 2.95Å; E1392-C1395 PolarHBondContact O-N 3.18Å; E1392-T1396 WeakPolarHBondContact O-CB 3.45Å; E1392-T1396 WeakPolarHBondContact O-CG2 3.22Å; E1392-T1396 PolarHBondContact O-N 3.16Å; E1392-T1396 PolarHBondContact O-OG1 3.22Å
1393F74.3Confident76.2Confident12.4 Ų12.423.9 Ų23.95%0.05413%0.129CC..Hα-helixtrans-61.4-50.6175.8-177-88000111.1W1188 P1189 M1190 I1194 L1229 V1232 T1234 W1382 L1389 P1390 F1391 C1395 T1396 L1397W1188-F1393 AromaticContact CE2-CE2 3.9Å; W1188-F1393 AromaticContact CE2-CZ 3.94Å; W1188-F1393 HydrophobicContact CZ2-CD2 4.21Å; W1188-F1393 HydrophobicContact CZ2-CE1 4.35Å; W1188-F1393 AromaticContact CZ2-CE2 3.64Å; W1188-F1393 HydrophobicContact CZ2-CE2 3.64Å; W1188-F1393 AromaticContact CZ2-CZ 3.78Å; W1188-F1393 HydrophobicContact CZ2-CZ 3.78Å; W1188-F1393 AromaticContact NE1-CD2 3.95Å; W1188-F1393 AromaticContact NE1-CE2 3.59Å; W1188-F1393 AromaticContact NE1-CZ 3.52Å; P1189-F1393 WeakPolarHBondContact O-CE2 3.3Å; M1190-F1393 HydrophobicContact CE-CE1 4.42Å; M1190-F1393 HydrophobicContact CE-CE2 3.65Å; M1190-F1393 HydrophobicContact CE-CZ 3.43Å; M1190-F1393 VanDerWaalsContact CE-CZ 3.43Å; M1190-F1393 HydrophobicContact SD-CZ 4.5Å; I1194-F1393 HydrophobicContact CD1-CZ 4.29Å; L1229-F1393 VanDerWaalsContact O-CD2 3.29Å; L1229-F1393 WeakPolarHBondContact O-CD2 3.26Å; V1232-F1393 HydrophobicContact CB-CE2 4.03Å; V1232-F1393 HydrophobicContact CG1-CE2 3.97Å; V1232-F1393 WeakPolarHBondContact O-CE2 3.36Å; T1234-F1393 HydrophobicContact CG2-CB 4.2Å; T1234-F1393 HydrophobicContact CG2-CD2 3.83Å; W1382-F1393 HydrophobicContact CB-CE1 4.5Å; W1382-F1393 HydrophobicContact CD2-CE1 4.26Å; W1382-F1393 AromaticContact CD2-CZ 3.99Å; W1382-F1393 HydrophobicContact CD2-CZ 4.13Å; W1382-F1393 AromaticContact CE3-CE1 3.81Å; W1382-F1393 HydrophobicContact CE3-CE1 3.95Å; W1382-F1393 AromaticContact CE3-CZ 3.9Å; W1382-F1393 HydrophobicContact CE3-CZ 4.01Å; W1382-F1393 HydrophobicContact CG-CZ 4.42Å; W1382-F1393 HydrophobicContact CH2-CZ 4.4Å; W1382-F1393 HydrophobicContact CZ3-CE1 4.24Å; W1382-F1393 HydrophobicContact CZ3-CZ 4.04Å; L1389-F1393 HydrophobicContact CB-CD1 4.05Å; L1389-F1393 HydrophobicContact CB-CE1 4.47Å; L1389-F1393 HydrophobicContact CD1-CD1 3.77Å; L1389-F1393 HydrophobicContact CD1-CE1 3.67Å; L1389-F1393 VanDerWaalsContact CD1-CE1 3.44Å; L1389-F1393 HydrophobicContact CD2-CD1 4.04Å; L1389-F1393 HydrophobicContact CD2-CE1 4.07Å; L1389-F1393 HydrophobicContact CD2-CG 4.43Å; L1389-F1393 HydrophobicContact CD2-CZ 4.45Å; L1389-F1393 HydrophobicContact CG-CD1 4.16Å; L1389-F1393 HydrophobicContact CG-CE1 4.22Å; P1390-F1393 HydrophobicContact CB-CB 4.39Å; P1390-F1393 HydrophobicContact CG-CB 4.5Å; P1390-F1393 WeakPolarHBondContact O-CB 3.33Å; P1390-F1393 PolarHBondContact O-N 3.19Å; P1390-F1393 VanDerWaalsContact O-N 3.11Å; F1391-F1393 VanDerWaalsContact C-N 3.3Å; F1391-F1393 PolarHBondContact O-N 3.19Å; F1393-C1395 VanDerWaalsContact C-N 3.32Å; F1393-C1395 PolarHBondContact O-N 3.25Å; F1393-T1396 WeakPolarHBondContact CA-OG1 3.37Å; F1393-T1396 PolarHBondContact O-N 3.07Å; F1393-T1396 PolarHBondContact O-OG1 3.5Å; F1393-L1397 HydrophobicContact CE1-CD2 4.2Å; F1393-L1397 VanDerWaalsContact O-CB 3.28Å; F1393-L1397 WeakPolarHBondContact O-CB 3.4Å; F1393-L1397 PolarHBondContact O-N 3.03Å
1394S76.7Confident77.1Confident0.2 Ų0.222.8 Ų22.80%0.00112%0.123CC..Hα-helixtrans-61.1-40.9179.4-64.30000112.4I1386 L1389 P1390 F1391 E1392 Q1398I1386-S1394 VanDerWaalsContact CG1-OG 3.31Å; I1386-S1394 WeakPolarHBondContact CG1-OG 3.34Å; I1386-S1394 PolarHBondContact O-OG 3Å; I1386-S1394 VanDerWaalsContact O-OG 3.1Å; L1389-S1394 WeakPolarHBondContact CB-OG 3.41Å; P1390-S1394 PolarHBondContact O-N 3.17Å; P1390-S1394 PolarHBondContact O-OG 3.2Å; P1390-S1394 VanDerWaalsContact O-OG 3.05Å; F1391-S1394 PolarHBondContact O-N 3.23Å; E1392-S1394 VanDerWaalsContact C-N 3.34Å; E1392-S1394 PolarHBondContact O-N 2.95Å; S1394-Q1398 VanDerWaalsContact O-CG 3.29Å; S1394-Q1398 WeakPolarHBondContact O-CG 3.36Å; S1394-Q1398 PolarHBondContact O-N 3.22Å; S1394-Q1398 VanDerWaalsContact O-N 3.11Å
1395C79.4Confident78.2Confident0 Ų015.6 Ų15.60%09%0.09CC..Hα-helixtrans-66.4-48.7177.7-171.50000111.2V1310 F1391 E1392 F1393 L1397 Q1398 W1399V1310-C1395 HydrophobicContact CG2-CB 4.11Å; V1310-C1395 VanDerWaalsContact CG2-SG 3.57Å; F1391-C1395 HydrophobicContact CE1-CB 4.38Å; F1391-C1395 HydrophobicContact CE2-CB 4.29Å; F1391-C1395 HydrophobicContact CZ-CB 4.09Å; F1391-C1395 VanDerWaalsContact O-CB 3.26Å; F1391-C1395 WeakPolarHBondContact O-CB 3.27Å; F1391-C1395 PolarHBondContact O-N 2.99Å; E1392-C1395 PolarHBondContact O-N 3.18Å; F1393-C1395 VanDerWaalsContact C-N 3.32Å; F1393-C1395 PolarHBondContact O-N 3.25Å; C1395-L1397 VanDerWaalsContact C-N 3.31Å; C1395-L1397 PolarHBondContact O-N 3.09Å; C1395-Q1398 PolarHBondContact O-N 3.11Å; C1395-W1399 VanDerWaalsContact O-CB 3.27Å; C1395-W1399 WeakPolarHBondContact O-CB 3.31Å; C1395-W1399 PolarHBondContact O-N 3.13Å
1396T78.5Confident79.3Confident3.2 Ų3.214.3 Ų14.32%0.028%0.08CC..Hα-helixtrans-61.6-40.6178.8-30.80000112.1W1188 T1234 Y1306 P1316 I1319 E1392 F1393 Q1398 W1399 N1400W1188-T1396 HydrophobicContact CH2-CG2 3.53Å; W1188-T1396 HydrophobicContact CZ3-CG2 3.82Å; T1234-T1396 HydrophobicContact CG2-CG2 4.41Å; Y1306-T1396 HydrophobicContact CE2-CG2 3.96Å; Y1306-T1396 WeakPolarHBondContact OH-CG2 3.42Å; Y1306-T1396 PolarHBondContact OH-OG1 3.14Å; P1316-T1396 HydrophobicContact CB-CG2 4.02Å; P1316-T1396 HydrophobicContact CG-CG2 3.73Å; I1319-T1396 HydrophobicContact CD1-CG2 3.83Å; I1319-T1396 VanDerWaalsContact CD1-CG2 3.45Å; I1319-T1396 HydrophobicContact CG1-CG2 4.06Å; E1392-T1396 WeakPolarHBondContact O-CB 3.45Å; E1392-T1396 WeakPolarHBondContact O-CG2 3.22Å; E1392-T1396 PolarHBondContact O-N 3.16Å; E1392-T1396 PolarHBondContact O-OG1 3.22Å; F1393-T1396 WeakPolarHBondContact CA-OG1 3.37Å; F1393-T1396 PolarHBondContact O-N 3.07Å; F1393-T1396 PolarHBondContact O-OG1 3.5Å; T1396-Q1398 PolarHBondContact O-N 3.49Å; T1396-W1399 WeakPolarHBondContact O-CB 3.39Å; T1396-W1399 PolarHBondContact O-N 3Å; T1396-N1400 WeakPolarHBondContact O-CB 3.27Å; T1396-N1400 VanDerWaalsContact O-CG 3.23Å; T1396-N1400 PolarHBondContact O-N 2.94Å; T1396-N1400 PolarHBondContact O-ND2 3.14Å
1397L81.7Confident80.4Confident3.6 Ų3.614.1 Ų14.12%0.0198%0.079CC..Hα-helixtrans-60-51.8177.1-17169000111.6W1188 M1190 T1379 W1382 L1383 I1386 F1393 C1395 W1399 N1400 L1401W1188-L1397 HydrophobicContact CD2-CD1 4.38Å; W1188-L1397 HydrophobicContact CH2-CD1 4.27Å; W1188-L1397 HydrophobicContact CZ2-CB 4.36Å; W1188-L1397 HydrophobicContact CZ2-CD1 3.8Å; M1190-L1397 HydrophobicContact CE-CD1 3.45Å; M1190-L1397 VanDerWaalsContact CE-CD1 3.45Å; M1190-L1397 HydrophobicContact SD-CD1 4.1Å; T1379-L1397 HydrophobicContact CG2-CD1 3.48Å; T1379-L1397 HydrophobicContact CG2-CD2 4.06Å; T1379-L1397 HydrophobicContact CG2-CG 3.89Å; T1379-L1397 VanDerWaalsContact OG1-CD1 3.32Å; T1379-L1397 WeakPolarHBondContact OG1-CD1 3.35Å; W1382-L1397 HydrophobicContact CB-CD2 3.81Å; L1383-L1397 HydrophobicContact CD1-CD2 4.37Å; I1386-L1397 HydrophobicContact CD1-CD2 4.43Å; F1393-L1397 HydrophobicContact CE1-CD2 4.2Å; F1393-L1397 VanDerWaalsContact O-CB 3.28Å; F1393-L1397 WeakPolarHBondContact O-CB 3.4Å; F1393-L1397 PolarHBondContact O-N 3.03Å; C1395-L1397 VanDerWaalsContact C-N 3.31Å; C1395-L1397 PolarHBondContact O-N 3.09Å; L1397-W1399 VanDerWaalsContact C-N 3.29Å; L1397-W1399 PolarHBondContact O-N 3.03Å; L1397-N1400 PolarHBondContact O-N 2.79Å; L1397-L1401 HydrophobicContact CG-CD1 4.43Å; L1397-L1401 WeakPolarHBondContact O-CB 3.43Å; L1397-L1401 VanDerWaalsContact O-CG 3.31Å; L1397-L1401 WeakPolarHBondContact O-CG 3.25Å; L1397-L1401 PolarHBondContact O-N 3.1Å; L1397-L1401 VanDerWaalsContact O-N 3.09Å
1398Q83.2Confident81.8Confident0.2 Ų0.212.5 Ų12.50%0.0017%0.069CC..Hα-helixtrans-63.8-36.1178.2-69-61.7-30.400112L1383 I1386 S1394 C1395 T1396 L1401 A1402 L1444 I1465 L1468L1383-Q1398 VanDerWaalsContact CD1-NE2 3.25Å; I1386-Q1398 HydrophobicContact CD1-CG 4.12Å; I1386-Q1398 VanDerWaalsContact CD1-NE2 3.35Å; S1394-Q1398 VanDerWaalsContact O-CG 3.29Å; S1394-Q1398 WeakPolarHBondContact O-CG 3.36Å; S1394-Q1398 PolarHBondContact O-N 3.22Å; S1394-Q1398 VanDerWaalsContact O-N 3.11Å; C1395-Q1398 PolarHBondContact O-N 3.11Å; T1396-Q1398 PolarHBondContact O-N 3.49Å; Q1398-L1401 PolarHBondContact O-N 3.09Å; Q1398-A1402 WeakPolarHBondContact O-CB 3.35Å; Q1398-A1402 PolarHBondContact O-N 3.28Å; Q1398-L1444 HydrophobicContact CG-CD2 4.49Å; Q1398-I1465 HydrophobicContact CG-CG2 4.41Å; Q1398-L1468 HydrophobicContact CB-CB 3.8Å; Q1398-L1468 HydrophobicContact CB-CD1 4.09Å
1399W84Confident83.2Confident2.8 Ų2.89.5 Ų9.51%0.0115%0.047CC..Hα-helixtrans-65.3-50.5178-161.9-68.9000112.2F1305 Y1306 T1309 I1319 C1395 T1396 L1397 L1401 A1402 L1403 L1468 L1587F1305-W1399 HydrophobicContact CB-CH2 4.23Å; F1305-W1399 AromaticContact CD1-CH2 3.43Å; F1305-W1399 HydrophobicContact CD1-CH2 3.43Å; F1305-W1399 VanDerWaalsContact CD1-CH2 3.47Å; F1305-W1399 AromaticContact CD1-CZ2 3.93Å; F1305-W1399 HydrophobicContact CD1-CZ2 4.01Å; F1305-W1399 AromaticContact CD1-CZ3 3.72Å; F1305-W1399 HydrophobicContact CD1-CZ3 3.91Å; F1305-W1399 AromaticContact CE1-CH2 3.86Å; F1305-W1399 HydrophobicContact CE1-CH2 3.96Å; F1305-W1399 AromaticContact CE1-CZ3 3.96Å; F1305-W1399 HydrophobicContact CE1-CZ3 4.21Å; F1305-W1399 HydrophobicContact CG-CH2 4.13Å; Y1306-W1399 VanDerWaalsContact CA-CH2 3.48Å; Y1306-W1399 AromaticContact CD2-CD2 3.93Å; Y1306-W1399 HydrophobicContact CD2-CD2 3.99Å; Y1306-W1399 AromaticContact CD2-CE3 3.79Å; Y1306-W1399 HydrophobicContact CD2-CE3 3.84Å; Y1306-W1399 HydrophobicContact CD2-CG 4.37Å; Y1306-W1399 HydrophobicContact CD2-CH2 4.39Å; Y1306-W1399 HydrophobicContact CD2-CZ2 4.49Å; Y1306-W1399 AromaticContact CD2-CZ3 3.94Å; Y1306-W1399 HydrophobicContact CD2-CZ3 4.14Å; Y1306-W1399 HydrophobicContact CG-CE3 4.46Å; Y1306-W1399 HydrophobicContact CG-CZ3 4.47Å; T1309-W1399 HydrophobicContact CG2-CZ3 4.29Å; T1309-W1399 WeakPolarHBondContact OG1-CZ3 3.24Å; I1319-W1399 HydrophobicContact CD1-CB 3.98Å; I1319-W1399 VanDerWaalsContact CD1-CD1 3.5Å; I1319-W1399 HydrophobicContact CD1-CD2 4.38Å; I1319-W1399 HydrophobicContact CD1-CG 3.81Å; I1319-W1399 HydrophobicContact CG1-CG 4.39Å; C1395-W1399 VanDerWaalsContact O-CB 3.27Å; C1395-W1399 WeakPolarHBondContact O-CB 3.31Å; C1395-W1399 PolarHBondContact O-N 3.13Å; T1396-W1399 WeakPolarHBondContact O-CB 3.39Å; T1396-W1399 PolarHBondContact O-N 3Å; L1397-W1399 VanDerWaalsContact C-N 3.29Å; L1397-W1399 PolarHBondContact O-N 3.03Å; W1399-L1401 VanDerWaalsContact C-N 3.28Å; W1399-L1401 PolarHBondContact O-N 3.07Å; W1399-A1402 PolarHBondContact O-N 3.08Å; W1399-L1403 WeakPolarHBondContact O-CG 3.26Å; W1399-L1403 PolarHBondContact O-N 3.09Å; W1399-L1468 HydrophobicContact CB-CD1 4.47Å; W1399-L1468 HydrophobicContact CD2-CD2 4.3Å; W1399-L1468 HydrophobicContact CE3-CD1 3.92Å; W1399-L1468 HydrophobicContact CE3-CD2 3.9Å; W1399-L1468 HydrophobicContact CE3-CG 4.46Å; W1399-L1468 HydrophobicContact CZ3-CD2 4.43Å; W1399-L1587 HydrophobicContact CD2-CD2 4.36Å; W1399-L1587 HydrophobicContact CE3-CD1 4.43Å; W1399-L1587 HydrophobicContact CH2-CD1 4.01Å; W1399-L1587 HydrophobicContact CH2-CD2 4.2Å; W1399-L1587 HydrophobicContact CH2-CG 4.04Å; W1399-L1587 HydrophobicContact CZ2-CD1 4.12Å; W1399-L1587 HydrophobicContact CZ2-CD2 4.09Å; W1399-L1587 HydrophobicContact CZ2-CG 4.31Å; W1399-L1587 HydrophobicContact CZ3-CD1 4.23Å
1400N86Confident84.2Confident0.2 Ų0.210.8 Ų10.80%0.0015%0.053CC..Hα-helixtrans-58.7-43176.6-78-32.3000110.9W1188 S1318 I1319 L1322 M1375 T1396 L1397 A1402 L1403 I1404W1188-N1400 VanDerWaalsContact CZ3-ND2 3.33Å; W1188-N1400 WeakPolarHBondContact CZ3-ND2 3.16Å; S1318-N1400 VanDerWaalsContact OG-CG 3.3Å; S1318-N1400 PolarHBondContact OG-ND2 3.15Å; S1318-N1400 PolarHBondContact OG-OD1 3.39Å; I1319-N1400 WeakPolarHBondContact CG1-OD1 3.38Å; I1319-N1400 PolarHBondContact N-OD1 3.21Å; L1322-N1400 HydrophobicContact CD1-CB 4.06Å; L1322-N1400 WeakPolarHBondContact CD1-OD1 3.37Å; M1375-N1400 HydrophobicContact CE-CB 3.48Å; M1375-N1400 HydrophobicContact SD-CB 3.87Å; T1396-N1400 WeakPolarHBondContact O-CB 3.27Å; T1396-N1400 VanDerWaalsContact O-CG 3.23Å; T1396-N1400 PolarHBondContact O-N 2.94Å; T1396-N1400 PolarHBondContact O-ND2 3.14Å; L1397-N1400 PolarHBondContact O-N 2.79Å; N1400-A1402 PolarHBondContact O-N 2.88Å; N1400-L1403 PolarHBondContact O-N 3.12Å; N1400-I1404 WeakPolarHBondContact O-CB 3.45Å; N1400-I1404 VanDerWaalsContact O-CG1 3.27Å; N1400-I1404 WeakPolarHBondContact O-CG1 3.42Å; N1400-I1404 PolarHBondContact O-N 3.15Å
1401L88.8Confident85.2Confident0.8 Ų0.88.8 Ų8.80%0.0044%0.04CC..Hα-helixtrans-62.3-45.1176.6-73.2169.3000112.7M1375 I1376 T1379 L1383 L1397 Q1398 W1399 L1403 I1404 W1405 R1472M1375-L1401 HydrophobicContact CE-CB 4.45Å; M1375-L1401 HydrophobicContact CE-CD2 3.73Å; M1375-L1401 HydrophobicContact CE-CG 3.89Å; I1376-L1401 HydrophobicContact CB-CD2 4.39Å; I1376-L1401 HydrophobicContact CG1-CD2 4.23Å; I1376-L1401 HydrophobicContact CG2-CD2 4.01Å; T1379-L1401 HydrophobicContact CG2-CD1 3.94Å; T1379-L1401 HydrophobicContact CG2-CD2 4.17Å; T1379-L1401 HydrophobicContact CG2-CG 4.13Å; T1379-L1401 VanDerWaalsContact OG1-CD2 3.27Å; T1379-L1401 WeakPolarHBondContact OG1-CD2 3.38Å; L1383-L1401 HydrophobicContact CD1-CD1 4Å; L1397-L1401 HydrophobicContact CG-CD1 4.43Å; L1397-L1401 WeakPolarHBondContact O-CB 3.43Å; L1397-L1401 VanDerWaalsContact O-CG 3.31Å; L1397-L1401 WeakPolarHBondContact O-CG 3.25Å; L1397-L1401 PolarHBondContact O-N 3.1Å; L1397-L1401 VanDerWaalsContact O-N 3.09Å; Q1398-L1401 PolarHBondContact O-N 3.09Å; W1399-L1401 VanDerWaalsContact C-N 3.28Å; W1399-L1401 PolarHBondContact O-N 3.07Å; L1401-L1403 VanDerWaalsContact C-N 3.3Å; L1401-L1403 PolarHBondContact O-N 3.11Å; L1401-I1404 PolarHBondContact O-N 3.11Å; L1401-W1405 WeakPolarHBondContact O-CB 3.39Å; L1401-W1405 VanDerWaalsContact O-CD1 3.23Å; L1401-W1405 PolarHBondContact O-N 3.01Å; L1401-R1472 HydrophobicContact CB-CG 4.28Å; L1401-R1472 VanDerWaalsContact CD1-NH1 3.3Å
1402A87.8Confident86Confident0.4 Ų0.47.8 Ų7.80%0.0034%0.035CC..Hα-helixtrans-58.4-44177.500000111.3Q1398 W1399 N1400 Q1406 L1468 R1472Q1398-A1402 WeakPolarHBondContact O-CB 3.35Å; Q1398-A1402 PolarHBondContact O-N 3.28Å; W1399-A1402 PolarHBondContact O-N 3.08Å; N1400-A1402 PolarHBondContact O-N 2.88Å; A1402-Q1406 WeakPolarHBondContact O-CB 3.35Å; A1402-Q1406 PolarHBondContact O-N 3.18Å; A1402-L1468 HydrophobicContact CB-CD2 4.4Å; A1402-R1472 HydrophobicContact CB-CB 4.41Å
1403L88.2Confident86.9Confident5.8 Ų5.87.9 Ų7.93%0.034%0.042CC..Hα-helixtrans-65.5-44176.4-68.2176.6000112.4I1319 L1322 Q1323 L1326 W1399 N1400 L1401 W1405 Q1406 I1407 L1587I1319-L1403 HydrophobicContact CG2-CD1 4.38Å; L1322-L1403 HydrophobicContact CB-CB 4.14Å; L1322-L1403 HydrophobicContact CB-CD1 3.79Å; L1322-L1403 HydrophobicContact CD1-CB 4.3Å; L1322-L1403 HydrophobicContact CD1-CD1 4.46Å; Q1323-L1403 HydrophobicContact CG-CD1 3.86Å; Q1323-L1403 HydrophobicContact CG-CD2 4.34Å; L1326-L1403 HydrophobicContact CD2-CD2 4.14Å; W1399-L1403 WeakPolarHBondContact O-CG 3.26Å; W1399-L1403 PolarHBondContact O-N 3.09Å; N1400-L1403 PolarHBondContact O-N 3.12Å; L1401-L1403 VanDerWaalsContact C-N 3.3Å; L1401-L1403 PolarHBondContact O-N 3.11Å; L1403-W1405 PolarHBondContact O-N 3.01Å; L1403-Q1406 WeakPolarHBondContact O-CB 3.3Å; L1403-Q1406 PolarHBondContact O-N 3.14Å; L1403-I1407 WeakPolarHBondContact O-CD1 3.26Å; L1403-I1407 VanDerWaalsContact O-CG1 3.29Å; L1403-I1407 WeakPolarHBondContact O-CG1 3.3Å; L1403-I1407 PolarHBondContact O-N 2.99Å; L1403-L1587 HydrophobicContact CD2-CD2 4.42Å
1404I91.8Very high87.7Confident0.2 Ų0.29.6 Ų9.60%0.0015%0.052CC..Hα-helixtrans-62-47.2179-72179.9000111.1I1186 L1322 M1372 M1375 I1376 N1400 L1401 Q1406 I1407 L1408I1186-I1404 HydrophobicContact CG2-CD1 4.26Å; L1322-I1404 HydrophobicContact CD1-CD1 4.36Å; L1322-I1404 HydrophobicContact CD1-CG1 3.93Å; L1322-I1404 HydrophobicContact CD2-CD1 4.44Å; L1322-I1404 HydrophobicContact CD2-CG1 3.86Å; M1372-I1404 HydrophobicContact CB-CD1 3.94Å; M1372-I1404 HydrophobicContact CB-CG1 4.26Å; M1372-I1404 HydrophobicContact CB-CG2 3.75Å; M1372-I1404 HydrophobicContact CG-CD1 3.86Å; M1372-I1404 HydrophobicContact CG-CG1 3.87Å; M1372-I1404 HydrophobicContact CG-CG2 4.11Å; M1372-I1404 HydrophobicContact SD-CG1 4.49Å; M1372-I1404 HydrophobicContact SD-CG2 4.37Å; M1375-I1404 HydrophobicContact CB-CD1 4.1Å; M1375-I1404 HydrophobicContact CE-CD1 3.24Å; M1375-I1404 HydrophobicContact CE-CG1 4.16Å; M1375-I1404 HydrophobicContact CG-CD1 4.41Å; M1375-I1404 HydrophobicContact SD-CD1 3.61Å; M1375-I1404 VanDerWaalsContact SD-CD1 3.58Å; I1376-I1404 HydrophobicContact CD1-CG2 3.62Å; I1376-I1404 VanDerWaalsContact CD1-CG2 3.47Å; I1376-I1404 HydrophobicContact CG1-CG2 3.92Å; N1400-I1404 WeakPolarHBondContact O-CB 3.45Å; N1400-I1404 VanDerWaalsContact O-CG1 3.27Å; N1400-I1404 WeakPolarHBondContact O-CG1 3.42Å; N1400-I1404 PolarHBondContact O-N 3.15Å; L1401-I1404 PolarHBondContact O-N 3.11Å; I1404-Q1406 VanDerWaalsContact C-N 3.27Å; I1404-Q1406 PolarHBondContact O-N 3.3Å; I1404-I1407 WeakPolarHBondContact O-CB 3.27Å; I1404-I1407 PolarHBondContact O-N 3.23Å; I1404-I1407 VanDerWaalsContact O-N 3.12Å; I1404-L1408 HydrophobicContact CG2-CD1 4.28Å; I1404-L1408 HydrophobicContact CG2-CG 4.45Å; I1404-L1408 WeakPolarHBondContact O-CG 3.36Å; I1404-L1408 PolarHBondContact O-N 3.21Å
1405W91.6Very high88.2Confident1.2 Ų1.214.9 Ų14.91%0.0059%0.086CC..Hα-helixtrans-64.8-33.3178.1-79.9104.9000112.2I1376 L1401 L1403 L1408 Y1409 L1431 L1432 Y1435 R1472 W1475 I1476 L1479I1376-W1405 HydrophobicContact CD1-CD2 4.45Å; I1376-W1405 HydrophobicContact CD1-CZ2 4.24Å; I1376-W1405 HydrophobicContact CG2-CZ2 4.01Å; L1401-W1405 WeakPolarHBondContact O-CB 3.39Å; L1401-W1405 VanDerWaalsContact O-CD1 3.23Å; L1401-W1405 PolarHBondContact O-N 3.01Å; L1403-W1405 PolarHBondContact O-N 3.01Å; W1405-L1408 HydrophobicContact CE3-CD1 4.18Å; W1405-L1408 HydrophobicContact CZ3-CD1 4.28Å; W1405-L1408 PolarHBondContact O-N 3.14Å; W1405-Y1409 WeakPolarHBondContact O-CB 3.35Å; W1405-Y1409 PolarHBondContact O-N 3.02Å; W1405-L1431 HydrophobicContact CH2-CD2 3.03Å; W1405-L1431 HydrophobicContact CH2-CG 4.48Å; W1405-L1431 HydrophobicContact CZ2-CD2 3.76Å; W1405-L1431 HydrophobicContact CZ3-CD2 3.63Å; W1405-L1432 HydrophobicContact CH2-CD2 4.49Å; W1405-L1432 HydrophobicContact CZ3-CD2 4.34Å; W1405-Y1435 AromaticContact CH2-CD2 3.71Å; W1405-Y1435 HydrophobicContact CH2-CD2 4.08Å; W1405-Y1435 HydrophobicContact CH2-CE2 4.31Å; W1405-Y1435 AromaticContact CH2-CG 3.98Å; W1405-Y1435 HydrophobicContact CH2-CG 4.19Å; W1405-Y1435 AromaticContact CZ2-CD1 3.99Å; W1405-Y1435 HydrophobicContact CZ2-CD1 4.22Å; W1405-Y1435 AromaticContact CZ2-CD2 3.88Å; W1405-Y1435 HydrophobicContact CZ2-CD2 3.93Å; W1405-Y1435 HydrophobicContact CZ2-CE1 4.29Å; W1405-Y1435 HydrophobicContact CZ2-CE2 4.32Å; W1405-Y1435 AromaticContact CZ2-CG 3.87Å; W1405-Y1435 HydrophobicContact CZ2-CG 3.87Å; W1405-R1472 VanDerWaalsContact CD1-CG 3.49Å; W1405-R1472 HydrophobicContact CG-CG 4.29Å; W1405-W1475 HydrophobicContact CB-CB 3.68Å; W1405-W1475 HydrophobicContact CB-CG 4.38Å; W1405-I1476 HydrophobicContact CD2-CD1 4.26Å; W1405-I1476 HydrophobicContact CD2-CG1 3.53Å; W1405-I1476 VanDerWaalsContact CD2-CG1 3.49Å; W1405-I1476 HydrophobicContact CE3-CB 4.43Å; W1405-I1476 HydrophobicContact CE3-CG1 3.65Å; W1405-I1476 HydrophobicContact CG-CG1 4.11Å; W1405-I1476 HydrophobicContact CH2-CB 4.38Å; W1405-I1476 HydrophobicContact CH2-CD1 4.22Å; W1405-I1476 HydrophobicContact CH2-CG1 3.73Å; W1405-I1476 HydrophobicContact CH2-CG2 4.16Å; W1405-I1476 HydrophobicContact CZ2-CD1 3.85Å; W1405-I1476 HydrophobicContact CZ2-CG1 3.7Å; W1405-I1476 HydrophobicContact CZ3-CB 4.26Å; W1405-I1476 HydrophobicContact CZ3-CG1 3.75Å; W1405-I1476 HydrophobicContact CZ3-CG2 4.33Å; W1405-L1479 HydrophobicContact CE3-CD2 4.39Å; W1405-L1479 HydrophobicContact CZ3-CD2 4.06Å
1406Q91.1Very high88.7Confident5 Ų517.5 Ų17.52%0.02310%0.1CC..Hα-helixtrans-64.2-42.2171.2-171.8178.78.900112.3L1326 A1402 L1403 I1404 Y1409 K1410 W1475 S1589L1326-Q1406 HydrophobicContact CD1-CB 4.43Å; L1326-Q1406 HydrophobicContact CD1-CG 3.82Å; L1326-Q1406 HydrophobicContact CD2-CG 4.41Å; L1326-Q1406 VanDerWaalsContact CD2-OE1 3.31Å; A1402-Q1406 WeakPolarHBondContact O-CB 3.35Å; A1402-Q1406 PolarHBondContact O-N 3.18Å; L1403-Q1406 WeakPolarHBondContact O-CB 3.3Å; L1403-Q1406 PolarHBondContact O-N 3.14Å; I1404-Q1406 VanDerWaalsContact C-N 3.27Å; I1404-Q1406 PolarHBondContact O-N 3.3Å; Q1406-Y1409 PolarHBondContact O-N 3.24Å; Q1406-K1410 WeakPolarHBondContact O-CB 3.33Å; Q1406-K1410 WeakPolarHBondContact O-CG 3.31Å; Q1406-K1410 PolarHBondContact O-N 3.26Å; Q1406-W1475 HydrophobicContact CB-CD2 4.02Å; Q1406-W1475 HydrophobicContact CB-CG 4.17Å; Q1406-W1475 HydrophobicContact CB-CZ2 4.25Å; Q1406-W1475 HydrophobicContact CG-CD2 4.16Å; Q1406-W1475 HydrophobicContact CG-CE3 4.49Å; Q1406-W1475 HydrophobicContact CG-CH2 4.1Å; Q1406-W1475 HydrophobicContact CG-CZ2 3.62Å; Q1406-W1475 HydrophobicContact CG-CZ3 4.45Å; Q1406-S1589 VanDerWaalsContact NE2-CB 3.3Å; Q1406-S1589 PolarHBondContact NE2-OG 3.09Å
1407I91.7Very high89.4Confident0.2 Ų0.217.4 Ų17.40%0.00110%0.099CC..Hα-helixtrans-62.1-48175.3-70.4158.9000110.3L1322 L1325 L1326 M1329 M1372 L1403 I1404 Y1409 K1410 L1411L1322-I1407 HydrophobicContact CB-CD1 4.44Å; L1322-I1407 HydrophobicContact CD2-CD1 3.82Å; L1325-I1407 HydrophobicContact CB-CD1 4.5Å; L1325-I1407 HydrophobicContact CD2-CB 4.43Å; L1325-I1407 HydrophobicContact CD2-CD1 3.83Å; L1325-I1407 HydrophobicContact CD2-CG1 3.92Å; L1325-I1407 HydrophobicContact CD2-CG2 3.64Å; L1326-I1407 HydrophobicContact CB-CG1 4.3Å; L1326-I1407 HydrophobicContact CD1-CG1 4.09Å; M1329-I1407 HydrophobicContact SD-CB 4.43Å; M1329-I1407 HydrophobicContact SD-CG1 4.36Å; M1329-I1407 HydrophobicContact SD-CG2 3.97Å; M1372-I1407 HydrophobicContact CE-CD1 3.92Å; M1372-I1407 HydrophobicContact CE-CG2 4.15Å; M1372-I1407 HydrophobicContact SD-CG2 4.05Å; L1403-I1407 WeakPolarHBondContact O-CD1 3.26Å; L1403-I1407 VanDerWaalsContact O-CG1 3.29Å; L1403-I1407 WeakPolarHBondContact O-CG1 3.3Å; L1403-I1407 PolarHBondContact O-N 2.99Å; I1404-I1407 WeakPolarHBondContact O-CB 3.27Å; I1404-I1407 PolarHBondContact O-N 3.23Å; I1404-I1407 VanDerWaalsContact O-N 3.12Å; I1407-Y1409 VanDerWaalsContact C-N 3.32Å; I1407-Y1409 PolarHBondContact O-N 3.01Å; I1407-K1410 PolarHBondContact O-N 3.24Å; I1407-K1410 VanDerWaalsContact O-N 3.17Å; I1407-L1411 HydrophobicContact CG2-CD1 4.16Å; I1407-L1411 HydrophobicContact CG2-CG 4.42Å; I1407-L1411 WeakPolarHBondContact O-CG 3.38Å; I1407-L1411 PolarHBondContact O-N 3.28Å
1408L93.5Very high89.9Confident0.2 Ų0.218.3 Ų18.30%0.00111%0.106CC..Hα-helixtrans-59.8-42.2176.5-68.8179000111.7L1369 L1373 I1376 I1404 W1405 L1411 G1412 L1421 L1425 L1431 L1479L1369-L1408 HydrophobicContact CD1-CD2 3.6Å; L1373-L1408 HydrophobicContact CD2-CD1 4.44Å; I1376-L1408 HydrophobicContact CD1-CD1 3.7Å; I1404-L1408 HydrophobicContact CG2-CD1 4.28Å; I1404-L1408 HydrophobicContact CG2-CG 4.45Å; I1404-L1408 WeakPolarHBondContact O-CG 3.36Å; I1404-L1408 PolarHBondContact O-N 3.21Å; W1405-L1408 HydrophobicContact CE3-CD1 4.18Å; W1405-L1408 HydrophobicContact CZ3-CD1 4.28Å; W1405-L1408 PolarHBondContact O-N 3.14Å; L1408-L1411 PolarHBondContact O-N 3.18Å; L1408-G1412 PolarHBondContact O-N 3.05Å; L1408-L1421 HydrophobicContact CD2-CD1 4.42Å; L1408-L1421 WeakPolarHBondContact O-CD2 3.42Å; L1408-L1425 HydrophobicContact CD2-CD1 4.41Å; L1408-L1431 HydrophobicContact CD1-CD1 4.46Å; L1408-L1479 HydrophobicContact CB-CD2 4.23Å
1409Y92.7Very high90.2Very high30 Ų3022 Ų2212%0.11812%0.123CC..Hα-helixtrans-61.3-48.2173.3168.2-98.7000112.3W1405 Q1406 I1407 L1411 G1412 S1413 W1475 R1478 I1482W1405-Y1409 WeakPolarHBondContact O-CB 3.35Å; W1405-Y1409 PolarHBondContact O-N 3.02Å; Q1406-Y1409 PolarHBondContact O-N 3.24Å; I1407-Y1409 VanDerWaalsContact C-N 3.32Å; I1407-Y1409 PolarHBondContact O-N 3.01Å; Y1409-L1411 VanDerWaalsContact C-N 3.32Å; Y1409-L1411 PolarHBondContact O-N 3.12Å; Y1409-G1412 CarbonylContact O-C 3.47Å; Y1409-G1412 PolarHBondContact O-N 3.11Å; Y1409-G1412 VanDerWaalsContact O-N 3.12Å; Y1409-S1413 WeakPolarHBondContact O-CB 3.35Å; Y1409-S1413 PolarHBondContact O-N 2.98Å; Y1409-S1413 PolarHBondContact O-OG 3.12Å; Y1409-W1475 AromaticContact CD1-CE3 3.47Å; Y1409-W1475 HydrophobicContact CD1-CE3 3.47Å; Y1409-W1475 VanDerWaalsContact CD1-CE3 3.43Å; Y1409-W1475 HydrophobicContact CD1-CH2 4.4Å; Y1409-W1475 AromaticContact CD1-CZ3 3.3Å; Y1409-W1475 HydrophobicContact CD1-CZ3 3.3Å; Y1409-W1475 HydrophobicContact CD2-CE3 4.36Å; Y1409-W1475 HydrophobicContact CD2-CZ3 4.45Å; Y1409-W1475 AromaticContact CE1-CE3 3.98Å; Y1409-W1475 HydrophobicContact CE1-CE3 4.09Å; Y1409-W1475 HydrophobicContact CE1-CH2 4.48Å; Y1409-W1475 AromaticContact CE1-CZ3 3.52Å; Y1409-W1475 HydrophobicContact CE1-CZ3 3.52Å; Y1409-W1475 VanDerWaalsContact CE1-CZ3 3.5Å; Y1409-W1475 AromaticContact CG-CE3 3.62Å; Y1409-W1475 HydrophobicContact CG-CE3 3.62Å; Y1409-W1475 AromaticContact CG-CZ3 3.91Å; Y1409-W1475 HydrophobicContact CG-CZ3 3.94Å; Y1409-R1478 HydrophobicContact CD2-CB 3.58Å; Y1409-R1478 HydrophobicContact CE2-CB 3.5Å; Y1409-R1478 VanDerWaalsContact CE2-CB 3.48Å; Y1409-R1478 HydrophobicContact CE2-CG 4.33Å; Y1409-R1478 HydrophobicContact CG-CB 4.48Å; Y1409-I1482 HydrophobicContact CD2-CD1 3.93Å; Y1409-I1482 HydrophobicContact CE2-CD1 3.61Å
1410K90.4Very high90.6Very high37.8 Ų37.822 Ų2216%0.16412%0.124CC..Hα-helixtrans-61.5-41.9179.4-78-131-179.2-179.60111.2L1326 M1329 E1330 Q1406 I1407 G1412 S1413 N1414 S1589L1326-K1410 HydrophobicContact CD1-CD 3.75Å; L1326-K1410 HydrophobicContact CD1-CG 4.44Å; L1326-K1410 PolarHBondContact O-NZ 3.18Å; M1329-K1410 HydrophobicContact CB-CD 4.46Å; M1329-K1410 HydrophobicContact CE-CB 3.37Å; M1329-K1410 HydrophobicContact CE-CD 4.44Å; M1329-K1410 HydrophobicContact SD-CB 4.14Å; M1329-K1410 HydrophobicContact SD-CD 4.36Å; E1330-K1410 IonicContact OE1-NZ 3.19Å; E1330-K1410 PolarHBondContact OE1-NZ 3.08Å; Q1406-K1410 WeakPolarHBondContact O-CB 3.33Å; Q1406-K1410 WeakPolarHBondContact O-CG 3.31Å; Q1406-K1410 PolarHBondContact O-N 3.26Å; I1407-K1410 PolarHBondContact O-N 3.24Å; I1407-K1410 VanDerWaalsContact O-N 3.17Å; K1410-G1412 VanDerWaalsContact C-N 3.35Å; K1410-G1412 PolarHBondContact O-N 3.29Å; K1410-S1413 WeakPolarHBondContact CA-OG 3.39Å; K1410-S1413 PolarHBondContact O-N 3.04Å; K1410-S1413 PolarHBondContact O-OG 3.19Å; K1410-N1414 WeakPolarHBondContact O-CB 3.25Å; K1410-N1414 PolarHBondContact O-N 3.23Å; K1410-S1589 WeakPolarHBondContact CE-OG 3.09Å
1411L92Very high91Very high3.2 Ų3.222 Ų222%0.01712%0.124CC..Hα-helixtrans-64.8-38.4173.7-70.2173.2000111.9M1329 C1341 F1343 I1407 L1408 Y1409 T1417 S1418 L1421M1329-L1411 HydrophobicContact CE-CB 4.33Å; M1329-L1411 HydrophobicContact CE-CD2 3.58Å; M1329-L1411 HydrophobicContact CE-CG 3.51Å; M1329-L1411 HydrophobicContact SD-CG 4.42Å; C1341-L1411 HydrophobicContact CB-CD1 4.39Å; F1343-L1411 HydrophobicContact CE2-CD1 4.33Å; F1343-L1411 HydrophobicContact CE2-CD2 3.94Å; F1343-L1411 HydrophobicContact CZ-CD2 4.26Å; I1407-L1411 HydrophobicContact CG2-CD1 4.16Å; I1407-L1411 HydrophobicContact CG2-CG 4.42Å; I1407-L1411 WeakPolarHBondContact O-CG 3.38Å; I1407-L1411 PolarHBondContact O-N 3.28Å; L1408-L1411 PolarHBondContact O-N 3.18Å; Y1409-L1411 VanDerWaalsContact C-N 3.32Å; Y1409-L1411 PolarHBondContact O-N 3.12Å; L1411-T1417 HydrophobicContact CD2-CG2 4.2Å; L1411-T1417 CarbonylContact O-C 3.46Å; L1411-T1417 WeakPolarHBondContact O-CB 3.32Å; L1411-T1417 PolarHBondContact O-OG1 3.1Å; L1411-S1418 PolarHBondContact O-N 3.21Å; L1411-L1421 HydrophobicContact CB-CD1 4.31Å; L1411-L1421 HydrophobicContact CB-CD2 3.6Å; L1411-L1421 VanDerWaalsContact CB-CD2 3.49Å; L1411-L1421 HydrophobicContact CB-CG 4.45Å; L1411-L1421 HydrophobicContact CD1-CD1 4.13Å; L1411-L1421 HydrophobicContact CG-CD1 4.49Å
1412G91.2Very high91.1Very high1.2 Ų1.222.1 Ų22.11%0.01212%0.124CC..Hα-helixtrans-72.7-27.8178.100000114.1L1408 Y1409 K1410 S1418L1408-G1412 PolarHBondContact O-N 3.05Å; Y1409-G1412 CarbonylContact O-C 3.47Å; Y1409-G1412 PolarHBondContact O-N 3.11Å; Y1409-G1412 VanDerWaalsContact O-N 3.12Å; K1410-G1412 VanDerWaalsContact C-N 3.35Å; K1410-G1412 PolarHBondContact O-N 3.29Å; G1412-S1418 WeakPolarHBondContact O-CB 3.32Å
1413S90.3Very high91.2Very high57.2 Ų57.227.6 Ų27.640%0.415%0.145SC..Hα-helixtrans-82.8-26179.170.90000113.7Y1409 K1410Y1409-S1413 WeakPolarHBondContact O-CB 3.35Å; Y1409-S1413 PolarHBondContact O-N 2.98Å; Y1409-S1413 PolarHBondContact O-OG 3.12Å; K1410-S1413 WeakPolarHBondContact CA-OG 3.39Å; K1410-S1413 PolarHBondContact O-N 3.04Å; K1410-S1413 PolarHBondContact O-OG 3.19Å
1414N90.6Very high91.4Very high48.4 Ų48.427.6 Ų27.626%0.25915%0.145SC..SBendtrans-78.1124.3-178178.4-14.5000110.7K1410 L1416 T1417 S1418K1410-N1414 WeakPolarHBondContact O-CB 3.25Å; K1410-N1414 PolarHBondContact O-N 3.23Å; N1414-L1416 PolarHBondContact O-N 3.38Å; N1414-L1416 VanDerWaalsContact O-N 3.09Å; N1414-L1416 WeakPolarHBondContact OD1-CB 3.31Å; N1414-L1416 PolarHBondContact OD1-N 3.18Å; N1414-T1417 WeakPolarHBondContact CB-OG1 3.35Å; N1414-T1417 PolarHBondContact O-N 3.09Å; N1414-T1417 VanDerWaalsContact O-N 3.11Å; N1414-T1417 PolarHBondContact O-OG1 3.34Å; N1414-S1418 VanDerWaalsContact O-CB 3.26Å; N1414-S1418 WeakPolarHBondContact O-CB 3.36Å; N1414-S1418 PolarHBondContact O-N 3.18Å; N1414-S1418 PolarHBondContact O-OG 3.19Å
1415P88.7Confident91.3Very high111 Ų11128 Ų2872%0.72115%0.147SC*.THydrogen-bonded Turntrans-61.6-20.2-176.625.7-36.3000114.5
1416L89.9Confident91.2Very high55 Ų5529.6 Ų29.629%0.28815%0.153SC..THydrogen-bonded Turntrans-78.6-31.5176.9-65.2177.4000113A1333 C1348 I1351 S1352 N1414A1333-L1416 HydrophobicContact CB-CD1 3.92Å; C1348-L1416 HydrophobicContact CB-CD1 4.41Å; C1348-L1416 HydrophobicContact CB-CD2 4.38Å; I1351-L1416 HydrophobicContact CG2-CB 4.31Å; S1352-L1416 VanDerWaalsContact CA-O 3.23Å; S1352-L1416 WeakPolarHBondContact CA-O 3.3Å; S1352-L1416 PolarHBondContact N-O 3.36Å; N1414-L1416 PolarHBondContact O-N 3.38Å; N1414-L1416 VanDerWaalsContact O-N 3.09Å; N1414-L1416 WeakPolarHBondContact OD1-CB 3.31Å; N1414-L1416 PolarHBondContact OD1-N 3.18Å
1417T91.7Very high90.8Very high0 Ų032.1 Ų32.10%018%0.18CC..THydrogen-bonded Turntrans-111.5-17.3-172.849.70000113.5H1338 F1343 I1351 L1411 N1414 E1419 P1420 L1421H1338-T1417 VanDerWaalsContact CD2-CG2 3.46Å; H1338-T1417 WeakPolarHBondContact CD2-CG2 3.44Å; H1338-T1417 WeakPolarHBondContact NE2-CG2 3.35Å; F1343-T1417 HydrophobicContact CD1-CG2 4.06Å; F1343-T1417 HydrophobicContact CE1-CG2 3.69Å; F1343-T1417 HydrophobicContact CE2-CG2 4.25Å; F1343-T1417 HydrophobicContact CG-CG2 4.43Å; F1343-T1417 HydrophobicContact CZ-CG2 3.8Å; I1351-T1417 HydrophobicContact CG2-CG2 3.69Å; L1411-T1417 HydrophobicContact CD2-CG2 4.2Å; L1411-T1417 CarbonylContact O-C 3.46Å; L1411-T1417 WeakPolarHBondContact O-CB 3.32Å; L1411-T1417 PolarHBondContact O-OG1 3.1Å; N1414-T1417 WeakPolarHBondContact CB-OG1 3.35Å; N1414-T1417 PolarHBondContact O-N 3.09Å; N1414-T1417 VanDerWaalsContact O-N 3.11Å; N1414-T1417 PolarHBondContact O-OG1 3.34Å; T1417-E1419 PolarHBondContact O-N 3.21Å; T1417-P1420 WeakPolarHBondContact O-CD 3.3Å; T1417-P1420 WeakPolarHBondContact O-CG 3.4Å; T1417-L1421 VanDerWaalsContact O-CB 3.24Å; T1417-L1421 WeakPolarHBondContact O-CB 3.35Å; T1417-L1421 PolarHBondContact O-N 3.13Å; T1417-L1421 VanDerWaalsContact O-N 3.07Å
1418S92.2Very high90.3Very high23.8 Ų23.835.8 Ų35.817%0.16620%0.2CC..Hα-helixtrans-56.8-54.1-17458.50000112.9L1411 G1412 N1414 L1421 L1422L1411-S1418 PolarHBondContact O-N 3.21Å; G1412-S1418 WeakPolarHBondContact O-CB 3.32Å; N1414-S1418 VanDerWaalsContact O-CB 3.26Å; N1414-S1418 WeakPolarHBondContact O-CB 3.36Å; N1414-S1418 PolarHBondContact O-N 3.18Å; N1414-S1418 PolarHBondContact O-OG 3.19Å; S1418-L1421 PolarHBondContact O-N 3.13Å; S1418-L1422 VanDerWaalsContact O-CB 3.24Å; S1418-L1422 WeakPolarHBondContact O-CB 3.3Å; S1418-L1422 WeakPolarHBondContact O-CG 3.26Å; S1418-L1422 PolarHBondContact O-N 3.02Å
1419E91.2Very high89.7Confident77 Ų7737.8 Ų37.836%0.3621%0.209SC..Hα-helixtrans-60.8-52.5-177.117961.6-157.700113.4T1417 L1421 R1423T1417-E1419 PolarHBondContact O-N 3.21Å; E1419-L1421 PolarHBondContact O-N 3.09Å; E1419-R1423 VanDerWaalsContact O-CB 3.28Å; E1419-R1423 WeakPolarHBondContact O-CB 3.25Å; E1419-R1423 PolarHBondContact O-N 3.23Å; E1419-R1423 VanDerWaalsContact O-N 3.11Å; E1419-R1423 IonicContact OE1-CZ 3.02Å; E1419-R1423 IonicContact OE1-NE 2.97Å; E1419-R1423 PolarHBondContact OE1-NE 3.05Å; E1419-R1423 IonicContact OE1-NH2 2.96Å; E1419-R1423 PolarHBondContact OE1-NH2 3.39Å
1420P91.7Very high89.2Confident4.4 Ų4.438.5 Ų38.53%0.02922%0.215CC..Hα-helixtrans-62.6-40.3176.512.9-20.8000113.6F1343 S1354 T1417 F1424F1343-P1420 HydrophobicContact CD1-CG 4.41Å; F1343-P1420 HydrophobicContact CE1-CB 4.27Å; F1343-P1420 HydrophobicContact CE1-CG 4.03Å; S1354-P1420 WeakPolarHBondContact O-CB 3.09Å; S1354-P1420 VanDerWaalsContact OG-CB 3.31Å; S1354-P1420 WeakPolarHBondContact OG-CB 3.4Å; T1417-P1420 WeakPolarHBondContact O-CD 3.3Å; T1417-P1420 WeakPolarHBondContact O-CG 3.4Å; P1420-F1424 WeakPolarHBondContact O-CB 3.26Å; P1420-F1424 PolarHBondContact O-N 3.28Å; P1420-F1424 VanDerWaalsContact O-N 3.13Å
1421L93.2Very high88.9Confident0 Ų036.9 Ų36.90%021%0.208CC..Hα-helixtrans-65.3-55.1178.4-177.785.6000111.6F1343 L1356 L1369 L1408 L1411 T1417 S1418 E1419 R1423 F1424 L1425F1343-L1421 HydrophobicContact CZ-CB 4.45Å; L1356-L1421 HydrophobicContact CD1-CD1 4.48Å; L1369-L1421 HydrophobicContact CD1-CD1 3.94Å; L1369-L1421 HydrophobicContact CD2-CD1 4.12Å; L1408-L1421 HydrophobicContact CD2-CD1 4.42Å; L1408-L1421 WeakPolarHBondContact O-CD2 3.42Å; L1411-L1421 HydrophobicContact CB-CD1 4.31Å; L1411-L1421 HydrophobicContact CB-CD2 3.6Å; L1411-L1421 VanDerWaalsContact CB-CD2 3.49Å; L1411-L1421 HydrophobicContact CB-CG 4.45Å; L1411-L1421 HydrophobicContact CD1-CD1 4.13Å; L1411-L1421 HydrophobicContact CG-CD1 4.49Å; T1417-L1421 VanDerWaalsContact O-CB 3.24Å; T1417-L1421 WeakPolarHBondContact O-CB 3.35Å; T1417-L1421 PolarHBondContact O-N 3.13Å; T1417-L1421 VanDerWaalsContact O-N 3.07Å; S1418-L1421 PolarHBondContact O-N 3.13Å; E1419-L1421 PolarHBondContact O-N 3.09Å; L1421-R1423 VanDerWaalsContact C-N 3.28Å; L1421-R1423 PolarHBondContact O-N 3.17Å; L1421-F1424 WeakPolarHBondContact O-CA 3.45Å; L1421-F1424 WeakPolarHBondContact O-CB 3.4Å; L1421-F1424 PolarHBondContact O-N 3.04Å; L1421-F1424 VanDerWaalsContact O-N 3.08Å; L1421-L1425 HydrophobicContact CD1-CD1 4.35Å; L1421-L1425 HydrophobicContact CD1-CG 4.4Å; L1421-L1425 HydrophobicContact CD2-CD1 4.09Å; L1421-L1425 HydrophobicContact CG-CD1 3.93Å; L1421-L1425 HydrophobicContact CG-CG 4.19Å; L1421-L1425 WeakPolarHBondContact O-CG 3.36Å; L1421-L1425 PolarHBondContact O-N 3.06Å
1422L92Very high88.6Confident2 Ų237 Ų371%0.0121%0.209CC..Hα-helixtrans-63.4-37-174.9-67.7177.1000111.2S1418 F1424 L1425 R1426 L1479 I1482 E1483 V1486S1418-L1422 VanDerWaalsContact O-CB 3.24Å; S1418-L1422 WeakPolarHBondContact O-CB 3.3Å; S1418-L1422 WeakPolarHBondContact O-CG 3.26Å; S1418-L1422 PolarHBondContact O-N 3.02Å; L1422-F1424 VanDerWaalsContact C-N 3.34Å; L1422-F1424 PolarHBondContact O-N 3Å; L1422-L1425 PolarHBondContact O-N 3.12Å; L1422-R1426 WeakPolarHBondContact O-CB 3.36Å; L1422-R1426 PolarHBondContact O-N 3.29Å; L1422-L1479 HydrophobicContact CD2-CD1 3.9Å; L1422-I1482 HydrophobicContact CD1-CG2 4Å; L1422-E1483 VanDerWaalsContact CB-OE2 3.32Å; L1422-E1483 WeakPolarHBondContact CB-OE2 3.39Å; L1422-E1483 HydrophobicContact CD2-CB 4.36Å; L1422-E1483 WeakPolarHBondContact CD2-OE2 3.33Å; L1422-V1486 HydrophobicContact CD1-CB 4.39Å; L1422-V1486 HydrophobicContact CD1-CG1 4.4Å; L1422-V1486 HydrophobicContact CD1-CG2 4.15Å
1423R90.3Very high88.1Confident115.2 Ų115.237.4 Ų37.444%0.43521%0.211SC..Hα-helixtrans-59.8-43.8172.2-169.8-173.6-56.7134.5-3112.1E1419 L1421 G1427E1419-R1423 VanDerWaalsContact O-CB 3.28Å; E1419-R1423 WeakPolarHBondContact O-CB 3.25Å; E1419-R1423 PolarHBondContact O-N 3.23Å; E1419-R1423 VanDerWaalsContact O-N 3.11Å; E1419-R1423 IonicContact OE1-CZ 3.02Å; E1419-R1423 IonicContact OE1-NE 2.97Å; E1419-R1423 PolarHBondContact OE1-NE 3.05Å; E1419-R1423 IonicContact OE1-NH2 2.96Å; E1419-R1423 PolarHBondContact OE1-NH2 3.39Å; L1421-R1423 VanDerWaalsContact C-N 3.28Å; L1421-R1423 PolarHBondContact O-N 3.17Å; R1423-G1427 PolarHBondContact O-N 3.24Å
1424F91.4Very high87.7Confident6.2 Ų6.239.2 Ų39.23%0.02721%0.212CC..Hα-helixtrans-66.1-49.3178.1173.1-106.3000112.4L1356 Q1357 D1358 L1369 H1370 L1373 P1420 L1421 L1422 R1426 G1427 N1428 H1429L1356-F1424 HydrophobicContact CB-CB 3.85Å; L1356-F1424 HydrophobicContact CB-CD1 4.32Å; L1356-F1424 HydrophobicContact CB-CD2 3.86Å; L1356-F1424 HydrophobicContact CB-CE2 4.42Å; L1356-F1424 HydrophobicContact CB-CG 3.76Å; L1356-F1424 HydrophobicContact CD1-CB 4.34Å; L1356-F1424 HydrophobicContact CD1-CG 4.49Å; L1356-F1424 VanDerWaalsContact O-CD2 3.31Å; L1356-F1424 WeakPolarHBondContact O-CD2 3.34Å; Q1357-F1424 VanDerWaalsContact C-CE2 3.48Å; D1358-F1424 VanDerWaalsContact OD1-CE2 3.27Å; D1358-F1424 WeakPolarHBondContact OD1-CE2 3.46Å; D1358-F1424 WeakPolarHBondContact OD1-CZ 3.35Å; L1369-F1424 HydrophobicContact CD2-CD1 3.89Å; L1369-F1424 HydrophobicContact CD2-CE1 3.61Å; L1369-F1424 VanDerWaalsContact CD2-CE1 3.45Å; L1369-F1424 HydrophobicContact CD2-CZ 4.24Å; L1369-F1424 HydrophobicContact CG-CE1 4.22Å; H1370-F1424 AromaticContact NE2-CZ 3.83Å; L1373-F1424 HydrophobicContact CD1-CE1 3.7Å; L1373-F1424 HydrophobicContact CD1-CZ 4.34Å; P1420-F1424 WeakPolarHBondContact O-CB 3.26Å; P1420-F1424 PolarHBondContact O-N 3.28Å; P1420-F1424 VanDerWaalsContact O-N 3.13Å; L1421-F1424 WeakPolarHBondContact O-CA 3.45Å; L1421-F1424 WeakPolarHBondContact O-CB 3.4Å; L1421-F1424 PolarHBondContact O-N 3.04Å; L1421-F1424 VanDerWaalsContact O-N 3.08Å; L1422-F1424 VanDerWaalsContact C-N 3.34Å; L1422-F1424 PolarHBondContact O-N 3Å; F1424-R1426 VanDerWaalsContact C-N 3.31Å; F1424-R1426 PolarHBondContact O-N 3.13Å; F1424-G1427 PolarHBondContact O-N 3.09Å; F1424-N1428 HydrophobicContact CD2-CB 4.4Å; F1424-N1428 WeakPolarHBondContact CD2-ND2 3.28Å; F1424-N1428 HydrophobicContact CE2-CB 4.35Å; F1424-N1428 VanDerWaalsContact CE2-ND2 3.27Å; F1424-N1428 WeakPolarHBondContact CE2-ND2 3.35Å; F1424-N1428 WeakPolarHBondContact O-CB 3.19Å; F1424-N1428 PolarHBondContact O-N 2.97Å; F1424-N1428 VanDerWaalsContact O-N 3.12Å; F1424-H1429 AromaticContact CE1-NE2 3.96Å; F1424-H1429 AromaticContact CZ-CD2 3.98Å; F1424-H1429 AromaticContact CZ-NE2 3.73Å
1425L90.7Very high87.2Confident8.6 Ų8.637.1 Ų37.15%0.04520%0.201CC..Iπ-helixtrans-62.2-37.5179.4-63-177.7000112.5L1373 L1408 L1421 L1422 H1429 D1430 L1431 L1479L1373-L1425 HydrophobicContact CD1-CD2 4.15Å; L1373-L1425 HydrophobicContact CD2-CD2 4.05Å; L1408-L1425 HydrophobicContact CD2-CD1 4.41Å; L1421-L1425 HydrophobicContact CD1-CD1 4.35Å; L1421-L1425 HydrophobicContact CD1-CG 4.4Å; L1421-L1425 HydrophobicContact CD2-CD1 4.09Å; L1421-L1425 HydrophobicContact CG-CD1 3.93Å; L1421-L1425 HydrophobicContact CG-CG 4.19Å; L1421-L1425 WeakPolarHBondContact O-CG 3.36Å; L1421-L1425 PolarHBondContact O-N 3.06Å; L1422-L1425 PolarHBondContact O-N 3.12Å; L1425-H1429 PolarHBondContact O-N 2.94Å; L1425-D1430 WeakPolarHBondContact O-CA 3.12Å; L1425-D1430 PolarHBondContact O-N 3.25Å; L1425-D1430 VanDerWaalsContact O-N 3.07Å; L1425-L1431 HydrophobicContact CB-CB 4.44Å; L1425-L1431 HydrophobicContact CB-CD1 4.13Å; L1425-L1431 HydrophobicContact CD2-CD1 3.76Å; L1425-L1431 VanDerWaalsContact CD2-CD1 3.43Å; L1425-L1431 HydrophobicContact CG-CD1 4.21Å; L1425-L1431 PolarHBondContact O-N 3.03Å; L1425-L1479 HydrophobicContact CD1-CD2 4.33Å
1426R88.5Confident86.6Confident34.8 Ų34.831.8 Ų31.813%0.13117%0.166CC..Iπ-helixtrans-72.5-45.4176.7-178.8-179.917.7-1743.2112.5L1422 F1424 E1483 C1487 Q1492 Y1495L1422-R1426 WeakPolarHBondContact O-CB 3.36Å; L1422-R1426 PolarHBondContact O-N 3.29Å; F1424-R1426 VanDerWaalsContact C-N 3.31Å; F1424-R1426 PolarHBondContact O-N 3.13Å; R1426-E1483 WeakPolarHBondContact CD-OE1 3.41Å; R1426-E1483 IonicContact CZ-OE1 3.4Å; R1426-E1483 IonicContact CZ-OE2 3.18Å; R1426-E1483 IonicContact NE-OE1 2.82Å; R1426-E1483 PolarHBondContact NE-OE1 3.03Å; R1426-E1483 IonicContact NH1-OE1 3.48Å; R1426-E1483 PolarHBondContact NH1-OE1 3.07Å; R1426-E1483 IonicContact NH2-OE1 3.51Å; R1426-E1483 PolarHBondContact NH2-OE1 2.95Å; R1426-E1483 IonicContact NH2-OE2 2.98Å; R1426-E1483 PolarHBondContact NH2-OE2 3.03Å; R1426-C1487 PolarHBondContact NE-SG 3Å; R1426-C1487 VanDerWaalsContact NE-SG 3.41Å; R1426-C1487 PolarHBondContact NH1-SG 3.27Å; R1426-C1487 PolarHBondContact NH2-SG 3.1Å; R1426-Q1492 VanDerWaalsContact CZ-CD 3.49Å; R1426-Q1492 VanDerWaalsContact CZ-NE2 3.31Å; R1426-Q1492 VanDerWaalsContact NE-OE1 3.1Å; R1426-Q1492 VanDerWaalsContact NH1-CD 3.27Å; R1426-Q1492 VanDerWaalsContact NH1-OE1 3.09Å; R1426-Y1495 HydrophobicContact CG-CD1 4.29Å; R1426-Y1495 HydrophobicContact CG-CD2 4.24Å; R1426-Y1495 HydrophobicContact CG-CE1 4.08Å; R1426-Y1495 HydrophobicContact CG-CE2 3.8Å; R1426-Y1495 HydrophobicContact CG-CG 4.41Å
1427G83.7Confident85.6Confident58.2 Ų58.235.2 Ų35.260%0.618%0.18SC*.Iπ-helixtrans-71.2-44.5-173.800000113.5R1423 F1424R1423-G1427 PolarHBondContact O-N 3.24Å; F1424-G1427 PolarHBondContact O-N 3.09Å
1428N80.6Confident84.4Confident77 Ų7738.1 Ų38.141%0.41220%0.2SC..Iπ-helixtrans-101.2-39-167.8-65.19.5000113D1358 F1424D1358-N1428 VanDerWaalsContact CG-ND2 3.31Å; D1358-N1428 WeakPolarHBondContact OD1-CB 3.47Å; D1358-N1428 PolarHBondContact OD1-ND2 3.1Å; D1358-N1428 PolarHBondContact OD2-ND2 3.28Å; F1424-N1428 HydrophobicContact CD2-CB 4.4Å; F1424-N1428 WeakPolarHBondContact CD2-ND2 3.28Å; F1424-N1428 HydrophobicContact CE2-CB 4.35Å; F1424-N1428 VanDerWaalsContact CE2-ND2 3.27Å; F1424-N1428 WeakPolarHBondContact CE2-ND2 3.35Å; F1424-N1428 WeakPolarHBondContact O-CB 3.19Å; F1424-N1428 PolarHBondContact O-N 2.97Å; F1424-N1428 VanDerWaalsContact O-N 3.12Å
1429H80.1Confident83.1Confident43.6 Ų43.637.6 Ų37.620%0.20220%0.196CC..Iπ-helixtrans-108.7-16.3-171.6-66.8-84.3000114.3D1358 L1373 F1424 L1425 L1431 K1434D1358-H1429 IonicContact OD1-NE2 3.21Å; L1373-H1429 WeakPolarHBondContact CD1-NE2 3.35Å; F1424-H1429 AromaticContact CE1-NE2 3.96Å; F1424-H1429 AromaticContact CZ-CD2 3.98Å; F1424-H1429 AromaticContact CZ-NE2 3.73Å; L1425-H1429 PolarHBondContact O-N 2.94Å; H1429-L1431 HydrophobicContact CB-CB 4.04Å; H1429-L1431 HydrophobicContact CB-CD1 3.95Å; H1429-L1431 HydrophobicContact CB-CD2 3.68Å; H1429-L1431 HydrophobicContact CB-CG 3.46Å; H1429-L1431 VanDerWaalsContact CB-CG 3.46Å; H1429-L1431 PolarHBondContact O-N 3.14Å; H1429-K1434 WeakPolarHBondContact O-CE 3.43Å; H1429-K1434 PolarHBondContact O-NZ 3.16Å
1430D83.5Confident82Confident43 Ų4333.9 Ų33.923%0.2318%0.179CC..  trans43.740.8-170.7-163.314.5000112.9L1425 L1432 A1433 K1434 R1498L1425-D1430 WeakPolarHBondContact O-CA 3.12Å; L1425-D1430 PolarHBondContact O-N 3.25Å; L1425-D1430 VanDerWaalsContact O-N 3.07Å; D1430-L1432 PolarHBondContact O-N 3.14Å; D1430-A1433 PolarHBondContact O-N 2.96Å; D1430-A1433 VanDerWaalsContact O-N 3.15Å; D1430-A1433 VanDerWaalsContact OD1-CB 3.31Å; D1430-A1433 WeakPolarHBondContact OD1-CB 3.27Å; D1430-K1434 PolarHBondContact O-N 3.17Å; D1430-K1434 VanDerWaalsContact O-N 3.14Å; D1430-R1498 IonicContact OD1-CZ 3.12Å; D1430-R1498 IonicContact OD1-NH1 3.32Å; D1430-R1498 IonicContact OD1-NH2 3.19Å; D1430-R1498 PolarHBondContact OD1-NH2 3.35Å; D1430-R1498 IonicContact OD2-CZ 2.99Å; D1430-R1498 IonicContact OD2-NH1 3.21Å; D1430-R1498 PolarHBondContact OD2-NH1 3.15Å; D1430-R1498 IonicContact OD2-NH2 3.34Å; D1430-R1498 PolarHBondContact OD2-NH2 3.18Å
1431L84.3Confident80.4Confident4.2 Ų4.234.9 Ų34.92%0.02219%0.186CC..Hα-helixtrans-60-50.7-156.3-149.6160.6000111.2L1373 W1405 L1408 L1425 H1429 A1433 K1434 Y1435L1373-L1431 HydrophobicContact CD1-CD1 4.27Å; L1373-L1431 HydrophobicContact CD2-CD1 3.29Å; L1373-L1431 HydrophobicContact CD2-CD2 4.35Å; W1405-L1431 HydrophobicContact CH2-CD2 3.03Å; W1405-L1431 HydrophobicContact CH2-CG 4.48Å; W1405-L1431 HydrophobicContact CZ2-CD2 3.76Å; W1405-L1431 HydrophobicContact CZ3-CD2 3.63Å; L1408-L1431 HydrophobicContact CD1-CD1 4.46Å; L1425-L1431 HydrophobicContact CB-CB 4.44Å; L1425-L1431 HydrophobicContact CB-CD1 4.13Å; L1425-L1431 HydrophobicContact CD2-CD1 3.76Å; L1425-L1431 VanDerWaalsContact CD2-CD1 3.43Å; L1425-L1431 HydrophobicContact CG-CD1 4.21Å; L1425-L1431 PolarHBondContact O-N 3.03Å; H1429-L1431 HydrophobicContact CB-CB 4.04Å; H1429-L1431 HydrophobicContact CB-CD1 3.95Å; H1429-L1431 HydrophobicContact CB-CD2 3.68Å; H1429-L1431 HydrophobicContact CB-CG 3.46Å; H1429-L1431 VanDerWaalsContact CB-CG 3.46Å; H1429-L1431 PolarHBondContact O-N 3.14Å; L1431-A1433 VanDerWaalsContact C-N 3.31Å; L1431-A1433 PolarHBondContact O-N 3.29Å; L1431-K1434 WeakPolarHBondContact O-CA 3.44Å; L1431-K1434 WeakPolarHBondContact O-CB 3.3Å; L1431-K1434 PolarHBondContact O-N 3.11Å; L1431-Y1435 HydrophobicContact CB-CD2 4.11Å; L1431-Y1435 HydrophobicContact CB-CE2 4.21Å; L1431-Y1435 HydrophobicContact CD2-CD2 3.64Å; L1431-Y1435 HydrophobicContact CD2-CE2 4.03Å; L1431-Y1435 HydrophobicContact CD2-CG 4.48Å; L1431-Y1435 HydrophobicContact CG-CD2 4.09Å; L1431-Y1435 HydrophobicContact CG-CE2 4.15Å; L1431-Y1435 VanDerWaalsContact O-CD2 3.25Å; L1431-Y1435 WeakPolarHBondContact O-CD2 3.19Å; L1431-Y1435 PolarHBondContact O-N 3.31Å; L1431-Y1435 VanDerWaalsContact O-N 3.14Å
1432L85Confident79Confident7 Ų741.2 Ų41.24%0.03722%0.215CC..Hα-helixtrans-63.6-39.3-176.6-70.6168.5000112.4W1405 D1430 K1434 Y1435 L1436 I1476 L1479 E1483W1405-L1432 HydrophobicContact CH2-CD2 4.49Å; W1405-L1432 HydrophobicContact CZ3-CD2 4.34Å; D1430-L1432 PolarHBondContact O-N 3.14Å; L1432-K1434 VanDerWaalsContact C-N 3.31Å; L1432-K1434 PolarHBondContact O-N 3.21Å; L1432-Y1435 PolarHBondContact O-N 3.07Å; L1432-L1436 VanDerWaalsContact O-CB 3.27Å; L1432-L1436 WeakPolarHBondContact O-CB 3.33Å; L1432-L1436 WeakPolarHBondContact O-CD1 3.21Å; L1432-L1436 WeakPolarHBondContact O-CG 3.31Å; L1432-L1436 PolarHBondContact O-N 3.24Å; L1432-I1476 HydrophobicContact CD2-CG2 4.4Å; L1432-L1479 HydrophobicContact CD1-CG 4.32Å; L1432-L1479 HydrophobicContact CD2-CB 4.32Å; L1432-L1479 HydrophobicContact CD2-CD2 4.27Å; L1432-L1479 HydrophobicContact CD2-CG 4.29Å; L1432-E1483 HydrophobicContact CD1-CB 3.4Å; L1432-E1483 HydrophobicContact CD1-CG 3.56Å
1433A81Confident77.4Confident8.2 Ų8.244 Ų447%0.06823%0.233CC..Hα-helixtrans-63.6-39.5177.600000111.7D1430 L1431 H1437 L1499 L1502D1430-A1433 PolarHBondContact O-N 2.96Å; D1430-A1433 VanDerWaalsContact O-N 3.15Å; D1430-A1433 VanDerWaalsContact OD1-CB 3.31Å; D1430-A1433 WeakPolarHBondContact OD1-CB 3.27Å; L1431-A1433 VanDerWaalsContact C-N 3.31Å; L1431-A1433 PolarHBondContact O-N 3.29Å; A1433-H1437 PolarHBondContact O-N 3.08Å; A1433-L1499 HydrophobicContact CB-CD2 4.35Å; A1433-L1502 HydrophobicContact CB-CD1 3.74Å
1434K81.3Confident75.8Confident94.6 Ų94.640 Ų4041%0.41122%0.221SC..Hα-helixtrans-62.8-50.7175.9-161.1179.3176.2-179.10112.2D1377 H1429 D1430 L1431 L1432 H1437 S1438D1377-K1434 VanDerWaalsContact CG-NZ 3.29Å; D1377-K1434 IonicContact OD1-NZ 3.23Å; D1377-K1434 PolarHBondContact OD1-NZ 2.97Å; D1377-K1434 IonicContact OD2-NZ 3.67Å; H1429-K1434 WeakPolarHBondContact O-CE 3.43Å; H1429-K1434 PolarHBondContact O-NZ 3.16Å; D1430-K1434 PolarHBondContact O-N 3.17Å; D1430-K1434 VanDerWaalsContact O-N 3.14Å; L1431-K1434 WeakPolarHBondContact O-CA 3.44Å; L1431-K1434 WeakPolarHBondContact O-CB 3.3Å; L1431-K1434 PolarHBondContact O-N 3.11Å; L1432-K1434 VanDerWaalsContact C-N 3.31Å; L1432-K1434 PolarHBondContact O-N 3.21Å; K1434-H1437 PolarHBondContact O-N 3.26Å; K1434-S1438 PolarHBondContact O-N 2.96Å; K1434-S1438 PolarHBondContact O-OG 3.21Å
1435Y80.2Confident74.2Confident4.4 Ų4.441.7 Ų41.72%0.01723%0.229CC..Hα-helixtrans-79.4-25.2-174.2-72.8-80.1000114.3I1376 D1377 T1380 W1405 L1431 L1432 H1437 D1439 L1440I1376-Y1435 VanDerWaalsContact C-OH 3.24Å; I1376-Y1435 HydrophobicContact CG2-CD1 4.32Å; I1376-Y1435 HydrophobicContact CG2-CD2 4.32Å; I1376-Y1435 HydrophobicContact CG2-CE1 3.63Å; I1376-Y1435 HydrophobicContact CG2-CE2 3.66Å; I1376-Y1435 VanDerWaalsContact CG2-OH 3.25Å; I1376-Y1435 WeakPolarHBondContact CG2-OH 3.33Å; I1376-Y1435 PolarHBondContact O-OH 3.28Å; I1376-Y1435 VanDerWaalsContact O-OH 3.13Å; D1377-Y1435 VanDerWaalsContact CA-OH 3.24Å; D1377-Y1435 WeakPolarHBondContact CA-OH 3.25Å; D1377-Y1435 PolarHBondContact N-OH 2.97Å; D1377-Y1435 PolarHBondContact OD1-OH 3.26Å; T1380-Y1435 HydrophobicContact CG2-CD1 4.5Å; T1380-Y1435 HydrophobicContact CG2-CE1 3.6Å; T1380-Y1435 VanDerWaalsContact CG2-CE1 3.45Å; T1380-Y1435 WeakPolarHBondContact CG2-OH 3.47Å; W1405-Y1435 AromaticContact CH2-CD2 3.71Å; W1405-Y1435 HydrophobicContact CH2-CD2 4.08Å; W1405-Y1435 HydrophobicContact CH2-CE2 4.31Å; W1405-Y1435 AromaticContact CH2-CG 3.98Å; W1405-Y1435 HydrophobicContact CH2-CG 4.19Å; W1405-Y1435 AromaticContact CZ2-CD1 3.99Å; W1405-Y1435 HydrophobicContact CZ2-CD1 4.22Å; W1405-Y1435 AromaticContact CZ2-CD2 3.88Å; W1405-Y1435 HydrophobicContact CZ2-CD2 3.93Å; W1405-Y1435 HydrophobicContact CZ2-CE1 4.29Å; W1405-Y1435 HydrophobicContact CZ2-CE2 4.32Å; W1405-Y1435 AromaticContact CZ2-CG 3.87Å; W1405-Y1435 HydrophobicContact CZ2-CG 3.87Å; L1431-Y1435 HydrophobicContact CB-CD2 4.11Å; L1431-Y1435 HydrophobicContact CB-CE2 4.21Å; L1431-Y1435 HydrophobicContact CD2-CD2 3.64Å; L1431-Y1435 HydrophobicContact CD2-CE2 4.03Å; L1431-Y1435 HydrophobicContact CD2-CG 4.48Å; L1431-Y1435 HydrophobicContact CG-CD2 4.09Å; L1431-Y1435 HydrophobicContact CG-CE2 4.15Å; L1431-Y1435 VanDerWaalsContact O-CD2 3.25Å; L1431-Y1435 WeakPolarHBondContact O-CD2 3.19Å; L1431-Y1435 PolarHBondContact O-N 3.31Å; L1431-Y1435 VanDerWaalsContact O-N 3.14Å; L1432-Y1435 PolarHBondContact O-N 3.07Å; Y1435-H1437 VanDerWaalsContact C-N 3.27Å; Y1435-H1437 PolarHBondContact O-N 3.13Å; Y1435-D1439 HydrophobicContact CD1-CB 4.15Å; Y1435-D1439 PolarHBondContact O-N 3.27Å; Y1435-D1439 VanDerWaalsContact O-N 3.13Å; Y1435-L1440 PolarHBondContact O-N 3.37Å
1436L76Confident72.2Confident0.4 Ų0.443.9 Ų43.90%0.00225%0.246CC..Hα-helixtrans-59.9-39.7169.5-77.4171.5000111.5L1432 L1440 Y1480 L1499 L1502 F1503 V1543L1432-L1436 VanDerWaalsContact O-CB 3.27Å; L1432-L1436 WeakPolarHBondContact O-CB 3.33Å; L1432-L1436 WeakPolarHBondContact O-CD1 3.21Å; L1432-L1436 WeakPolarHBondContact O-CG 3.31Å; L1432-L1436 PolarHBondContact O-N 3.24Å; L1436-L1440 HydrophobicContact CD2-CD1 3.56Å; L1436-L1440 VanDerWaalsContact CD2-CD1 3.47Å; L1436-L1440 HydrophobicContact CG-CD1 4.38Å; L1436-Y1480 HydrophobicContact CD1-CD2 3.69Å; L1436-Y1480 HydrophobicContact CD1-CE2 3.82Å; L1436-Y1480 HydrophobicContact CD1-CG 4.48Å; L1436-Y1480 HydrophobicContact CD2-CD2 4.25Å; L1436-Y1480 HydrophobicContact CD2-CE2 4.42Å; L1436-Y1480 HydrophobicContact CD2-CG 4.42Å; L1436-Y1480 HydrophobicContact CG-CD2 4.45Å; L1436-L1499 HydrophobicContact CD1-CD2 3.89Å; L1436-L1502 HydrophobicContact CB-CB 4.36Å; L1436-L1502 HydrophobicContact CD1-CB 4.31Å; L1436-F1503 HydrophobicContact CD2-CD2 4.29Å; L1436-V1543 HydrophobicContact CB-CG2 4.46Å; L1436-V1543 HydrophobicContact CD2-CG1 4.39Å; L1436-V1543 HydrophobicContact CD2-CG2 4.4Å; L1436-V1543 WeakPolarHBondContact O-CG2 3.31Å
1437H68.8Low70Confident126.4 Ų126.447.6 Ų47.659%0.58528%0.277SS*.Hα-helixtrans-78.2-39.4-175.7-165.823.7000113.3A1433 K1434 Y1435 L1502A1433-H1437 PolarHBondContact O-N 3.08Å; K1434-H1437 PolarHBondContact O-N 3.26Å; Y1435-H1437 VanDerWaalsContact C-N 3.27Å; Y1435-H1437 PolarHBondContact O-N 3.13Å; H1437-L1502 HydrophobicContact CB-CD2 4.44Å
1438S67.5Low67.7Low60.2 Ų60.249.4 Ų49.442%0.42128%0.28SS..Hα-helixtrans-95.1-41.7-170.574.90000114.8K1434K1434-S1438 PolarHBondContact O-N 2.96Å; K1434-S1438 PolarHBondContact O-OG 3.21Å
1439D64.8Low65.6Low14 Ų1452.8 Ų52.88%0.07530%0.297CS..THydrogen-bonded Turntrans-107.9-28.5-157.6-165.727.1000113.7L1383 Y1435 C1441 R1472 K1473L1383-D1439 VanDerWaalsContact CD2-OD1 3.23Å; L1383-D1439 WeakPolarHBondContact CD2-OD1 3.3Å; Y1435-D1439 HydrophobicContact CD1-CB 4.15Å; Y1435-D1439 PolarHBondContact O-N 3.27Å; Y1435-D1439 VanDerWaalsContact O-N 3.13Å; D1439-C1441 PolarHBondContact O-N 2.59Å; D1439-R1472 VanDerWaalsContact CG-NH1 3.33Å; D1439-R1472 VanDerWaalsContact CG-NH2 3.32Å; D1439-R1472 IonicContact OD1-CZ 3.33Å; D1439-R1472 IonicContact OD1-NH1 3.21Å; D1439-R1472 PolarHBondContact OD1-NH1 3.24Å; D1439-R1472 IonicContact OD1-NH2 2.98Å; D1439-R1472 PolarHBondContact OD1-NH2 3.06Å; D1439-R1472 IonicContact OD2-CZ 3.26Å; D1439-R1472 VanDerWaalsContact OD2-CZ 3.26Å; D1439-R1472 IonicContact OD2-NE 3.28Å; D1439-R1472 PolarHBondContact OD2-NE 3.36Å; D1439-R1472 IonicContact OD2-NH1 3.46Å; D1439-R1472 PolarHBondContact OD2-NH1 3.14Å; D1439-R1472 IonicContact OD2-NH2 3.46Å; D1439-R1472 PolarHBondContact OD2-NH2 3.06Å; D1439-K1473 VanDerWaalsContact O-CE 3.26Å; D1439-K1473 WeakPolarHBondContact O-CE 3.33Å; D1439-K1473 PolarHBondContact O-NZ 3.23Å
1440L67.3Low63.4Low0 Ų058.5 Ų58.50%033%0.33CS..SBendtrans-75.1-35.5-177.6-69.9-178.7000113.2Y1435 L1436 Q1442 K1473 I1476 L1477 V1543 F1547 I1550Y1435-L1440 PolarHBondContact O-N 3.37Å; L1436-L1440 HydrophobicContact CD2-CD1 3.56Å; L1436-L1440 VanDerWaalsContact CD2-CD1 3.47Å; L1436-L1440 HydrophobicContact CG-CD1 4.38Å; L1440-Q1442 PolarHBondContact O-N 3.39Å; L1440-K1473 HydrophobicContact CD2-CB 3.72Å; L1440-K1473 HydrophobicContact CD2-CD 4.17Å; L1440-K1473 HydrophobicContact CD2-CG 3.71Å; L1440-K1473 PolarHBondContact O-NZ 3.19Å; L1440-I1476 HydrophobicContact CD1-CG2 4.15Å; L1440-I1476 HydrophobicContact CD2-CB 4.3Å; L1440-I1476 HydrophobicContact CD2-CD1 4.16Å; L1440-I1476 HydrophobicContact CD2-CG2 4.18Å; L1440-I1476 HydrophobicContact CG-CG2 4.43Å; L1440-L1477 HydrophobicContact CD1-CD2 3.83Å; L1440-L1477 HydrophobicContact CD1-CG 4.24Å; L1440-L1477 HydrophobicContact CD2-CG 4.33Å; L1440-V1543 HydrophobicContact CB-CG1 3.9Å; L1440-V1543 HydrophobicContact CD1-CG1 3.74Å; L1440-V1543 HydrophobicContact CG-CG1 4.44Å; L1440-F1547 HydrophobicContact CB-CD2 4.49Å; L1440-F1547 HydrophobicContact CD2-CD2 4.3Å; L1440-F1547 HydrophobicContact CD2-CE2 4.11Å; L1440-I1550 VanDerWaalsContact O-CD1 3.24Å; L1440-I1550 WeakPolarHBondContact O-CD1 3.25Å
1441C58.5Low61.1Low25 Ų2558.9 Ų58.917%0.16934%0.344CS..SBendtrans-79.8-19.6-171.2-69.80000114.9D1439 N1546D1439-C1441 PolarHBondContact O-N 2.59Å; C1441-N1546 HydrophobicContact CB-CB 4.14Å
1442Q63.3Low58.9Low132.2 Ų132.265.7 Ų65.762%0.61838%0.38SS*.SBendtrans-97.6124.4-174.3-159.5158.4-0.400111L1440 L1444 K1473L1440-Q1442 PolarHBondContact O-N 3.39Å; Q1442-L1444 PolarHBondContact O-N 2.8Å; Q1442-K1473 PolarHBondContact O-NZ 3.08Å
1443P58.9Low56.9Low60.6 Ų60.669.2 Ų69.239%0.39440%0.402SS..  trans-64.6129.3166.125.7-30.7000108.7L1445 I1550P1443-L1445 VanDerWaalsContact C-N 3.29Å; P1443-L1445 PolarHBondContact O-N 3.27Å; P1443-I1550 HydrophobicContact CB-CG1 4.37Å
1444L57.7Low55.3Low31.8 Ų31.870.8 Ų70.817%0.16641%0.412CS..SBendtrans-67.3-32.7-176.4-153.788.8000112.1L1383 I1386 Q1398 Q1442 I1465 S1469L1383-L1444 HydrophobicContact CD1-CD1 4.03Å; L1383-L1444 HydrophobicContact CD2-CD1 3.76Å; L1383-L1444 HydrophobicContact CD2-CD2 4.41Å; L1383-L1444 HydrophobicContact CD2-CG 4.49Å; L1383-L1444 HydrophobicContact CG-CD1 3.73Å; I1386-L1444 HydrophobicContact CB-CD2 4.32Å; I1386-L1444 HydrophobicContact CD1-CD1 4.27Å; I1386-L1444 HydrophobicContact CD1-CD2 3.77Å; I1386-L1444 VanDerWaalsContact CD1-CD2 3.47Å; I1386-L1444 HydrophobicContact CD1-CG 4.16Å; I1386-L1444 HydrophobicContact CG1-CD2 4.37Å; I1386-L1444 HydrophobicContact CG2-CD1 4.06Å; I1386-L1444 HydrophobicContact CG2-CD2 3.75Å; I1386-L1444 HydrophobicContact CG2-CG 4.12Å; Q1398-L1444 HydrophobicContact CG-CD2 4.49Å; Q1442-L1444 PolarHBondContact O-N 2.8Å; L1444-I1465 HydrophobicContact CD2-CG2 3.68Å; L1444-I1465 VanDerWaalsContact CD2-CG2 3.41Å; L1444-S1469 WeakPolarHBondContact CD1-OG 3.22Å
1445L56.8Low53.9Low40.6 Ų40.673.9 Ų73.921%0.21343%0.428CS..SBendtrans-126.582.6179.7-61.4172000107.3T1387 P1443 S1447 K1462 I1465T1387-L1445 HydrophobicContact CG2-CD2 3.9Å; P1443-L1445 VanDerWaalsContact C-N 3.29Å; P1443-L1445 PolarHBondContact O-N 3.27Å; L1445-S1447 PolarHBondContact O-N 3.31Å; L1445-K1462 HydrophobicContact CD1-CB 4Å; L1445-K1462 HydrophobicContact CD1-CG 4.12Å; L1445-K1462 WeakPolarHBondContact CD1-O 3.41Å; L1445-I1465 HydrophobicContact CD1-CB 4.46Å; L1445-I1465 HydrophobicContact CD1-CG2 4.23Å
1446S48Very low53.1Low55 Ų5579.3 Ų79.339%0.38546%0.457SS..  trans-72.6116.6173.156.50000109.5S1448S1446-S1448 VanDerWaalsContact C-N 3.28Å; S1446-S1448 PolarHBondContact O-N 3.08Å
1447S43.6Very low52.9Low113.8 Ų113.879.9 Ų79.980%0.79646%0.46SS*.THydrogen-bonded Turntrans-72-3.8174.156.70000113.7L1445L1445-S1447 PolarHBondContact O-N 3.31Å
1448S35.1Very low53.1Low94.6 Ų94.677.6 Ų77.666%0.66246%0.455SS*.THydrogen-bonded Turntrans-11146-168.869.40000114.6S1446 D1450S1446-S1448 VanDerWaalsContact C-N 3.28Å; S1446-S1448 PolarHBondContact O-N 3.08Å; S1448-D1450 PolarHBondContact O-N 3.24Å
1449L36.5Very low53.2Low148.2 Ų148.280.8 Ų80.878%0.77647%0.467SS*.SBendtrans-108.5101.4162.4-12096.3000111.4G1451L1449-G1451 VanDerWaalsContact C-N 3.34Å; L1449-G1451 PolarHBondContact O-N 3.17Å; L1449-G1451 VanDerWaalsContact O-N 3.12Å
1450D33.3Very low53.6Low164.6 Ų164.684 Ų8488%0.8848%0.478SS*.SBendtrans-61.2108.9175.7-68-39.3000110.6S1448 N1452S1448-D1450 PolarHBondContact O-N 3.24Å; D1450-N1452 PolarHBondContact O-N 3.39Å
1451G35Very low54.1Low52 Ų5285.9 Ų85.954%0.53649%0.487SS..SBendtrans13385.3174.700000116L1449 V1453L1449-G1451 VanDerWaalsContact C-N 3.34Å; L1449-G1451 PolarHBondContact O-N 3.17Å; L1449-G1451 VanDerWaalsContact O-N 3.12Å; G1451-V1453 VanDerWaalsContact C-N 3.27Å; G1451-V1453 WeakPolarHBondContact O-CG2 2.99Å; G1451-V1453 PolarHBondContact O-N 3.14Å
1452N38.2Very low55Low145.4 Ų145.487.4 Ų87.478%0.77849%0.491SS*.SBendtrans38.614.4147.7-62.97.7000120.5D1450D1450-N1452 PolarHBondContact O-N 3.39Å
1453V43.1Very low55.6Low82.2 Ų82.281.6 Ų81.650%0.49847%0.466SS..  trans-89.8-18.6-175.7-1750000113.2T1387 T1388 G1451 E1455T1387-V1453 VanDerWaalsContact OG1-CG1 3.32Å; T1387-V1453 WeakPolarHBondContact OG1-CG1 3.27Å; T1388-V1453 HydrophobicContact CG2-CG1 4.17Å; G1451-V1453 VanDerWaalsContact C-N 3.27Å; G1451-V1453 WeakPolarHBondContact O-CG2 2.99Å; G1451-V1453 PolarHBondContact O-N 3.14Å; V1453-E1455 PolarHBondContact O-N 3.32Å
1454C47.1Very low56.6Low41.4 Ų41.478.9 Ų78.928%0.2845%0.448SS..SBendtrans-87.724.2-177.8-68.70000115T1387 N1456 F1457 K1462T1387-C1454 VanDerWaalsContact CG2-SG 3.59Å; C1454-N1456 VanDerWaalsContact C-N 3.25Å; C1454-N1456 PolarHBondContact O-N 3.13Å; C1454-F1457 HydrophobicContact CB-CD2 4.47Å; C1454-F1457 PolarHBondContact O-N 3.49Å; C1454-K1462 WeakPolarHBondContact O-CE 3.28Å; C1454-K1462 PolarHBondContact O-NZ 2.99Å; C1454-K1462 VanDerWaalsContact O-NZ 3.09Å
1455E52.5Low57.7Low158.2 Ų158.277.5 Ų77.574%0.73944%0.441SS*.THydrogen-bonded Turntrans-70.9-17.3179.5-68.8-169.5160.800113.1V1453 F1457V1453-E1455 PolarHBondContact O-N 3.32Å; E1455-F1457 VanDerWaalsContact C-N 3.31Å; E1455-F1457 PolarHBondContact O-N 3.04Å
1456N63.7Low58.9Low118.4 Ų118.478 Ų7863%0.63344%0.442SS*.THydrogen-bonded Turntrans-71.9-23.6-174.3-66.3-4.1000114.6C1454C1454-N1456 VanDerWaalsContact C-N 3.25Å; C1454-N1456 PolarHBondContact O-N 3.13Å
1457F70.5Confident60.5Low13.4 Ų13.475.5 Ų75.56%0.05943%0.425CS..SBendtrans-105.6132.2-177.4-60.1-35.2000111.7L1389 F1391 C1454 E1455 Q1461 K1462 I1465L1389-F1457 WeakPolarHBondContact O-CE1 3.45Å; L1389-F1457 VanDerWaalsContact O-CZ 3.26Å; L1389-F1457 WeakPolarHBondContact O-CZ 3.21Å; F1391-F1457 VanDerWaalsContact CA-CE1 3.48Å; F1391-F1457 HydrophobicContact CB-CD1 3.96Å; F1391-F1457 HydrophobicContact CB-CE1 3.69Å; F1391-F1457 AromaticContact CD2-CD1 3.95Å; F1391-F1457 HydrophobicContact CD2-CD1 4.22Å; F1391-F1457 HydrophobicContact CD2-CE1 4.34Å; F1391-F1457 HydrophobicContact CG-CD1 4.38Å; F1391-F1457 HydrophobicContact CG-CE1 4.39Å; C1454-F1457 HydrophobicContact CB-CD2 4.47Å; C1454-F1457 PolarHBondContact O-N 3.49Å; E1455-F1457 VanDerWaalsContact C-N 3.31Å; E1455-F1457 PolarHBondContact O-N 3.04Å; F1457-Q1461 HydrophobicContact CB-CB 4.09Å; F1457-K1462 HydrophobicContact CB-CG 3.81Å; F1457-K1462 WeakPolarHBondContact O-CE 3.22Å; F1457-K1462 PolarHBondContact O-NZ 3.1Å; F1457-I1465 HydrophobicContact CD2-CD1 4.04Å; F1457-I1465 HydrophobicContact CE2-CD1 3.81Å; F1457-I1465 HydrophobicContact CZ-CD1 4.27Å
1458T73.8Confident62.4Low78.8 Ų78.870.2 Ų70.248%0.48339%0.387SS..  trans-62.7156.3168.160.90000110.8R1460 Q1461 K1462T1458-R1460 PolarHBondContact O-N 3.08Å; T1458-R1460 VanDerWaalsContact O-N 3.14Å; T1458-Q1461 WeakPolarHBondContact O-CA 3.38Å; T1458-Q1461 WeakPolarHBondContact O-CB 3.41Å; T1458-Q1461 PolarHBondContact O-N 3.18Å; T1458-Q1461 VanDerWaalsContact OG1-CD 3.27Å; T1458-Q1461 WeakPolarHBondContact OG1-CG 3.32Å; T1458-Q1461 PolarHBondContact OG1-N 3.13Å; T1458-Q1461 PolarHBondContact OG1-OE1 3.19Å; T1458-Q1461 VanDerWaalsContact OG1-OE1 3.07Å; T1458-K1462 PolarHBondContact O-N 3.34Å
1459D69.7Low64.8Low126 Ų12665.9 Ų65.967%0.67436%0.357SS*.Hα-helixtrans-60-32.5-179.3-60.5-31.8000112.5Q1461 K1462 A1463D1459-Q1461 PolarHBondContact O-N 2.74Å; D1459-K1462 PolarHBondContact O-N 3.13Å; D1459-K1462 IonicContact OD1-NZ 2.68Å; D1459-A1463 WeakPolarHBondContact O-CB 3.39Å; D1459-A1463 PolarHBondContact O-N 3.01Å
1460R72.8Confident67.2Low81.8 Ų81.858.9 Ų58.931%0.30932%0.321SS..Hα-helixtrans-59.1-47.9171-106.5179.2-175.1172.42.1111.9V1308 T1458 K1462 A1463 V1464 E1683 D1686 H1687 I1690V1308-R1460 PolarHBondContact O-NH2 2.91Å; T1458-R1460 PolarHBondContact O-N 3.08Å; T1458-R1460 VanDerWaalsContact O-N 3.14Å; R1460-K1462 VanDerWaalsContact C-N 3.34Å; R1460-A1463 PolarHBondContact O-N 3.18Å; R1460-V1464 WeakPolarHBondContact O-CG2 3.42Å; R1460-V1464 PolarHBondContact O-N 3.07Å; R1460-V1464 VanDerWaalsContact O-N 3.13Å; R1460-E1683 IonicContact NH2-OE1 3.59Å; R1460-E1683 PolarHBondContact NH2-OE1 3.49Å; R1460-E1683 VanDerWaalsContact NH2-OE1 3.15Å; R1460-D1686 IonicContact CZ-OD1 3.58Å; R1460-D1686 IonicContact CZ-OD2 3.07Å; R1460-D1686 IonicContact NH1-OD1 2.68Å; R1460-D1686 PolarHBondContact NH1-OD1 3.29Å; R1460-D1686 IonicContact NH1-OD2 3.46Å; R1460-D1686 PolarHBondContact NH1-OD2 3.34Å; R1460-D1686 IonicContact NH2-OD1 2.83Å; R1460-D1686 IonicContact NH2-OD2 3.33Å; R1460-D1686 PolarHBondContact NH2-OD2 3.05Å; R1460-H1687 PolarHBondContact NH2-CE1 3.01Å; R1460-H1687 PolarHBondContact NH2-NE2 3.08Å; R1460-I1690 HydrophobicContact CB-CD1 3.98Å; R1460-I1690 VanDerWaalsContact CD-CD1 3.42Å; R1460-I1690 HydrophobicContact CG-CD1 3.71Å; R1460-I1690 VanDerWaalsContact CG-CD1 3.5Å; R1460-I1690 HydrophobicContact CG-CG1 4.32Å
1461Q78.2Confident69.6Low40.8 Ų40.851.2 Ų51.219%0.19128%0.28CS..Hα-helixtrans-65.9-40.8-179.8-74.1170.8-30.400111.6F1391 F1457 T1458 D1459 V1464 I1465F1391-Q1461 HydrophobicContact CD1-CG 4Å; F1391-Q1461 HydrophobicContact CD2-CB 3.54Å; F1391-Q1461 VanDerWaalsContact CD2-CB 3.48Å; F1391-Q1461 HydrophobicContact CD2-CG 3.59Å; F1391-Q1461 HydrophobicContact CE1-CG 3.88Å; F1391-Q1461 HydrophobicContact CE2-CB 3.38Å; F1391-Q1461 VanDerWaalsContact CE2-CB 3.42Å; F1391-Q1461 HydrophobicContact CE2-CG 3.48Å; F1391-Q1461 VanDerWaalsContact CE2-CG 3.48Å; F1391-Q1461 HydrophobicContact CG-CB 4.29Å; F1391-Q1461 HydrophobicContact CG-CG 3.86Å; F1391-Q1461 HydrophobicContact CZ-CB 4.01Å; F1391-Q1461 HydrophobicContact CZ-CG 3.63Å; F1457-Q1461 HydrophobicContact CB-CB 4.09Å; T1458-Q1461 WeakPolarHBondContact O-CA 3.38Å; T1458-Q1461 WeakPolarHBondContact O-CB 3.41Å; T1458-Q1461 PolarHBondContact O-N 3.18Å; T1458-Q1461 VanDerWaalsContact OG1-CD 3.27Å; T1458-Q1461 WeakPolarHBondContact OG1-CG 3.32Å; T1458-Q1461 PolarHBondContact OG1-N 3.13Å; T1458-Q1461 PolarHBondContact OG1-OE1 3.19Å; T1458-Q1461 VanDerWaalsContact OG1-OE1 3.07Å; D1459-Q1461 PolarHBondContact O-N 2.74Å; Q1461-V1464 PolarHBondContact O-N 3.19Å; Q1461-I1465 WeakPolarHBondContact O-CG1 3.38Å; Q1461-I1465 PolarHBondContact O-N 3.16Å; Q1461-I1465 VanDerWaalsContact O-N 3.08Å
1462K76.9Confident72.1Confident54.6 Ų54.648.9 Ų48.924%0.23726%0.255CS..Hα-helixtrans-59.6-47.9174.4-69.3172.7177.3156.50111.3L1445 C1454 F1457 T1458 D1459 R1460 V1464 I1465 E1466L1445-K1462 HydrophobicContact CD1-CB 4Å; L1445-K1462 HydrophobicContact CD1-CG 4.12Å; L1445-K1462 WeakPolarHBondContact CD1-O 3.41Å; C1454-K1462 WeakPolarHBondContact O-CE 3.28Å; C1454-K1462 PolarHBondContact O-NZ 2.99Å; C1454-K1462 VanDerWaalsContact O-NZ 3.09Å; F1457-K1462 HydrophobicContact CB-CG 3.81Å; F1457-K1462 WeakPolarHBondContact O-CE 3.22Å; F1457-K1462 PolarHBondContact O-NZ 3.1Å; T1458-K1462 PolarHBondContact O-N 3.34Å; D1459-K1462 PolarHBondContact O-N 3.13Å; D1459-K1462 IonicContact OD1-NZ 2.68Å; R1460-K1462 VanDerWaalsContact C-N 3.34Å; K1462-V1464 VanDerWaalsContact C-N 3.33Å; K1462-V1464 PolarHBondContact O-N 3.11Å; K1462-I1465 PolarHBondContact O-N 3.12Å; K1462-E1466 VanDerWaalsContact O-CB 3.31Å; K1462-E1466 WeakPolarHBondContact O-CB 3.31Å; K1462-E1466 PolarHBondContact O-N 3.18Å
1463A77Confident74.5Confident11 Ų1142.1 Ų42.19%0.09122%0.218CC..Hα-helixtrans-61-39.117900000112.9D1459 R1460 A1467 I1690 H1694D1459-A1463 WeakPolarHBondContact O-CB 3.39Å; D1459-A1463 PolarHBondContact O-N 3.01Å; R1460-A1463 PolarHBondContact O-N 3.18Å; A1463-A1467 VanDerWaalsContact O-CB 3.28Å; A1463-A1467 WeakPolarHBondContact O-CB 3.3Å; A1463-A1467 PolarHBondContact O-N 3.14Å; A1463-I1690 HydrophobicContact CB-CG1 4.48Å; A1463-I1690 HydrophobicContact CB-CG2 3.81Å; A1463-H1694 PolarHBondContact O-CD2 3.07Å
1464V79.3Confident76.6Confident5.2 Ų5.238.2 Ų38.23%0.03219%0.194CC..Hα-helixtrans-66.5-48.1176.6172.30000111.5T1309 R1460 Q1461 K1462 E1466 A1467 L1468 L1693T1309-V1464 HydrophobicContact CG2-CG1 4.13Å; T1309-V1464 HydrophobicContact CG2-CG2 4.12Å; R1460-V1464 WeakPolarHBondContact O-CG2 3.42Å; R1460-V1464 PolarHBondContact O-N 3.07Å; R1460-V1464 VanDerWaalsContact O-N 3.13Å; Q1461-V1464 PolarHBondContact O-N 3.19Å; K1462-V1464 VanDerWaalsContact C-N 3.33Å; K1462-V1464 PolarHBondContact O-N 3.11Å; V1464-E1466 VanDerWaalsContact C-N 3.32Å; V1464-E1466 PolarHBondContact O-N 3.16Å; V1464-A1467 PolarHBondContact O-N 3.12Å; V1464-L1468 HydrophobicContact CG1-CD1 4.1Å; V1464-L1468 HydrophobicContact CG1-CG 4.49Å; V1464-L1468 WeakPolarHBondContact O-CB 3.46Å; V1464-L1468 WeakPolarHBondContact O-CG 3.24Å; V1464-L1468 PolarHBondContact O-N 3.22Å; V1464-L1693 HydrophobicContact CB-CD2 4.36Å; V1464-L1693 HydrophobicContact CG1-CD2 4.37Å; V1464-L1693 HydrophobicContact CG2-CD2 4.01Å
1465I81.3Confident78.7Confident0.8 Ų0.836.4 Ų36.40%0.00418%0.182CC..Hα-helixtrans-61.3-43.4178.5-73.1171.9000110.7I1386 F1391 Q1398 L1444 L1445 F1457 Q1461 K1462 L1468 S1469I1386-I1465 HydrophobicContact CD1-CG2 4.35Å; F1391-I1465 HydrophobicContact CD2-CD1 3.78Å; F1391-I1465 HydrophobicContact CD2-CG1 4.37Å; F1391-I1465 HydrophobicContact CE2-CD1 3.82Å; F1391-I1465 HydrophobicContact CE2-CG1 3.99Å; Q1398-I1465 HydrophobicContact CG-CG2 4.41Å; L1444-I1465 HydrophobicContact CD2-CG2 3.68Å; L1444-I1465 VanDerWaalsContact CD2-CG2 3.41Å; L1445-I1465 HydrophobicContact CD1-CB 4.46Å; L1445-I1465 HydrophobicContact CD1-CG2 4.23Å; F1457-I1465 HydrophobicContact CD2-CD1 4.04Å; F1457-I1465 HydrophobicContact CE2-CD1 3.81Å; F1457-I1465 HydrophobicContact CZ-CD1 4.27Å; Q1461-I1465 WeakPolarHBondContact O-CG1 3.38Å; Q1461-I1465 PolarHBondContact O-N 3.16Å; Q1461-I1465 VanDerWaalsContact O-N 3.08Å; K1462-I1465 PolarHBondContact O-N 3.12Å; I1465-L1468 PolarHBondContact O-N 3.26Å; I1465-S1469 WeakPolarHBondContact O-CB 3.28Å; I1465-S1469 PolarHBondContact O-N 3.17Å
1466E81.1Confident80.6Confident51.8 Ų51.828.8 Ų28.824%0.24215%0.147CC..Hα-helixtrans-63.4-44.8177.1-166.8-170.9164.600111.4K1462 V1464 L1468 S1469 L1470 H1694K1462-E1466 VanDerWaalsContact O-CB 3.31Å; K1462-E1466 WeakPolarHBondContact O-CB 3.31Å; K1462-E1466 PolarHBondContact O-N 3.18Å; V1464-E1466 VanDerWaalsContact C-N 3.32Å; V1464-E1466 PolarHBondContact O-N 3.16Å; E1466-L1468 VanDerWaalsContact C-N 3.33Å; E1466-L1468 PolarHBondContact O-N 3.19Å; E1466-S1469 WeakPolarHBondContact O-CB 3.43Å; E1466-S1469 PolarHBondContact O-N 3.29Å; E1466-S1469 PolarHBondContact O-OG 3.4Å; E1466-L1470 HydrophobicContact CG-CD1 4.32Å; E1466-L1470 WeakPolarHBondContact O-CB 3.33Å; E1466-L1470 WeakPolarHBondContact O-CG 3.15Å; E1466-L1470 PolarHBondContact O-N 2.98Å; E1466-H1694 IonicContact OE1-CD2 3.2Å; E1466-H1694 IonicContact OE1-CE1 2.68Å; E1466-H1694 IonicContact OE1-NE2 3.11Å; E1466-H1694 PolarHBondContact OE1-NE2 3.09Å; E1466-H1694 IonicContact OE2-CD2 3.13Å; E1466-H1694 PolarHBondContact OE2-CD2 3.49Å; E1466-H1694 VanDerWaalsContact OE2-CD2 3.27Å; E1466-H1694 IonicContact OE2-CE1 3.49Å; E1466-H1694 IonicContact OE2-NE2 3.12Å; E1466-H1694 PolarHBondContact OE2-NE2 3.24Å
1467A82.1Confident81.9Confident2 Ų223.2 Ų23.22%0.01712%0.116CC..Hα-helixtrans-61-43.2177.600000112.3A1463 V1464 S1469 L1470 N1471 L1693A1463-A1467 VanDerWaalsContact O-CB 3.28Å; A1463-A1467 WeakPolarHBondContact O-CB 3.3Å; A1463-A1467 PolarHBondContact O-N 3.14Å; V1464-A1467 PolarHBondContact O-N 3.12Å; A1467-S1469 VanDerWaalsContact C-N 3.35Å; A1467-L1470 PolarHBondContact O-N 3Å; A1467-N1471 WeakPolarHBondContact O-CB 3.39Å; A1467-N1471 PolarHBondContact O-N 3.09Å; A1467-L1693 HydrophobicContact CB-CD1 4.27Å; A1467-L1693 HydrophobicContact CB-CD2 3.8Å; A1467-L1693 HydrophobicContact CB-CG 3.85Å
1468L84.1Confident82.9Confident2 Ų223.3 Ų23.31%0.0112%0.116CC..Hα-helixtrans-64.4-41.3175.4-69.5171.1000111.7Q1398 W1399 A1402 V1464 I1465 E1466 L1470 N1471 R1472 L1587Q1398-L1468 HydrophobicContact CB-CB 3.8Å; Q1398-L1468 HydrophobicContact CB-CD1 4.09Å; W1399-L1468 HydrophobicContact CB-CD1 4.47Å; W1399-L1468 HydrophobicContact CD2-CD2 4.3Å; W1399-L1468 HydrophobicContact CE3-CD1 3.92Å; W1399-L1468 HydrophobicContact CE3-CD2 3.9Å; W1399-L1468 HydrophobicContact CE3-CG 4.46Å; W1399-L1468 HydrophobicContact CZ3-CD2 4.43Å; A1402-L1468 HydrophobicContact CB-CD2 4.4Å; V1464-L1468 HydrophobicContact CG1-CD1 4.1Å; V1464-L1468 HydrophobicContact CG1-CG 4.49Å; V1464-L1468 WeakPolarHBondContact O-CB 3.46Å; V1464-L1468 WeakPolarHBondContact O-CG 3.24Å; V1464-L1468 PolarHBondContact O-N 3.22Å; I1465-L1468 PolarHBondContact O-N 3.26Å; E1466-L1468 VanDerWaalsContact C-N 3.33Å; E1466-L1468 PolarHBondContact O-N 3.19Å; L1468-L1470 PolarHBondContact O-N 3.29Å; L1468-N1471 WeakPolarHBondContact O-CB 3.38Å; L1468-N1471 PolarHBondContact O-N 3.15Å; L1468-R1472 WeakPolarHBondContact O-CB 3.34Å; L1468-R1472 PolarHBondContact O-N 2.98Å; L1468-L1587 HydrophobicContact CD2-CD1 3.72Å; L1468-L1587 HydrophobicContact CD2-CD2 4.13Å; L1468-L1587 VanDerWaalsContact CD2-CD2 3.48Å; L1468-L1587 HydrophobicContact CD2-CG 4.28Å; L1468-L1587 HydrophobicContact CG-CD1 4.3Å
1469S84.8Confident83.8Confident4.6 Ų4.619.6 Ų19.63%0.0329%0.094CC..Hα-helixtrans-62.3-44.8175.7169.80000111.8L1444 I1465 E1466 A1467 N1471 R1472 K1473L1444-S1469 WeakPolarHBondContact CD1-OG 3.22Å; I1465-S1469 WeakPolarHBondContact O-CB 3.28Å; I1465-S1469 PolarHBondContact O-N 3.17Å; E1466-S1469 WeakPolarHBondContact O-CB 3.43Å; E1466-S1469 PolarHBondContact O-N 3.29Å; E1466-S1469 PolarHBondContact O-OG 3.4Å; A1467-S1469 VanDerWaalsContact C-N 3.35Å; S1469-N1471 VanDerWaalsContact C-N 3.33Å; S1469-N1471 PolarHBondContact O-N 3.04Å; S1469-R1472 WeakPolarHBondContact O-CB 3.31Å; S1469-R1472 PolarHBondContact O-N 3.16Å; S1469-K1473 WeakPolarHBondContact O-CB 3.34Å; S1469-K1473 VanDerWaalsContact O-CG 3.28Å; S1469-K1473 WeakPolarHBondContact O-CG 3.42Å; S1469-K1473 PolarHBondContact O-N 3.24Å
1470L85.7Confident84.9Confident2.4 Ų2.413.6 Ų13.61%0.0136%0.061CC..Hα-helixtrans-63.5-40175.6-72.6174.1000111.7E1466 A1467 L1468 K1473 N1474 I1550 L1551 K1699 A1702E1466-L1470 HydrophobicContact CG-CD1 4.32Å; E1466-L1470 WeakPolarHBondContact O-CB 3.33Å; E1466-L1470 WeakPolarHBondContact O-CG 3.15Å; E1466-L1470 PolarHBondContact O-N 2.98Å; A1467-L1470 PolarHBondContact O-N 3Å; L1468-L1470 PolarHBondContact O-N 3.29Å; L1470-K1473 PolarHBondContact O-N 3.38Å; L1470-N1474 WeakPolarHBondContact O-CB 3.3Å; L1470-N1474 PolarHBondContact O-N 3.1Å; L1470-I1550 HydrophobicContact CD2-CG2 3.98Å; L1470-L1551 HydrophobicContact CD2-CD2 4.32Å; L1470-K1699 HydrophobicContact CD1-CG 3.9Å; L1470-A1702 HydrophobicContact CB-CB 4.34Å; L1470-A1702 HydrophobicContact CD2-CB 4.31Å
1471N85.2Confident85.9Confident2.4 Ų2.49.8 Ų9.81%0.0135%0.048CC..Hα-helixtrans-63.7-44.4176.8-166.1-11.1000111.7A1467 L1468 S1469 K1473 N1474 W1475 L1587 A1697A1467-N1471 WeakPolarHBondContact O-CB 3.39Å; A1467-N1471 PolarHBondContact O-N 3.09Å; L1468-N1471 WeakPolarHBondContact O-CB 3.38Å; L1468-N1471 PolarHBondContact O-N 3.15Å; S1469-N1471 VanDerWaalsContact C-N 3.33Å; S1469-N1471 PolarHBondContact O-N 3.04Å; N1471-K1473 PolarHBondContact O-N 3.11Å; N1471-N1474 VanDerWaalsContact O-CB 3.28Å; N1471-N1474 WeakPolarHBondContact O-CB 3.31Å; N1471-N1474 PolarHBondContact O-N 3.12Å; N1471-N1474 PolarHBondContact O-ND2 3.22Å; N1471-N1474 PolarHBondContact OD1-ND2 2.97Å; N1471-W1475 PolarHBondContact O-N 3.21Å; N1471-W1475 VanDerWaalsContact O-N 3.12Å; N1471-W1475 PolarHBondContact OD1-NE1 3.34Å; N1471-L1587 PolarHBondContact ND2-O 3.16Å; N1471-A1697 WeakPolarHBondContact CB-O 3.43Å; N1471-A1697 PolarHBondContact ND2-O 3.42Å
1472R87.1Confident86.5Confident3.4 Ų3.49.7 Ų9.71%0.0135%0.048CC..Hα-helixtrans-55.5-51171.7179-176.268.6137.66.4111.3L1401 A1402 W1405 D1439 L1468 S1469 N1474 W1475 I1476L1401-R1472 HydrophobicContact CB-CG 4.28Å; L1401-R1472 VanDerWaalsContact CD1-NH1 3.3Å; A1402-R1472 HydrophobicContact CB-CB 4.41Å; W1405-R1472 VanDerWaalsContact CD1-CG 3.49Å; W1405-R1472 HydrophobicContact CG-CG 4.29Å; D1439-R1472 VanDerWaalsContact CG-NH1 3.33Å; D1439-R1472 VanDerWaalsContact CG-NH2 3.32Å; D1439-R1472 IonicContact OD1-CZ 3.33Å; D1439-R1472 IonicContact OD1-NH1 3.21Å; D1439-R1472 PolarHBondContact OD1-NH1 3.24Å; D1439-R1472 IonicContact OD1-NH2 2.98Å; D1439-R1472 PolarHBondContact OD1-NH2 3.06Å; D1439-R1472 IonicContact OD2-CZ 3.26Å; D1439-R1472 VanDerWaalsContact OD2-CZ 3.26Å; D1439-R1472 IonicContact OD2-NE 3.28Å; D1439-R1472 PolarHBondContact OD2-NE 3.36Å; D1439-R1472 IonicContact OD2-NH1 3.46Å; D1439-R1472 PolarHBondContact OD2-NH1 3.14Å; D1439-R1472 IonicContact OD2-NH2 3.46Å; D1439-R1472 PolarHBondContact OD2-NH2 3.06Å; L1468-R1472 WeakPolarHBondContact O-CB 3.34Å; L1468-R1472 PolarHBondContact O-N 2.98Å; S1469-R1472 WeakPolarHBondContact O-CB 3.31Å; S1469-R1472 PolarHBondContact O-N 3.16Å; R1472-N1474 VanDerWaalsContact C-N 3.29Å; R1472-N1474 PolarHBondContact O-N 3.16Å; R1472-W1475 PolarHBondContact O-N 3.14Å; R1472-W1475 VanDerWaalsContact O-N 3.11Å; R1472-I1476 HydrophobicContact CG-CD1 4.34Å; R1472-I1476 WeakPolarHBondContact O-CG1 3.38Å; R1472-I1476 PolarHBondContact O-N 3.09Å; R1472-I1476 VanDerWaalsContact O-N 3.12Å
1473K87.8Confident87.3Confident2.2 Ų2.27.2 Ų7.21%0.014%0.037CC..Hα-helixtrans-60.9-35.7178.4-67.8-178.9-178.2-166.30112.7D1439 L1440 Q1442 S1469 L1470 N1471 I1476 L1477 F1547D1439-K1473 VanDerWaalsContact O-CE 3.26Å; D1439-K1473 WeakPolarHBondContact O-CE 3.33Å; D1439-K1473 PolarHBondContact O-NZ 3.23Å; L1440-K1473 HydrophobicContact CD2-CB 3.72Å; L1440-K1473 HydrophobicContact CD2-CD 4.17Å; L1440-K1473 HydrophobicContact CD2-CG 3.71Å; L1440-K1473 PolarHBondContact O-NZ 3.19Å; Q1442-K1473 PolarHBondContact O-NZ 3.08Å; S1469-K1473 WeakPolarHBondContact O-CB 3.34Å; S1469-K1473 VanDerWaalsContact O-CG 3.28Å; S1469-K1473 WeakPolarHBondContact O-CG 3.42Å; S1469-K1473 PolarHBondContact O-N 3.24Å; L1470-K1473 PolarHBondContact O-N 3.38Å; N1471-K1473 PolarHBondContact O-N 3.11Å; K1473-I1476 PolarHBondContact O-N 2.98Å; K1473-L1477 WeakPolarHBondContact O-CG 3.25Å; K1473-L1477 PolarHBondContact O-N 3.08Å; K1473-F1547 HydrophobicContact CB-CE2 3.81Å; K1473-F1547 HydrophobicContact CB-CZ 4.17Å; K1473-F1547 HydrophobicContact CD-CE2 3.92Å; K1473-F1547 HydrophobicContact CG-CE2 4.36Å
1474N88.9Confident87.9Confident0.2 Ų0.26.7 Ų6.70%0.0013%0.033CC..Hα-helixtrans-56.1-50.8171.6146.568.8000111.6L1470 N1471 R1472 I1476 L1477 R1478 V1701 A1705L1470-N1474 WeakPolarHBondContact O-CB 3.3Å; L1470-N1474 PolarHBondContact O-N 3.1Å; N1471-N1474 VanDerWaalsContact O-CB 3.28Å; N1471-N1474 WeakPolarHBondContact O-CB 3.31Å; N1471-N1474 PolarHBondContact O-N 3.12Å; N1471-N1474 PolarHBondContact O-ND2 3.22Å; N1471-N1474 PolarHBondContact OD1-ND2 2.97Å; R1472-N1474 VanDerWaalsContact C-N 3.29Å; R1472-N1474 PolarHBondContact O-N 3.16Å; N1474-I1476 VanDerWaalsContact C-N 3.32Å; N1474-I1476 PolarHBondContact O-N 3.32Å; N1474-L1477 PolarHBondContact O-N 3.06Å; N1474-R1478 WeakPolarHBondContact O-CG 3.34Å; N1474-R1478 PolarHBondContact O-N 3.3Å; N1474-R1478 WeakPolarHBondContact OD1-CD 3.38Å; N1474-R1478 VanDerWaalsContact OD1-CZ 3.26Å; N1474-R1478 PolarHBondContact OD1-NE 2.99Å; N1474-R1478 PolarHBondContact OD1-NH2 2.92Å; N1474-R1478 VanDerWaalsContact OD1-NH2 3.16Å; N1474-V1701 HydrophobicContact CB-CB 4.39Å; N1474-V1701 HydrophobicContact CB-CG1 3.91Å; N1474-V1701 HydrophobicContact CB-CG2 4.17Å; N1474-V1701 VanDerWaalsContact ND2-CG1 3.26Å; N1474-V1701 WeakPolarHBondContact ND2-CG1 3.38Å; N1474-V1701 VanDerWaalsContact OD1-CG1 3.27Å; N1474-V1701 WeakPolarHBondContact OD1-CG1 3.37Å; N1474-V1701 PolarHBondContact OD1-O 3.23Å; N1474-V1701 VanDerWaalsContact OD1-O 3.08Å; N1474-A1705 HydrophobicContact CB-CB 4.09Å; N1474-A1705 VanDerWaalsContact O-CB 3.31Å; N1474-A1705 WeakPolarHBondContact O-CB 3.33Å; N1474-A1705 WeakPolarHBondContact OD1-CB 3.33Å
1475W90.7Very high88.4Confident4 Ų413.1 Ų13.12%0.0156%0.057CC..Hα-helixtrans-64.4-37.1-178.8-64.2122.7000112.7W1405 Q1406 Y1409 N1471 R1472 R1478 L1479 S1589W1405-W1475 HydrophobicContact CB-CB 3.68Å; W1405-W1475 HydrophobicContact CB-CG 4.38Å; Q1406-W1475 HydrophobicContact CB-CD2 4.02Å; Q1406-W1475 HydrophobicContact CB-CG 4.17Å; Q1406-W1475 HydrophobicContact CB-CZ2 4.25Å; Q1406-W1475 HydrophobicContact CG-CD2 4.16Å; Q1406-W1475 HydrophobicContact CG-CE3 4.49Å; Q1406-W1475 HydrophobicContact CG-CH2 4.1Å; Q1406-W1475 HydrophobicContact CG-CZ2 3.62Å; Q1406-W1475 HydrophobicContact CG-CZ3 4.45Å; Y1409-W1475 AromaticContact CD1-CE3 3.47Å; Y1409-W1475 HydrophobicContact CD1-CE3 3.47Å; Y1409-W1475 VanDerWaalsContact CD1-CE3 3.43Å; Y1409-W1475 HydrophobicContact CD1-CH2 4.4Å; Y1409-W1475 AromaticContact CD1-CZ3 3.3Å; Y1409-W1475 HydrophobicContact CD1-CZ3 3.3Å; Y1409-W1475 HydrophobicContact CD2-CE3 4.36Å; Y1409-W1475 HydrophobicContact CD2-CZ3 4.45Å; Y1409-W1475 AromaticContact CE1-CE3 3.98Å; Y1409-W1475 HydrophobicContact CE1-CE3 4.09Å; Y1409-W1475 HydrophobicContact CE1-CH2 4.48Å; Y1409-W1475 AromaticContact CE1-CZ3 3.52Å; Y1409-W1475 HydrophobicContact CE1-CZ3 3.52Å; Y1409-W1475 VanDerWaalsContact CE1-CZ3 3.5Å; Y1409-W1475 AromaticContact CG-CE3 3.62Å; Y1409-W1475 HydrophobicContact CG-CE3 3.62Å; Y1409-W1475 AromaticContact CG-CZ3 3.91Å; Y1409-W1475 HydrophobicContact CG-CZ3 3.94Å; N1471-W1475 PolarHBondContact O-N 3.21Å; N1471-W1475 VanDerWaalsContact O-N 3.12Å; N1471-W1475 PolarHBondContact OD1-NE1 3.34Å; R1472-W1475 PolarHBondContact O-N 3.14Å; R1472-W1475 VanDerWaalsContact O-N 3.11Å; W1475-R1478 PolarHBondContact O-N 3.25Å; W1475-L1479 WeakPolarHBondContact O-CB 3.32Å; W1475-L1479 PolarHBondContact O-N 3.14Å; W1475-S1589 VanDerWaalsContact CH2-OG 3.23Å; W1475-S1589 WeakPolarHBondContact CH2-OG 3.18Å; W1475-S1589 WeakPolarHBondContact CZ2-OG 3.32Å
1476I91Very high88.8Confident0 Ų014.9 Ų14.90%07%0.068CC..Hα-helixtrans-58.7-50.4173.3-61.2171.8000110.5W1405 L1432 L1440 R1472 K1473 N1474 R1478 L1479 Y1480W1405-I1476 HydrophobicContact CD2-CD1 4.26Å; W1405-I1476 HydrophobicContact CD2-CG1 3.53Å; W1405-I1476 VanDerWaalsContact CD2-CG1 3.49Å; W1405-I1476 HydrophobicContact CE3-CB 4.43Å; W1405-I1476 HydrophobicContact CE3-CG1 3.65Å; W1405-I1476 HydrophobicContact CG-CG1 4.11Å; W1405-I1476 HydrophobicContact CH2-CB 4.38Å; W1405-I1476 HydrophobicContact CH2-CD1 4.22Å; W1405-I1476 HydrophobicContact CH2-CG1 3.73Å; W1405-I1476 HydrophobicContact CH2-CG2 4.16Å; W1405-I1476 HydrophobicContact CZ2-CD1 3.85Å; W1405-I1476 HydrophobicContact CZ2-CG1 3.7Å; W1405-I1476 HydrophobicContact CZ3-CB 4.26Å; W1405-I1476 HydrophobicContact CZ3-CG1 3.75Å; W1405-I1476 HydrophobicContact CZ3-CG2 4.33Å; L1432-I1476 HydrophobicContact CD2-CG2 4.4Å; L1440-I1476 HydrophobicContact CD1-CG2 4.15Å; L1440-I1476 HydrophobicContact CD2-CB 4.3Å; L1440-I1476 HydrophobicContact CD2-CD1 4.16Å; L1440-I1476 HydrophobicContact CD2-CG2 4.18Å; L1440-I1476 HydrophobicContact CG-CG2 4.43Å; R1472-I1476 HydrophobicContact CG-CD1 4.34Å; R1472-I1476 WeakPolarHBondContact O-CG1 3.38Å; R1472-I1476 PolarHBondContact O-N 3.09Å; R1472-I1476 VanDerWaalsContact O-N 3.12Å; K1473-I1476 PolarHBondContact O-N 2.98Å; N1474-I1476 VanDerWaalsContact C-N 3.32Å; N1474-I1476 PolarHBondContact O-N 3.32Å; I1476-R1478 PolarHBondContact O-N 3.06Å; I1476-L1479 PolarHBondContact O-N 3.28Å; I1476-Y1480 WeakPolarHBondContact O-CB 3.37Å; I1476-Y1480 PolarHBondContact O-N 3.03Å
1477L91.2Very high89.2Confident0 Ų012.5 Ų12.50%06%0.056CC..Hα-helixtrans-64.9-37.2-178.9-76.2174.3000112.8L1440 K1473 N1474 Y1480 A1481 F1503 V1543 F1547 A1705 W1706 A1709L1440-L1477 HydrophobicContact CD1-CD2 3.83Å; L1440-L1477 HydrophobicContact CD1-CG 4.24Å; L1440-L1477 HydrophobicContact CD2-CG 4.33Å; K1473-L1477 WeakPolarHBondContact O-CG 3.25Å; K1473-L1477 PolarHBondContact O-N 3.08Å; N1474-L1477 PolarHBondContact O-N 3.06Å; L1477-Y1480 WeakPolarHBondContact O-CB 3.34Å; L1477-Y1480 PolarHBondContact O-N 3.34Å; L1477-A1481 WeakPolarHBondContact O-CB 3.38Å; L1477-A1481 PolarHBondContact O-N 3.21Å; L1477-F1503 HydrophobicContact CD2-CD2 4.47Å; L1477-F1503 HydrophobicContact CD2-CE2 3.88Å; L1477-V1543 HydrophobicContact CD2-CG1 4.46Å; L1477-F1547 HydrophobicContact CD1-CD1 4.06Å; L1477-F1547 HydrophobicContact CD1-CD2 4.24Å; L1477-F1547 HydrophobicContact CD1-CE1 3.61Å; L1477-F1547 HydrophobicContact CD1-CE2 3.82Å; L1477-F1547 HydrophobicContact CD1-CG 4.29Å; L1477-F1547 HydrophobicContact CD1-CZ 3.48Å; L1477-F1547 VanDerWaalsContact CD1-CZ 3.47Å; L1477-A1705 HydrophobicContact CB-CB 3.75Å; L1477-A1705 HydrophobicContact CD1-CB 4.38Å; L1477-W1706 HydrophobicContact CD1-CB 4.23Å; L1477-A1709 HydrophobicContact CD2-CB 4.21Å
1478R92.2Very high89.4Confident16 Ų1612.5 Ų12.56%0.066%0.057CC..Hα-helixtrans-67.5-41.2174.9-68.7-173.3-176.1-153.5-3.2112.3Y1409 N1474 W1475 I1476 Y1480 A1481 I1482 A1705Y1409-R1478 HydrophobicContact CD2-CB 3.58Å; Y1409-R1478 HydrophobicContact CE2-CB 3.5Å; Y1409-R1478 VanDerWaalsContact CE2-CB 3.48Å; Y1409-R1478 HydrophobicContact CE2-CG 4.33Å; Y1409-R1478 HydrophobicContact CG-CB 4.48Å; N1474-R1478 WeakPolarHBondContact O-CG 3.34Å; N1474-R1478 PolarHBondContact O-N 3.3Å; N1474-R1478 WeakPolarHBondContact OD1-CD 3.38Å; N1474-R1478 VanDerWaalsContact OD1-CZ 3.26Å; N1474-R1478 PolarHBondContact OD1-NE 2.99Å; N1474-R1478 PolarHBondContact OD1-NH2 2.92Å; N1474-R1478 VanDerWaalsContact OD1-NH2 3.16Å; W1475-R1478 PolarHBondContact O-N 3.25Å; I1476-R1478 PolarHBondContact O-N 3.06Å; R1478-Y1480 VanDerWaalsContact C-N 3.34Å; R1478-A1481 WeakPolarHBondContact O-CB 3.43Å; R1478-A1481 PolarHBondContact O-N 3.25Å; R1478-I1482 WeakPolarHBondContact O-CG1 3.33Å; R1478-I1482 PolarHBondContact O-N 3.26Å; R1478-I1482 VanDerWaalsContact O-N 3.11Å; R1478-A1705 HydrophobicContact CG-CB 3.75Å
1479L92.8Very high89.4Confident0.2 Ų0.218.4 Ų18.40%0.0019%0.085CC..Hα-helixtrans-66.3-39.2175.9-172.663.3000111.1W1405 L1408 L1422 L1425 L1432 W1475 I1476 A1481 I1482 E1483W1405-L1479 HydrophobicContact CE3-CD2 4.39Å; W1405-L1479 HydrophobicContact CZ3-CD2 4.06Å; L1408-L1479 HydrophobicContact CB-CD2 4.23Å; L1422-L1479 HydrophobicContact CD2-CD1 3.9Å; L1425-L1479 HydrophobicContact CD1-CD2 4.33Å; L1432-L1479 HydrophobicContact CD1-CG 4.32Å; L1432-L1479 HydrophobicContact CD2-CB 4.32Å; L1432-L1479 HydrophobicContact CD2-CD2 4.27Å; L1432-L1479 HydrophobicContact CD2-CG 4.29Å; W1475-L1479 WeakPolarHBondContact O-CB 3.32Å; W1475-L1479 PolarHBondContact O-N 3.14Å; I1476-L1479 PolarHBondContact O-N 3.28Å; L1479-A1481 VanDerWaalsContact C-N 3.33Å; L1479-A1481 PolarHBondContact O-N 3.01Å; L1479-I1482 PolarHBondContact O-N 3.01Å; L1479-E1483 WeakPolarHBondContact O-CB 3.28Å; L1479-E1483 PolarHBondContact O-N 3.15Å
1480Y93Very high89.4Confident0 Ų020.8 Ų20.80%011%0.106CC..Hα-helixtrans-56.3-46.6170.1164.1-98000112.2L1436 I1476 L1477 R1478 I1482 E1483 I1484 L1499 F1503 A1709L1436-Y1480 HydrophobicContact CD1-CD2 3.69Å; L1436-Y1480 HydrophobicContact CD1-CE2 3.82Å; L1436-Y1480 HydrophobicContact CD1-CG 4.48Å; L1436-Y1480 HydrophobicContact CD2-CD2 4.25Å; L1436-Y1480 HydrophobicContact CD2-CE2 4.42Å; L1436-Y1480 HydrophobicContact CD2-CG 4.42Å; L1436-Y1480 HydrophobicContact CG-CD2 4.45Å; I1476-Y1480 WeakPolarHBondContact O-CB 3.37Å; I1476-Y1480 PolarHBondContact O-N 3.03Å; L1477-Y1480 WeakPolarHBondContact O-CB 3.34Å; L1477-Y1480 PolarHBondContact O-N 3.34Å; R1478-Y1480 VanDerWaalsContact C-N 3.34Å; Y1480-I1482 VanDerWaalsContact C-N 3.3Å; Y1480-I1482 PolarHBondContact O-N 2.94Å; Y1480-E1483 PolarHBondContact O-N 3.17Å; Y1480-I1484 HydrophobicContact CE1-CG2 4.41Å; Y1480-I1484 HydrophobicContact CE2-CB 4.38Å; Y1480-I1484 HydrophobicContact CE2-CD1 4.17Å; Y1480-I1484 WeakPolarHBondContact O-CB 3.44Å; Y1480-I1484 VanDerWaalsContact O-CG2 3.3Å; Y1480-I1484 WeakPolarHBondContact O-CG2 3.3Å; Y1480-I1484 PolarHBondContact O-N 3.06Å; Y1480-I1484 VanDerWaalsContact OH-CD1 3.3Å; Y1480-I1484 WeakPolarHBondContact OH-CD1 3.19Å; Y1480-L1499 HydrophobicContact CE2-CB 4.07Å; Y1480-L1499 HydrophobicContact CE2-CD1 4.43Å; Y1480-L1499 HydrophobicContact CE2-CD2 4.27Å; Y1480-L1499 HydrophobicContact CE2-CG 4.45Å; Y1480-F1503 HydrophobicContact CD1-CD2 4.48Å; Y1480-F1503 HydrophobicContact CE1-CB 4.36Å; Y1480-F1503 HydrophobicContact CE1-CD1 4.12Å; Y1480-F1503 AromaticContact CE1-CD2 3.95Å; Y1480-F1503 HydrophobicContact CE1-CD2 3.96Å; Y1480-F1503 HydrophobicContact CE1-CE1 4.4Å; Y1480-F1503 HydrophobicContact CE1-CE2 4.28Å; Y1480-F1503 AromaticContact CE1-CG 3.88Å; Y1480-F1503 HydrophobicContact CE1-CG 3.88Å; Y1480-F1503 HydrophobicContact CE1-CZ 4.46Å; Y1480-F1503 HydrophobicContact CE2-CB 4.2Å; Y1480-F1503 HydrophobicContact CE2-CG 4.48Å; Y1480-F1503 AromaticContact CZ-CG 3.7Å; Y1480-F1503 WeakPolarHBondContact OH-CB 3.41Å; Y1480-F1503 WeakPolarHBondContact OH-CD1 3.35Å; Y1480-F1503 VanDerWaalsContact OH-CG 3.31Å; Y1480-F1503 WeakPolarHBondContact OH-CG 3.28Å; Y1480-A1709 HydrophobicContact CD1-CB 3.75Å; Y1480-A1709 HydrophobicContact CE1-CB 3.88Å
1481A93Very high89.3Confident2.2 Ų2.223.8 Ų23.82%0.01812%0.122CC..Hα-helixtrans-61.9-37179.800000112.5L1477 R1478 L1479 I1484 R1485 Q1708 I1712L1477-A1481 WeakPolarHBondContact O-CB 3.38Å; L1477-A1481 PolarHBondContact O-N 3.21Å; R1478-A1481 WeakPolarHBondContact O-CB 3.43Å; R1478-A1481 PolarHBondContact O-N 3.25Å; L1479-A1481 VanDerWaalsContact C-N 3.33Å; L1479-A1481 PolarHBondContact O-N 3.01Å; A1481-I1484 WeakPolarHBondContact O-CG2 3.44Å; A1481-R1485 WeakPolarHBondContact O-CB 3.35Å; A1481-R1485 PolarHBondContact O-N 3.08Å; A1481-Q1708 HydrophobicContact CB-CB 4.48Å; A1481-I1712 HydrophobicContact CB-CD1 3.7Å
1482I92.2Very high89.3Confident38.2 Ų38.226.9 Ų26.920%0.19614%0.136CC..Hα-helixtrans-68.3-51.2172.5-65.5168.7000110.2Y1409 L1422 R1478 L1479 Y1480 I1484 R1485 V1486Y1409-I1482 HydrophobicContact CD2-CD1 3.93Å; Y1409-I1482 HydrophobicContact CE2-CD1 3.61Å; L1422-I1482 HydrophobicContact CD1-CG2 4Å; R1478-I1482 WeakPolarHBondContact O-CG1 3.33Å; R1478-I1482 PolarHBondContact O-N 3.26Å; R1478-I1482 VanDerWaalsContact O-N 3.11Å; L1479-I1482 PolarHBondContact O-N 3.01Å; Y1480-I1482 VanDerWaalsContact C-N 3.3Å; Y1480-I1482 PolarHBondContact O-N 2.94Å; I1482-I1484 PolarHBondContact O-N 3.14Å; I1482-R1485 WeakPolarHBondContact O-CB 3.47Å; I1482-R1485 PolarHBondContact O-N 3.34Å; I1482-V1486 HydrophobicContact CG2-CG2 4.13Å; I1482-V1486 VanDerWaalsContact O-CG2 3.32Å; I1482-V1486 WeakPolarHBondContact O-CG2 3.36Å; I1482-V1486 PolarHBondContact O-N 3.21Å
1483E92.2Very high89.1Confident2.6 Ų2.630.4 Ų30.41%0.01215%0.149CC..Hα-helixtrans-58.8-49.9-175.317769.6172.200112L1422 R1426 L1432 L1479 Y1480 R1485 V1486 C1487 Y1495 L1499L1422-E1483 VanDerWaalsContact CB-OE2 3.32Å; L1422-E1483 WeakPolarHBondContact CB-OE2 3.39Å; L1422-E1483 HydrophobicContact CD2-CB 4.36Å; L1422-E1483 WeakPolarHBondContact CD2-OE2 3.33Å; R1426-E1483 WeakPolarHBondContact CD-OE1 3.41Å; R1426-E1483 IonicContact CZ-OE1 3.4Å; R1426-E1483 IonicContact CZ-OE2 3.18Å; R1426-E1483 IonicContact NE-OE1 2.82Å; R1426-E1483 PolarHBondContact NE-OE1 3.03Å; R1426-E1483 IonicContact NH1-OE1 3.48Å; R1426-E1483 PolarHBondContact NH1-OE1 3.07Å; R1426-E1483 IonicContact NH2-OE1 3.51Å; R1426-E1483 PolarHBondContact NH2-OE1 2.95Å; R1426-E1483 IonicContact NH2-OE2 2.98Å; R1426-E1483 PolarHBondContact NH2-OE2 3.03Å; L1432-E1483 HydrophobicContact CD1-CB 3.4Å; L1432-E1483 HydrophobicContact CD1-CG 3.56Å; L1479-E1483 WeakPolarHBondContact O-CB 3.28Å; L1479-E1483 PolarHBondContact O-N 3.15Å; Y1480-E1483 PolarHBondContact O-N 3.17Å; E1483-R1485 VanDerWaalsContact C-N 3.27Å; E1483-R1485 PolarHBondContact O-N 3.08Å; E1483-V1486 PolarHBondContact O-N 3.26Å; E1483-C1487 VanDerWaalsContact O-CB 3.31Å; E1483-C1487 WeakPolarHBondContact O-CB 3.36Å; E1483-C1487 PolarHBondContact O-N 3.07Å; E1483-C1487 PolarHBondContact O-SG 3.17Å; E1483-C1487 PolarHBondContact OE1-SG 3.19Å; E1483-C1487 VanDerWaalsContact OE1-SG 3.39Å; E1483-Y1495 HydrophobicContact CG-CE1 3.87Å; E1483-Y1495 WeakPolarHBondContact OE1-CE1 3.36Å; E1483-Y1495 PolarHBondContact OE1-OH 2.79Å; E1483-L1499 HydrophobicContact CG-CD1 4.1Å
1484I90.2Very high88.9Confident0 Ų034.3 Ų34.30%018%0.176CC..Hα-helixtrans-62.2-37.8-177.7-165.4173000111.3Y1480 A1481 I1482 A1488 V1496 L1499 L1500 I1712 L1716Y1480-I1484 HydrophobicContact CE1-CG2 4.41Å; Y1480-I1484 HydrophobicContact CE2-CB 4.38Å; Y1480-I1484 HydrophobicContact CE2-CD1 4.17Å; Y1480-I1484 WeakPolarHBondContact O-CB 3.44Å; Y1480-I1484 VanDerWaalsContact O-CG2 3.3Å; Y1480-I1484 WeakPolarHBondContact O-CG2 3.3Å; Y1480-I1484 PolarHBondContact O-N 3.06Å; Y1480-I1484 VanDerWaalsContact OH-CD1 3.3Å; Y1480-I1484 WeakPolarHBondContact OH-CD1 3.19Å; A1481-I1484 WeakPolarHBondContact O-CG2 3.44Å; I1482-I1484 PolarHBondContact O-N 3.14Å; I1484-A1488 VanDerWaalsContact O-CB 3.29Å; I1484-A1488 WeakPolarHBondContact O-CB 3.3Å; I1484-A1488 PolarHBondContact O-N 3.22Å; I1484-V1496 HydrophobicContact CD1-CG1 4.43Å; I1484-V1496 HydrophobicContact CG1-CG1 4.07Å; I1484-L1499 HydrophobicContact CB-CD1 4.4Å; I1484-L1499 HydrophobicContact CD1-CB 4.44Å; I1484-L1500 HydrophobicContact CD1-CD2 3.51Å; I1484-L1500 VanDerWaalsContact CD1-CD2 3.48Å; I1484-L1500 HydrophobicContact CD1-CG 3.78Å; I1484-I1712 HydrophobicContact CG2-CG2 3.83Å; I1484-L1716 HydrophobicContact CB-CD1 4.49Å; I1484-L1716 HydrophobicContact CD1-CD1 4.31Å; I1484-L1716 HydrophobicContact CG1-CD1 3.88Å; I1484-L1716 HydrophobicContact CG2-CD1 4.17Å
1485R90.2Very high88.8Confident141 Ų14135.2 Ų35.253%0.53218%0.18SC..Hα-helixtrans-67.2-48176.2-179.4179.6171.2-177-1111.5A1481 I1482 E1483 C1487 A1488 M1489 I1712A1481-R1485 WeakPolarHBondContact O-CB 3.35Å; A1481-R1485 PolarHBondContact O-N 3.08Å; I1482-R1485 WeakPolarHBondContact O-CB 3.47Å; I1482-R1485 PolarHBondContact O-N 3.34Å; E1483-R1485 VanDerWaalsContact C-N 3.27Å; E1483-R1485 PolarHBondContact O-N 3.08Å; R1485-C1487 VanDerWaalsContact C-N 3.33Å; R1485-C1487 PolarHBondContact O-N 3.35Å; R1485-A1488 PolarHBondContact O-N 3.09Å; R1485-M1489 HydrophobicContact CG-CE 4.29Å; R1485-M1489 HydrophobicContact CG-SD 4.18Å; R1485-M1489 WeakPolarHBondContact O-CB 3.28Å; R1485-M1489 VanDerWaalsContact O-CG 3.31Å; R1485-M1489 WeakPolarHBondContact O-CG 3.39Å; R1485-M1489 PolarHBondContact O-N 3.14Å; R1485-I1712 HydrophobicContact CB-CG2 4.01Å
1486V89.2Confident88.7Confident38.6 Ų38.635 Ų3523%0.23418%0.179CC..Hα-helixtrans-61.4-44.8178.8171.10000110.5L1422 I1482 E1483 A1488 M1489 A1490L1422-V1486 HydrophobicContact CD1-CB 4.39Å; L1422-V1486 HydrophobicContact CD1-CG1 4.4Å; L1422-V1486 HydrophobicContact CD1-CG2 4.15Å; I1482-V1486 HydrophobicContact CG2-CG2 4.13Å; I1482-V1486 VanDerWaalsContact O-CG2 3.32Å; I1482-V1486 WeakPolarHBondContact O-CG2 3.36Å; I1482-V1486 PolarHBondContact O-N 3.21Å; E1483-V1486 PolarHBondContact O-N 3.26Å; V1486-A1488 PolarHBondContact O-N 3.06Å; V1486-M1489 PolarHBondContact O-N 3.16Å; V1486-A1490 VanDerWaalsContact O-CB 3.29Å; V1486-A1490 WeakPolarHBondContact O-CB 3.29Å; V1486-A1490 PolarHBondContact O-N 3.38Å
1487C88.5Confident88.3Confident0 Ų035.3 Ų35.30%018%0.181CC..Hα-helixtrans-64.4-39.8177.6-66.70000112.8R1426 E1483 R1485 A1490 N1491 Q1492 Y1495 V1496R1426-C1487 PolarHBondContact NE-SG 3Å; R1426-C1487 VanDerWaalsContact NE-SG 3.41Å; R1426-C1487 PolarHBondContact NH1-SG 3.27Å; R1426-C1487 PolarHBondContact NH2-SG 3.1Å; E1483-C1487 VanDerWaalsContact O-CB 3.31Å; E1483-C1487 WeakPolarHBondContact O-CB 3.36Å; E1483-C1487 PolarHBondContact O-N 3.07Å; E1483-C1487 PolarHBondContact O-SG 3.17Å; E1483-C1487 PolarHBondContact OE1-SG 3.19Å; E1483-C1487 VanDerWaalsContact OE1-SG 3.39Å; R1485-C1487 VanDerWaalsContact C-N 3.33Å; R1485-C1487 PolarHBondContact O-N 3.35Å; C1487-A1490 CarbonylContact O-C 3.5Å; C1487-A1490 PolarHBondContact O-N 3.14Å; C1487-N1491 PolarHBondContact O-N 3.21Å; C1487-N1491 VanDerWaalsContact O-N 3.14Å; C1487-Q1492 HydrophobicContact CB-CB 4.29Å; C1487-Q1492 PolarHBondContact O-N 3.03Å; C1487-Y1495 HydrophobicContact CB-CD1 4.07Å; C1487-Y1495 HydrophobicContact CB-CE1 4.39Å; C1487-Y1495 VanDerWaalsContact SG-CD1 3.53Å; C1487-Y1495 WeakPolarHBondContact SG-CD1 3.44Å; C1487-Y1495 VanDerWaalsContact SG-CE1 3.53Å; C1487-Y1495 WeakPolarHBondContact SG-CE1 3.48Å; C1487-V1496 HydrophobicContact CB-CG2 3.5Å; C1487-V1496 VanDerWaalsContact CB-CG2 3.49Å
1488A86.4Confident88.1Confident3.2 Ų3.239.9 Ų39.93%0.02620%0.198CC..Hα-helixtrans-65.7-41.3176.300000111.7I1484 R1485 V1486 A1490 N1491 V1496 L1716 V1743 Y1746I1484-A1488 VanDerWaalsContact O-CB 3.29Å; I1484-A1488 WeakPolarHBondContact O-CB 3.3Å; I1484-A1488 PolarHBondContact O-N 3.22Å; R1485-A1488 PolarHBondContact O-N 3.09Å; V1486-A1488 PolarHBondContact O-N 3.06Å; A1488-A1490 VanDerWaalsContact C-N 3.31Å; A1488-A1490 PolarHBondContact O-N 3.34Å; A1488-N1491 PolarHBondContact O-N 3.08Å; A1488-N1491 VanDerWaalsContact O-N 3.16Å; A1488-V1496 HydrophobicContact CB-CG1 4.38Å; A1488-V1496 HydrophobicContact CB-CG2 4.16Å; A1488-L1716 HydrophobicContact CB-CD1 3.91Å; A1488-L1716 HydrophobicContact CB-CD2 3.6Å; A1488-L1716 HydrophobicContact CB-CG 4.35Å; A1488-V1743 HydrophobicContact CB-CG1 4.31Å; A1488-V1743 HydrophobicContact CB-CG2 4.26Å; A1488-Y1746 WeakPolarHBondContact CA-OH 3.46Å; A1488-Y1746 PolarHBondContact O-OH 3.24Å
1489M85.1Confident87.8Confident125.4 Ų125.439.2 Ų39.262%0.61820%0.196SC*.Hα-helixtrans-67-33.3173.8-69.7-179.585.800112.4R1485 V1486 N1491 M1740R1485-M1489 HydrophobicContact CG-CE 4.29Å; R1485-M1489 HydrophobicContact CG-SD 4.18Å; R1485-M1489 WeakPolarHBondContact O-CB 3.28Å; R1485-M1489 VanDerWaalsContact O-CG 3.31Å; R1485-M1489 WeakPolarHBondContact O-CG 3.39Å; R1485-M1489 PolarHBondContact O-N 3.14Å; V1486-M1489 PolarHBondContact O-N 3.16Å; M1489-N1491 VanDerWaalsContact C-N 3.27Å; M1489-N1491 PolarHBondContact O-N 3.27Å; M1489-M1740 WeakPolarHBondContact O-CE 3.4Å
1490A85.5Confident87.5Confident55 Ų5539.2 Ų39.246%0.45520%0.196SC..THydrogen-bonded Turntrans-81.15.6175.200000113.9V1486 C1487 A1488 Q1492V1486-A1490 VanDerWaalsContact O-CB 3.29Å; V1486-A1490 WeakPolarHBondContact O-CB 3.29Å; V1486-A1490 PolarHBondContact O-N 3.38Å; C1487-A1490 CarbonylContact O-C 3.5Å; C1487-A1490 PolarHBondContact O-N 3.14Å; A1488-A1490 VanDerWaalsContact C-N 3.31Å; A1488-A1490 PolarHBondContact O-N 3.34Å; A1490-Q1492 VanDerWaalsContact C-N 3.25Å; A1490-Q1492 HydrophobicContact CB-CG 4.21Å; A1490-Q1492 PolarHBondContact O-N 3.27Å
1491N83Confident87.1Confident65.4 Ų65.442.5 Ų42.535%0.3521%0.21SC..THydrogen-bonded Turntrans55.731.1-177.5-71.1-48.8000114.6C1487 A1488 M1489 R1493 M1740 Y1746C1487-N1491 PolarHBondContact O-N 3.21Å; C1487-N1491 VanDerWaalsContact O-N 3.14Å; A1488-N1491 PolarHBondContact O-N 3.08Å; A1488-N1491 VanDerWaalsContact O-N 3.16Å; M1489-N1491 VanDerWaalsContact C-N 3.27Å; M1489-N1491 PolarHBondContact O-N 3.27Å; N1491-R1493 VanDerWaalsContact C-N 3.26Å; N1491-R1493 VanDerWaalsContact O-CG 3.27Å; N1491-R1493 WeakPolarHBondContact O-CG 3.37Å; N1491-R1493 PolarHBondContact O-N 3.15Å; N1491-M1740 PolarHBondContact OD1-SD 3.48Å; N1491-Y1746 WeakPolarHBondContact OD1-CE1 3.15Å
1492Q85.7Confident86.6Confident67.6 Ų67.644.3 Ų44.332%0.31622%0.219SC..  trans-83.268.8175.9-64.2-169.53.400111.5R1426 C1487 A1490 S1494 Y1495 V1496R1426-Q1492 VanDerWaalsContact CZ-CD 3.49Å; R1426-Q1492 VanDerWaalsContact CZ-NE2 3.31Å; R1426-Q1492 VanDerWaalsContact NE-OE1 3.1Å; R1426-Q1492 VanDerWaalsContact NH1-CD 3.27Å; R1426-Q1492 VanDerWaalsContact NH1-OE1 3.09Å; C1487-Q1492 HydrophobicContact CB-CB 4.29Å; C1487-Q1492 PolarHBondContact O-N 3.03Å; A1490-Q1492 VanDerWaalsContact C-N 3.25Å; A1490-Q1492 HydrophobicContact CB-CG 4.21Å; A1490-Q1492 PolarHBondContact O-N 3.27Å; Q1492-S1494 PolarHBondContact O-N 3.17Å; Q1492-Y1495 PolarHBondContact O-N 3.02Å; Q1492-V1496 VanDerWaalsContact O-CG2 3.25Å; Q1492-V1496 WeakPolarHBondContact O-CG2 3.4Å; Q1492-V1496 PolarHBondContact O-N 3.11Å; Q1492-V1496 VanDerWaalsContact O-N 3.12Å
1493R82.6Confident86.4Confident77.6 Ų77.642.5 Ų42.529%0.29321%0.21SC..Hα-helixtrans-57.5-50.8-165.1-52-176.4171.5168.81.2113.7N1491 Y1495 V1496 T1497 I1741 Y1746 E1750N1491-R1493 VanDerWaalsContact C-N 3.26Å; N1491-R1493 VanDerWaalsContact O-CG 3.27Å; N1491-R1493 WeakPolarHBondContact O-CG 3.37Å; N1491-R1493 PolarHBondContact O-N 3.15Å; R1493-Y1495 VanDerWaalsContact C-N 3.27Å; R1493-Y1495 PolarHBondContact O-N 3.13Å; R1493-V1496 PolarHBondContact O-N 3.13Å; R1493-V1496 VanDerWaalsContact O-N 3.13Å; R1493-T1497 WeakPolarHBondContact O-CB 3.37Å; R1493-T1497 WeakPolarHBondContact O-CG2 3.34Å; R1493-T1497 PolarHBondContact O-N 3.08Å; R1493-T1497 PolarHBondContact O-OG1 3.19Å; R1493-T1497 VanDerWaalsContact O-OG1 3.07Å; R1493-I1741 VanDerWaalsContact NH2-CD1 3.28Å; R1493-Y1746 HydrophobicContact CB-CD2 3.58Å; R1493-Y1746 HydrophobicContact CB-CE2 3.66Å; R1493-Y1746 HydrophobicContact CB-CG 4.03Å; R1493-Y1746 HydrophobicContact CG-CD1 3.81Å; R1493-Y1746 HydrophobicContact CG-CD2 3.43Å; R1493-Y1746 VanDerWaalsContact CG-CD2 3.4Å; R1493-Y1746 HydrophobicContact CG-CE1 3.88Å; R1493-Y1746 HydrophobicContact CG-CE2 3.52Å; R1493-Y1746 VanDerWaalsContact CG-CE2 3.46Å; R1493-Y1746 HydrophobicContact CG-CG 3.92Å; R1493-Y1746 VanDerWaalsContact NE-CG 3.29Å; R1493-E1750 VanDerWaalsContact C-CD 3.42Å; R1493-E1750 VanDerWaalsContact CA-OE2 3.28Å; R1493-E1750 WeakPolarHBondContact CA-OE2 3.33Å; R1493-E1750 HydrophobicContact CB-CG 4.34Å; R1493-E1750 WeakPolarHBondContact CB-OE2 3.35Å
1494S84.1Confident85.9Confident82.4 Ų82.442.5 Ų42.558%0.57621%0.21SC*.Hα-helixtrans-61.6-35.3-177.655.20000113.2Q1492 T1497 R1498 E1750Q1492-S1494 PolarHBondContact O-N 3.17Å; S1494-T1497 WeakPolarHBondContact CA-OG1 3.36Å; S1494-T1497 PolarHBondContact O-N 3.43Å; S1494-T1497 PolarHBondContact O-OG1 3.15Å; S1494-R1498 WeakPolarHBondContact O-CB 3.33Å; S1494-R1498 PolarHBondContact O-N 3.27Å; S1494-E1750 WeakPolarHBondContact CA-OE1 3.45Å; S1494-E1750 VanDerWaalsContact CB-OE1 3.32Å; S1494-E1750 WeakPolarHBondContact CB-OE1 3.25Å; S1494-E1750 PolarHBondContact N-OE1 3.12Å; S1494-E1750 PolarHBondContact N-OE2 3.19Å
1495Y86.8Confident85.4Confident20.4 Ų20.442.6 Ų42.68%0.0821%0.211CC..Hα-helixtrans-74.5-43.5177.3-176-104.7000111.7R1426 E1483 C1487 Q1492 R1493 T1497 R1498 L1499R1426-Y1495 HydrophobicContact CG-CD1 4.29Å; R1426-Y1495 HydrophobicContact CG-CD2 4.24Å; R1426-Y1495 HydrophobicContact CG-CE1 4.08Å; R1426-Y1495 HydrophobicContact CG-CE2 3.8Å; R1426-Y1495 HydrophobicContact CG-CG 4.41Å; E1483-Y1495 HydrophobicContact CG-CE1 3.87Å; E1483-Y1495 WeakPolarHBondContact OE1-CE1 3.36Å; E1483-Y1495 PolarHBondContact OE1-OH 2.79Å; C1487-Y1495 HydrophobicContact CB-CD1 4.07Å; C1487-Y1495 HydrophobicContact CB-CE1 4.39Å; C1487-Y1495 VanDerWaalsContact SG-CD1 3.53Å; C1487-Y1495 WeakPolarHBondContact SG-CD1 3.44Å; C1487-Y1495 VanDerWaalsContact SG-CE1 3.53Å; C1487-Y1495 WeakPolarHBondContact SG-CE1 3.48Å; Q1492-Y1495 PolarHBondContact O-N 3.02Å; R1493-Y1495 VanDerWaalsContact C-N 3.27Å; R1493-Y1495 PolarHBondContact O-N 3.13Å; Y1495-T1497 VanDerWaalsContact C-N 3.3Å; Y1495-T1497 PolarHBondContact O-N 3.31Å; Y1495-R1498 VanDerWaalsContact CD2-NH2 3.27Å; Y1495-R1498 PolarHBondContact O-N 3.12Å; Y1495-L1499 HydrophobicContact CD1-CD1 3.9Å; Y1495-L1499 HydrophobicContact CD1-CG 4.3Å; Y1495-L1499 HydrophobicContact CE1-CD1 3.34Å; Y1495-L1499 HydrophobicContact CE1-CD2 4.49Å; Y1495-L1499 HydrophobicContact CE1-CG 3.94Å; Y1495-L1499 HydrophobicContact CE2-CG 4.46Å; Y1495-L1499 WeakPolarHBondContact O-CB 3.38Å; Y1495-L1499 WeakPolarHBondContact O-CG 3.36Å; Y1495-L1499 PolarHBondContact O-N 3.03Å
1496V87Confident84.5Confident0.2 Ų0.237.1 Ų37.10%0.00119%0.192CC..Hα-helixtrans-60.8-44.9175.71760000110.9I1484 C1487 A1488 Q1492 R1493 R1498 L1499 L1500 V1743 L1747I1484-V1496 HydrophobicContact CD1-CG1 4.43Å; I1484-V1496 HydrophobicContact CG1-CG1 4.07Å; C1487-V1496 HydrophobicContact CB-CG2 3.5Å; C1487-V1496 VanDerWaalsContact CB-CG2 3.49Å; A1488-V1496 HydrophobicContact CB-CG1 4.38Å; A1488-V1496 HydrophobicContact CB-CG2 4.16Å; Q1492-V1496 VanDerWaalsContact O-CG2 3.25Å; Q1492-V1496 WeakPolarHBondContact O-CG2 3.4Å; Q1492-V1496 PolarHBondContact O-N 3.11Å; Q1492-V1496 VanDerWaalsContact O-N 3.12Å; R1493-V1496 PolarHBondContact O-N 3.13Å; R1493-V1496 VanDerWaalsContact O-N 3.13Å; V1496-R1498 VanDerWaalsContact C-N 3.34Å; V1496-R1498 PolarHBondContact O-N 3.33Å; V1496-L1499 PolarHBondContact O-N 3.22Å; V1496-L1500 HydrophobicContact CG1-CD1 4.02Å; V1496-L1500 HydrophobicContact CG1-CG 4.41Å; V1496-L1500 WeakPolarHBondContact O-CB 3.24Å; V1496-L1500 VanDerWaalsContact O-CG 3.32Å; V1496-L1500 WeakPolarHBondContact O-CG 3.37Å; V1496-L1500 PolarHBondContact O-N 3.12Å; V1496-V1743 HydrophobicContact CG1-CG1 4.23Å; V1496-L1747 HydrophobicContact CB-CD2 3.97Å; V1496-L1747 HydrophobicContact CG1-CD1 4.34Å; V1496-L1747 HydrophobicContact CG1-CD2 3.53Å; V1496-L1747 VanDerWaalsContact CG1-CD2 3.47Å
1497T83.8Confident83.8Confident4.8 Ų4.835.9 Ų35.93%0.02919%0.185CC..Hα-helixtrans-63.7-39.4177.9370000112.2R1493 S1494 Y1495 L1500 K1501 L1747 E1750 L1751 L1754R1493-T1497 WeakPolarHBondContact O-CB 3.37Å; R1493-T1497 WeakPolarHBondContact O-CG2 3.34Å; R1493-T1497 PolarHBondContact O-N 3.08Å; R1493-T1497 PolarHBondContact O-OG1 3.19Å; R1493-T1497 VanDerWaalsContact O-OG1 3.07Å; S1494-T1497 WeakPolarHBondContact CA-OG1 3.36Å; S1494-T1497 PolarHBondContact O-N 3.43Å; S1494-T1497 PolarHBondContact O-OG1 3.15Å; Y1495-T1497 VanDerWaalsContact C-N 3.3Å; Y1495-T1497 PolarHBondContact O-N 3.31Å; T1497-L1500 PolarHBondContact O-N 3.1Å; T1497-K1501 VanDerWaalsContact O-CB 3.3Å; T1497-K1501 WeakPolarHBondContact O-CB 3.28Å; T1497-K1501 PolarHBondContact O-N 3.09Å; T1497-L1747 HydrophobicContact CG2-CD2 3.72Å; T1497-L1747 HydrophobicContact CG2-CG 4.43Å; T1497-E1750 HydrophobicContact CG2-CB 3.81Å; T1497-E1750 HydrophobicContact CG2-CG 3.89Å; T1497-E1750 VanDerWaalsContact CG2-OE2 3.25Å; T1497-E1750 WeakPolarHBondContact CG2-OE2 3.3Å; T1497-E1750 WeakPolarHBondContact OG1-CB 3.01Å; T1497-E1750 PolarHBondContact OG1-OE2 2.8Å; T1497-L1751 HydrophobicContact CG2-CD2 3.95Å; T1497-L1751 VanDerWaalsContact CG2-CD2 3.5Å; T1497-L1751 HydrophobicContact CG2-CG 3.82Å; T1497-L1754 HydrophobicContact CG2-CD1 4.07Å
1498R85.6Confident83.1Confident97.8 Ų97.836.1 Ų36.137%0.36919%0.185SC..Hα-helixtrans-62.7-45.9173.4-174.7175.380.8163.24.2112.2D1430 S1494 Y1495 V1496 L1500 K1501 L1502D1430-R1498 IonicContact OD1-CZ 3.12Å; D1430-R1498 IonicContact OD1-NH1 3.32Å; D1430-R1498 IonicContact OD1-NH2 3.19Å; D1430-R1498 PolarHBondContact OD1-NH2 3.35Å; D1430-R1498 IonicContact OD2-CZ 2.99Å; D1430-R1498 IonicContact OD2-NH1 3.21Å; D1430-R1498 PolarHBondContact OD2-NH1 3.15Å; D1430-R1498 IonicContact OD2-NH2 3.34Å; D1430-R1498 PolarHBondContact OD2-NH2 3.18Å; S1494-R1498 WeakPolarHBondContact O-CB 3.33Å; S1494-R1498 PolarHBondContact O-N 3.27Å; Y1495-R1498 VanDerWaalsContact CD2-NH2 3.27Å; Y1495-R1498 PolarHBondContact O-N 3.12Å; V1496-R1498 VanDerWaalsContact C-N 3.34Å; V1496-R1498 PolarHBondContact O-N 3.33Å; R1498-L1500 VanDerWaalsContact C-N 3.34Å; R1498-L1500 PolarHBondContact O-N 3.09Å; R1498-K1501 PolarHBondContact O-N 3.2Å; R1498-L1502 HydrophobicContact CG-CD1 4.42Å; R1498-L1502 WeakPolarHBondContact O-CG 3.36Å; R1498-L1502 PolarHBondContact O-N 3.2Å
1499L87.4Confident82.3Confident0 Ų037 Ų370%019%0.189CC..Hα-helixtrans-62.7-40.8177.1-78.6-172.5000112.5A1433 L1436 Y1480 E1483 I1484 Y1495 V1496 L1502 F1503A1433-L1499 HydrophobicContact CB-CD2 4.35Å; L1436-L1499 HydrophobicContact CD1-CD2 3.89Å; Y1480-L1499 HydrophobicContact CE2-CB 4.07Å; Y1480-L1499 HydrophobicContact CE2-CD1 4.43Å; Y1480-L1499 HydrophobicContact CE2-CD2 4.27Å; Y1480-L1499 HydrophobicContact CE2-CG 4.45Å; E1483-L1499 HydrophobicContact CG-CD1 4.1Å; I1484-L1499 HydrophobicContact CB-CD1 4.4Å; I1484-L1499 HydrophobicContact CD1-CB 4.44Å; Y1495-L1499 HydrophobicContact CD1-CD1 3.9Å; Y1495-L1499 HydrophobicContact CD1-CG 4.3Å; Y1495-L1499 HydrophobicContact CE1-CD1 3.34Å; Y1495-L1499 HydrophobicContact CE1-CD2 4.49Å; Y1495-L1499 HydrophobicContact CE1-CG 3.94Å; Y1495-L1499 HydrophobicContact CE2-CG 4.46Å; Y1495-L1499 WeakPolarHBondContact O-CB 3.38Å; Y1495-L1499 WeakPolarHBondContact O-CG 3.36Å; Y1495-L1499 PolarHBondContact O-N 3.03Å; V1496-L1499 PolarHBondContact O-N 3.22Å; L1499-L1502 PolarHBondContact O-N 2.98Å; L1499-F1503 WeakPolarHBondContact O-CB 3.22Å; L1499-F1503 PolarHBondContact O-N 3.17Å
1500L86.7Confident81.1Confident1.6 Ų1.633.4 Ų33.41%0.00817%0.172CC..Hα-helixtrans-63.1-44.7173.4-72.8171.2000111.3I1484 V1496 T1497 R1498 L1502 F1503 L1504 L1508 M1717 V1743 L1747I1484-L1500 HydrophobicContact CD1-CD2 3.51Å; I1484-L1500 VanDerWaalsContact CD1-CD2 3.48Å; I1484-L1500 HydrophobicContact CD1-CG 3.78Å; V1496-L1500 HydrophobicContact CG1-CD1 4.02Å; V1496-L1500 HydrophobicContact CG1-CG 4.41Å; V1496-L1500 WeakPolarHBondContact O-CB 3.24Å; V1496-L1500 VanDerWaalsContact O-CG 3.32Å; V1496-L1500 WeakPolarHBondContact O-CG 3.37Å; V1496-L1500 PolarHBondContact O-N 3.12Å; T1497-L1500 PolarHBondContact O-N 3.1Å; R1498-L1500 VanDerWaalsContact C-N 3.34Å; R1498-L1500 PolarHBondContact O-N 3.09Å; L1500-L1502 VanDerWaalsContact C-N 3.29Å; L1500-L1502 PolarHBondContact O-N 3.24Å; L1500-F1503 PolarHBondContact O-N 3.3Å; L1500-L1504 HydrophobicContact CB-CD1 4.18Å; L1500-L1504 HydrophobicContact CD2-CD1 3.65Å; L1500-L1504 HydrophobicContact CG-CD1 4.5Å; L1500-L1504 WeakPolarHBondContact O-CB 3.29Å; L1500-L1504 VanDerWaalsContact O-CD1 3.27Å; L1500-L1504 WeakPolarHBondContact O-CD1 3.24Å; L1500-L1504 PolarHBondContact O-N 3.24Å; L1500-L1508 HydrophobicContact CB-CD1 4.42Å; L1500-L1508 WeakPolarHBondContact O-CD1 3.37Å; L1500-M1717 HydrophobicContact CD1-CG 4.41Å; L1500-M1717 HydrophobicContact CD1-SD 4.5Å; L1500-M1717 HydrophobicContact CD2-SD 4.43Å; L1500-V1743 HydrophobicContact CD1-CG1 4.25Å; L1500-L1747 HydrophobicContact CD1-CD1 4.12Å; L1500-L1747 HydrophobicContact CD1-CD2 4.38Å; L1500-L1747 HydrophobicContact CD1-CG 4.44Å
1501K83.5Confident79.5Confident67.6 Ų67.633.2 Ų33.229%0.29416%0.164SC..Hα-helixtrans-57.9-41.4176.2-172.1178.4179.2-178.30111.6T1497 R1498 G1505 L1508 F1509 L1751 D1758T1497-K1501 VanDerWaalsContact O-CB 3.3Å; T1497-K1501 WeakPolarHBondContact O-CB 3.28Å; T1497-K1501 PolarHBondContact O-N 3.09Å; R1498-K1501 PolarHBondContact O-N 3.2Å; K1501-G1505 WeakPolarHBondContact O-CA 3.26Å; K1501-G1505 PolarHBondContact O-N 3.11Å; K1501-L1508 HydrophobicContact CB-CD1 4.47Å; K1501-F1509 HydrophobicContact CD-CE2 4.41Å; K1501-F1509 HydrophobicContact CD-CZ 4.44Å; K1501-F1509 HydrophobicContact CG-CE2 4.32Å; K1501-F1509 HydrophobicContact CG-CZ 4.35Å; K1501-L1751 HydrophobicContact CB-CD2 4.32Å; K1501-L1751 HydrophobicContact CD-CD2 4.27Å; K1501-D1758 IonicContact NZ-OD1 3.23Å; K1501-D1758 IonicContact NZ-OD2 3.46Å; K1501-D1758 PolarHBondContact NZ-OD2 3Å; K1501-D1758 VanDerWaalsContact NZ-OD2 3.13Å
1502L83.8Confident77.8Confident41.4 Ų41.433.9 Ų33.922%0.21717%0.173CC..Hα-helixtrans-69.2-41.4177.1-69.5171.4000112.7A1433 L1436 H1437 R1498 L1499 L1500 V1543A1433-L1502 HydrophobicContact CB-CD1 3.74Å; L1436-L1502 HydrophobicContact CB-CB 4.36Å; L1436-L1502 HydrophobicContact CD1-CB 4.31Å; H1437-L1502 HydrophobicContact CB-CD2 4.44Å; R1498-L1502 HydrophobicContact CG-CD1 4.42Å; R1498-L1502 WeakPolarHBondContact O-CG 3.36Å; R1498-L1502 PolarHBondContact O-N 3.2Å; L1499-L1502 PolarHBondContact O-N 2.98Å; L1500-L1502 VanDerWaalsContact C-N 3.29Å; L1500-L1502 PolarHBondContact O-N 3.24Å; L1502-V1543 WeakPolarHBondContact O-CG2 3.11Å
1503F86.5Confident75.6Confident0.4 Ų0.434.8 Ų34.80%0.00218%0.18CC..Hα-helixtrans-76.9-46.8-175.4-177.4-109.4000113.3L1436 L1477 Y1480 L1499 L1500 V1543 L1544 A1709 V1710L1436-F1503 HydrophobicContact CD2-CD2 4.29Å; L1477-F1503 HydrophobicContact CD2-CD2 4.47Å; L1477-F1503 HydrophobicContact CD2-CE2 3.88Å; Y1480-F1503 HydrophobicContact CD1-CD2 4.48Å; Y1480-F1503 HydrophobicContact CE1-CB 4.36Å; Y1480-F1503 HydrophobicContact CE1-CD1 4.12Å; Y1480-F1503 AromaticContact CE1-CD2 3.95Å; Y1480-F1503 HydrophobicContact CE1-CD2 3.96Å; Y1480-F1503 HydrophobicContact CE1-CE1 4.4Å; Y1480-F1503 HydrophobicContact CE1-CE2 4.28Å; Y1480-F1503 AromaticContact CE1-CG 3.88Å; Y1480-F1503 HydrophobicContact CE1-CG 3.88Å; Y1480-F1503 HydrophobicContact CE1-CZ 4.46Å; Y1480-F1503 HydrophobicContact CE2-CB 4.2Å; Y1480-F1503 HydrophobicContact CE2-CG 4.48Å; Y1480-F1503 AromaticContact CZ-CG 3.7Å; Y1480-F1503 WeakPolarHBondContact OH-CB 3.41Å; Y1480-F1503 WeakPolarHBondContact OH-CD1 3.35Å; Y1480-F1503 VanDerWaalsContact OH-CG 3.31Å; Y1480-F1503 WeakPolarHBondContact OH-CG 3.28Å; L1499-F1503 WeakPolarHBondContact O-CB 3.22Å; L1499-F1503 PolarHBondContact O-N 3.17Å; L1500-F1503 PolarHBondContact O-N 3.3Å; F1503-V1543 HydrophobicContact CD2-CB 4.05Å; F1503-V1543 HydrophobicContact CD2-CG1 3.99Å; F1503-V1543 HydrophobicContact CE2-CB 4.46Å; F1503-V1543 HydrophobicContact CE2-CG1 4.15Å; F1503-V1543 PolarHBondContact O-N 3.02Å; F1503-V1543 VanDerWaalsContact O-N 3.13Å; F1503-L1544 HydrophobicContact CE1-CB 4.31Å; F1503-L1544 HydrophobicContact CE1-CD1 4.14Å; F1503-L1544 HydrophobicContact CE1-CG 4.47Å; F1503-L1544 HydrophobicContact CZ-CB 4.32Å; F1503-L1544 PolarHBondContact O-N 3.31Å; F1503-L1544 VanDerWaalsContact O-N 3.07Å; F1503-A1709 HydrophobicContact CE1-CB 4.33Å; F1503-A1709 HydrophobicContact CE2-CB 3.93Å; F1503-A1709 HydrophobicContact CZ-CB 3.62Å; F1503-V1710 HydrophobicContact CE1-CG2 4.01Å; F1503-V1710 HydrophobicContact CZ-CG2 3.87Å
1504L83.3Confident73.4Confident2.8 Ų2.836.2 Ų36.22%0.01519%0.193CC..Hα-helixtrans-86.2-21.9-179.6-69.393.3000112.5L1500 D1506 L1507 L1508 S1542 L1714 M1717 L1783L1500-L1504 HydrophobicContact CB-CD1 4.18Å; L1500-L1504 HydrophobicContact CD2-CD1 3.65Å; L1500-L1504 HydrophobicContact CG-CD1 4.5Å; L1500-L1504 WeakPolarHBondContact O-CB 3.29Å; L1500-L1504 VanDerWaalsContact O-CD1 3.27Å; L1500-L1504 WeakPolarHBondContact O-CD1 3.24Å; L1500-L1504 PolarHBondContact O-N 3.24Å; L1504-D1506 PolarHBondContact O-N 3.24Å; L1504-L1507 VanDerWaalsContact O-CB 3.3Å; L1504-L1507 WeakPolarHBondContact O-CB 3.42Å; L1504-L1507 PolarHBondContact O-N 3.08Å; L1504-L1508 HydrophobicContact CB-CD1 3.83Å; L1504-L1508 HydrophobicContact CB-CD2 4.09Å; L1504-L1508 HydrophobicContact CB-CG 3.6Å; L1504-L1508 HydrophobicContact CD1-CD2 4.48Å; L1504-L1508 HydrophobicContact CD2-CD2 3.87Å; L1504-L1508 HydrophobicContact CD2-CG 4.2Å; L1504-L1508 HydrophobicContact CG-CD2 4.38Å; L1504-L1508 HydrophobicContact CG-CG 4.36Å; L1504-S1542 WeakPolarHBondContact O-CB 3.29Å; L1504-L1714 HydrophobicContact CD2-CD2 4Å; L1504-M1717 HydrophobicContact CD2-SD 4.43Å; L1504-L1783 HydrophobicContact CD2-CD1 3.75Å; L1504-L1783 HydrophobicContact CD2-CD2 3.57Å; L1504-L1783 HydrophobicContact CD2-CG 4.25Å
1505G79.4Confident71.1Confident2 Ų236.9 Ų36.92%0.02119%0.189CC..G310 helixtrans54.5-137.517800000112.9K1501 L1507 L1508K1501-G1505 WeakPolarHBondContact O-CA 3.26Å; K1501-G1505 PolarHBondContact O-N 3.11Å; G1505-L1507 PolarHBondContact O-N 3.11Å; G1505-L1507 VanDerWaalsContact O-N 3.12Å; G1505-L1508 WeakPolarHBondContact O-CB 2.86Å; G1505-L1508 PolarHBondContact O-N 3.15Å; G1505-L1508 VanDerWaalsContact O-N 3.12Å
1506D71.1Confident68.7Low25.6 Ų25.644.1 Ų44.114%0.13722%0.221CC..G310 helixtrans-62.9-15.4-178.8-70.9-13.2000114.1L1504 L1508 F1509 N1511 F1538 K1539 S1540L1504-D1506 PolarHBondContact O-N 3.24Å; D1506-L1508 PolarHBondContact O-N 3.1Å; D1506-L1508 VanDerWaalsContact O-N 3.12Å; D1506-F1509 PolarHBondContact O-N 3.05Å; D1506-F1509 VanDerWaalsContact O-N 3.13Å; D1506-N1511 PolarHBondContact O-ND2 3.36Å; D1506-F1538 HydrophobicContact CB-CB 4.46Å; D1506-F1538 HydrophobicContact CB-CD1 3.47Å; D1506-F1538 VanDerWaalsContact CB-CD1 3.47Å; D1506-F1538 HydrophobicContact CB-CE1 3.87Å; D1506-F1538 VanDerWaalsContact CB-CE1 3.41Å; D1506-F1538 HydrophobicContact CB-CG 4.26Å; D1506-F1538 HydrophobicContact CB-CZ 4.15Å; D1506-F1538 VanDerWaalsContact OD2-CA 3.26Å; D1506-F1538 WeakPolarHBondContact OD2-CA 3.27Å; D1506-F1538 VanDerWaalsContact OD2-CB 3.28Å; D1506-F1538 WeakPolarHBondContact OD2-CB 3.37Å; D1506-F1538 VanDerWaalsContact OD2-CD1 3.29Å; D1506-F1538 WeakPolarHBondContact OD2-CD1 3.34Å; D1506-F1538 WeakPolarHBondContact OD2-CG 3.4Å; D1506-K1539 PolarHBondContact OD2-N 3.21Å; D1506-S1540 VanDerWaalsContact CG-O 3.29Å; D1506-S1540 VanDerWaalsContact CG-OG 3.27Å; D1506-S1540 PolarHBondContact N-O 3.17Å; D1506-S1540 PolarHBondContact N-OG 3.02Å; D1506-S1540 WeakPolarHBondContact OD1-CB 3.32Å; D1506-S1540 PolarHBondContact OD1-N 2.89Å; D1506-S1540 PolarHBondContact OD1-OG 3.14Å; D1506-S1540 PolarHBondContact OD2-N 3.26Å; D1506-S1540 VanDerWaalsContact OD2-N 3.14Å
1507L74Confident66.3Low13.4 Ų13.447.9 Ų47.97%0.0725%0.248CC..G310 helixtrans-61.4-28.6174.6-74.9168.8000112.5L1504 G1505 F1509 F1533 L1544 V1545 R1778 L1783 D1786 V1787L1504-L1507 VanDerWaalsContact O-CB 3.3Å; L1504-L1507 WeakPolarHBondContact O-CB 3.42Å; L1504-L1507 PolarHBondContact O-N 3.08Å; G1505-L1507 PolarHBondContact O-N 3.11Å; G1505-L1507 VanDerWaalsContact O-N 3.12Å; L1507-F1509 VanDerWaalsContact C-N 3.31Å; L1507-F1509 PolarHBondContact O-N 3.02Å; L1507-F1509 VanDerWaalsContact O-N 3.15Å; L1507-F1533 HydrophobicContact CD2-CE1 4.07Å; L1507-F1533 HydrophobicContact CD2-CZ 4.01Å; L1507-L1544 HydrophobicContact CD1-CD1 4.43Å; L1507-L1544 HydrophobicContact CD1-CD2 4.06Å; L1507-V1545 HydrophobicContact CD1-CG2 3.61Å; L1507-V1545 HydrophobicContact CD2-CG2 4.43Å; L1507-V1545 HydrophobicContact CG-CG2 4.13Å; L1507-R1778 VanDerWaalsContact O-CD 3.25Å; L1507-R1778 WeakPolarHBondContact O-CD 3.18Å; L1507-L1783 HydrophobicContact CB-CD1 4.46Å; L1507-L1783 HydrophobicContact CB-CD2 4.29Å; L1507-L1783 WeakPolarHBondContact O-CD1 3.41Å; L1507-L1783 WeakPolarHBondContact O-CD2 3.38Å; L1507-D1786 HydrophobicContact CD2-CB 4.48Å; L1507-V1787 HydrophobicContact CD1-CG2 4.43Å
1508L74Confident64.1Low3.6 Ų3.655.1 Ų55.12%0.01929%0.286CS..G310 helixtrans-67.5-18.8178.3-76168.2000113.4L1500 K1501 L1504 G1505 D1506 M1717 L1777 R1778 L1783L1500-L1508 HydrophobicContact CB-CD1 4.42Å; L1500-L1508 WeakPolarHBondContact O-CD1 3.37Å; K1501-L1508 HydrophobicContact CB-CD1 4.47Å; L1504-L1508 HydrophobicContact CB-CD1 3.83Å; L1504-L1508 HydrophobicContact CB-CD2 4.09Å; L1504-L1508 HydrophobicContact CB-CG 3.6Å; L1504-L1508 HydrophobicContact CD1-CD2 4.48Å; L1504-L1508 HydrophobicContact CD2-CD2 3.87Å; L1504-L1508 HydrophobicContact CD2-CG 4.2Å; L1504-L1508 HydrophobicContact CG-CD2 4.38Å; L1504-L1508 HydrophobicContact CG-CG 4.36Å; G1505-L1508 WeakPolarHBondContact O-CB 2.86Å; G1505-L1508 PolarHBondContact O-N 3.15Å; G1505-L1508 VanDerWaalsContact O-N 3.12Å; D1506-L1508 PolarHBondContact O-N 3.1Å; D1506-L1508 VanDerWaalsContact O-N 3.12Å; L1508-M1717 HydrophobicContact CD2-CE 3.93Å; L1508-M1717 HydrophobicContact CD2-SD 4.36Å; L1508-L1777 HydrophobicContact CB-CD1 4.35Å; L1508-L1777 WeakPolarHBondContact O-CD1 3.36Å; L1508-L1777 WeakPolarHBondContact O-CD2 3.48Å; L1508-R1778 WeakPolarHBondContact O-CB 3.24Å; L1508-R1778 PolarHBondContact O-N 3.09Å; L1508-L1783 HydrophobicContact CD2-CD1 4.18Å
1509F70Confident61.9Low22.8 Ų22.856.2 Ų56.210%0.130%0.299CS..BIsolated β-bridgetrans-115.8138.6-171.4-54.4-66.7000111.3K1501 D1506 L1507 N1511 L1751 L1755 F1775 K1776 L1777K1501-F1509 HydrophobicContact CD-CE2 4.41Å; K1501-F1509 HydrophobicContact CD-CZ 4.44Å; K1501-F1509 HydrophobicContact CG-CE2 4.32Å; K1501-F1509 HydrophobicContact CG-CZ 4.35Å; D1506-F1509 PolarHBondContact O-N 3.05Å; D1506-F1509 VanDerWaalsContact O-N 3.13Å; L1507-F1509 VanDerWaalsContact C-N 3.31Å; L1507-F1509 PolarHBondContact O-N 3.02Å; L1507-F1509 VanDerWaalsContact O-N 3.15Å; F1509-N1511 PolarHBondContact O-N 3.27Å; F1509-N1511 VanDerWaalsContact O-N 3.08Å; F1509-L1751 HydrophobicContact CE1-CD1 3.93Å; F1509-L1751 HydrophobicContact CZ-CD1 4.08Å; F1509-L1751 HydrophobicContact CZ-CD2 4.24Å; F1509-L1755 HydrophobicContact CD1-CD1 3.86Å; F1509-L1755 HydrophobicContact CD1-CD2 3.4Å; F1509-L1755 VanDerWaalsContact CD1-CD2 3.44Å; F1509-L1755 HydrophobicContact CD1-CG 3.98Å; F1509-L1755 HydrophobicContact CE1-CD1 3.84Å; F1509-L1755 HydrophobicContact CE1-CD2 3.19Å; F1509-L1755 HydrophobicContact CE1-CG 3.58Å; F1509-L1755 HydrophobicContact CG-CD2 4.24Å; F1509-L1755 HydrophobicContact CZ-CD1 4.36Å; F1509-L1755 HydrophobicContact CZ-CD2 3.89Å; F1509-L1755 HydrophobicContact CZ-CG 4.49Å; F1509-F1775 HydrophobicContact CB-CD1 4.37Å; F1509-F1775 HydrophobicContact CD1-CB 4.27Å; F1509-F1775 HydrophobicContact CD1-CD1 4.32Å; F1509-F1775 HydrophobicContact CG-CD1 4.37Å; F1509-K1776 WeakPolarHBondContact CA-O 3.25Å; F1509-L1777 HydrophobicContact CD1-CD1 4.21Å; F1509-L1777 HydrophobicContact CE1-CD1 4.05Å
1510D59.5Low59.8Low48.2 Ų48.264.6 Ų64.626%0.25834%0.339SS..  trans-74.691.4175.6-100.8-20.7000110.5S1512 K1776 R1778D1510-S1512 VanDerWaalsContact C-N 3.33Å; D1510-S1512 PolarHBondContact O-N 3.24Å; D1510-S1512 VanDerWaalsContact O-N 3.07Å; D1510-S1512 WeakPolarHBondContact OD1-CB 3.43Å; D1510-S1512 PolarHBondContact OD1-N 3.16Å; D1510-S1512 PolarHBondContact OD1-OG 3.25Å; D1510-K1776 HydrophobicContact CB-CB 4.36Å; D1510-K1776 WeakPolarHBondContact CB-O 3.32Å; D1510-K1776 PolarHBondContact N-O 3.14Å; D1510-R1778 VanDerWaalsContact OD1-CG 3.31Å; D1510-R1778 WeakPolarHBondContact OD1-CG 3.29Å; D1510-R1778 IonicContact OD1-NE 3.31Å
1511N52.6Low57.7Low52.6 Ų52.674.7 Ų74.728%0.28138%0.377SS..G310 helixtrans-71.64.8174.2-74.7-23.7000113D1506 F1509 L1513 L1514 F1538D1506-N1511 PolarHBondContact O-ND2 3.36Å; F1509-N1511 PolarHBondContact O-N 3.27Å; F1509-N1511 VanDerWaalsContact O-N 3.08Å; N1511-L1513 PolarHBondContact O-N 3.17Å; N1511-L1513 VanDerWaalsContact O-N 3.14Å; N1511-L1514 WeakPolarHBondContact O-CB 3.5Å; N1511-L1514 PolarHBondContact O-N 3.14Å; N1511-L1514 VanDerWaalsContact O-N 3.11Å; N1511-F1538 VanDerWaalsContact ND2-CE1 3.34Å; N1511-F1538 WeakPolarHBondContact ND2-CE1 3.31Å
1512S46.8Very low55.7Low79.6 Ų79.675.9 Ų75.956%0.55739%0.385SS*.G310 helixtrans-44.8-13172.166.50000114.3D1510 L1514 L1515D1510-S1512 VanDerWaalsContact C-N 3.33Å; D1510-S1512 PolarHBondContact O-N 3.24Å; D1510-S1512 VanDerWaalsContact O-N 3.07Å; D1510-S1512 WeakPolarHBondContact OD1-CB 3.43Å; D1510-S1512 PolarHBondContact OD1-N 3.16Å; D1510-S1512 PolarHBondContact OD1-OG 3.25Å; S1512-L1514 VanDerWaalsContact C-N 3.29Å; S1512-L1514 PolarHBondContact O-N 3.2Å; S1512-L1515 PolarHBondContact O-N 3.25Å
1513L39.5Very low53.6Low85.4 Ų85.477.8 Ų77.845%0.44740%0.402SS..G310 helixtrans-83.1-11.5177.7-84.1170.1000114.2N1511 L1515 K1516 K1774 K1776N1511-L1513 PolarHBondContact O-N 3.17Å; N1511-L1513 VanDerWaalsContact O-N 3.14Å; L1513-L1515 PolarHBondContact O-N 3.1Å; L1513-K1516 HydrophobicContact CD2-CD 4.37Å; L1513-K1516 PolarHBondContact O-N 3.23Å; L1513-K1774 WeakPolarHBondContact CD1-O 3.49Å; L1513-K1776 HydrophobicContact CD1-CB 4.2Å; L1513-K1776 HydrophobicContact CD1-CD 4.22Å; L1513-K1776 HydrophobicContact CD1-CG 4.03Å
1514L35.8Very low51.3Low107.6 Ų107.683.9 Ų83.956%0.56343%0.43SS*.G310 helixtrans-79.7-6.2176.2-84.5165.7000113N1511 S1512 Y1773 F1775N1511-L1514 WeakPolarHBondContact O-CB 3.5Å; N1511-L1514 PolarHBondContact O-N 3.14Å; N1511-L1514 VanDerWaalsContact O-N 3.11Å; S1512-L1514 VanDerWaalsContact C-N 3.29Å; S1512-L1514 PolarHBondContact O-N 3.2Å; L1514-Y1773 HydrophobicContact CD2-CD1 3.97Å; L1514-Y1773 HydrophobicContact CD2-CE1 4.16Å; L1514-Y1773 HydrophobicContact CD2-CG 4.33Å; L1514-F1775 HydrophobicContact CD1-CE1 4.24Å; L1514-F1775 HydrophobicContact CD1-CZ 4.24Å; L1514-F1775 HydrophobicContact CG-CE1 4.47Å
1515L36Very low49Very low97.4 Ų97.489.9 Ų89.951%0.5146%0.457SS..G310 helixtrans-103.527.5-178.4-79.7149.7000112.4S1512 L1513 S1517 W1521 I1522 I1526S1512-L1515 PolarHBondContact O-N 3.25Å; L1513-L1515 PolarHBondContact O-N 3.1Å; L1515-S1517 PolarHBondContact O-N 3.32Å; L1515-S1517 VanDerWaalsContact O-N 3.11Å; L1515-W1521 WeakPolarHBondContact O-CH2 3.44Å; L1515-W1521 WeakPolarHBondContact O-CZ2 3.31Å; L1515-I1522 HydrophobicContact CD2-CG2 4.12Å; L1515-I1526 HydrophobicContact CD2-CD1 4.09Å
1516K36.6Very low47.2Very low171 Ų17193.5 Ų93.574%0.74348%0.475SS*.  trans-87.661.7160.9-77-178177-177.70112.5L1513L1513-K1516 HydrophobicContact CD2-CD 4.37Å; L1513-K1516 PolarHBondContact O-N 3.23Å
1517S36.9Very low45.8Very low81 Ų8197.3 Ų97.357%0.56649%0.494SS*.SBendtrans-82.9119.2153.3560000110.3L1515 D1519L1515-S1517 PolarHBondContact O-N 3.32Å; L1515-S1517 VanDerWaalsContact O-N 3.11Å; S1517-D1519 PolarHBondContact O-N 3.05Å
1518N37Very low44Very low154.8 Ų154.8100.3 Ų100.383%0.82851%0.51SS*.SBendtrans-28.970.8174.1-66.1-13.2000116.4E1520 W1521N1518-E1520 PolarHBondContact O-N 2.96Å; N1518-W1521 PolarHBondContact O-NE1 2.94Å
1519D40.2Very low42.2Very low121 Ų121102.8 Ų102.865%0.64753%0.526SS*.  trans-111.5103.3169.3-73.5-37.7000110.4S1517 W1521 I1522S1517-D1519 PolarHBondContact O-N 3.05Å; D1519-W1521 PolarHBondContact O-N 3.13Å; D1519-I1522 HydrophobicContact CB-CD1 4.24Å; D1519-I1522 HydrophobicContact CB-CG1 4.32Å; D1519-I1522 WeakPolarHBondContact O-CD1 3.45Å; D1519-I1522 WeakPolarHBondContact O-CG1 3.26Å; D1519-I1522 PolarHBondContact O-N 3.03Å
1520E43.6Very low40.8Very low177.6 Ų177.6107.3 Ų107.383%0.8355%0.546SS*.Hα-helixtrans-73.22.8179.2-75.7-179.9156.300113.5N1518 I1522 S1523N1518-E1520 PolarHBondContact O-N 2.96Å; E1520-I1522 VanDerWaalsContact C-N 3.31Å; E1520-I1522 PolarHBondContact O-N 3.02Å; E1520-S1523 PolarHBondContact O-OG 3.31Å
1521W42.6Very low39.8Very low213.4 Ų213.4111.6 Ų111.681%0.80856%0.562SS**Hα-helixtrans-85.6-13.7-172.1-77.333.6000115L1515 N1518 D1519L1515-W1521 WeakPolarHBondContact O-CH2 3.44Å; L1515-W1521 WeakPolarHBondContact O-CZ2 3.31Å; N1518-W1521 PolarHBondContact O-NE1 2.94Å; D1519-W1521 PolarHBondContact O-N 3.13Å
1522I40.8Very low39.1Very low92.4 Ų92.4113 Ų11347%0.47457%0.569SS.*Hα-helixtrans-84.4-30.9-172.9-60.8175.6000112.2L1515 D1519 E1520 H1524 F1525 I1526L1515-I1522 HydrophobicContact CD2-CG2 4.12Å; D1519-I1522 HydrophobicContact CB-CD1 4.24Å; D1519-I1522 HydrophobicContact CB-CG1 4.32Å; D1519-I1522 WeakPolarHBondContact O-CD1 3.45Å; D1519-I1522 WeakPolarHBondContact O-CG1 3.26Å; D1519-I1522 PolarHBondContact O-N 3.03Å; E1520-I1522 VanDerWaalsContact C-N 3.31Å; E1520-I1522 PolarHBondContact O-N 3.02Å; I1522-H1524 VanDerWaalsContact C-N 3.29Å; I1522-H1524 PolarHBondContact O-N 3.27Å; I1522-H1524 VanDerWaalsContact O-N 3.11Å; I1522-F1525 HydrophobicContact CG2-CB 4.35Å; I1522-F1525 VanDerWaalsContact O-CB 3.29Å; I1522-F1525 WeakPolarHBondContact O-CB 3.03Å; I1522-F1525 PolarHBondContact O-N 3.05Å; I1522-I1526 HydrophobicContact CG2-CD1 3.52Å; I1522-I1526 HydrophobicContact CG2-CG1 4.05Å; I1522-I1526 WeakPolarHBondContact O-CB 3.3Å; I1522-I1526 WeakPolarHBondContact O-CG1 3.4Å; I1522-I1526 PolarHBondContact O-N 3.07Å; I1522-I1526 VanDerWaalsContact O-N 3.12Å
1523S40Very low38.8Very low81.8 Ų81.8113.5 Ų113.557%0.57256%0.561SS**Hα-helixtrans-64-34.4-179.853.50000112.8E1520 F1525 L1527E1520-S1523 PolarHBondContact O-OG 3.31Å; S1523-F1525 VanDerWaalsContact C-N 3.3Å; S1523-F1525 PolarHBondContact O-N 2.96Å; S1523-L1527 WeakPolarHBondContact O-CB 3.38Å; S1523-L1527 PolarHBondContact O-N 3.13Å; S1523-L1527 VanDerWaalsContact O-N 3.13Å
1524H37.9Very low38.7Very low128 Ų128115.6 Ų115.659%0.59357%0.573SS**Hα-helixtrans-77.8-19.3-179.7-143.9-61.7000113.2I1522 N1528I1522-H1524 VanDerWaalsContact C-N 3.29Å; I1522-H1524 PolarHBondContact O-N 3.27Å; I1522-H1524 VanDerWaalsContact O-N 3.11Å; H1524-N1528 PolarHBondContact CE1-ND2 3.33Å; H1524-N1528 VanDerWaalsContact ND1-CG 3.29Å; H1524-N1528 PolarHBondContact ND1-ND2 3.11Å; H1524-N1528 VanDerWaalsContact ND1-ND2 3.14Å; H1524-N1528 PolarHBondContact ND1-OD1 2.96Å; H1524-N1528 WeakPolarHBondContact O-CA 3.27Å; H1524-N1528 WeakPolarHBondContact O-CB 3.31Å; H1524-N1528 PolarHBondContact O-N 2.87Å; H1524-N1528 PolarHBondContact O-ND2 3.36Å
1525F35.8Very low38.6Very low129.2 Ų129.2117.3 Ų117.357%0.56758%0.582SS**Hα-helixtrans-82.6-34.3-179.3-157.7-98.5000112.3I1522 S1523 L1527 N1528 T1529 L1532I1522-F1525 HydrophobicContact CG2-CB 4.35Å; I1522-F1525 VanDerWaalsContact O-CB 3.29Å; I1522-F1525 WeakPolarHBondContact O-CB 3.03Å; I1522-F1525 PolarHBondContact O-N 3.05Å; S1523-F1525 VanDerWaalsContact C-N 3.3Å; S1523-F1525 PolarHBondContact O-N 2.96Å; F1525-L1527 VanDerWaalsContact C-N 3.3Å; F1525-L1527 PolarHBondContact O-N 2.84Å; F1525-N1528 CarbonylContact O-C 3.45Å; F1525-N1528 PolarHBondContact O-N 3.25Å; F1525-T1529 HydrophobicContact CE1-CG2 4.43Å; F1525-T1529 PolarHBondContact O-N 3.37Å; F1525-T1529 PolarHBondContact O-OG1 3.22Å; F1525-L1532 HydrophobicContact CD1-CD1 4.1Å; F1525-L1532 HydrophobicContact CE1-CD1 3.12Å; F1525-L1532 HydrophobicContact CE1-CD2 4.17Å; F1525-L1532 HydrophobicContact CE1-CG 4.26Å; F1525-L1532 HydrophobicContact CE2-CD1 4.46Å; F1525-L1532 HydrophobicContact CZ-CD1 3.33Å
1526I39.9Very low38.6Very low77.2 Ų77.2116.1 Ų116.140%0.39658%0.578SS.*Hα-helixtrans-72.8-34.1-178.4-65.1177.5000112L1515 I1522 N1528 T1529 F1530 L1532 P1853L1515-I1526 HydrophobicContact CD2-CD1 4.09Å; I1522-I1526 HydrophobicContact CG2-CD1 3.52Å; I1522-I1526 HydrophobicContact CG2-CG1 4.05Å; I1522-I1526 WeakPolarHBondContact O-CB 3.3Å; I1522-I1526 WeakPolarHBondContact O-CG1 3.4Å; I1522-I1526 PolarHBondContact O-N 3.07Å; I1522-I1526 VanDerWaalsContact O-N 3.12Å; I1526-N1528 VanDerWaalsContact C-N 3.28Å; I1526-N1528 PolarHBondContact O-N 3.45Å; I1526-T1529 VanDerWaalsContact C-OG1 3.28Å; I1526-T1529 WeakPolarHBondContact CA-OG1 3.46Å; I1526-T1529 PolarHBondContact O-N 3.17Å; I1526-T1529 PolarHBondContact O-OG1 3.08Å; I1526-F1530 HydrophobicContact CG2-CD2 3.65Å; I1526-F1530 HydrophobicContact CG2-CE2 3.78Å; I1526-F1530 PolarHBondContact O-N 3.16Å; I1526-L1532 HydrophobicContact CG2-CD1 3.56Å; I1526-P1853 HydrophobicContact CD1-CB 4Å; I1526-P1853 HydrophobicContact CG1-CB 4.37Å
1527L41.4Very low38.5Very low105.2 Ų105.2113.4 Ų113.455%0.55158%0.581SS**Hα-helixtrans-71.4-27.9176.4-130.3125.7000112.8S1523 F1525 T1529 K1531 I1932S1523-L1527 WeakPolarHBondContact O-CB 3.38Å; S1523-L1527 PolarHBondContact O-N 3.13Å; S1523-L1527 VanDerWaalsContact O-N 3.13Å; F1525-L1527 VanDerWaalsContact C-N 3.3Å; F1525-L1527 PolarHBondContact O-N 2.84Å; L1527-T1529 PolarHBondContact O-N 2.8Å; L1527-K1531 HydrophobicContact CD2-CD 3.94Å; L1527-K1531 HydrophobicContact CD2-CG 4.41Å; L1527-K1531 WeakPolarHBondContact O-CB 3.38Å; L1527-K1531 PolarHBondContact O-N 3.05Å; L1527-I1932 HydrophobicContact CD1-CB 3.92Å; L1527-I1932 HydrophobicContact CD1-CD1 4.35Å; L1527-I1932 HydrophobicContact CD1-CG2 3.03Å; L1527-I1932 HydrophobicContact CD2-CD1 4.07Å; L1527-I1932 WeakPolarHBondContact O-CG2 3.24Å
1528N36.7Very low38.6Very low76.8 Ų76.8113.9 Ų113.941%0.41157%0.573SS.*THydrogen-bonded Turntrans-87.9-3.6177.8-79.7-9.2000113.8H1524 F1525 I1526 F1530 K1531 L1532 I1932H1524-N1528 PolarHBondContact CE1-ND2 3.33Å; H1524-N1528 VanDerWaalsContact ND1-CG 3.29Å; H1524-N1528 PolarHBondContact ND1-ND2 3.11Å; H1524-N1528 VanDerWaalsContact ND1-ND2 3.14Å; H1524-N1528 PolarHBondContact ND1-OD1 2.96Å; H1524-N1528 WeakPolarHBondContact O-CA 3.27Å; H1524-N1528 WeakPolarHBondContact O-CB 3.31Å; H1524-N1528 PolarHBondContact O-N 2.87Å; H1524-N1528 PolarHBondContact O-ND2 3.36Å; F1525-N1528 CarbonylContact O-C 3.45Å; F1525-N1528 PolarHBondContact O-N 3.25Å; I1526-N1528 VanDerWaalsContact C-N 3.28Å; I1526-N1528 PolarHBondContact O-N 3.45Å; N1528-F1530 PolarHBondContact O-N 3.49Å; N1528-K1531 CarbonylContact O-C 3.59Å; N1528-K1531 WeakPolarHBondContact O-CA 3.3Å; N1528-K1531 PolarHBondContact O-N 3.15Å; N1528-L1532 HydrophobicContact CB-CD1 4.37Å; N1528-L1532 WeakPolarHBondContact O-CA 3.47Å; N1528-L1532 WeakPolarHBondContact O-CB 3.32Å; N1528-L1532 WeakPolarHBondContact O-CD1 3.46Å; N1528-L1532 WeakPolarHBondContact O-CG 2.96Å; N1528-L1532 PolarHBondContact O-N 3.2Å; N1528-I1932 HydrophobicContact CB-CD1 3.95Å; N1528-I1932 WeakPolarHBondContact O-CD1 3.41Å; N1528-I1932 WeakPolarHBondContact O-CG2 3.37Å; N1528-I1932 WeakPolarHBondContact OD1-CD1 3.45Å; N1528-I1932 WeakPolarHBondContact OD1-CG1 3.41Å
1529T36.3Very low39.1Very low55.2 Ų55.2116 Ų11634%0.33958%0.575SS.*Hα-helixtrans-93.79.4173.530000111.2F1525 I1526 L1527 K1531 L1532 F1533F1525-T1529 HydrophobicContact CE1-CG2 4.43Å; F1525-T1529 PolarHBondContact O-N 3.37Å; F1525-T1529 PolarHBondContact O-OG1 3.22Å; I1526-T1529 VanDerWaalsContact C-OG1 3.28Å; I1526-T1529 WeakPolarHBondContact CA-OG1 3.46Å; I1526-T1529 PolarHBondContact O-N 3.17Å; I1526-T1529 PolarHBondContact O-OG1 3.08Å; L1527-T1529 PolarHBondContact O-N 2.8Å; T1529-K1531 HydrophobicContact CG2-CB 4.19Å; T1529-K1531 PolarHBondContact O-N 3.03Å; T1529-L1532 CarbonylContact O-C 3.5Å; T1529-L1532 WeakPolarHBondContact O-CA 3.4Å; T1529-L1532 VanDerWaalsContact O-CB 3.29Å; T1529-L1532 WeakPolarHBondContact O-CB 3.27Å; T1529-L1532 PolarHBondContact O-N 3.17Å; T1529-L1532 VanDerWaalsContact O-N 3.12Å; T1529-F1533 HydrophobicContact CG2-CE2 4.41Å; T1529-F1533 VanDerWaalsContact O-CD2 3.23Å; T1529-F1533 WeakPolarHBondContact O-CD2 3.2Å; T1529-F1533 PolarHBondContact O-N 3.46Å
1530F40.1Very low39.6Very low117.8 Ų117.8112.3 Ų112.352%0.51756%0.559SS.*Hα-helixtrans-62.9-13.6172.4-101.2-85.5000114.3I1526 N1528 L1532 F1533 I1789 L1790 H1933I1526-F1530 HydrophobicContact CG2-CD2 3.65Å; I1526-F1530 HydrophobicContact CG2-CE2 3.78Å; I1526-F1530 PolarHBondContact O-N 3.16Å; N1528-F1530 PolarHBondContact O-N 3.49Å; F1530-L1532 VanDerWaalsContact C-N 3.29Å; F1530-L1532 PolarHBondContact O-N 3.01Å; F1530-F1533 HydrophobicContact CD1-CD2 4.42Å; F1530-F1533 PolarHBondContact O-N 3.04Å; F1530-I1789 HydrophobicContact CE2-CG2 4.06Å; F1530-I1789 HydrophobicContact CZ-CG2 4.24Å; F1530-L1790 HydrophobicContact CE1-CD2 3.48Å; F1530-L1790 VanDerWaalsContact CE1-CD2 3.48Å; F1530-L1790 HydrophobicContact CE1-CG 4.45Å; F1530-L1790 HydrophobicContact CZ-CD2 3.58Å; F1530-L1790 HydrophobicContact CZ-CG 4.07Å; F1530-H1933 AromaticContact CE2-CE1 3.74Å; F1530-H1933 AromaticContact CE2-ND1 3.91Å; F1530-H1933 AromaticContact CZ-CE1 3.97Å
1531K39.4Very low40.4Very low139.6 Ų139.6106.6 Ų106.661%0.60754%0.537SS*.Hα-helixtrans-81.43.3168.5-81-173.7173.5-164.60112.7L1527 N1528 T1529 F1533 D1534 L1535L1527-K1531 HydrophobicContact CD2-CD 3.94Å; L1527-K1531 HydrophobicContact CD2-CG 4.41Å; L1527-K1531 WeakPolarHBondContact O-CB 3.38Å; L1527-K1531 PolarHBondContact O-N 3.05Å; N1528-K1531 CarbonylContact O-C 3.59Å; N1528-K1531 WeakPolarHBondContact O-CA 3.3Å; N1528-K1531 PolarHBondContact O-N 3.15Å; T1529-K1531 HydrophobicContact CG2-CB 4.19Å; T1529-K1531 PolarHBondContact O-N 3.03Å; K1531-F1533 VanDerWaalsContact C-N 3.28Å; K1531-F1533 PolarHBondContact O-N 3.21Å; K1531-F1533 VanDerWaalsContact O-N 3.14Å; K1531-D1534 HydrophobicContact CB-CB 4.25Å; K1531-D1534 WeakPolarHBondContact CD-OD2 3.49Å; K1531-D1534 WeakPolarHBondContact CE-OD2 3.14Å; K1531-D1534 IonicContact NZ-OD2 3.19Å; K1531-D1534 PolarHBondContact NZ-OD2 2.7Å; K1531-D1534 CarbonylContact O-C 3.55Å; K1531-D1534 PolarHBondContact O-N 3.04Å; K1531-D1534 VanDerWaalsContact O-N 3.08Å; K1531-L1535 HydrophobicContact CB-CD1 4.08Å; K1531-L1535 HydrophobicContact CD-CD1 4.17Å; K1531-L1535 HydrophobicContact CG-CD1 4.4Å; K1531-L1535 WeakPolarHBondContact O-CA 3.47Å; K1531-L1535 WeakPolarHBondContact O-CB 3.48Å; K1531-L1535 PolarHBondContact O-N 3.12Å
1532L36.9Very low41.8Very low80.6 Ų80.696.8 Ų96.842%0.42250%0.501SS..Hα-helixtrans-74.1-21.6178-136.1128000112.3F1525 I1526 N1528 T1529 F1530 D1534 L1535 V1536F1525-L1532 HydrophobicContact CD1-CD1 4.1Å; F1525-L1532 HydrophobicContact CE1-CD1 3.12Å; F1525-L1532 HydrophobicContact CE1-CD2 4.17Å; F1525-L1532 HydrophobicContact CE1-CG 4.26Å; F1525-L1532 HydrophobicContact CE2-CD1 4.46Å; F1525-L1532 HydrophobicContact CZ-CD1 3.33Å; I1526-L1532 HydrophobicContact CG2-CD1 3.56Å; N1528-L1532 HydrophobicContact CB-CD1 4.37Å; N1528-L1532 WeakPolarHBondContact O-CA 3.47Å; N1528-L1532 WeakPolarHBondContact O-CB 3.32Å; N1528-L1532 WeakPolarHBondContact O-CD1 3.46Å; N1528-L1532 WeakPolarHBondContact O-CG 2.96Å; N1528-L1532 PolarHBondContact O-N 3.2Å; T1529-L1532 CarbonylContact O-C 3.5Å; T1529-L1532 WeakPolarHBondContact O-CA 3.4Å; T1529-L1532 VanDerWaalsContact O-CB 3.29Å; T1529-L1532 WeakPolarHBondContact O-CB 3.27Å; T1529-L1532 PolarHBondContact O-N 3.17Å; T1529-L1532 VanDerWaalsContact O-N 3.12Å; F1530-L1532 VanDerWaalsContact C-N 3.29Å; F1530-L1532 PolarHBondContact O-N 3.01Å; L1532-D1534 PolarHBondContact O-N 3.17Å; L1532-L1535 PolarHBondContact O-N 3.21Å; L1532-V1536 HydrophobicContact CB-CG2 4.33Å; L1532-V1536 HydrophobicContact CD2-CB 4.18Å; L1532-V1536 HydrophobicContact CD2-CG1 4.4Å; L1532-V1536 HydrophobicContact CD2-CG2 3.49Å; L1532-V1536 HydrophobicContact CG-CB 4.18Å; L1532-V1536 HydrophobicContact CG-CG2 3.77Å; L1532-V1536 WeakPolarHBondContact O-CA 3.45Å; L1532-V1536 WeakPolarHBondContact O-CB 3.41Å; L1532-V1536 WeakPolarHBondContact O-CG2 3.4Å; L1532-V1536 PolarHBondContact O-N 2.94Å; L1532-V1536 VanDerWaalsContact O-N 3.17Å
1533F40.4Very low43.6Very low90.2 Ų90.292.5 Ų92.540%0.39648%0.479SS..Hα-helixtrans-78.9-15.9176.7-87.4-79.4000113.4L1507 T1529 F1530 K1531 L1535 F1538 V1545 L1790L1507-F1533 HydrophobicContact CD2-CE1 4.07Å; L1507-F1533 HydrophobicContact CD2-CZ 4.01Å; T1529-F1533 HydrophobicContact CG2-CE2 4.41Å; T1529-F1533 VanDerWaalsContact O-CD2 3.23Å; T1529-F1533 WeakPolarHBondContact O-CD2 3.2Å; T1529-F1533 PolarHBondContact O-N 3.46Å; F1530-F1533 HydrophobicContact CD1-CD2 4.42Å; F1530-F1533 PolarHBondContact O-N 3.04Å; K1531-F1533 VanDerWaalsContact C-N 3.28Å; K1531-F1533 PolarHBondContact O-N 3.21Å; K1531-F1533 VanDerWaalsContact O-N 3.14Å; F1533-L1535 PolarHBondContact O-N 3.35Å; F1533-F1538 HydrophobicContact CB-CE2 4.41Å; F1533-F1538 HydrophobicContact CD1-CD2 4.42Å; F1533-F1538 AromaticContact CD1-CE2 3.57Å; F1533-F1538 HydrophobicContact CD1-CE2 3.57Å; F1533-F1538 AromaticContact CD1-CZ 3.51Å; F1533-F1538 HydrophobicContact CD1-CZ 3.73Å; F1533-F1538 HydrophobicContact CE1-CE1 4.21Å; F1533-F1538 AromaticContact CE1-CE2 3.75Å; F1533-F1538 HydrophobicContact CE1-CE2 3.91Å; F1533-F1538 AromaticContact CE1-CZ 3.65Å; F1533-F1538 HydrophobicContact CE1-CZ 3.65Å; F1533-F1538 HydrophobicContact CG-CE2 4.06Å; F1533-F1538 HydrophobicContact CG-CZ 4.11Å; F1533-F1538 HydrophobicContact CZ-CZ 4.11Å; F1533-V1545 HydrophobicContact CD1-CG1 4.13Å; F1533-V1545 HydrophobicContact CD1-CG2 4.46Å; F1533-V1545 HydrophobicContact CE1-CG1 4.08Å; F1533-V1545 HydrophobicContact CE1-CG2 4.19Å; F1533-L1790 HydrophobicContact CD1-CD2 4.45Å; F1533-L1790 HydrophobicContact CD2-CD2 4.16Å; F1533-L1790 HydrophobicContact CE1-CD1 4.19Å; F1533-L1790 HydrophobicContact CE1-CD2 4.23Å; F1533-L1790 HydrophobicContact CE2-CD2 3.84Å; F1533-L1790 HydrophobicContact CE2-CG 4.4Å; F1533-L1790 HydrophobicContact CG-CD2 4.37Å; F1533-L1790 HydrophobicContact CZ-CD1 4.04Å; F1533-L1790 HydrophobicContact CZ-CD2 3.78Å; F1533-L1790 HydrophobicContact CZ-CG 4.3Å
1534D38.4Very low45.6Very low129.6 Ų129.688.7 Ų88.769%0.69345%0.452SS*.Hα-helixtrans-82.4-16.7178.5-76.5-17.8000113.9K1531 L1532K1531-D1534 HydrophobicContact CB-CB 4.25Å; K1531-D1534 WeakPolarHBondContact CD-OD2 3.49Å; K1531-D1534 WeakPolarHBondContact CE-OD2 3.14Å; K1531-D1534 IonicContact NZ-OD2 3.19Å; K1531-D1534 PolarHBondContact NZ-OD2 2.7Å; K1531-D1534 CarbonylContact O-C 3.55Å; K1531-D1534 PolarHBondContact O-N 3.04Å; K1531-D1534 VanDerWaalsContact O-N 3.08Å; L1532-D1534 PolarHBondContact O-N 3.17Å
1535L33.7Very low47.4Very low143.6 Ų143.683 Ų8375%0.75243%0.426SS*.Hα-helixtrans-109.8-19.8-169.7-98.9156.1000115.4K1531 L1532 F1533 S1537K1531-L1535 HydrophobicContact CB-CD1 4.08Å; K1531-L1535 HydrophobicContact CD-CD1 4.17Å; K1531-L1535 HydrophobicContact CG-CD1 4.4Å; K1531-L1535 WeakPolarHBondContact O-CA 3.47Å; K1531-L1535 WeakPolarHBondContact O-CB 3.48Å; K1531-L1535 PolarHBondContact O-N 3.12Å; L1532-L1535 PolarHBondContact O-N 3.21Å; F1533-L1535 PolarHBondContact O-N 3.35Å; L1535-S1537 PolarHBondContact O-N 3Å; L1535-S1537 VanDerWaalsContact O-N 3.14Å
1536V35.9Very low49.4Very low72 Ų7278.5 Ų78.544%0.43641%0.408SS..  trans-99.792.5173.3-174.90000108.5L1532 F1538L1532-V1536 HydrophobicContact CB-CG2 4.33Å; L1532-V1536 HydrophobicContact CD2-CB 4.18Å; L1532-V1536 HydrophobicContact CD2-CG1 4.4Å; L1532-V1536 HydrophobicContact CD2-CG2 3.49Å; L1532-V1536 HydrophobicContact CG-CB 4.18Å; L1532-V1536 HydrophobicContact CG-CG2 3.77Å; L1532-V1536 WeakPolarHBondContact O-CA 3.45Å; L1532-V1536 WeakPolarHBondContact O-CB 3.41Å; L1532-V1536 WeakPolarHBondContact O-CG2 3.4Å; L1532-V1536 PolarHBondContact O-N 2.94Å; L1532-V1536 VanDerWaalsContact O-N 3.17Å; V1536-F1538 VanDerWaalsContact C-N 3.26Å; V1536-F1538 HydrophobicContact CB-CD1 4.28Å; V1536-F1538 HydrophobicContact CB-CD2 3.85Å; V1536-F1538 HydrophobicContact CB-CE1 3.99Å; V1536-F1538 HydrophobicContact CB-CE2 3.49Å; V1536-F1538 VanDerWaalsContact CB-CE2 3.49Å; V1536-F1538 HydrophobicContact CB-CG 4.26Å; V1536-F1538 HydrophobicContact CB-CZ 3.59Å; V1536-F1538 HydrophobicContact CG1-CD1 4.02Å; V1536-F1538 HydrophobicContact CG1-CD2 3.8Å; V1536-F1538 HydrophobicContact CG1-CE1 3.8Å; V1536-F1538 HydrophobicContact CG1-CE2 3.62Å; V1536-F1538 HydrophobicContact CG1-CG 3.69Å; V1536-F1538 HydrophobicContact CG1-CZ 3.32Å; V1536-F1538 HydrophobicContact CG2-CE2 4.36Å; V1536-F1538 HydrophobicContact CG2-CZ 4.17Å; V1536-F1538 VanDerWaalsContact O-CD2 3.25Å; V1536-F1538 WeakPolarHBondContact O-CD2 3.37Å; V1536-F1538 PolarHBondContact O-N 3.05Å
1537S33.9Very low51.3Low114.6 Ų114.674.8 Ų74.880%0.80139%0.39SS*.  trans-71.2100.2157.6-70.80000109L1535 K1539L1535-S1537 PolarHBondContact O-N 3Å; L1535-S1537 VanDerWaalsContact O-N 3.14Å; S1537-K1539 PolarHBondContact O-N 2.88Å; S1537-K1539 VanDerWaalsContact O-N 3.11Å
1538F39.8Very low52.9Low91.8 Ų91.870.1 Ų70.140%0.40337%0.365SS..  trans-60.4125.1176.8-76.4-77.9000109.2D1506 N1511 F1533 V1536 S1540D1506-F1538 HydrophobicContact CB-CB 4.46Å; D1506-F1538 HydrophobicContact CB-CD1 3.47Å; D1506-F1538 VanDerWaalsContact CB-CD1 3.47Å; D1506-F1538 HydrophobicContact CB-CE1 3.87Å; D1506-F1538 VanDerWaalsContact CB-CE1 3.41Å; D1506-F1538 HydrophobicContact CB-CG 4.26Å; D1506-F1538 HydrophobicContact CB-CZ 4.15Å; D1506-F1538 VanDerWaalsContact OD2-CA 3.26Å; D1506-F1538 WeakPolarHBondContact OD2-CA 3.27Å; D1506-F1538 VanDerWaalsContact OD2-CB 3.28Å; D1506-F1538 WeakPolarHBondContact OD2-CB 3.37Å; D1506-F1538 VanDerWaalsContact OD2-CD1 3.29Å; D1506-F1538 WeakPolarHBondContact OD2-CD1 3.34Å; D1506-F1538 WeakPolarHBondContact OD2-CG 3.4Å; N1511-F1538 VanDerWaalsContact ND2-CE1 3.34Å; N1511-F1538 WeakPolarHBondContact ND2-CE1 3.31Å; F1533-F1538 HydrophobicContact CB-CE2 4.41Å; F1533-F1538 HydrophobicContact CD1-CD2 4.42Å; F1533-F1538 AromaticContact CD1-CE2 3.57Å; F1533-F1538 HydrophobicContact CD1-CE2 3.57Å; F1533-F1538 AromaticContact CD1-CZ 3.51Å; F1533-F1538 HydrophobicContact CD1-CZ 3.73Å; F1533-F1538 HydrophobicContact CE1-CE1 4.21Å; F1533-F1538 AromaticContact CE1-CE2 3.75Å; F1533-F1538 HydrophobicContact CE1-CE2 3.91Å; F1533-F1538 AromaticContact CE1-CZ 3.65Å; F1533-F1538 HydrophobicContact CE1-CZ 3.65Å; F1533-F1538 HydrophobicContact CG-CE2 4.06Å; F1533-F1538 HydrophobicContact CG-CZ 4.11Å; F1533-F1538 HydrophobicContact CZ-CZ 4.11Å; V1536-F1538 VanDerWaalsContact C-N 3.26Å; V1536-F1538 HydrophobicContact CB-CD1 4.28Å; V1536-F1538 HydrophobicContact CB-CD2 3.85Å; V1536-F1538 HydrophobicContact CB-CE1 3.99Å; V1536-F1538 HydrophobicContact CB-CE2 3.49Å; V1536-F1538 VanDerWaalsContact CB-CE2 3.49Å; V1536-F1538 HydrophobicContact CB-CG 4.26Å; V1536-F1538 HydrophobicContact CB-CZ 3.59Å; V1536-F1538 HydrophobicContact CG1-CD1 4.02Å; V1536-F1538 HydrophobicContact CG1-CD2 3.8Å; V1536-F1538 HydrophobicContact CG1-CE1 3.8Å; V1536-F1538 HydrophobicContact CG1-CE2 3.62Å; V1536-F1538 HydrophobicContact CG1-CG 3.69Å; V1536-F1538 HydrophobicContact CG1-CZ 3.32Å; V1536-F1538 HydrophobicContact CG2-CE2 4.36Å; V1536-F1538 HydrophobicContact CG2-CZ 4.17Å; V1536-F1538 VanDerWaalsContact O-CD2 3.25Å; V1536-F1538 WeakPolarHBondContact O-CD2 3.37Å; V1536-F1538 PolarHBondContact O-N 3.05Å; F1538-S1540 PolarHBondContact O-N 3.32Å
1539K47.2Very low54.6Low197.8 Ų197.871.2 Ų71.286%0.8637%0.367SS*.SBendtrans-79.8-17.1173.9-75.3-176.1177.1-179.50110.2D1506 S1537 P1541D1506-K1539 PolarHBondContact OD2-N 3.21Å; S1537-K1539 PolarHBondContact O-N 2.88Å; S1537-K1539 VanDerWaalsContact O-N 3.11Å; K1539-P1541 WeakPolarHBondContact O-CD 3.41Å
1540S50.7Low56.3Low43.8 Ų43.869.8 Ų69.831%0.30636%0.358SS..SBendtrans-118.2104.217352.80000110.9D1506 F1538 S1542D1506-S1540 VanDerWaalsContact CG-O 3.29Å; D1506-S1540 VanDerWaalsContact CG-OG 3.27Å; D1506-S1540 PolarHBondContact N-O 3.17Å; D1506-S1540 PolarHBondContact N-OG 3.02Å; D1506-S1540 WeakPolarHBondContact OD1-CB 3.32Å; D1506-S1540 PolarHBondContact OD1-N 2.89Å; D1506-S1540 PolarHBondContact OD1-OG 3.14Å; D1506-S1540 PolarHBondContact OD2-N 3.26Å; D1506-S1540 VanDerWaalsContact OD2-N 3.14Å; F1538-S1540 PolarHBondContact O-N 3.32Å; S1540-S1542 PolarHBondContact O-N 3.01Å
1541P61.6Low57.7Low57.2 Ų57.264.4 Ų64.437%0.37133%0.334SS..  trans-63.1122.3-179.623.8-31.4000110.2K1539 V1543 N1546K1539-P1541 WeakPolarHBondContact O-CD 3.41Å; P1541-V1543 PolarHBondContact O-N 3.22Å; P1541-N1546 VanDerWaalsContact CB-ND2 3.27Å; P1541-N1546 WeakPolarHBondContact CB-ND2 3.28Å
1542S72Confident58.8Low8 Ų860.8 Ų60.86%0.05632%0.322CS..  trans-71.9119.6173.259.80000109.8L1504 S1540 L1544 V1545 N1546L1504-S1542 WeakPolarHBondContact O-CB 3.29Å; S1540-S1542 PolarHBondContact O-N 3.01Å; S1542-L1544 PolarHBondContact O-N 3.1Å; S1542-L1544 VanDerWaalsContact O-N 3.12Å; S1542-V1545 PolarHBondContact O-N 2.84Å; S1542-V1545 WeakPolarHBondContact OG-CB 3.25Å; S1542-V1545 VanDerWaalsContact OG-CG2 3.31Å; S1542-V1545 WeakPolarHBondContact OG-CG2 3.35Å; S1542-V1545 PolarHBondContact OG-N 2.89Å; S1542-N1546 WeakPolarHBondContact O-CB 3.49Å; S1542-N1546 PolarHBondContact O-N 3.1Å; S1542-N1546 VanDerWaalsContact O-N 3.11Å
1543V77.9Confident59.5Low2.8 Ų2.858 Ų582%0.01731%0.308CS..Hα-helixtrans-53.1-40.9173.6177.40000110.2L1436 L1440 L1477 L1502 F1503 P1541 V1545 N1546 F1547L1436-V1543 HydrophobicContact CB-CG2 4.46Å; L1436-V1543 HydrophobicContact CD2-CG1 4.39Å; L1436-V1543 HydrophobicContact CD2-CG2 4.4Å; L1436-V1543 WeakPolarHBondContact O-CG2 3.31Å; L1440-V1543 HydrophobicContact CB-CG1 3.9Å; L1440-V1543 HydrophobicContact CD1-CG1 3.74Å; L1440-V1543 HydrophobicContact CG-CG1 4.44Å; L1477-V1543 HydrophobicContact CD2-CG1 4.46Å; L1502-V1543 WeakPolarHBondContact O-CG2 3.11Å; F1503-V1543 HydrophobicContact CD2-CB 4.05Å; F1503-V1543 HydrophobicContact CD2-CG1 3.99Å; F1503-V1543 HydrophobicContact CE2-CB 4.46Å; F1503-V1543 HydrophobicContact CE2-CG1 4.15Å; F1503-V1543 PolarHBondContact O-N 3.02Å; F1503-V1543 VanDerWaalsContact O-N 3.13Å; P1541-V1543 PolarHBondContact O-N 3.22Å; V1543-V1545 VanDerWaalsContact C-N 3.28Å; V1543-V1545 PolarHBondContact O-N 3.31Å; V1543-N1546 PolarHBondContact O-N 3.37Å; V1543-F1547 VanDerWaalsContact O-CB 3.28Å; V1543-F1547 WeakPolarHBondContact O-CB 3.29Å; V1543-F1547 PolarHBondContact O-N 3.05Å
1544L81Confident59.9Low1.6 Ų1.656.5 Ų56.51%0.00831%0.309CS..Hα-helixtrans-52-50.2179.1-173.3156.8000113F1503 L1507 S1542 W1706 V1710 V1787 L1790F1503-L1544 HydrophobicContact CE1-CB 4.31Å; F1503-L1544 HydrophobicContact CE1-CD1 4.14Å; F1503-L1544 HydrophobicContact CE1-CG 4.47Å; F1503-L1544 HydrophobicContact CZ-CB 4.32Å; F1503-L1544 PolarHBondContact O-N 3.31Å; F1503-L1544 VanDerWaalsContact O-N 3.07Å; L1507-L1544 HydrophobicContact CD1-CD1 4.43Å; L1507-L1544 HydrophobicContact CD1-CD2 4.06Å; S1542-L1544 PolarHBondContact O-N 3.1Å; S1542-L1544 VanDerWaalsContact O-N 3.12Å; L1544-W1706 HydrophobicContact CD2-CZ2 3.99Å; L1544-W1706 HydrophobicContact CG-CZ2 4.07Å; L1544-W1706 PolarHBondContact O-NE1 3.15Å; L1544-V1710 HydrophobicContact CD1-CG1 4.4Å; L1544-V1710 HydrophobicContact CD1-CG2 3.76Å; L1544-V1710 HydrophobicContact CG-CG2 3.98Å; L1544-V1787 HydrophobicContact CD1-CG1 4.47Å; L1544-V1787 HydrophobicContact CD1-CG2 3.87Å; L1544-V1787 HydrophobicContact CD2-CG1 4.36Å; L1544-V1787 HydrophobicContact CD2-CG2 4.04Å; L1544-L1790 HydrophobicContact CD2-CD1 4.39Å
1545V77Confident60.4Low7.6 Ų7.655.1 Ų55.15%0.04630%0.301CS..Hα-helixtrans-78.7-44.7-175.5-177.50000111.2L1507 F1533 S1542 V1543 F1547 L1548 Q1549 L1790L1507-V1545 HydrophobicContact CD1-CG2 3.61Å; L1507-V1545 HydrophobicContact CD2-CG2 4.43Å; L1507-V1545 HydrophobicContact CG-CG2 4.13Å; F1533-V1545 HydrophobicContact CD1-CG1 4.13Å; F1533-V1545 HydrophobicContact CD1-CG2 4.46Å; F1533-V1545 HydrophobicContact CE1-CG1 4.08Å; F1533-V1545 HydrophobicContact CE1-CG2 4.19Å; S1542-V1545 PolarHBondContact O-N 2.84Å; S1542-V1545 WeakPolarHBondContact OG-CB 3.25Å; S1542-V1545 VanDerWaalsContact OG-CG2 3.31Å; S1542-V1545 WeakPolarHBondContact OG-CG2 3.35Å; S1542-V1545 PolarHBondContact OG-N 2.89Å; V1543-V1545 VanDerWaalsContact C-N 3.28Å; V1543-V1545 PolarHBondContact O-N 3.31Å; V1545-F1547 VanDerWaalsContact C-N 3.28Å; V1545-F1547 PolarHBondContact O-N 3.38Å; V1545-L1548 WeakPolarHBondContact O-CB 3.43Å; V1545-L1548 PolarHBondContact O-N 3.24Å; V1545-L1548 VanDerWaalsContact O-N 3.15Å; V1545-Q1549 PolarHBondContact O-N 3.15Å; V1545-L1790 HydrophobicContact CG1-CD1 4.42Å; V1545-L1790 HydrophobicContact CG1-CD2 4.44Å; V1545-L1790 HydrophobicContact CG2-CD1 3.81Å
1546N76.7Confident61.1Low35 Ų3556 Ų5619%0.18730%0.301CS..Hα-helixtrans-65.2-35.2-177.6-70.23.7000111.6C1441 P1541 S1542 V1543 L1548 Q1549 I1550C1441-N1546 HydrophobicContact CB-CB 4.14Å; P1541-N1546 VanDerWaalsContact CB-ND2 3.27Å; P1541-N1546 WeakPolarHBondContact CB-ND2 3.28Å; S1542-N1546 WeakPolarHBondContact O-CB 3.49Å; S1542-N1546 PolarHBondContact O-N 3.1Å; S1542-N1546 VanDerWaalsContact O-N 3.11Å; V1543-N1546 PolarHBondContact O-N 3.37Å; N1546-L1548 VanDerWaalsContact C-N 3.3Å; N1546-L1548 PolarHBondContact O-N 3.1Å; N1546-Q1549 WeakPolarHBondContact O-CB 3.24Å; N1546-Q1549 PolarHBondContact O-N 3.28Å; N1546-I1550 WeakPolarHBondContact O-CG1 3.42Å; N1546-I1550 PolarHBondContact O-N 3.07Å; N1546-I1550 VanDerWaalsContact O-N 3.09Å
1547F80Confident61.8Low0.4 Ų0.454.1 Ų54.10%0.00229%0.289CS..Hα-helixtrans-64.1-36177.4-162.1-98.3000112.4L1440 K1473 L1477 V1543 V1545 Q1549 I1550 L1551 A1702 W1706L1440-F1547 HydrophobicContact CB-CD2 4.49Å; L1440-F1547 HydrophobicContact CD2-CD2 4.3Å; L1440-F1547 HydrophobicContact CD2-CE2 4.11Å; K1473-F1547 HydrophobicContact CB-CE2 3.81Å; K1473-F1547 HydrophobicContact CB-CZ 4.17Å; K1473-F1547 HydrophobicContact CD-CE2 3.92Å; K1473-F1547 HydrophobicContact CG-CE2 4.36Å; L1477-F1547 HydrophobicContact CD1-CD1 4.06Å; L1477-F1547 HydrophobicContact CD1-CD2 4.24Å; L1477-F1547 HydrophobicContact CD1-CE1 3.61Å; L1477-F1547 HydrophobicContact CD1-CE2 3.82Å; L1477-F1547 HydrophobicContact CD1-CG 4.29Å; L1477-F1547 HydrophobicContact CD1-CZ 3.48Å; L1477-F1547 VanDerWaalsContact CD1-CZ 3.47Å; V1543-F1547 VanDerWaalsContact O-CB 3.28Å; V1543-F1547 WeakPolarHBondContact O-CB 3.29Å; V1543-F1547 PolarHBondContact O-N 3.05Å; V1545-F1547 VanDerWaalsContact C-N 3.28Å; V1545-F1547 PolarHBondContact O-N 3.38Å; F1547-Q1549 VanDerWaalsContact C-N 3.31Å; F1547-Q1549 PolarHBondContact O-N 3.3Å; F1547-I1550 HydrophobicContact CD2-CD1 4.49Å; F1547-I1550 WeakPolarHBondContact O-CB 3.35Å; F1547-I1550 PolarHBondContact O-N 3.18Å; F1547-L1551 HydrophobicContact CD1-CD1 3.59Å; F1547-L1551 VanDerWaalsContact CD1-CD1 3.47Å; F1547-L1551 HydrophobicContact CD1-CG 4.18Å; F1547-L1551 HydrophobicContact CE1-CD1 3.67Å; F1547-L1551 HydrophobicContact CE1-CD2 4.32Å; F1547-L1551 HydrophobicContact CE1-CG 4.11Å; F1547-L1551 VanDerWaalsContact O-CG 3.28Å; F1547-L1551 WeakPolarHBondContact O-CG 3.34Å; F1547-L1551 PolarHBondContact O-N 3.2Å; F1547-A1702 HydrophobicContact CE1-CB 4.07Å; F1547-A1702 WeakPolarHBondContact CE1-O 3.3Å; F1547-A1702 HydrophobicContact CZ-CB 3.94Å; F1547-W1706 HydrophobicContact CD1-CB 3.84Å; F1547-W1706 AromaticContact CD1-CD1 3.52Å; F1547-W1706 VanDerWaalsContact CD1-CD1 3.46Å; F1547-W1706 AromaticContact CD1-CG 3.92Å; F1547-W1706 HydrophobicContact CD1-CG 3.94Å; F1547-W1706 HydrophobicContact CE1-CB 3.93Å; F1547-W1706 HydrophobicContact CE1-CG 4.47Å; F1547-W1706 AromaticContact CG-CD1 3.96Å
1548L76.2Confident62.5Low6.8 Ų6.852.2 Ų52.24%0.03627%0.272CS..Hα-helixtrans-65.7-35.8175.9-85.3168.7000112.2V1545 N1546 I1550 L1551 N1552 W1706 L1790 L1791 Q1794 I1795V1545-L1548 WeakPolarHBondContact O-CB 3.43Å; V1545-L1548 PolarHBondContact O-N 3.24Å; V1545-L1548 VanDerWaalsContact O-N 3.15Å; N1546-L1548 VanDerWaalsContact C-N 3.3Å; N1546-L1548 PolarHBondContact O-N 3.1Å; L1548-I1550 VanDerWaalsContact C-N 3.3Å; L1548-I1550 PolarHBondContact O-N 3.34Å; L1548-L1551 HydrophobicContact CD2-CD1 4.34Å; L1548-L1551 WeakPolarHBondContact O-CA 3.24Å; L1548-L1551 WeakPolarHBondContact O-CB 3.3Å; L1548-L1551 PolarHBondContact O-N 3.14Å; L1548-L1551 VanDerWaalsContact O-N 3.1Å; L1548-N1552 PolarHBondContact O-N 3.07Å; L1548-N1552 VanDerWaalsContact O-N 3.09Å; L1548-N1552 PolarHBondContact O-OD1 3.41Å; L1548-W1706 HydrophobicContact CD1-CH2 4.01Å; L1548-W1706 HydrophobicContact CD1-CZ2 3.55Å; L1548-W1706 VanDerWaalsContact CD1-CZ2 3.46Å; L1548-W1706 HydrophobicContact CD2-CD2 4.09Å; L1548-W1706 HydrophobicContact CD2-CE3 4.31Å; L1548-W1706 HydrophobicContact CD2-CH2 3.98Å; L1548-W1706 HydrophobicContact CD2-CZ2 3.7Å; L1548-W1706 HydrophobicContact CD2-CZ3 4.27Å; L1548-W1706 HydrophobicContact CG-CD2 4.46Å; L1548-W1706 HydrophobicContact CG-CH2 4.32Å; L1548-W1706 HydrophobicContact CG-CZ2 3.63Å; L1548-L1790 HydrophobicContact CD1-CB 4.28Å; L1548-L1791 HydrophobicContact CD1-CD1 4.24Å; L1548-Q1794 HydrophobicContact CD2-CB 4.03Å; L1548-Q1794 HydrophobicContact CD2-CG 4.18Å; L1548-Q1794 PolarHBondContact O-NE2 2.86Å; L1548-Q1794 PolarHBondContact O-OE1 3.48Å; L1548-I1795 HydrophobicContact CD2-CD1 3.62Å
1549Q72.2Confident62.9Low98.2 Ų98.254 Ų5446%0.45929%0.286SS..Hα-helixtrans-64-38.9175-65.5178.9-13.800112.2V1545 N1546 F1547 L1551 N1552V1545-Q1549 PolarHBondContact O-N 3.15Å; N1546-Q1549 WeakPolarHBondContact O-CB 3.24Å; N1546-Q1549 PolarHBondContact O-N 3.28Å; F1547-Q1549 VanDerWaalsContact C-N 3.31Å; F1547-Q1549 PolarHBondContact O-N 3.3Å; Q1549-L1551 PolarHBondContact O-N 3.18Å; Q1549-N1552 VanDerWaalsContact O-CB 3.27Å; Q1549-N1552 WeakPolarHBondContact O-CB 3.23Å; Q1549-N1552 PolarHBondContact O-N 2.94Å; Q1549-N1552 VanDerWaalsContact O-N 3.08Å; Q1549-N1552 PolarHBondContact O-ND2 3.47Å
1550I70.9Confident63Low26.6 Ų26.650.6 Ų50.614%0.13628%0.277CS..Hα-helixtrans-64.2-30.8175.3-64.1167.6000111.1L1440 P1443 L1470 N1546 F1547 L1548 N1552L1440-I1550 VanDerWaalsContact O-CD1 3.24Å; L1440-I1550 WeakPolarHBondContact O-CD1 3.25Å; P1443-I1550 HydrophobicContact CB-CG1 4.37Å; L1470-I1550 HydrophobicContact CD2-CG2 3.98Å; N1546-I1550 WeakPolarHBondContact O-CG1 3.42Å; N1546-I1550 PolarHBondContact O-N 3.07Å; N1546-I1550 VanDerWaalsContact O-N 3.09Å; F1547-I1550 HydrophobicContact CD2-CD1 4.49Å; F1547-I1550 WeakPolarHBondContact O-CB 3.35Å; F1547-I1550 PolarHBondContact O-N 3.18Å; L1548-I1550 VanDerWaalsContact C-N 3.3Å; L1548-I1550 PolarHBondContact O-N 3.34Å; I1550-N1552 PolarHBondContact O-N 3.34Å; I1550-N1552 VanDerWaalsContact O-N 3.12Å
1551L69.3Low63.1Low4.8 Ų4.850.7 Ų50.73%0.02528%0.277CS..THydrogen-bonded Turntrans-79.3-9.8179.7-68.9167.5000113.9L1470 F1547 L1548 Q1549 T1553 A1702 I1703 W1706L1470-L1551 HydrophobicContact CD2-CD2 4.32Å; F1547-L1551 HydrophobicContact CD1-CD1 3.59Å; F1547-L1551 VanDerWaalsContact CD1-CD1 3.47Å; F1547-L1551 HydrophobicContact CD1-CG 4.18Å; F1547-L1551 HydrophobicContact CE1-CD1 3.67Å; F1547-L1551 HydrophobicContact CE1-CD2 4.32Å; F1547-L1551 HydrophobicContact CE1-CG 4.11Å; F1547-L1551 VanDerWaalsContact O-CG 3.28Å; F1547-L1551 WeakPolarHBondContact O-CG 3.34Å; F1547-L1551 PolarHBondContact O-N 3.2Å; L1548-L1551 HydrophobicContact CD2-CD1 4.34Å; L1548-L1551 WeakPolarHBondContact O-CA 3.24Å; L1548-L1551 WeakPolarHBondContact O-CB 3.3Å; L1548-L1551 PolarHBondContact O-N 3.14Å; L1548-L1551 VanDerWaalsContact O-N 3.1Å; Q1549-L1551 PolarHBondContact O-N 3.18Å; L1551-T1553 WeakPolarHBondContact O-CA 3.33Å; L1551-T1553 VanDerWaalsContact O-CG2 3.29Å; L1551-T1553 WeakPolarHBondContact O-CG2 3.35Å; L1551-T1553 PolarHBondContact O-N 3.2Å; L1551-T1553 VanDerWaalsContact O-N 3.09Å; L1551-A1702 HydrophobicContact CD2-CB 3.72Å; L1551-I1703 HydrophobicContact CB-CD1 4.25Å; L1551-I1703 HydrophobicContact CB-CG1 4.25Å; L1551-I1703 HydrophobicContact CD1-CB 4.46Å; L1551-I1703 HydrophobicContact CD1-CD1 4.31Å; L1551-I1703 HydrophobicContact CD1-CG1 3.4Å; L1551-I1703 VanDerWaalsContact CD1-CG1 3.43Å; L1551-I1703 HydrophobicContact CD2-CD1 4.23Å; L1551-I1703 HydrophobicContact CD2-CG1 3.78Å; L1551-I1703 HydrophobicContact CG-CD1 4.38Å; L1551-I1703 HydrophobicContact CG-CG1 4.02Å; L1551-W1706 HydrophobicContact CD1-CB 4.44Å; L1551-W1706 HydrophobicContact CD1-CG 4.48Å
1552N62.4Low62.9Low64.4 Ų64.454 Ų5434%0.34429%0.292SS..  trans-43.8115.1-173.9-94.2-14.7000111.5L1548 Q1549 I1550 S1554 K1699 Q1794L1548-N1552 PolarHBondContact O-N 3.07Å; L1548-N1552 VanDerWaalsContact O-N 3.09Å; L1548-N1552 PolarHBondContact O-OD1 3.41Å; Q1549-N1552 VanDerWaalsContact O-CB 3.27Å; Q1549-N1552 WeakPolarHBondContact O-CB 3.23Å; Q1549-N1552 PolarHBondContact O-N 2.94Å; Q1549-N1552 VanDerWaalsContact O-N 3.08Å; Q1549-N1552 PolarHBondContact O-ND2 3.47Å; I1550-N1552 PolarHBondContact O-N 3.34Å; I1550-N1552 VanDerWaalsContact O-N 3.12Å; N1552-S1554 VanDerWaalsContact C-N 3.25Å; N1552-S1554 PolarHBondContact O-N 3.12Å; N1552-K1699 PolarHBondContact O-NZ 2.91Å; N1552-Q1794 PolarHBondContact ND2-OE1 2.86Å; N1552-Q1794 PolarHBondContact OD1-NE2 3.21Å
1553T52.5Low62.3Low20.6 Ų20.658 Ų5813%0.12632%0.318CS..THydrogen-bonded Turntrans-829.2-171.752.40000111.9L1551 N1555 L1557 K1699 I1703 V1798 V1801 I1805L1551-T1553 WeakPolarHBondContact O-CA 3.33Å; L1551-T1553 VanDerWaalsContact O-CG2 3.29Å; L1551-T1553 WeakPolarHBondContact O-CG2 3.35Å; L1551-T1553 PolarHBondContact O-N 3.2Å; L1551-T1553 VanDerWaalsContact O-N 3.09Å; T1553-N1555 PolarHBondContact O-N 3.32Å; T1553-N1555 VanDerWaalsContact O-N 3.14Å; T1553-L1557 HydrophobicContact CG2-CD1 4.1Å; T1553-K1699 HydrophobicContact CG2-CD 4.18Å; T1553-I1703 HydrophobicContact CG2-CD1 4.42Å; T1553-V1798 VanDerWaalsContact OG1-CG2 3.29Å; T1553-V1798 WeakPolarHBondContact OG1-CG2 3.37Å; T1553-V1801 HydrophobicContact CG2-CG1 4.23Å; T1553-V1801 HydrophobicContact CG2-CG2 4.39Å; T1553-V1801 VanDerWaalsContact OG1-CA 3.29Å; T1553-V1801 WeakPolarHBondContact OG1-CA 3.33Å; T1553-V1801 WeakPolarHBondContact OG1-CG2 3.28Å; T1553-I1805 HydrophobicContact CG2-CD1 4.11Å; T1553-I1805 HydrophobicContact CG2-CG2 4.19Å
1554S49Very low61.7Low60.2 Ų60.259.9 Ų59.942%0.42133%0.326SS..THydrogen-bonded Turntrans-70.2-6.9-17853.50000113.3N1552 E1556 L1557 V1558N1552-S1554 VanDerWaalsContact C-N 3.25Å; N1552-S1554 PolarHBondContact O-N 3.12Å; S1554-E1556 PolarHBondContact O-N 3.12Å; S1554-E1556 VanDerWaalsContact O-N 3.08Å; S1554-L1557 PolarHBondContact O-N 3.07Å; S1554-V1558 WeakPolarHBondContact O-CG2 3.3Å
1555N48.1Very low60.7Low99.8 Ų99.868.4 Ų68.453%0.53437%0.366SS..SBendtrans-72.571.6179.5-72.3-5.4000110.2T1553 L1557 V1558T1553-N1555 PolarHBondContact O-N 3.32Å; T1553-N1555 VanDerWaalsContact O-N 3.14Å; N1555-L1557 VanDerWaalsContact C-N 3.31Å; N1555-L1557 PolarHBondContact O-N 3.14Å; N1555-V1558 PolarHBondContact O-N 3.48Å
1556E48.6Very low59.9Low161 Ų16169.1 Ų69.175%0.75237%0.371SS*.THydrogen-bonded Turntrans-46.442.4174.5-65.8178.7166.900111.4S1554 V1558 H1694S1554-E1556 PolarHBondContact O-N 3.12Å; S1554-E1556 VanDerWaalsContact O-N 3.08Å; E1556-V1558 VanDerWaalsContact C-N 3.34Å; E1556-V1558 PolarHBondContact O-N 3.31Å; E1556-H1694 IonicContact OE2-CE1 3.1Å
1557L50.1Low59.1Low32.2 Ų32.276.9 Ų76.917%0.16940%0.403CS..  trans-69.963.3175.7-77.8167.8000108T1553 S1554 N1555 N1559 H1691 H1694 L1695 K1699 P1802T1553-L1557 HydrophobicContact CG2-CD1 4.1Å; S1554-L1557 PolarHBondContact O-N 3.07Å; N1555-L1557 VanDerWaalsContact C-N 3.31Å; N1555-L1557 PolarHBondContact O-N 3.14Å; L1557-N1559 WeakPolarHBondContact O-CA 3.22Å; L1557-N1559 PolarHBondContact O-N 3.21Å; L1557-H1691 PolarHBondContact O-CE1 2.97Å; L1557-H1694 HydrophobicContact CD2-CB 4.38Å; L1557-H1694 WeakPolarHBondContact CD2-ND1 2.96Å; L1557-L1695 HydrophobicContact CD1-CD1 4.25Å; L1557-L1695 HydrophobicContact CD2-CB 4.29Å; L1557-L1695 HydrophobicContact CD2-CD1 4.42Å; L1557-K1699 HydrophobicContact CD1-CD 4Å; L1557-K1699 HydrophobicContact CD2-CD 4.18Å; L1557-P1802 HydrophobicContact CD1-CG 3.77Å; L1557-P1802 VanDerWaalsContact CD1-CG 3.44Å
1558V48.7Very low58Low75.6 Ų75.681.4 Ų81.446%0.45843%0.427SS..SBendtrans-42.762-173.5177.20000110.4S1554 N1555 E1556 D1560 H1691S1554-V1558 WeakPolarHBondContact O-CG2 3.3Å; N1555-V1558 PolarHBondContact O-N 3.48Å; E1556-V1558 VanDerWaalsContact C-N 3.34Å; E1556-V1558 PolarHBondContact O-N 3.31Å; V1558-D1560 VanDerWaalsContact C-N 3.34Å; V1558-D1560 PolarHBondContact O-N 3.19Å; V1558-D1560 VanDerWaalsContact O-N 3.11Å; V1558-H1691 PolarHBondContact O-CE1 3.24Å; V1558-H1691 PolarHBondContact O-ND1 2.96Å
1559N48.6Very low57.4Low130.2 Ų130.282.9 Ų82.970%0.69643%0.433SS*.  trans-41.192.4-172.3-67.9-29.3000113L1557 C1561L1557-N1559 WeakPolarHBondContact O-CA 3.22Å; L1557-N1559 PolarHBondContact O-N 3.21Å; N1559-C1561 VanDerWaalsContact C-N 3.26Å; N1559-C1561 WeakPolarHBondContact O-CA 3.43Å; N1559-C1561 PolarHBondContact O-N 3.12Å
1560D50Low57Low125.4 Ų125.483.1 Ų83.167%0.67144%0.437SS*.  trans-46.490.8170.5-86-16000109.2V1558 N1562 H1691V1558-D1560 VanDerWaalsContact C-N 3.34Å; V1558-D1560 PolarHBondContact O-N 3.19Å; V1558-D1560 VanDerWaalsContact O-N 3.11Å; D1560-N1562 VanDerWaalsContact C-N 3.3Å; D1560-N1562 PolarHBondContact O-N 3.19Å; D1560-H1691 IonicContact OD1-CE1 3.21Å
1561C52.7Low57Low45.8 Ų45.884.9 Ų84.931%0.30945%0.452SS..  trans-67.991.1-173.3-800000108.6N1559N1559-C1561 VanDerWaalsContact C-N 3.26Å; N1559-C1561 WeakPolarHBondContact O-CA 3.43Å; N1559-C1561 PolarHBondContact O-N 3.12Å
1562N56.5Low57.1Low126.8 Ų126.890.4 Ų90.468%0.67848%0.482SS*.  trans-52.9143175.5-75.4-30.5000109.4D1560 F1564 W1684D1560-N1562 VanDerWaalsContact C-N 3.3Å; D1560-N1562 PolarHBondContact O-N 3.19Å; N1562-F1564 PolarHBondContact O-N 3.25Å; N1562-F1564 VanDerWaalsContact O-N 3.14Å; N1562-W1684 PolarHBondContact O-NE1 3.16Å
1563P60.8Low57.5Low92.6 Ų92.689.6 Ų89.660%0.60148%0.479SS*.  trans-55132.3177.123.8-33000109.5E1565P1563-E1565 PolarHBondContact O-N 3.12Å
1564F63.8Low58.5Low42.4 Ų42.489 Ų8919%0.18648%0.475CS..  trans-65.1106.1-177.6-176-99.3000110.3N1562 S1566 L1574 D1680 L1681 W1684N1562-F1564 PolarHBondContact O-N 3.25Å; N1562-F1564 VanDerWaalsContact O-N 3.14Å; F1564-S1566 PolarHBondContact O-N 3.2Å; F1564-S1566 VanDerWaalsContact O-N 3.12Å; F1564-L1574 HydrophobicContact CB-CD2 4.43Å; F1564-L1574 HydrophobicContact CD1-CD1 4.22Å; F1564-L1574 HydrophobicContact CD1-CD2 3.89Å; F1564-L1574 HydrophobicContact CE1-CD1 4.33Å; F1564-L1574 HydrophobicContact CE1-CD2 4.47Å; F1564-D1680 HydrophobicContact CE2-CB 4.27Å; F1564-L1681 HydrophobicContact CB-CD1 4.33Å; F1564-L1681 HydrophobicContact CD1-CD1 3.91Å; F1564-L1681 HydrophobicContact CD2-CD1 4.1Å; F1564-L1681 HydrophobicContact CE1-CB 4.21Å; F1564-L1681 HydrophobicContact CE1-CD1 3.79Å; F1564-L1681 VanDerWaalsContact CE1-CD1 3.47Å; F1564-L1681 HydrophobicContact CE1-CG 4.39Å; F1564-L1681 HydrophobicContact CE2-CB 4.13Å; F1564-L1681 HydrophobicContact CE2-CD1 4.19Å; F1564-L1681 HydrophobicContact CG-CD1 3.81Å; F1564-L1681 HydrophobicContact CZ-CB 3.82Å; F1564-L1681 HydrophobicContact CZ-CD1 4.19Å; F1564-L1681 HydrophobicContact CZ-CG 4.47Å; F1564-W1684 HydrophobicContact CB-CD2 4.02Å; F1564-W1684 HydrophobicContact CB-CE3 4.42Å; F1564-W1684 HydrophobicContact CB-CG 4.32Å; F1564-W1684 HydrophobicContact CB-CZ2 4.33Å; F1564-W1684 HydrophobicContact CD2-CB 4.09Å; F1564-W1684 HydrophobicContact CD2-CD2 4.39Å; F1564-W1684 AromaticContact CD2-CG 3.92Å; F1564-W1684 HydrophobicContact CD2-CG 4.04Å; F1564-W1684 HydrophobicContact CE2-CB 4.47Å
1565E60.8Low59.7Low179.4 Ų179.491.8 Ų91.884%0.83848%0.481SS*.  trans-81.888176.8-70.1-172.3173.700110.4P1563P1563-E1565 PolarHBondContact O-N 3.12Å
1566S60.6Low61Low22.2 Ų22.290.7 Ų90.716%0.15547%0.473CS..  trans-78.1125.5174.759.30000111.7F1564 F1569F1564-S1566 PolarHBondContact O-N 3.2Å; F1564-S1566 VanDerWaalsContact O-N 3.12Å; S1566-F1569 PolarHBondContact OG-O 3.12Å
1567K59.2Low62Low199.6 Ų199.683.5 Ų83.587%0.86844%0.439SS*.SBendtrans-76.7-22.6172.4-67.8-178.7-178.71760113.9
1568L57Low63.4Low95.6 Ų95.682.6 Ų82.650%0.50144%0.435SS..SBendtrans-103.9-34.2-176.3-64.5171000113.8A1673 L1674 Q1677L1568-A1673 HydrophobicContact CD1-CB 4.37Å; L1568-L1674 HydrophobicContact CD1-CB 4.36Å; L1568-L1674 HydrophobicContact CD1-CG 4.48Å; L1568-Q1677 VanDerWaalsContact CB-OE1 3.26Å; L1568-Q1677 VanDerWaalsContact CD1-CD 3.42Å; L1568-Q1677 HydrophobicContact CD1-CG 4.38Å; L1568-Q1677 VanDerWaalsContact CG-NE2 3.33Å
1569F63.2Low64.7Low38.4 Ų38.487.1 Ų87.117%0.16845%0.448CS..SBendtrans-92.3141-179.9-63.1-74.3000111.2S1566 S1571 L1574 L1611 L1674S1566-F1569 PolarHBondContact OG-O 3.12Å; F1569-S1571 PolarHBondContact O-N 3.25Å; F1569-L1574 HydrophobicContact CB-CD1 4.09Å; F1569-L1574 HydrophobicContact CD2-CD1 4.36Å; F1569-L1574 HydrophobicContact CG-CD1 4.33Å; F1569-L1611 HydrophobicContact CD1-CD1 4.47Å; F1569-L1611 HydrophobicContact CE1-CD1 4.03Å; F1569-L1611 HydrophobicContact CE1-CD2 4.46Å; F1569-L1611 HydrophobicContact CE1-CG 4.39Å; F1569-L1611 HydrophobicContact CE2-CD1 4.42Å; F1569-L1611 HydrophobicContact CZ-CD1 3.96Å; F1569-L1611 HydrophobicContact CZ-CD2 4.43Å; F1569-L1674 HydrophobicContact CZ-CD2 4.37Å
1570N65.3Low65.7Low101.4 Ų101.487 Ų8754%0.54244%0.441SS..  trans-67.5122.2169.2-173.1-19.3000108.7N1572 V1573 L1574N1570-N1572 PolarHBondContact O-N 3.07Å; N1570-N1572 VanDerWaalsContact O-N 3.12Å; N1570-N1572 PolarHBondContact OD1-N 3.24Å; N1570-N1572 VanDerWaalsContact OD1-N 3.11Å; N1570-V1573 HydrophobicContact CB-CB 4.46Å; N1570-V1573 HydrophobicContact CB-CG2 4.1Å; N1570-V1573 PolarHBondContact O-N 3.35Å; N1570-L1574 PolarHBondContact O-N 3.22Å; N1570-L1574 VanDerWaalsContact O-N 3.07Å
1571S69.5Low66.8Low65 Ų6581 Ų8146%0.45541%0.41SS..Hα-helixtrans-53.4-35.3-175.769.70000112.9F1569 L1574 H1575F1569-S1571 PolarHBondContact O-N 3.25Å; S1571-L1574 WeakPolarHBondContact O-CB 3.31Å; S1571-L1574 PolarHBondContact O-N 3.24Å; S1571-H1575 WeakPolarHBondContact O-CB 3.3Å; S1571-H1575 PolarHBondContact O-CD2 3.05Å; S1571-H1575 VanDerWaalsContact O-CD2 3.29Å; S1571-H1575 PolarHBondContact O-N 3.19Å; S1571-H1575 PolarHBondContact OG-CD2 3.46Å
1572N72.1Confident67.9Low120.2 Ų120.280.8 Ų80.864%0.64341%0.408SS*.Hα-helixtrans-66.5-41.8178.2-69.5-9.7000112.3N1570 H1575 E1576N1570-N1572 PolarHBondContact O-N 3.07Å; N1570-N1572 VanDerWaalsContact O-N 3.12Å; N1570-N1572 PolarHBondContact OD1-N 3.24Å; N1570-N1572 VanDerWaalsContact OD1-N 3.11Å; N1572-H1575 PolarHBondContact O-N 3.26Å; N1572-E1576 WeakPolarHBondContact O-CB 3.37Å; N1572-E1576 PolarHBondContact O-N 3.08Å
1573V70Confident68.6Low46.4 Ų46.475.9 Ų75.928%0.28138%0.382SS..Hα-helixtrans-68.3-41.4177.9179.60000109.8N1570 H1575 E1576 L1577 K1614N1570-V1573 HydrophobicContact CB-CB 4.46Å; N1570-V1573 HydrophobicContact CB-CG2 4.1Å; N1570-V1573 PolarHBondContact O-N 3.35Å; V1573-H1575 VanDerWaalsContact C-N 3.33Å; V1573-H1575 PolarHBondContact O-N 2.86Å; V1573-E1576 PolarHBondContact O-N 3Å; V1573-L1577 HydrophobicContact CG1-CD1 3.99Å; V1573-L1577 HydrophobicContact CG1-CG 4.36Å; V1573-L1577 WeakPolarHBondContact O-CB 3.4Å; V1573-L1577 VanDerWaalsContact O-CG 3.26Å; V1573-L1577 WeakPolarHBondContact O-CG 3.3Å; V1573-L1577 PolarHBondContact O-N 3.09Å; V1573-K1614 HydrophobicContact CG1-CD 4.03Å; V1573-K1614 HydrophobicContact CG1-CG 4.14Å
1574L73.6Confident68.9Low8.2 Ų8.276.3 Ų76.34%0.04338%0.379CS..Hα-helixtrans-59.7-47.5175.3-16899.8000111F1564 F1569 N1570 S1571 E1576 L1577 L1578 F1607 L1681F1564-L1574 HydrophobicContact CB-CD2 4.43Å; F1564-L1574 HydrophobicContact CD1-CD1 4.22Å; F1564-L1574 HydrophobicContact CD1-CD2 3.89Å; F1564-L1574 HydrophobicContact CE1-CD1 4.33Å; F1564-L1574 HydrophobicContact CE1-CD2 4.47Å; F1569-L1574 HydrophobicContact CB-CD1 4.09Å; F1569-L1574 HydrophobicContact CD2-CD1 4.36Å; F1569-L1574 HydrophobicContact CG-CD1 4.33Å; N1570-L1574 PolarHBondContact O-N 3.22Å; N1570-L1574 VanDerWaalsContact O-N 3.07Å; S1571-L1574 WeakPolarHBondContact O-CB 3.31Å; S1571-L1574 PolarHBondContact O-N 3.24Å; L1574-E1576 VanDerWaalsContact C-N 3.34Å; L1574-E1576 PolarHBondContact O-N 3.35Å; L1574-L1577 PolarHBondContact O-N 2.99Å; L1574-L1578 HydrophobicContact CD2-CD1 3.99Å; L1574-L1578 HydrophobicContact CD2-CG 3.94Å; L1574-L1578 HydrophobicContact CG-CD1 4.05Å; L1574-L1578 HydrophobicContact CG-CG 4.34Å; L1574-L1578 WeakPolarHBondContact O-CB 3.39Å; L1574-L1578 VanDerWaalsContact O-CG 3.24Å; L1574-L1578 WeakPolarHBondContact O-CG 3.24Å; L1574-L1578 PolarHBondContact O-N 3.17Å; L1574-F1607 HydrophobicContact CD1-CE2 3.89Å; L1574-F1607 HydrophobicContact CD1-CZ 3.94Å; L1574-L1681 HydrophobicContact CD1-CD1 3.93Å; L1574-L1681 HydrophobicContact CD1-CD2 4.01Å; L1574-L1681 HydrophobicContact CD2-CD1 4.26Å
1575H73.8Confident69.1Low120.2 Ų120.274.5 Ų74.556%0.55637%0.372SS*.Hα-helixtrans-62.3-39.6177.1-99.7-62.6000113.2S1571 N1572 V1573 L1577 L1578 K1579S1571-H1575 WeakPolarHBondContact O-CB 3.3Å; S1571-H1575 PolarHBondContact O-CD2 3.05Å; S1571-H1575 VanDerWaalsContact O-CD2 3.29Å; S1571-H1575 PolarHBondContact O-N 3.19Å; S1571-H1575 PolarHBondContact OG-CD2 3.46Å; N1572-H1575 PolarHBondContact O-N 3.26Å; V1573-H1575 VanDerWaalsContact C-N 3.33Å; V1573-H1575 PolarHBondContact O-N 2.86Å; H1575-L1577 VanDerWaalsContact C-N 3.35Å; H1575-L1578 PolarHBondContact O-N 3.04Å; H1575-K1579 WeakPolarHBondContact O-CB 3.42Å; H1575-K1579 PolarHBondContact O-N 3.15Å
1576E75.5Confident69.2Low75.8 Ų75.867.7 Ų67.735%0.35434%0.343SS..Hα-helixtrans-62.6-45.1175.1-165.5-158.9146.300111.3N1572 V1573 L1574 K1579 K1580 K1614N1572-E1576 WeakPolarHBondContact O-CB 3.37Å; N1572-E1576 PolarHBondContact O-N 3.08Å; V1573-E1576 PolarHBondContact O-N 3Å; L1574-E1576 VanDerWaalsContact C-N 3.34Å; L1574-E1576 PolarHBondContact O-N 3.35Å; E1576-K1579 PolarHBondContact O-N 3.21Å; E1576-K1580 HydrophobicContact CG-CD 4.47Å; E1576-K1580 WeakPolarHBondContact O-CB 3.4Å; E1576-K1580 WeakPolarHBondContact O-CG 3.4Å; E1576-K1580 PolarHBondContact O-N 3.07Å; E1576-K1580 WeakPolarHBondContact OE1-CE 3.34Å; E1576-K1580 IonicContact OE1-NZ 3.46Å; E1576-K1580 PolarHBondContact OE1-NZ 3.24Å; E1576-K1614 IonicContact OE1-NZ 3.12Å; E1576-K1614 PolarHBondContact OE1-NZ 2.65Å; E1576-K1614 IonicContact OE2-NZ 3.53Å; E1576-K1614 PolarHBondContact OE2-NZ 3.1Å
1577L71.4Confident69.4Low9.8 Ų9.867 Ų675%0.05134%0.337CS..Hα-helixtrans-65.5-43.1177.8-70.5172.7000111.9V1573 L1574 H1575 K1579 K1580 S1581 F1607 N1610 L1611 K1614V1573-L1577 HydrophobicContact CG1-CD1 3.99Å; V1573-L1577 HydrophobicContact CG1-CG 4.36Å; V1573-L1577 WeakPolarHBondContact O-CB 3.4Å; V1573-L1577 VanDerWaalsContact O-CG 3.26Å; V1573-L1577 WeakPolarHBondContact O-CG 3.3Å; V1573-L1577 PolarHBondContact O-N 3.09Å; L1574-L1577 PolarHBondContact O-N 2.99Å; H1575-L1577 VanDerWaalsContact C-N 3.35Å; L1577-K1579 VanDerWaalsContact C-N 3.32Å; L1577-K1579 PolarHBondContact O-N 3.35Å; L1577-K1580 CarbonylContact O-C 3.58Å; L1577-K1580 PolarHBondContact O-N 3.07Å; L1577-K1580 VanDerWaalsContact O-N 3.17Å; L1577-S1581 WeakPolarHBondContact O-CB 3.22Å; L1577-S1581 PolarHBondContact O-N 3.21Å; L1577-S1581 PolarHBondContact O-OG 3.2Å; L1577-S1581 VanDerWaalsContact O-OG 3.05Å; L1577-F1607 HydrophobicContact CB-CD2 4.14Å; L1577-F1607 HydrophobicContact CB-CE2 3.84Å; L1577-F1607 HydrophobicContact CD1-CE2 4.49Å; L1577-N1610 VanDerWaalsContact CD2-C 3.48Å; L1577-N1610 HydrophobicContact CD2-CB 3.65Å; L1577-N1610 WeakPolarHBondContact CD2-O 3.44Å; L1577-L1611 HydrophobicContact CD1-CB 4.11Å; L1577-L1611 HydrophobicContact CD1-CD1 4.49Å; L1577-L1611 HydrophobicContact CD1-CG 4.45Å; L1577-K1614 HydrophobicContact CD2-CB 4.34Å; L1577-K1614 HydrophobicContact CD2-CD 4.19Å
1578L78.8Confident69.5Low13.4 Ų13.458 Ų587%0.0730%0.299CS..Hα-helixtrans-60.8-43.7176-70.3173.2000111L1574 H1575 K1580 S1581 S1582 I1602 F1607 W1684 I1685L1574-L1578 HydrophobicContact CD2-CD1 3.99Å; L1574-L1578 HydrophobicContact CD2-CG 3.94Å; L1574-L1578 HydrophobicContact CG-CD1 4.05Å; L1574-L1578 HydrophobicContact CG-CG 4.34Å; L1574-L1578 WeakPolarHBondContact O-CB 3.39Å; L1574-L1578 VanDerWaalsContact O-CG 3.24Å; L1574-L1578 WeakPolarHBondContact O-CG 3.24Å; L1574-L1578 PolarHBondContact O-N 3.17Å; H1575-L1578 PolarHBondContact O-N 3.04Å; L1578-K1580 VanDerWaalsContact C-N 3.28Å; L1578-K1580 PolarHBondContact O-N 3.32Å; L1578-S1581 VanDerWaalsContact CA-OG 3.32Å; L1578-S1581 WeakPolarHBondContact CA-OG 3.36Å; L1578-S1581 CarbonylContact O-C 3.55Å; L1578-S1581 PolarHBondContact O-N 3.1Å; L1578-S1581 PolarHBondContact O-OG 3.26Å; L1578-S1582 PolarHBondContact O-N 3.07Å; L1578-S1582 VanDerWaalsContact O-N 3.16Å; L1578-I1602 HydrophobicContact CB-CD1 4.34Å; L1578-I1602 HydrophobicContact CD2-CD1 3.88Å; L1578-I1602 HydrophobicContact CD2-CG1 4.44Å; L1578-I1602 HydrophobicContact CD2-CG2 4.2Å; L1578-F1607 HydrophobicContact CD2-CD2 3.72Å; L1578-F1607 HydrophobicContact CD2-CE2 3.75Å; L1578-F1607 HydrophobicContact CD2-CG 4.45Å; L1578-F1607 HydrophobicContact CD2-CZ 4.44Å; L1578-F1607 HydrophobicContact CG-CD2 4.35Å; L1578-F1607 HydrophobicContact CG-CE2 4.12Å; L1578-W1684 HydrophobicContact CD1-CH2 4.45Å; L1578-W1684 HydrophobicContact CD1-CZ3 4.21Å; L1578-W1684 HydrophobicContact CD2-CZ3 4.44Å; L1578-I1685 HydrophobicContact CD2-CD1 4.06Å; L1578-I1685 HydrophobicContact CD2-CG1 4.41Å
1579K75.5Confident69.5Low170.6 Ų170.655 Ų5574%0.74229%0.286SS*.Hα-helixtrans-65.1-37.2176.2-170.7178.1-179.6-178.30112.6H1575 E1576 L1577 S1581 S1582H1575-K1579 WeakPolarHBondContact O-CB 3.42Å; H1575-K1579 PolarHBondContact O-N 3.15Å; E1576-K1579 PolarHBondContact O-N 3.21Å; L1577-K1579 VanDerWaalsContact C-N 3.32Å; L1577-K1579 PolarHBondContact O-N 3.35Å; K1579-S1581 VanDerWaalsContact C-N 3.31Å; K1579-S1581 PolarHBondContact O-N 3.24Å; K1579-S1582 PolarHBondContact O-N 3.34Å; K1579-S1582 PolarHBondContact O-OG 2.92Å; K1579-S1582 VanDerWaalsContact O-OG 3.06Å
1580K70.8Confident69.1Low126.8 Ų126.853.6 Ų53.655%0.55128%0.281SS*.Hα-helixtrans-72.1-24.1174.7-77.8176.2171.3171.60113.4E1576 L1577 L1578E1576-K1580 HydrophobicContact CG-CD 4.47Å; E1576-K1580 WeakPolarHBondContact O-CB 3.4Å; E1576-K1580 WeakPolarHBondContact O-CG 3.4Å; E1576-K1580 PolarHBondContact O-N 3.07Å; E1576-K1580 WeakPolarHBondContact OE1-CE 3.34Å; E1576-K1580 IonicContact OE1-NZ 3.46Å; E1576-K1580 PolarHBondContact OE1-NZ 3.24Å; L1577-K1580 CarbonylContact O-C 3.58Å; L1577-K1580 PolarHBondContact O-N 3.07Å; L1577-K1580 VanDerWaalsContact O-N 3.17Å; L1578-K1580 VanDerWaalsContact C-N 3.28Å; L1578-K1580 PolarHBondContact O-N 3.32Å
1581S72Confident68.5Low0.8 Ų0.854.7 Ų54.71%0.00629%0.287CS..THydrogen-bonded Turntrans-95.74179.561.20000114.4L1577 L1578 K1579 H1603L1577-S1581 WeakPolarHBondContact O-CB 3.22Å; L1577-S1581 PolarHBondContact O-N 3.21Å; L1577-S1581 PolarHBondContact O-OG 3.2Å; L1577-S1581 VanDerWaalsContact O-OG 3.05Å; L1578-S1581 VanDerWaalsContact CA-OG 3.32Å; L1578-S1581 WeakPolarHBondContact CA-OG 3.36Å; L1578-S1581 CarbonylContact O-C 3.55Å; L1578-S1581 PolarHBondContact O-N 3.1Å; L1578-S1581 PolarHBondContact O-OG 3.26Å; K1579-S1581 VanDerWaalsContact C-N 3.31Å; K1579-S1581 PolarHBondContact O-N 3.24Å; S1581-H1603 PolarHBondContact O-N 3.14Å; S1581-H1603 VanDerWaalsContact O-N 3.11Å
1582S75.1Confident67.8Low40.2 Ų40.254.2 Ų54.228%0.28128%0.283SS..EExtended strand (participates in β ladder)trans-84.7122.3-17973.30000111.1L1578 K1579 M1601L1578-S1582 PolarHBondContact O-N 3.07Å; L1578-S1582 VanDerWaalsContact O-N 3.16Å; K1579-S1582 PolarHBondContact O-N 3.34Å; K1579-S1582 PolarHBondContact O-OG 2.92Å; K1579-S1582 VanDerWaalsContact O-OG 3.06Å; S1582-M1601 CarbonylContact C-O 3.56Å; S1582-M1601 WeakPolarHBondContact CA-O 3.42Å
1583I71.1Confident67Low25.8 Ų25.854.3 Ų54.313%0.13228%0.284CS..EExtended strand (participates in β ladder)trans-110.4144.6178.2-48.4177.6000109M1291 W1304 T1600 M1601 H1603 I1606M1291-I1583 HydrophobicContact CE-CD1 3.98Å; M1291-I1583 HydrophobicContact SD-CD1 4.06Å; W1304-I1583 HydrophobicContact CD2-CD1 4.47Å; W1304-I1583 HydrophobicContact CH2-CD1 4.44Å; W1304-I1583 HydrophobicContact CZ2-CB 4.04Å; W1304-I1583 HydrophobicContact CZ2-CD1 4.1Å; W1304-I1583 HydrophobicContact CZ2-CG1 4.38Å; W1304-I1583 HydrophobicContact CZ2-CG2 4.16Å; I1583-T1600 CarbonylContact O-C 3.5Å; I1583-T1600 WeakPolarHBondContact O-CA 3.36Å; I1583-T1600 WeakPolarHBondContact O-CB 3.37Å; I1583-M1601 PolarHBondContact N-O 3.29Å; I1583-M1601 PolarHBondContact O-N 2.96Å; I1583-H1603 HydrophobicContact CD1-CB 3.61Å; I1583-H1603 HydrophobicContact CG1-CB 4.26Å; I1583-I1606 HydrophobicContact CD1-CD1 3.66Å; I1583-I1606 HydrophobicContact CG1-CD1 4.23Å
1584N68.5Low66.1Low99.6 Ų99.655.3 Ų55.353%0.53330%0.297SS..EExtended strand (participates in β ladder)trans-66137.3173.6-65.2-22.2000110.6P1586N1584-P1586 WeakPolarHBondContact O-CD 3.1Å
1585C68.1Low65.4Low4.8 Ų4.855.7 Ų55.73%0.03230%0.3CS..  trans-73.5123.8174.3-174.20000110.3L1587 L1588 S1599 M1601C1585-L1587 VanDerWaalsContact C-N 3.31Å; C1585-L1587 PolarHBondContact O-N 2.94Å; C1585-L1588 HydrophobicContact CB-CB 4.35Å; C1585-L1588 HydrophobicContact CB-CD1 3.75Å; C1585-L1588 HydrophobicContact CB-CG 4.45Å; C1585-L1588 WeakPolarHBondContact O-CB 3.46Å; C1585-L1588 PolarHBondContact O-N 3.11Å; C1585-L1588 VanDerWaalsContact O-N 3.11Å; C1585-S1599 WeakPolarHBondContact CB-O 3.42Å; C1585-S1599 PolarHBondContact N-O 2.75Å; C1585-M1601 HydrophobicContact CB-CE 4.18Å; C1585-M1601 HydrophobicContact CB-CG 4.2Å
1586P62.6Low64.8Low37.2 Ų37.254 Ų5424%0.24229%0.291CS..THydrogen-bonded Turntrans-66.5-27.2-177.319.4-25.6000113.5A1300 F1305 N1584 L1588 S1589A1300-P1586 WeakPolarHBondContact O-CB 3.45Å; F1305-P1586 HydrophobicContact CB-CG 4.3Å; F1305-P1586 HydrophobicContact CD1-CG 4.49Å; N1584-P1586 WeakPolarHBondContact O-CD 3.1Å; P1586-L1588 VanDerWaalsContact C-N 3.32Å; P1586-L1588 PolarHBondContact O-N 3.11Å; P1586-L1588 VanDerWaalsContact O-N 3.08Å; P1586-S1589 PolarHBondContact O-N 3.47Å
1587L65.3Low63.8Low6.2 Ų6.255.5 Ų55.53%0.03231%0.305CS..THydrogen-bonded Turntrans-68.5-10.9177.7-67.4171.4000113.2F1305 W1399 L1403 L1468 N1471 C1585 L1693 A1697F1305-L1587 HydrophobicContact CD1-CD1 4.12Å; F1305-L1587 HydrophobicContact CE1-CD1 3.96Å; W1399-L1587 HydrophobicContact CD2-CD2 4.36Å; W1399-L1587 HydrophobicContact CE3-CD1 4.43Å; W1399-L1587 HydrophobicContact CH2-CD1 4.01Å; W1399-L1587 HydrophobicContact CH2-CD2 4.2Å; W1399-L1587 HydrophobicContact CH2-CG 4.04Å; W1399-L1587 HydrophobicContact CZ2-CD1 4.12Å; W1399-L1587 HydrophobicContact CZ2-CD2 4.09Å; W1399-L1587 HydrophobicContact CZ2-CG 4.31Å; W1399-L1587 HydrophobicContact CZ3-CD1 4.23Å; L1403-L1587 HydrophobicContact CD2-CD2 4.42Å; L1468-L1587 HydrophobicContact CD2-CD1 3.72Å; L1468-L1587 HydrophobicContact CD2-CD2 4.13Å; L1468-L1587 VanDerWaalsContact CD2-CD2 3.48Å; L1468-L1587 HydrophobicContact CD2-CG 4.28Å; L1468-L1587 HydrophobicContact CG-CD1 4.3Å; N1471-L1587 PolarHBondContact ND2-O 3.16Å; C1585-L1587 VanDerWaalsContact C-N 3.31Å; C1585-L1587 PolarHBondContact O-N 2.94Å; L1587-L1693 HydrophobicContact CD1-CD1 4.24Å; L1587-A1697 HydrophobicContact CB-CB 4.15Å
1588L59.8Low63.2Low11.8 Ų11.858.5 Ų58.56%0.06232%0.321CS..  trans-111.662.1-172.8-106.2127.5000112.4C1585 P1586 S1590 M1601 Y1696 A1697 V1701C1585-L1588 HydrophobicContact CB-CB 4.35Å; C1585-L1588 HydrophobicContact CB-CD1 3.75Å; C1585-L1588 HydrophobicContact CB-CG 4.45Å; C1585-L1588 WeakPolarHBondContact O-CB 3.46Å; C1585-L1588 PolarHBondContact O-N 3.11Å; C1585-L1588 VanDerWaalsContact O-N 3.11Å; P1586-L1588 VanDerWaalsContact C-N 3.32Å; P1586-L1588 PolarHBondContact O-N 3.11Å; P1586-L1588 VanDerWaalsContact O-N 3.08Å; L1588-S1590 VanDerWaalsContact C-N 3.29Å; L1588-S1590 WeakPolarHBondContact CD2-OG 3.46Å; L1588-S1590 PolarHBondContact O-N 3.12Å; L1588-S1590 PolarHBondContact O-OG 2.93Å; L1588-M1601 HydrophobicContact CD1-CE 4.38Å; L1588-Y1696 WeakPolarHBondContact CD1-O 3.49Å; L1588-A1697 HydrophobicContact CD1-CB 3.69Å; L1588-A1697 VanDerWaalsContact CD1-CB 3.49Å; L1588-A1697 VanDerWaalsContact CD2-CA 3.41Å; L1588-A1697 HydrophobicContact CD2-CB 4.11Å; L1588-A1697 HydrophobicContact CG-CB 3.67Å; L1588-V1701 HydrophobicContact CD1-CG2 3.51Å; L1588-V1701 HydrophobicContact CD2-CB 4.29Å; L1588-V1701 HydrophobicContact CD2-CG1 3.89Å; L1588-V1701 HydrophobicContact CD2-CG2 3.75Å; L1588-V1701 HydrophobicContact CG-CG2 4.34Å
1589S57Low62.6Low33 Ų3358 Ų5823%0.23132%0.318CS..  trans-76.971.7168.176.20000110.5Q1406 K1410 W1475 P1586Q1406-S1589 VanDerWaalsContact NE2-CB 3.3Å; Q1406-S1589 PolarHBondContact NE2-OG 3.09Å; K1410-S1589 WeakPolarHBondContact CE-OG 3.09Å; W1475-S1589 VanDerWaalsContact CH2-OG 3.23Å; W1475-S1589 WeakPolarHBondContact CH2-OG 3.18Å; W1475-S1589 WeakPolarHBondContact CZ2-OG 3.32Å; P1586-S1589 PolarHBondContact O-N 3.47Å
1590S54.4Low62.4Low8.2 Ų8.251 Ų516%0.05729%0.29CS..  trans-98.2130.2173.194.50000109.2L1588 S1592 T1595 K1596L1588-S1590 VanDerWaalsContact C-N 3.29Å; L1588-S1590 WeakPolarHBondContact CD2-OG 3.46Å; L1588-S1590 PolarHBondContact O-N 3.12Å; L1588-S1590 PolarHBondContact O-OG 2.93Å; S1590-S1592 PolarHBondContact O-N 3.28Å; S1590-S1592 VanDerWaalsContact O-N 3.08Å; S1590-S1592 PolarHBondContact OG-N 3.16Å; S1590-S1592 PolarHBondContact OG-OG 3.05Å; S1590-T1595 VanDerWaalsContact CB-OG1 3.29Å; S1590-T1595 WeakPolarHBondContact CB-OG1 3.3Å; S1590-T1595 VanDerWaalsContact OG-CB 3.24Å; S1590-T1595 WeakPolarHBondContact OG-CB 3.44Å; S1590-T1595 PolarHBondContact OG-OG1 3.26Å; S1590-K1596 WeakPolarHBondContact O-CD 3.33Å; S1590-K1596 VanDerWaalsContact O-CE 3.29Å; S1590-K1596 WeakPolarHBondContact O-CE 3.37Å; S1590-K1596 WeakPolarHBondContact O-CG 3.48Å; S1590-K1596 PolarHBondContact O-NZ 2.82Å
1591D53.2Low62.8Low124 Ų12445.2 Ų45.266%0.66327%0.265SS*.SBendtrans-66.4-20.6-179.3-61-35000112.7N1593D1591-N1593 PolarHBondContact O-N 3.07Å; D1591-N1593 VanDerWaalsContact O-N 3.13Å
1592S55.1Low63Low55 Ų5545.4 Ų45.439%0.38527%0.266SS..  trans-71.4114176.365.60000111.5S1590 A1594 T1595 K1596S1590-S1592 PolarHBondContact O-N 3.28Å; S1590-S1592 VanDerWaalsContact O-N 3.08Å; S1590-S1592 PolarHBondContact OG-N 3.16Å; S1590-S1592 PolarHBondContact OG-OG 3.05Å; S1592-A1594 PolarHBondContact O-N 3.13Å; S1592-T1595 WeakPolarHBondContact CB-OG1 3.16Å; S1592-T1595 PolarHBondContact O-N 3.2Å; S1592-T1595 VanDerWaalsContact O-N 3.09Å; S1592-T1595 PolarHBondContact O-OG1 3.14Å; S1592-T1595 WeakPolarHBondContact OG-CG2 3.28Å; S1592-T1595 PolarHBondContact OG-N 3.04Å; S1592-T1595 PolarHBondContact OG-OG1 3.22Å; S1592-K1596 PolarHBondContact O-N 3Å
1593N54.3Low63Low121.6 Ų121.644.7 Ų44.765%0.6526%0.258SS*.Hα-helixtrans-55.2-31.1175.6-71.8-22.4000113.1D1591 T1595 K1596 V1597D1591-N1593 PolarHBondContact O-N 3.07Å; D1591-N1593 VanDerWaalsContact O-N 3.13Å; N1593-T1595 VanDerWaalsContact C-N 3.33Å; N1593-T1595 PolarHBondContact O-N 2.93Å; N1593-K1596 PolarHBondContact O-N 2.95Å; N1593-V1597 VanDerWaalsContact O-CG2 3.26Å; N1593-V1597 WeakPolarHBondContact O-CG2 3.38Å; N1593-V1597 PolarHBondContact O-N 3.27Å
1594A52Low63.1Low68.6 Ų68.644.6 Ų44.657%0.56726%0.257SS*.Hα-helixtrans-62.5-40.8177.600000112.8S1592 V1597 L1598S1592-A1594 PolarHBondContact O-N 3.13Å; A1594-V1597 PolarHBondContact O-N 3.08Å; A1594-L1598 WeakPolarHBondContact O-CB 3.39Å; A1594-L1598 WeakPolarHBondContact O-CD1 3.48Å; A1594-L1598 VanDerWaalsContact O-CG 3.3Å; A1594-L1598 WeakPolarHBondContact O-CG 3.42Å; A1594-L1598 PolarHBondContact O-N 3.15Å; A1594-L1598 VanDerWaalsContact O-N 3.08Å
1595T58.8Low62.9Low16.6 Ų16.642.3 Ų42.310%0.10224%0.242CC..Hα-helixtrans-72.6-36.8177.250.80000111.6S1590 S1592 N1593 V1597 L1598 S1599 Q1700S1590-T1595 VanDerWaalsContact CB-OG1 3.29Å; S1590-T1595 WeakPolarHBondContact CB-OG1 3.3Å; S1590-T1595 VanDerWaalsContact OG-CB 3.24Å; S1590-T1595 WeakPolarHBondContact OG-CB 3.44Å; S1590-T1595 PolarHBondContact OG-OG1 3.26Å; S1592-T1595 WeakPolarHBondContact CB-OG1 3.16Å; S1592-T1595 PolarHBondContact O-N 3.2Å; S1592-T1595 VanDerWaalsContact O-N 3.09Å; S1592-T1595 PolarHBondContact O-OG1 3.14Å; S1592-T1595 WeakPolarHBondContact OG-CG2 3.28Å; S1592-T1595 PolarHBondContact OG-N 3.04Å; S1592-T1595 PolarHBondContact OG-OG1 3.22Å; N1593-T1595 VanDerWaalsContact C-N 3.33Å; N1593-T1595 PolarHBondContact O-N 2.93Å; T1595-V1597 VanDerWaalsContact C-N 3.31Å; T1595-V1597 PolarHBondContact O-N 3.12Å; T1595-L1598 PolarHBondContact O-N 3.16Å; T1595-S1599 VanDerWaalsContact O-CB 3.23Å; T1595-S1599 WeakPolarHBondContact O-CB 3.36Å; T1595-S1599 PolarHBondContact O-N 3.18Å; T1595-S1599 PolarHBondContact O-OG 3.14Å; T1595-S1599 VanDerWaalsContact O-OG 3.08Å; T1595-Q1700 VanDerWaalsContact CG2-NE2 3.32Å
1596K60.9Low62.9Low84 Ų8443.6 Ų43.637%0.36525%0.248SC..Hα-helixtrans-56.8-45.1175.9-70.8-177.6178.3173.40112.1S1590 S1592 N1593 L1598 S1599 T1600S1590-K1596 WeakPolarHBondContact O-CD 3.33Å; S1590-K1596 VanDerWaalsContact O-CE 3.29Å; S1590-K1596 WeakPolarHBondContact O-CE 3.37Å; S1590-K1596 WeakPolarHBondContact O-CG 3.48Å; S1590-K1596 PolarHBondContact O-NZ 2.82Å; S1592-K1596 PolarHBondContact O-N 3Å; N1593-K1596 PolarHBondContact O-N 2.95Å; K1596-L1598 VanDerWaalsContact C-N 3.35Å; K1596-L1598 PolarHBondContact O-N 3.2Å; K1596-S1599 WeakPolarHBondContact CA-OG 3.3Å; K1596-S1599 PolarHBondContact O-N 3.1Å; K1596-S1599 PolarHBondContact O-OG 3.28Å; K1596-T1600 PolarHBondContact O-N 3.46Å
1597V55.8Low63.5Low107.4 Ų107.441.9 Ų41.965%0.65124%0.237SC*.Hα-helixtrans-66.5-39.2179.8175.60000112.1N1593 A1594 T1595 S1599 T1600N1593-V1597 VanDerWaalsContact O-CG2 3.26Å; N1593-V1597 WeakPolarHBondContact O-CG2 3.38Å; N1593-V1597 PolarHBondContact O-N 3.27Å; A1594-V1597 PolarHBondContact O-N 3.08Å; T1595-V1597 VanDerWaalsContact C-N 3.31Å; T1595-V1597 PolarHBondContact O-N 3.12Å; V1597-S1599 VanDerWaalsContact C-N 3.32Å; V1597-S1599 PolarHBondContact O-N 2.96Å; V1597-T1600 WeakPolarHBondContact O-CB 3.2Å; V1597-T1600 VanDerWaalsContact O-CG2 3.27Å; V1597-T1600 WeakPolarHBondContact O-CG2 3.39Å; V1597-T1600 PolarHBondContact O-N 2.76Å; V1597-T1600 PolarHBondContact O-OG1 3.16Å; V1597-T1600 VanDerWaalsContact O-OG1 3.1Å
1598L58.3Low63.6Low72.6 Ų72.642.4 Ų42.438%0.3824%0.24SC..Hα-helixtrans-76.8-25.6-179.3-69.6167.4000112.9A1594 T1595 K1596 T1600 N1692 Y1696 T1804A1594-L1598 WeakPolarHBondContact O-CB 3.39Å; A1594-L1598 WeakPolarHBondContact O-CD1 3.48Å; A1594-L1598 VanDerWaalsContact O-CG 3.3Å; A1594-L1598 WeakPolarHBondContact O-CG 3.42Å; A1594-L1598 PolarHBondContact O-N 3.15Å; A1594-L1598 VanDerWaalsContact O-N 3.08Å; T1595-L1598 PolarHBondContact O-N 3.16Å; K1596-L1598 VanDerWaalsContact C-N 3.35Å; K1596-L1598 PolarHBondContact O-N 3.2Å; L1598-T1600 VanDerWaalsContact C-N 3.28Å; L1598-T1600 PolarHBondContact O-N 3.11Å; L1598-T1600 VanDerWaalsContact O-N 3.09Å; L1598-N1692 PolarHBondContact O-ND2 3.02Å; L1598-Y1696 HydrophobicContact CB-CD1 4.14Å; L1598-Y1696 HydrophobicContact CB-CE1 3.72Å; L1598-Y1696 HydrophobicContact CB-CE2 4.35Å; L1598-Y1696 HydrophobicContact CD1-CE1 4.16Å; L1598-Y1696 HydrophobicContact CG-CE1 4.43Å; L1598-Y1696 WeakPolarHBondContact O-CD2 3.38Å; L1598-Y1696 WeakPolarHBondContact O-CE2 3.39Å; L1598-T1804 HydrophobicContact CD1-CG2 4.13Å
1599S65.1Low63.8Low2.8 Ų2.843.5 Ų43.52%0.0225%0.245CC..THydrogen-bonded Turntrans-83.113.9-177.371.90000115C1585 T1595 K1596 V1597 M1601C1585-S1599 WeakPolarHBondContact CB-O 3.42Å; C1585-S1599 PolarHBondContact N-O 2.75Å; T1595-S1599 VanDerWaalsContact O-CB 3.23Å; T1595-S1599 WeakPolarHBondContact O-CB 3.36Å; T1595-S1599 PolarHBondContact O-N 3.18Å; T1595-S1599 PolarHBondContact O-OG 3.14Å; T1595-S1599 VanDerWaalsContact O-OG 3.08Å; K1596-S1599 WeakPolarHBondContact CA-OG 3.3Å; K1596-S1599 PolarHBondContact O-N 3.1Å; K1596-S1599 PolarHBondContact O-OG 3.28Å; V1597-S1599 VanDerWaalsContact C-N 3.32Å; V1597-S1599 PolarHBondContact O-N 2.96Å; S1599-M1601 PolarHBondContact O-N 3.15Å
1600T71.9Confident64.4Low23.8 Ų23.843.8 Ų43.815%0.14624%0.244CC..EExtended strand (participates in β ladder)trans-74.2130.3-178.4570000111.8I1583 K1596 V1597 L1598 R1688 N1692I1583-T1600 CarbonylContact O-C 3.5Å; I1583-T1600 WeakPolarHBondContact O-CA 3.36Å; I1583-T1600 WeakPolarHBondContact O-CB 3.37Å; K1596-T1600 PolarHBondContact O-N 3.46Å; V1597-T1600 WeakPolarHBondContact O-CB 3.2Å; V1597-T1600 VanDerWaalsContact O-CG2 3.27Å; V1597-T1600 WeakPolarHBondContact O-CG2 3.39Å; V1597-T1600 PolarHBondContact O-N 2.76Å; V1597-T1600 PolarHBondContact O-OG1 3.16Å; V1597-T1600 VanDerWaalsContact O-OG1 3.1Å; L1598-T1600 VanDerWaalsContact C-N 3.28Å; L1598-T1600 PolarHBondContact O-N 3.11Å; L1598-T1600 VanDerWaalsContact O-N 3.09Å; T1600-R1688 PolarHBondContact O-NH1 3.19Å; T1600-R1688 VanDerWaalsContact O-NH1 3.14Å; T1600-R1688 PolarHBondContact O-NH2 3.28Å; T1600-N1692 PolarHBondContact O-ND2 2.76Å
1601M78.4Confident65.1Low5.6 Ų5.643.8 Ų43.83%0.02824%0.243CC..EExtended strand (participates in β ladder)trans-101.7139.6176.1-61.1-59172.200109.3W1304 F1305 S1582 I1583 C1585 L1588 S1599 H1603 N1689 N1692 L1693W1304-M1601 HydrophobicContact CH2-CB 3.85Å; W1304-M1601 HydrophobicContact CZ2-CB 4.35Å; F1305-M1601 HydrophobicContact CE2-CG 4.17Å; S1582-M1601 CarbonylContact C-O 3.56Å; S1582-M1601 WeakPolarHBondContact CA-O 3.42Å; I1583-M1601 PolarHBondContact N-O 3.29Å; I1583-M1601 PolarHBondContact O-N 2.96Å; C1585-M1601 HydrophobicContact CB-CE 4.18Å; C1585-M1601 HydrophobicContact CB-CG 4.2Å; L1588-M1601 HydrophobicContact CD1-CE 4.38Å; S1599-M1601 PolarHBondContact O-N 3.15Å; M1601-H1603 PolarHBondContact O-N 3.47Å; M1601-N1689 WeakPolarHBondContact CA-OD1 3.5Å; M1601-N1689 HydrophobicContact SD-CB 4Å; M1601-N1692 HydrophobicContact CE-CB 4.12Å; M1601-N1692 HydrophobicContact SD-CB 4.17Å; M1601-L1693 VanDerWaalsContact CE-CA 3.5Å; M1601-L1693 HydrophobicContact CE-CB 3.72Å; M1601-L1693 HydrophobicContact CE-CD1 4.03Å; M1601-L1693 HydrophobicContact CE-CG 4.27Å
1602I76.9Confident65.6Low4.4 Ų4.439.3 Ų39.32%0.02322%0.218CC..EExtended strand (participates in β ladder)trans-89.1118.7176.7-66.1158.9000108.3L1578 F1604 F1607 W1684 I1685 R1688 N1689L1578-I1602 HydrophobicContact CB-CD1 4.34Å; L1578-I1602 HydrophobicContact CD2-CD1 3.88Å; L1578-I1602 HydrophobicContact CD2-CG1 4.44Å; L1578-I1602 HydrophobicContact CD2-CG2 4.2Å; I1602-F1604 PolarHBondContact O-N 3.18Å; I1602-F1607 HydrophobicContact CG2-CB 4.4Å; I1602-W1684 HydrophobicContact CD1-CZ3 4.36Å; I1602-I1685 HydrophobicContact CB-CG1 4.46Å; I1602-I1685 HydrophobicContact CB-CG2 3.93Å; I1602-I1685 HydrophobicContact CD1-CG1 4.36Å; I1602-I1685 HydrophobicContact CG2-CD1 3.78Å; I1602-I1685 HydrophobicContact CG2-CG1 4.11Å; I1602-I1685 HydrophobicContact CG2-CG2 3.88Å; I1602-R1688 VanDerWaalsContact CD1-CZ 3.47Å; I1602-R1688 VanDerWaalsContact CD1-NH1 3.26Å; I1602-N1689 PolarHBondContact N-OD1 3.13Å; I1602-N1689 PolarHBondContact O-ND2 3.17Å
1603H74.6Confident65.9Low25.8 Ų25.839.6 Ų39.612%0.11921%0.214CC..  trans-83.4106.5174-170.1-34.6000109.6M1291 W1304 S1581 I1583 M1601 K1605 I1606 F1607M1291-H1603 WeakPolarHBondContact CE-NE2 3.26Å; W1304-H1603 AromaticContact CD2-CD2 3.54Å; W1304-H1603 AromaticContact CD2-NE2 3.82Å; W1304-H1603 AromaticContact CE2-CD2 3.94Å; W1304-H1603 AromaticContact CE3-CD2 3.32Å; W1304-H1603 VanDerWaalsContact CE3-CD2 3.41Å; W1304-H1603 AromaticContact CE3-NE2 3.7Å; W1304-H1603 AromaticContact CG-CD2 3.77Å; W1304-H1603 AromaticContact CG-NE2 3.94Å; W1304-H1603 HydrophobicContact CH2-CB 4.38Å; W1304-H1603 HydrophobicContact CZ3-CB 4.23Å; W1304-H1603 AromaticContact CZ3-CD2 3.82Å; S1581-H1603 PolarHBondContact O-N 3.14Å; S1581-H1603 VanDerWaalsContact O-N 3.11Å; I1583-H1603 HydrophobicContact CD1-CB 3.61Å; I1583-H1603 HydrophobicContact CG1-CB 4.26Å; M1601-H1603 PolarHBondContact O-N 3.47Å; H1603-K1605 VanDerWaalsContact C-N 3.28Å; H1603-K1605 WeakPolarHBondContact CE1-CB 3.35Å; H1603-K1605 WeakPolarHBondContact ND1-CB 3.37Å; H1603-K1605 PolarHBondContact ND1-N 2.95Å; H1603-K1605 VanDerWaalsContact ND1-N 3.15Å; H1603-K1605 PolarHBondContact O-N 3.3Å; H1603-K1605 VanDerWaalsContact O-N 3.12Å; H1603-I1606 HydrophobicContact CB-CB 4.2Å; H1603-I1606 HydrophobicContact CB-CD1 4.01Å; H1603-I1606 HydrophobicContact CB-CG1 4.03Å; H1603-I1606 WeakPolarHBondContact CD2-CD1 3.39Å; H1603-I1606 PolarHBondContact O-N 3.07Å; H1603-I1606 VanDerWaalsContact O-N 3.07Å; H1603-F1607 PolarHBondContact O-N 3.04Å
1604F73.4Confident66.5Low22.8 Ų22.837 Ų3710%0.120%0.197CC..Hα-helixtrans-54.9-40.9-175.6-174.5-104.2000113.5I1602 I1606 F1607 L1608 V1641 I1678 L1681 R1682 I1685I1602-F1604 PolarHBondContact O-N 3.18Å; F1604-I1606 PolarHBondContact O-N 3.32Å; F1604-F1607 HydrophobicContact CD2-CD1 4.44Å; F1604-F1607 HydrophobicContact CE2-CD1 4.36Å; F1604-F1607 WeakPolarHBondContact O-CB 3.28Å; F1604-F1607 PolarHBondContact O-N 3.27Å; F1604-L1608 HydrophobicContact CD1-CD1 4.5Å; F1604-L1608 HydrophobicContact CE1-CB 4.5Å; F1604-L1608 HydrophobicContact CE1-CD1 3.86Å; F1604-L1608 HydrophobicContact CZ-CD1 4.2Å; F1604-L1608 WeakPolarHBondContact O-CB 3.3Å; F1604-L1608 PolarHBondContact O-N 3.23Å; F1604-V1641 HydrophobicContact CD1-CG1 4.13Å; F1604-V1641 HydrophobicContact CD1-CG2 3.81Å; F1604-V1641 HydrophobicContact CE1-CG1 3.81Å; F1604-V1641 HydrophobicContact CE1-CG2 3.82Å; F1604-V1641 VanDerWaalsContact CE1-CG2 3.44Å; F1604-V1641 HydrophobicContact CZ-CG1 4.25Å; F1604-I1678 HydrophobicContact CZ-CG2 3.95Å; F1604-L1681 HydrophobicContact CD2-CD2 4.43Å; F1604-L1681 HydrophobicContact CE2-CD2 3.92Å; F1604-R1682 HydrophobicContact CD1-CG 4.22Å; F1604-R1682 HydrophobicContact CD2-CB 4.04Å; F1604-R1682 HydrophobicContact CD2-CG 4.06Å; F1604-R1682 HydrophobicContact CE1-CB 4.29Å; F1604-R1682 HydrophobicContact CE1-CG 4.11Å; F1604-R1682 VanDerWaalsContact CE2-CA 3.49Å; F1604-R1682 HydrophobicContact CE2-CB 3.52Å; F1604-R1682 VanDerWaalsContact CE2-CB 3.47Å; F1604-R1682 HydrophobicContact CE2-CG 3.95Å; F1604-R1682 HydrophobicContact CG-CG 4.2Å; F1604-R1682 HydrophobicContact CZ-CB 3.66Å; F1604-R1682 HydrophobicContact CZ-CG 3.98Å; F1604-I1685 HydrophobicContact CB-CG2 4.39Å; F1604-I1685 HydrophobicContact CD2-CD1 3.78Å; F1604-I1685 HydrophobicContact CE2-CD1 4.3Å
1605K65.8Low67Low51.6 Ų51.636.6 Ų36.622%0.22419%0.185CC..Hα-helixtrans-59.3-44.8175.2-166.4175.2169.9163.90113.5M1284 N1289 M1291 H1603 F1607 L1608 M1609 V1641 F1642M1284-K1605 HydrophobicContact CE-CG 4.29Å; M1284-K1605 HydrophobicContact SD-CD 3.76Å; M1284-K1605 WeakPolarHBondContact SD-CE 3.4Å; M1284-K1605 HydrophobicContact SD-CG 3.37Å; M1284-K1605 WeakPolarHBondContact SD-CG 3.48Å; N1289-K1605 PolarHBondContact O-NZ 3.48Å; M1291-K1605 HydrophobicContact CB-CD 4.05Å; M1291-K1605 HydrophobicContact CE-CD 4.25Å; M1291-K1605 HydrophobicContact CG-CD 4.13Å; H1603-K1605 VanDerWaalsContact C-N 3.28Å; H1603-K1605 WeakPolarHBondContact CE1-CB 3.35Å; H1603-K1605 WeakPolarHBondContact ND1-CB 3.37Å; H1603-K1605 PolarHBondContact ND1-N 2.95Å; H1603-K1605 VanDerWaalsContact ND1-N 3.15Å; H1603-K1605 PolarHBondContact O-N 3.3Å; H1603-K1605 VanDerWaalsContact O-N 3.12Å; K1605-F1607 VanDerWaalsContact C-N 3.32Å; K1605-L1608 PolarHBondContact O-N 3.27Å; K1605-M1609 WeakPolarHBondContact O-CB 3.44Å; K1605-M1609 PolarHBondContact O-N 3.28Å; K1605-M1609 VanDerWaalsContact O-N 3.1Å; K1605-V1641 HydrophobicContact CD-CB 4.43Å; K1605-V1641 HydrophobicContact CD-CG2 4.1Å; K1605-V1641 VanDerWaalsContact CE-CA 3.47Å; K1605-V1641 VanDerWaalsContact CE-CG1 3.41Å; K1605-V1641 WeakPolarHBondContact CE-O 3.42Å; K1605-V1641 HydrophobicContact CG-CG2 3.84Å; K1605-V1641 PolarHBondContact NZ-O 3.48Å; K1605-F1642 HydrophobicContact CB-CZ 3.9Å; K1605-F1642 HydrophobicContact CD-CD1 3.68Å; K1605-F1642 HydrophobicContact CD-CE1 4Å; K1605-F1642 VanDerWaalsContact CD-CE1 3.41Å; K1605-F1642 HydrophobicContact CD-CZ 3.68Å; K1605-F1642 HydrophobicContact CG-CD1 4.01Å; K1605-F1642 HydrophobicContact CG-CE1 3.33Å; K1605-F1642 HydrophobicContact CG-CE2 4.5Å; K1605-F1642 HydrophobicContact CG-CZ 3.97Å
1606I67.9Low66.9Low31.8 Ų31.837.8 Ų37.816%0.16319%0.19CC..Hα-helixtrans-67.5-40.2176.8-60.6-176.6000110M1291 I1583 H1603 F1604 L1608 M1609 N1610M1291-I1606 HydrophobicContact CB-CD1 4.24Å; M1291-I1606 HydrophobicContact CB-CG1 4.35Å; M1291-I1606 HydrophobicContact CG-CD1 3.94Å; M1291-I1606 HydrophobicContact CG-CG1 4.5Å; M1291-I1606 HydrophobicContact SD-CD1 4.14Å; I1583-I1606 HydrophobicContact CD1-CD1 3.66Å; I1583-I1606 HydrophobicContact CG1-CD1 4.23Å; H1603-I1606 HydrophobicContact CB-CB 4.2Å; H1603-I1606 HydrophobicContact CB-CD1 4.01Å; H1603-I1606 HydrophobicContact CB-CG1 4.03Å; H1603-I1606 WeakPolarHBondContact CD2-CD1 3.39Å; H1603-I1606 PolarHBondContact O-N 3.07Å; H1603-I1606 VanDerWaalsContact O-N 3.07Å; F1604-I1606 PolarHBondContact O-N 3.32Å; I1606-L1608 VanDerWaalsContact C-N 3.33Å; I1606-L1608 PolarHBondContact O-N 2.92Å; I1606-M1609 WeakPolarHBondContact O-CB 3.41Å; I1606-M1609 PolarHBondContact O-N 3.35Å; I1606-N1610 WeakPolarHBondContact CG2-ND2 3.22Å; I1606-N1610 WeakPolarHBondContact O-CB 3.29Å; I1606-N1610 VanDerWaalsContact O-CG 3.28Å; I1606-N1610 PolarHBondContact O-N 3.07Å; I1606-N1610 PolarHBondContact O-ND2 3.11Å
1607F75Confident66.7Low3 Ų337 Ų371%0.01320%0.196CC..Hα-helixtrans-57.8-50.4174171.7-93.5000111.5L1574 L1577 L1578 I1602 H1603 F1604 K1605 M1609 N1610 L1611 L1681 I1685L1574-F1607 HydrophobicContact CD1-CE2 3.89Å; L1574-F1607 HydrophobicContact CD1-CZ 3.94Å; L1577-F1607 HydrophobicContact CB-CD2 4.14Å; L1577-F1607 HydrophobicContact CB-CE2 3.84Å; L1577-F1607 HydrophobicContact CD1-CE2 4.49Å; L1578-F1607 HydrophobicContact CD2-CD2 3.72Å; L1578-F1607 HydrophobicContact CD2-CE2 3.75Å; L1578-F1607 HydrophobicContact CD2-CG 4.45Å; L1578-F1607 HydrophobicContact CD2-CZ 4.44Å; L1578-F1607 HydrophobicContact CG-CD2 4.35Å; L1578-F1607 HydrophobicContact CG-CE2 4.12Å; I1602-F1607 HydrophobicContact CG2-CB 4.4Å; H1603-F1607 PolarHBondContact O-N 3.04Å; F1604-F1607 HydrophobicContact CD2-CD1 4.44Å; F1604-F1607 HydrophobicContact CE2-CD1 4.36Å; F1604-F1607 WeakPolarHBondContact O-CB 3.28Å; F1604-F1607 PolarHBondContact O-N 3.27Å; K1605-F1607 VanDerWaalsContact C-N 3.32Å; F1607-M1609 VanDerWaalsContact C-N 3.32Å; F1607-M1609 PolarHBondContact O-N 3.32Å; F1607-N1610 PolarHBondContact O-N 2.96Å; F1607-N1610 VanDerWaalsContact O-N 3.16Å; F1607-L1611 HydrophobicContact CE1-CB 4.39Å; F1607-L1611 HydrophobicContact CE1-CD1 3.65Å; F1607-L1611 HydrophobicContact CZ-CB 4.4Å; F1607-L1611 HydrophobicContact CZ-CD1 3.59Å; F1607-L1611 VanDerWaalsContact O-CB 3.28Å; F1607-L1611 WeakPolarHBondContact O-CB 3.42Å; F1607-L1611 PolarHBondContact O-N 3.25Å; F1607-L1681 HydrophobicContact CD1-CD2 3.97Å; F1607-L1681 HydrophobicContact CE1-CD1 4.03Å; F1607-L1681 HydrophobicContact CE1-CD2 3.26Å; F1607-L1681 HydrophobicContact CE1-CG 4.36Å; F1607-L1681 HydrophobicContact CE2-CD2 4.3Å; F1607-L1681 HydrophobicContact CZ-CD1 3.73Å; F1607-L1681 HydrophobicContact CZ-CD2 3.59Å; F1607-L1681 HydrophobicContact CZ-CG 4.45Å; F1607-I1685 HydrophobicContact CD1-CD1 4.34Å; F1607-I1685 HydrophobicContact CG-CD1 4.36Å
1608L67.4Low66.7Low16.6 Ų16.635 Ų359%0.08718%0.183CC..Hα-helixtrans-61.7-41.3-179.3-161.6160.2000110.8F1604 K1605 I1606 L1611 F1612 L1633 T1637 F1638 V1641F1604-L1608 HydrophobicContact CD1-CD1 4.5Å; F1604-L1608 HydrophobicContact CE1-CB 4.5Å; F1604-L1608 HydrophobicContact CE1-CD1 3.86Å; F1604-L1608 HydrophobicContact CZ-CD1 4.2Å; F1604-L1608 WeakPolarHBondContact O-CB 3.3Å; F1604-L1608 PolarHBondContact O-N 3.23Å; K1605-L1608 PolarHBondContact O-N 3.27Å; I1606-L1608 VanDerWaalsContact C-N 3.33Å; I1606-L1608 PolarHBondContact O-N 2.92Å; L1608-L1611 PolarHBondContact O-N 3.12Å; L1608-F1612 VanDerWaalsContact O-CB 3.29Å; L1608-F1612 WeakPolarHBondContact O-CB 3.27Å; L1608-F1612 PolarHBondContact O-N 3.13Å; L1608-L1633 HydrophobicContact CD2-CD2 4.45Å; L1608-T1637 HydrophobicContact CD2-CG2 3.04Å; L1608-F1638 HydrophobicContact CD1-CD2 4.24Å; L1608-F1638 HydrophobicContact CD1-CE2 3.66Å; L1608-F1638 HydrophobicContact CD1-CZ 3.93Å; L1608-F1638 HydrophobicContact CD2-CD1 4.37Å; L1608-F1638 HydrophobicContact CD2-CD2 4.22Å; L1608-F1638 HydrophobicContact CD2-CE1 3.8Å; L1608-F1638 HydrophobicContact CD2-CE2 3.34Å; L1608-F1638 HydrophobicContact CD2-CG 4.4Å; L1608-F1638 HydrophobicContact CD2-CZ 3.48Å; L1608-F1638 HydrophobicContact CG-CE2 4.05Å; L1608-F1638 HydrophobicContact CG-CZ 4.2Å; L1608-V1641 HydrophobicContact CD1-CG1 3.92Å; L1608-V1641 HydrophobicContact CD1-CG2 4.5Å; L1608-V1641 HydrophobicContact CD2-CG1 4.26Å
1609M63.4Low66.3Low34.4 Ų34.437.2 Ų37.217%0.16919%0.187CC..Hα-helixtrans-62.1-47.5174.6-171.961.477.900112.3F1253 M1284 T1287 H1288 K1605 I1606 F1607 L1611 F1612 M1613 F1638 F1642F1253-M1609 HydrophobicContact CE1-CE 3.83Å; F1253-M1609 HydrophobicContact CE1-SD 3.76Å; F1253-M1609 HydrophobicContact CZ-CE 3.65Å; F1253-M1609 HydrophobicContact CZ-SD 3.85Å; M1284-M1609 HydrophobicContact CB-CE 3.97Å; M1284-M1609 HydrophobicContact CE-CB 4.19Å; M1284-M1609 HydrophobicContact CE-CE 3.31Å; M1284-M1609 HydrophobicContact CE-CG 4.43Å; M1284-M1609 HydrophobicContact CE-SD 3.84Å; M1284-M1609 HydrophobicContact SD-CE 4.44Å; T1287-M1609 WeakPolarHBondContact OG1-CE 3.39Å; H1288-M1609 HydrophobicContact CB-CE 3.83Å; H1288-M1609 HydrophobicContact CB-CG 3.67Å; H1288-M1609 HydrophobicContact CB-SD 3.36Å; H1288-M1609 WeakPolarHBondContact CB-SD 3.49Å; H1288-M1609 VanDerWaalsContact CD2-CG 3.44Å; H1288-M1609 WeakPolarHBondContact CD2-CG 3.39Å; H1288-M1609 PolarHBondContact CD2-SD 3.22Å; H1288-M1609 VanDerWaalsContact CG-SD 3.57Å; H1288-M1609 VanDerWaalsContact N-CE 3.25Å; K1605-M1609 WeakPolarHBondContact O-CB 3.44Å; K1605-M1609 PolarHBondContact O-N 3.28Å; K1605-M1609 VanDerWaalsContact O-N 3.1Å; I1606-M1609 WeakPolarHBondContact O-CB 3.41Å; I1606-M1609 PolarHBondContact O-N 3.35Å; F1607-M1609 VanDerWaalsContact C-N 3.32Å; F1607-M1609 PolarHBondContact O-N 3.32Å; M1609-L1611 VanDerWaalsContact C-N 3.33Å; M1609-L1611 PolarHBondContact O-N 3.1Å; M1609-F1612 WeakPolarHBondContact O-CB 3.2Å; M1609-F1612 PolarHBondContact O-N 3.1Å; M1609-F1612 HydrophobicContact SD-CD1 4.42Å; M1609-M1613 VanDerWaalsContact O-CG 3.26Å; M1609-M1613 WeakPolarHBondContact O-CG 3.33Å; M1609-M1613 PolarHBondContact O-N 3.16Å; M1609-F1638 HydrophobicContact CE-CD2 4.01Å; M1609-F1638 HydrophobicContact CE-CE1 4.31Å; M1609-F1638 HydrophobicContact CE-CE2 3.24Å; M1609-F1638 HydrophobicContact CE-CZ 4.12Å; M1609-F1638 VanDerWaalsContact CE-CZ 3.43Å; M1609-F1638 HydrophobicContact SD-CE2 4.46Å; M1609-F1642 HydrophobicContact CE-CZ 4.4Å
1610N69Low65.4Low38.2 Ų38.243.9 Ų43.920%0.20422%0.222CC..Hα-helixtrans-66-37.9178.8-72.4-25.5000112L1577 I1606 F1607 F1612 M1613 K1614L1577-N1610 VanDerWaalsContact CD2-C 3.48Å; L1577-N1610 HydrophobicContact CD2-CB 3.65Å; L1577-N1610 WeakPolarHBondContact CD2-O 3.44Å; I1606-N1610 WeakPolarHBondContact CG2-ND2 3.22Å; I1606-N1610 WeakPolarHBondContact O-CB 3.29Å; I1606-N1610 VanDerWaalsContact O-CG 3.28Å; I1606-N1610 PolarHBondContact O-N 3.07Å; I1606-N1610 PolarHBondContact O-ND2 3.11Å; F1607-N1610 PolarHBondContact O-N 2.96Å; F1607-N1610 VanDerWaalsContact O-N 3.16Å; N1610-F1612 VanDerWaalsContact C-N 3.32Å; N1610-M1613 PolarHBondContact O-N 3.14Å; N1610-K1614 VanDerWaalsContact O-CB 3.32Å; N1610-K1614 WeakPolarHBondContact O-CB 3.31Å; N1610-K1614 PolarHBondContact O-N 3.03Å
1611L69.9Low64.1Low10.2 Ų10.249.8 Ų49.85%0.05325%0.253CS..Hα-helixtrans-61.3-46.3174.3-178.9148.1000110.1F1569 L1577 F1607 L1608 M1609 K1614 L1615F1569-L1611 HydrophobicContact CD1-CD1 4.47Å; F1569-L1611 HydrophobicContact CE1-CD1 4.03Å; F1569-L1611 HydrophobicContact CE1-CD2 4.46Å; F1569-L1611 HydrophobicContact CE1-CG 4.39Å; F1569-L1611 HydrophobicContact CE2-CD1 4.42Å; F1569-L1611 HydrophobicContact CZ-CD1 3.96Å; F1569-L1611 HydrophobicContact CZ-CD2 4.43Å; L1577-L1611 HydrophobicContact CD1-CB 4.11Å; L1577-L1611 HydrophobicContact CD1-CD1 4.49Å; L1577-L1611 HydrophobicContact CD1-CG 4.45Å; F1607-L1611 HydrophobicContact CE1-CB 4.39Å; F1607-L1611 HydrophobicContact CE1-CD1 3.65Å; F1607-L1611 HydrophobicContact CZ-CB 4.4Å; F1607-L1611 HydrophobicContact CZ-CD1 3.59Å; F1607-L1611 VanDerWaalsContact O-CB 3.28Å; F1607-L1611 WeakPolarHBondContact O-CB 3.42Å; F1607-L1611 PolarHBondContact O-N 3.25Å; L1608-L1611 PolarHBondContact O-N 3.12Å; M1609-L1611 VanDerWaalsContact C-N 3.33Å; M1609-L1611 PolarHBondContact O-N 3.1Å; L1611-K1614 PolarHBondContact O-N 3.22Å; L1611-L1615 HydrophobicContact CD2-CD1 3.52Å; L1611-L1615 VanDerWaalsContact CD2-CD1 3.49Å; L1611-L1615 HydrophobicContact CD2-CG 4.18Å; L1611-L1615 HydrophobicContact CG-CD1 4.45Å; L1611-L1615 WeakPolarHBondContact O-CB 3.31Å; L1611-L1615 WeakPolarHBondContact O-CG 3.28Å; L1611-L1615 PolarHBondContact O-N 3.22Å
1612F63.3Low62.3Low27.8 Ų27.853.4 Ų53.412%0.12227%0.272CS..Hα-helixtrans-60.5-49176.3178.1-109.7000112.3W1281 L1608 M1609 N1610 K1614 L1615 I1616 L1630 L1633 I1634 T1637W1281-F1612 AromaticContact CE3-CZ 3.99Å; W1281-F1612 HydrophobicContact CE3-CZ 3.99Å; W1281-F1612 HydrophobicContact CZ3-CE2 4.2Å; W1281-F1612 AromaticContact CZ3-CZ 3.86Å; W1281-F1612 HydrophobicContact CZ3-CZ 3.86Å; L1608-F1612 VanDerWaalsContact O-CB 3.29Å; L1608-F1612 WeakPolarHBondContact O-CB 3.27Å; L1608-F1612 PolarHBondContact O-N 3.13Å; M1609-F1612 WeakPolarHBondContact O-CB 3.2Å; M1609-F1612 PolarHBondContact O-N 3.1Å; M1609-F1612 HydrophobicContact SD-CD1 4.42Å; N1610-F1612 VanDerWaalsContact C-N 3.32Å; F1612-K1614 VanDerWaalsContact C-N 3.26Å; F1612-K1614 PolarHBondContact O-N 3.24Å; F1612-L1615 PolarHBondContact O-N 3.15Å; F1612-L1615 VanDerWaalsContact O-N 3.13Å; F1612-I1616 HydrophobicContact CD1-CD1 3.7Å; F1612-I1616 HydrophobicContact CD2-CD1 4.14Å; F1612-I1616 HydrophobicContact CD2-CG1 4.38Å; F1612-I1616 HydrophobicContact CE1-CD1 3.16Å; F1612-I1616 HydrophobicContact CE1-CG1 4.29Å; F1612-I1616 HydrophobicContact CE2-CD1 3.85Å; F1612-I1616 VanDerWaalsContact CE2-CD1 3.47Å; F1612-I1616 HydrophobicContact CE2-CG1 4.1Å; F1612-I1616 HydrophobicContact CG-CD1 4.27Å; F1612-I1616 HydrophobicContact CZ-CD1 3.26Å; F1612-I1616 VanDerWaalsContact CZ-CD1 3.42Å; F1612-I1616 HydrophobicContact CZ-CG1 4.04Å; F1612-I1616 WeakPolarHBondContact O-CG1 3.38Å; F1612-I1616 PolarHBondContact O-N 3.1Å; F1612-L1630 HydrophobicContact CD2-CD2 4.37Å; F1612-L1630 HydrophobicContact CE2-CD2 3.78Å; F1612-L1630 HydrophobicContact CE2-CG 4.04Å; F1612-L1630 HydrophobicContact CZ-CD2 3.62Å; F1612-L1633 HydrophobicContact CD2-CB 4.39Å; F1612-L1633 HydrophobicContact CE1-CD2 4.33Å; F1612-L1633 HydrophobicContact CE2-CD2 4.06Å; F1612-L1633 HydrophobicContact CZ-CD2 3.43Å; F1612-L1633 VanDerWaalsContact CZ-CD2 3.43Å; F1612-L1633 HydrophobicContact CZ-CG 4.49Å; F1612-I1634 HydrophobicContact CD2-CD1 3.99Å; F1612-I1634 HydrophobicContact CD2-CG1 4.26Å; F1612-I1634 HydrophobicContact CE1-CG1 4.24Å; F1612-I1634 HydrophobicContact CE2-CD1 3.56Å; F1612-I1634 HydrophobicContact CE2-CG1 4.02Å; F1612-I1634 HydrophobicContact CZ-CD1 3.88Å; F1612-I1634 HydrophobicContact CZ-CG1 3.81Å; F1612-T1637 HydrophobicContact CB-CG2 4.34Å; F1612-T1637 HydrophobicContact CD2-CG2 4.44Å; F1612-T1637 HydrophobicContact CE2-CG2 4.33Å; F1612-T1637 HydrophobicContact CG-CG2 4.34Å; F1612-T1637 HydrophobicContact CZ-CG2 4.32Å
1613M62.5Low60.8Low62.2 Ų62.261.2 Ų61.231%0.30631%0.314SS..Hα-helixtrans-59.2-38.2176.5-70.5-57.1-6700112.2I901 T904 F1253 M1609 N1610 I1616 S1617I901-M1613 VanDerWaalsContact CA-CE 3.49Å; I901-M1613 HydrophobicContact CB-CE 4.18Å; I901-M1613 HydrophobicContact CG1-CE 3.79Å; I901-M1613 HydrophobicContact CG1-SD 4.37Å; T904-M1613 HydrophobicContact CG2-CB 4.07Å; T904-M1613 HydrophobicContact CG2-CE 3.74Å; T904-M1613 HydrophobicContact CG2-CG 4.11Å; T904-M1613 WeakPolarHBondContact OG1-CE 3.38Å; F1253-M1613 HydrophobicContact CD1-CE 4.32Å; F1253-M1613 HydrophobicContact CD1-SD 3.55Å; F1253-M1613 VanDerWaalsContact CD1-SD 3.55Å; F1253-M1613 HydrophobicContact CE1-SD 3.76Å; M1609-M1613 VanDerWaalsContact O-CG 3.26Å; M1609-M1613 WeakPolarHBondContact O-CG 3.33Å; M1609-M1613 PolarHBondContact O-N 3.16Å; N1610-M1613 PolarHBondContact O-N 3.14Å; M1613-I1616 PolarHBondContact O-N 3.21Å; M1613-I1616 HydrophobicContact SD-CD1 4.42Å; M1613-S1617 WeakPolarHBondContact O-CB 3.36Å; M1613-S1617 PolarHBondContact O-N 3.08Å; M1613-S1617 PolarHBondContact O-OG 3.17Å
1614K65.2Low59.6Low67.2 Ų67.264.2 Ų64.229%0.29234%0.337SS..Hα-helixtrans-68.8-43.3176.7-162.684.7179.8-169.70111.4V1573 E1576 L1577 N1610 L1611 F1612 I1616 S1617 T1618V1573-K1614 HydrophobicContact CG1-CD 4.03Å; V1573-K1614 HydrophobicContact CG1-CG 4.14Å; E1576-K1614 IonicContact OE1-NZ 3.12Å; E1576-K1614 PolarHBondContact OE1-NZ 2.65Å; E1576-K1614 IonicContact OE2-NZ 3.53Å; E1576-K1614 PolarHBondContact OE2-NZ 3.1Å; L1577-K1614 HydrophobicContact CD2-CB 4.34Å; L1577-K1614 HydrophobicContact CD2-CD 4.19Å; N1610-K1614 VanDerWaalsContact O-CB 3.32Å; N1610-K1614 WeakPolarHBondContact O-CB 3.31Å; N1610-K1614 PolarHBondContact O-N 3.03Å; L1611-K1614 PolarHBondContact O-N 3.22Å; F1612-K1614 VanDerWaalsContact C-N 3.26Å; F1612-K1614 PolarHBondContact O-N 3.24Å; K1614-I1616 VanDerWaalsContact C-N 3.31Å; K1614-I1616 PolarHBondContact O-N 3.08Å; K1614-S1617 WeakPolarHBondContact CA-OG 3.37Å; K1614-S1617 PolarHBondContact O-N 3.14Å; K1614-S1617 VanDerWaalsContact O-N 3.13Å; K1614-S1617 PolarHBondContact O-OG 3.13Å; K1614-T1618 HydrophobicContact CG-CG2 4.45Å; K1614-T1618 WeakPolarHBondContact O-CB 3.3Å; K1614-T1618 VanDerWaalsContact O-CG2 3.31Å; K1614-T1618 WeakPolarHBondContact O-CG2 3.36Å; K1614-T1618 PolarHBondContact O-N 3.08Å; K1614-T1618 PolarHBondContact O-OG1 3.21Å; K1614-T1618 VanDerWaalsContact O-OG1 3.07Å
1615L62.8Low58.5Low60.6 Ų60.667.8 Ų67.832%0.31735%0.351SS..Hα-helixtrans-60.5-40.3175.4-72.4178.4000112.1L1611 F1612 T1618 R1619 L1633L1611-L1615 HydrophobicContact CD2-CD1 3.52Å; L1611-L1615 VanDerWaalsContact CD2-CD1 3.49Å; L1611-L1615 HydrophobicContact CD2-CG 4.18Å; L1611-L1615 HydrophobicContact CG-CD1 4.45Å; L1611-L1615 WeakPolarHBondContact O-CB 3.31Å; L1611-L1615 WeakPolarHBondContact O-CG 3.28Å; L1611-L1615 PolarHBondContact O-N 3.22Å; F1612-L1615 PolarHBondContact O-N 3.15Å; F1612-L1615 VanDerWaalsContact O-N 3.13Å; L1615-T1618 WeakPolarHBondContact CA-OG1 3.34Å; L1615-T1618 PolarHBondContact O-N 3.16Å; L1615-T1618 PolarHBondContact O-OG1 3.14Å; L1615-R1619 PolarHBondContact O-N 3.06Å; L1615-L1633 HydrophobicContact CD1-CD1 4.11Å
1616I57.8Low58Low40 Ų4067.9 Ų67.921%0.20536%0.358CS..Hα-helixtrans-63.9-46.1173.1-67.9166.7000110.9Q992 W1281 F1612 M1613 K1614 T1618 R1619 L1622 L1630Q992-I1616 HydrophobicContact CG-CG2 3.95Å; W1281-I1616 HydrophobicContact CZ3-CD1 4.3Å; W1281-I1616 HydrophobicContact CZ3-CG1 4.36Å; F1612-I1616 HydrophobicContact CD1-CD1 3.7Å; F1612-I1616 HydrophobicContact CD2-CD1 4.14Å; F1612-I1616 HydrophobicContact CD2-CG1 4.38Å; F1612-I1616 HydrophobicContact CE1-CD1 3.16Å; F1612-I1616 HydrophobicContact CE1-CG1 4.29Å; F1612-I1616 HydrophobicContact CE2-CD1 3.85Å; F1612-I1616 VanDerWaalsContact CE2-CD1 3.47Å; F1612-I1616 HydrophobicContact CE2-CG1 4.1Å; F1612-I1616 HydrophobicContact CG-CD1 4.27Å; F1612-I1616 HydrophobicContact CZ-CD1 3.26Å; F1612-I1616 VanDerWaalsContact CZ-CD1 3.42Å; F1612-I1616 HydrophobicContact CZ-CG1 4.04Å; F1612-I1616 WeakPolarHBondContact O-CG1 3.38Å; F1612-I1616 PolarHBondContact O-N 3.1Å; M1613-I1616 PolarHBondContact O-N 3.21Å; M1613-I1616 HydrophobicContact SD-CD1 4.42Å; K1614-I1616 VanDerWaalsContact C-N 3.31Å; K1614-I1616 PolarHBondContact O-N 3.08Å; I1616-T1618 VanDerWaalsContact C-N 3.27Å; I1616-T1618 PolarHBondContact O-N 3.07Å; I1616-R1619 WeakPolarHBondContact O-CB 3.35Å; I1616-R1619 PolarHBondContact O-N 3.27Å; I1616-R1619 VanDerWaalsContact O-N 3.1Å; I1616-L1622 HydrophobicContact CG2-CD1 4.26Å; I1616-L1622 HydrophobicContact CG2-CD2 3.74Å; I1616-L1630 HydrophobicContact CG1-CD2 4.33Å
1617S56.1Low57.1Low69 Ų6971.1 Ų71.148%0.48338%0.375SS..Hα-helixtrans-64.9-29.9-178.4690000113.3M1613 K1614 R1619M1613-S1617 WeakPolarHBondContact O-CB 3.36Å; M1613-S1617 PolarHBondContact O-N 3.08Å; M1613-S1617 PolarHBondContact O-OG 3.17Å; K1614-S1617 WeakPolarHBondContact CA-OG 3.37Å; K1614-S1617 PolarHBondContact O-N 3.14Å; K1614-S1617 VanDerWaalsContact O-N 3.13Å; K1614-S1617 PolarHBondContact O-OG 3.13Å; S1617-R1619 VanDerWaalsContact C-N 3.29Å; S1617-R1619 PolarHBondContact O-N 3.05Å
1618T55.7Low56Low64.4 Ų64.476.7 Ų76.740%0.39540%0.402SS..G310 helixtrans-82.5-2.1177.750.90000113.6K1614 L1615 I1616 N1620 D1621K1614-T1618 HydrophobicContact CG-CG2 4.45Å; K1614-T1618 WeakPolarHBondContact O-CB 3.3Å; K1614-T1618 VanDerWaalsContact O-CG2 3.31Å; K1614-T1618 WeakPolarHBondContact O-CG2 3.36Å; K1614-T1618 PolarHBondContact O-N 3.08Å; K1614-T1618 PolarHBondContact O-OG1 3.21Å; K1614-T1618 VanDerWaalsContact O-OG1 3.07Å; L1615-T1618 WeakPolarHBondContact CA-OG1 3.34Å; L1615-T1618 PolarHBondContact O-N 3.16Å; L1615-T1618 PolarHBondContact O-OG1 3.14Å; I1616-T1618 VanDerWaalsContact C-N 3.27Å; I1616-T1618 PolarHBondContact O-N 3.07Å; T1618-N1620 PolarHBondContact O-N 3.32Å; T1618-N1620 VanDerWaalsContact O-N 3.1Å; T1618-D1621 PolarHBondContact O-N 3Å
1619R51.1Low55.2Low118.8 Ų118.877.9 Ų77.945%0.44841%0.408SS..G310 helixtrans-61.6-4.1-179.5-174.5174.2176.1-179.3-0.5113S991 L1615 I1616 S1617 D1621 L1622 N1627S991-R1619 PolarHBondContact OG-NH1 3.4Å; L1615-R1619 PolarHBondContact O-N 3.06Å; I1616-R1619 WeakPolarHBondContact O-CB 3.35Å; I1616-R1619 PolarHBondContact O-N 3.27Å; I1616-R1619 VanDerWaalsContact O-N 3.1Å; S1617-R1619 VanDerWaalsContact C-N 3.29Å; S1617-R1619 PolarHBondContact O-N 3.05Å; R1619-D1621 VanDerWaalsContact C-N 3.27Å; R1619-D1621 PolarHBondContact O-N 3.11Å; R1619-D1621 VanDerWaalsContact O-N 3.08Å; R1619-L1622 PolarHBondContact O-N 3.03Å; R1619-N1627 PolarHBondContact NH2-OD1 3.05Å
1620N45.2Very low54.6Low144.6 Ų144.678.4 Ų78.477%0.77341%0.412SS*.G310 helixtrans-65.3-13.2-179.3-72-5.3000114.7T1618T1618-N1620 PolarHBondContact O-N 3.32Å; T1618-N1620 VanDerWaalsContact O-N 3.1Å
1621D43.9Very low53.8Low147 Ų14779.4 Ų79.479%0.78642%0.417SS*.G310 helixtrans-115.611.4-179.8-69.5-28.4000114.1T1618 R1619 D1623 S1624T1618-D1621 PolarHBondContact O-N 3Å; R1619-D1621 VanDerWaalsContact C-N 3.27Å; R1619-D1621 PolarHBondContact O-N 3.11Å; R1619-D1621 VanDerWaalsContact O-N 3.08Å; D1621-D1623 PolarHBondContact O-N 3.25Å; D1621-S1624 PolarHBondContact O-OG 2.92Å
1622L40.7Very low52.9Low80.4 Ų80.483.5 Ų83.542%0.42143%0.434SS..  trans-115.156.4-174.6-75167.3000112.9I1616 R1619 S1624I1616-L1622 HydrophobicContact CG2-CD1 4.26Å; I1616-L1622 HydrophobicContact CG2-CD2 3.74Å; R1619-L1622 PolarHBondContact O-N 3.03Å; L1622-S1624 PolarHBondContact O-N 3.08Å; L1622-S1624 VanDerWaalsContact O-N 3.07Å
1623D45.5Very low52.2Low169.8 Ų169.883.5 Ų83.591%0.90844%0.435SS*.THydrogen-bonded Turntrans-707.2175.1-81.3-21.3000114.5D1621D1621-D1623 PolarHBondContact O-N 3.25Å
1624S50.4Low51.5Low87.2 Ų87.282 Ų8261%0.6143%0.428SS*.THydrogen-bonded Turntrans-99.9-4-173.262.20000116.3D1621 L1622D1621-S1624 PolarHBondContact O-OG 2.92Å; L1622-S1624 PolarHBondContact O-N 3.08Å; L1622-S1624 VanDerWaalsContact O-N 3.07Å
1625Y50.6Low50.7Low99.6 Ų99.681.6 Ų81.639%0.39143%0.431SS..SBendtrans-112.1127.9180-66.2-81.2000111.3D1629Y1625-D1629 HydrophobicContact CD1-CB 4.31Å
1626S54.4Low49.9Very low52.8 Ų52.881.6 Ų81.637%0.36943%0.431SS..  trans-71146.8176780000110.4E1628 D1629 L1630S1626-E1628 PolarHBondContact O-N 3.08Å; S1626-E1628 VanDerWaalsContact O-N 3.12Å; S1626-D1629 PolarHBondContact N-OD2 3.14Å; S1626-D1629 PolarHBondContact O-N 3.25Å; S1626-D1629 VanDerWaalsContact O-N 3.08Å; S1626-D1629 PolarHBondContact OG-N 3.17Å; S1626-D1629 VanDerWaalsContact OG-N 3.17Å; S1626-D1629 PolarHBondContact OG-OD2 3.21Å; S1626-L1630 PolarHBondContact O-N 3.35Å; S1626-L1630 VanDerWaalsContact O-N 3.08Å
1627N49.4Very low49.4Very low98.4 Ų98.480.1 Ų80.153%0.52642%0.424SS..Hα-helixtrans-54.3-29.2174.4-80.8-22.3000112W1281 R1619 N1631W1281-N1627 HydrophobicContact CZ2-CB 4.5Å; R1619-N1627 PolarHBondContact NH2-OD1 3.05Å; N1627-N1631 VanDerWaalsContact O-CB 3.3Å; N1627-N1631 WeakPolarHBondContact O-CB 3.26Å; N1627-N1631 PolarHBondContact O-N 3.23Å; N1627-N1631 PolarHBondContact O-ND2 2.99Å; N1627-N1631 PolarHBondContact O-OD1 3.15Å
1628E50.8Low48.9Very low121 Ų12179.4 Ų79.457%0.56541%0.412SS*.Hα-helixtrans-72.8-37.4179.6-151.8176.9177.900112.1S1626 N1631 K1632S1626-E1628 PolarHBondContact O-N 3.08Å; S1626-E1628 VanDerWaalsContact O-N 3.12Å; E1628-N1631 CarbonylContact O-C 3.57Å; E1628-N1631 PolarHBondContact O-N 3.32Å; E1628-K1632 HydrophobicContact CG-CD 4.46Å; E1628-K1632 WeakPolarHBondContact O-CB 3.34Å; E1628-K1632 VanDerWaalsContact O-CG 3.28Å; E1628-K1632 WeakPolarHBondContact O-CG 3.41Å; E1628-K1632 PolarHBondContact O-N 3.06Å; E1628-K1632 WeakPolarHBondContact OE1-CE 3.39Å; E1628-K1632 IonicContact OE1-NZ 3.08Å; E1628-K1632 PolarHBondContact OE1-NZ 3.25Å; E1628-K1632 IonicContact OE2-NZ 3.29Å
1629D51.9Low48.3Very low42.6 Ų42.681.4 Ų81.423%0.22842%0.421CS..Hα-helixtrans-68.5-40.9175-64-41.6000111.4Y1625 S1626 N1631 K1632 L1633 V1671Y1625-D1629 HydrophobicContact CD1-CB 4.31Å; S1626-D1629 PolarHBondContact N-OD2 3.14Å; S1626-D1629 PolarHBondContact O-N 3.25Å; S1626-D1629 VanDerWaalsContact O-N 3.08Å; S1626-D1629 PolarHBondContact OG-N 3.17Å; S1626-D1629 VanDerWaalsContact OG-N 3.17Å; S1626-D1629 PolarHBondContact OG-OD2 3.21Å; D1629-N1631 VanDerWaalsContact C-N 3.33Å; D1629-N1631 PolarHBondContact O-N 3.42Å; D1629-K1632 WeakPolarHBondContact O-CB 3.36Å; D1629-K1632 PolarHBondContact O-N 3.26Å; D1629-K1632 IonicContact OD1-NZ 3.34Å; D1629-L1633 VanDerWaalsContact O-CB 3.24Å; D1629-L1633 WeakPolarHBondContact O-CB 3.42Å; D1629-L1633 PolarHBondContact O-N 3.32Å; D1629-V1671 HydrophobicContact CB-CG2 3.99Å
1630L50.3Low47.9Very low45.4 Ų45.478.2 Ų78.224%0.23841%0.411CS..Hα-helixtrans-65.7-40.7176-147.9137.6000110.6W1281 F1612 I1616 S1626 L1633 I1634W1281-L1630 HydrophobicContact CH2-CD2 3.98Å; W1281-L1630 HydrophobicContact CZ3-CD2 4.43Å; F1612-L1630 HydrophobicContact CD2-CD2 4.37Å; F1612-L1630 HydrophobicContact CE2-CD2 3.78Å; F1612-L1630 HydrophobicContact CE2-CG 4.04Å; F1612-L1630 HydrophobicContact CZ-CD2 3.62Å; I1616-L1630 HydrophobicContact CG1-CD2 4.33Å; S1626-L1630 PolarHBondContact O-N 3.35Å; S1626-L1630 VanDerWaalsContact O-N 3.08Å; L1630-L1633 CarbonylContact O-C 3.5Å; L1630-L1633 WeakPolarHBondContact O-CB 3.23Å; L1630-L1633 PolarHBondContact O-N 3.31Å; L1630-I1634 HydrophobicContact CD2-CD1 3.86Å; L1630-I1634 HydrophobicContact CD2-CG1 4.24Å; L1630-I1634 HydrophobicContact CG-CD1 4.11Å; L1630-I1634 VanDerWaalsContact O-CB 3.24Å; L1630-I1634 WeakPolarHBondContact O-CB 3.41Å; L1630-I1634 WeakPolarHBondContact O-CD1 3.45Å; L1630-I1634 VanDerWaalsContact O-CG1 3.24Å; L1630-I1634 WeakPolarHBondContact O-CG1 3.38Å; L1630-I1634 PolarHBondContact O-N 3.16Å
1631N51.4Low47.8Very low58.6 Ų58.672.7 Ų72.731%0.31338%0.383SS..Hα-helixtrans-65.2-40.2173.4-78.2-10.1000112.9Y1273 L1274 E1280 W1281 N1627 E1628 D1629 L1633 I1634 T1635Y1273-N1631 WeakPolarHBondContact CE1-OD1 3.35Å; Y1273-N1631 WeakPolarHBondContact CE2-OD1 3.49Å; Y1273-N1631 PolarHBondContact OH-OD1 3.39Å; L1274-N1631 HydrophobicContact CD1-CB 3.56Å; E1280-N1631 VanDerWaalsContact OE2-CB 3.32Å; E1280-N1631 WeakPolarHBondContact OE2-CB 3.49Å; E1280-N1631 PolarHBondContact OE2-ND2 3.39Å; W1281-N1631 WeakPolarHBondContact CZ2-OD1 3.15Å; W1281-N1631 PolarHBondContact NE1-ND2 3.1Å; W1281-N1631 PolarHBondContact NE1-OD1 2.94Å; N1627-N1631 VanDerWaalsContact O-CB 3.3Å; N1627-N1631 WeakPolarHBondContact O-CB 3.26Å; N1627-N1631 PolarHBondContact O-N 3.23Å; N1627-N1631 PolarHBondContact O-ND2 2.99Å; N1627-N1631 PolarHBondContact O-OD1 3.15Å; E1628-N1631 CarbonylContact O-C 3.57Å; E1628-N1631 PolarHBondContact O-N 3.32Å; D1629-N1631 VanDerWaalsContact C-N 3.33Å; D1629-N1631 PolarHBondContact O-N 3.42Å; N1631-L1633 VanDerWaalsContact C-N 3.31Å; N1631-L1633 PolarHBondContact O-N 3.36Å; N1631-I1634 CarbonylContact O-C 3.46Å; N1631-I1634 WeakPolarHBondContact O-CB 3.42Å; N1631-I1634 PolarHBondContact O-N 3.18Å; N1631-I1634 WeakPolarHBondContact OD1-CD1 3.1Å; N1631-T1635 WeakPolarHBondContact O-CG2 3.34Å; N1631-T1635 PolarHBondContact O-N 2.96Å; N1631-T1635 PolarHBondContact O-OG1 3.17Å; N1631-T1635 VanDerWaalsContact O-OG1 3.12Å
1632K51.3Low47.7Very low96.8 Ų96.869.5 Ų69.542%0.42136%0.362SS..Hα-helixtrans-64.5-39.7173.7-77.4170.7-174.1164.10111.5E1628 D1629 I1634 T1635 L1636E1628-K1632 HydrophobicContact CG-CD 4.46Å; E1628-K1632 WeakPolarHBondContact O-CB 3.34Å; E1628-K1632 VanDerWaalsContact O-CG 3.28Å; E1628-K1632 WeakPolarHBondContact O-CG 3.41Å; E1628-K1632 PolarHBondContact O-N 3.06Å; E1628-K1632 WeakPolarHBondContact OE1-CE 3.39Å; E1628-K1632 IonicContact OE1-NZ 3.08Å; E1628-K1632 PolarHBondContact OE1-NZ 3.25Å; E1628-K1632 IonicContact OE2-NZ 3.29Å; D1629-K1632 WeakPolarHBondContact O-CB 3.36Å; D1629-K1632 PolarHBondContact O-N 3.26Å; D1629-K1632 IonicContact OD1-NZ 3.34Å; K1632-I1634 VanDerWaalsContact C-N 3.34Å; K1632-I1634 PolarHBondContact O-N 2.65Å; K1632-T1635 VanDerWaalsContact CA-OG1 3.25Å; K1632-T1635 WeakPolarHBondContact CA-OG1 3.36Å; K1632-T1635 PolarHBondContact O-N 3.13Å; K1632-T1635 PolarHBondContact O-OG1 3.06Å; K1632-T1635 VanDerWaalsContact O-OG1 3.11Å; K1632-L1636 HydrophobicContact CB-CD1 4.38Å; K1632-L1636 WeakPolarHBondContact O-CA 3.42Å; K1632-L1636 VanDerWaalsContact O-CB 3.27Å; K1632-L1636 WeakPolarHBondContact O-CB 3.37Å; K1632-L1636 WeakPolarHBondContact O-CD1 3.32Å; K1632-L1636 VanDerWaalsContact O-CG 3.25Å; K1632-L1636 WeakPolarHBondContact O-CG 3.27Å; K1632-L1636 PolarHBondContact O-N 3.28Å
1633L48.5Very low47.6Very low26.4 Ų26.470.1 Ų70.114%0.13837%0.365CS..Hα-helixtrans-64.1-41.1174.3-144.9166.8000110.7L1608 F1612 L1615 D1629 L1630 N1631 L1636 T1637 F1657 V1671 L1674 I1675 I1678L1608-L1633 HydrophobicContact CD2-CD2 4.45Å; F1612-L1633 HydrophobicContact CD2-CB 4.39Å; F1612-L1633 HydrophobicContact CE1-CD2 4.33Å; F1612-L1633 HydrophobicContact CE2-CD2 4.06Å; F1612-L1633 HydrophobicContact CZ-CD2 3.43Å; F1612-L1633 VanDerWaalsContact CZ-CD2 3.43Å; F1612-L1633 HydrophobicContact CZ-CG 4.49Å; L1615-L1633 HydrophobicContact CD1-CD1 4.11Å; D1629-L1633 VanDerWaalsContact O-CB 3.24Å; D1629-L1633 WeakPolarHBondContact O-CB 3.42Å; D1629-L1633 PolarHBondContact O-N 3.32Å; L1630-L1633 CarbonylContact O-C 3.5Å; L1630-L1633 WeakPolarHBondContact O-CB 3.23Å; L1630-L1633 PolarHBondContact O-N 3.31Å; N1631-L1633 VanDerWaalsContact C-N 3.31Å; N1631-L1633 PolarHBondContact O-N 3.36Å; L1633-L1636 CarbonylContact O-C 3.55Å; L1633-L1636 PolarHBondContact O-N 3.03Å; L1633-T1637 HydrophobicContact CD2-CG2 3.86Å; L1633-T1637 VanDerWaalsContact CD2-CG2 3.5Å; L1633-T1637 HydrophobicContact CG-CG2 4.32Å; L1633-T1637 WeakPolarHBondContact O-CA 3.25Å; L1633-T1637 VanDerWaalsContact O-CB 3.28Å; L1633-T1637 WeakPolarHBondContact O-CB 3.39Å; L1633-T1637 VanDerWaalsContact O-CG2 3.25Å; L1633-T1637 WeakPolarHBondContact O-CG2 3.32Å; L1633-T1637 PolarHBondContact O-N 3.22Å; L1633-T1637 PolarHBondContact O-OG1 3.15Å; L1633-F1657 HydrophobicContact CD1-CE1 3.9Å; L1633-F1657 HydrophobicContact CD1-CZ 4.29Å; L1633-F1657 HydrophobicContact CD2-CE1 3.74Å; L1633-F1657 HydrophobicContact CD2-CE2 4.05Å; L1633-F1657 HydrophobicContact CD2-CZ 3.23Å; L1633-F1657 HydrophobicContact CG-CE1 3.55Å; L1633-F1657 HydrophobicContact CG-CZ 3.49Å; L1633-F1657 VanDerWaalsContact CG-CZ 3.49Å; L1633-V1671 HydrophobicContact CB-CG1 4.17Å; L1633-V1671 HydrophobicContact CD1-CG1 4.15Å; L1633-V1671 HydrophobicContact CG-CG1 4.37Å; L1633-L1674 HydrophobicContact CD1-CB 4.1Å; L1633-L1674 HydrophobicContact CD1-CD1 3.9Å; L1633-L1674 HydrophobicContact CD1-CD2 3.71Å; L1633-L1674 VanDerWaalsContact CD1-CD2 3.41Å; L1633-L1674 HydrophobicContact CD1-CG 3.96Å; L1633-L1674 HydrophobicContact CD2-CD2 4Å; L1633-L1674 HydrophobicContact CG-CD2 4.21Å; L1633-I1675 HydrophobicContact CD2-CG1 4.3Å; L1633-I1675 HydrophobicContact CG-CD1 4.47Å; L1633-I1675 HydrophobicContact CG-CG1 3.84Å; L1633-I1678 HydrophobicContact CD2-CD1 3.92Å
1634I49.4Very low47.3Very low31.2 Ų31.265.9 Ų65.916%0.1634%0.342CS..Hα-helixtrans-62.7-51.1173.9-71.6164.1000110.8Y1273 W1281 M1284 F1612 L1630 N1631 K1632 L1636 T1637 F1638Y1273-I1634 HydrophobicContact CE1-CD1 4.42Å; W1281-I1634 HydrophobicContact CH2-CG2 4.21Å; W1281-I1634 HydrophobicContact CZ2-CG2 3.83Å; M1284-I1634 HydrophobicContact CB-CG2 4.37Å; M1284-I1634 HydrophobicContact CE-CB 4.12Å; M1284-I1634 HydrophobicContact CE-CD1 4.41Å; M1284-I1634 HydrophobicContact CE-CG1 3.98Å; M1284-I1634 HydrophobicContact CE-CG2 3.25Å; M1284-I1634 HydrophobicContact CG-CG2 3.31Å; M1284-I1634 HydrophobicContact SD-CG2 3.47Å; M1284-I1634 WeakPolarHBondContact SD-CG2 3.07Å; F1612-I1634 HydrophobicContact CD2-CD1 3.99Å; F1612-I1634 HydrophobicContact CD2-CG1 4.26Å; F1612-I1634 HydrophobicContact CE1-CG1 4.24Å; F1612-I1634 HydrophobicContact CE2-CD1 3.56Å; F1612-I1634 HydrophobicContact CE2-CG1 4.02Å; F1612-I1634 HydrophobicContact CZ-CD1 3.88Å; F1612-I1634 HydrophobicContact CZ-CG1 3.81Å; L1630-I1634 HydrophobicContact CD2-CD1 3.86Å; L1630-I1634 HydrophobicContact CD2-CG1 4.24Å; L1630-I1634 HydrophobicContact CG-CD1 4.11Å; L1630-I1634 VanDerWaalsContact O-CB 3.24Å; L1630-I1634 WeakPolarHBondContact O-CB 3.41Å; L1630-I1634 WeakPolarHBondContact O-CD1 3.45Å; L1630-I1634 VanDerWaalsContact O-CG1 3.24Å; L1630-I1634 WeakPolarHBondContact O-CG1 3.38Å; L1630-I1634 PolarHBondContact O-N 3.16Å; N1631-I1634 CarbonylContact O-C 3.46Å; N1631-I1634 WeakPolarHBondContact O-CB 3.42Å; N1631-I1634 PolarHBondContact O-N 3.18Å; N1631-I1634 WeakPolarHBondContact OD1-CD1 3.1Å; K1632-I1634 VanDerWaalsContact C-N 3.34Å; K1632-I1634 PolarHBondContact O-N 2.65Å; I1634-L1636 VanDerWaalsContact C-N 3.34Å; I1634-L1636 PolarHBondContact O-N 3.35Å; I1634-T1637 WeakPolarHBondContact CA-OG1 3.44Å; I1634-T1637 CarbonylContact O-C 3.59Å; I1634-T1637 PolarHBondContact O-N 3.17Å; I1634-T1637 VanDerWaalsContact O-N 3.16Å; I1634-T1637 PolarHBondContact O-OG1 3.19Å; I1634-F1638 HydrophobicContact CB-CD2 4.39Å; I1634-F1638 HydrophobicContact CG2-CD2 3.61Å; I1634-F1638 HydrophobicContact CG2-CE2 3.93Å; I1634-F1638 VanDerWaalsContact O-CB 3.24Å; I1634-F1638 WeakPolarHBondContact O-CB 3.35Å; I1634-F1638 VanDerWaalsContact O-CD2 3.29Å; I1634-F1638 WeakPolarHBondContact O-CD2 3.3Å; I1634-F1638 PolarHBondContact O-N 3.19Å
1635T48Very low46.8Very low59.4 Ų59.468 Ų6836%0.36435%0.347SS..Hα-helixtrans-64.1-42.318049.40000111.8L1274 T1276 N1631 K1632 T1637 F1638 D1639L1274-T1635 HydrophobicContact CD1-CG2 4.16Å; L1274-T1635 HydrophobicContact CD2-CG2 3.9Å; T1276-T1635 HydrophobicContact CG2-CG2 4.25Å; N1631-T1635 WeakPolarHBondContact O-CG2 3.34Å; N1631-T1635 PolarHBondContact O-N 2.96Å; N1631-T1635 PolarHBondContact O-OG1 3.17Å; N1631-T1635 VanDerWaalsContact O-OG1 3.12Å; K1632-T1635 VanDerWaalsContact CA-OG1 3.25Å; K1632-T1635 WeakPolarHBondContact CA-OG1 3.36Å; K1632-T1635 PolarHBondContact O-N 3.13Å; K1632-T1635 PolarHBondContact O-OG1 3.06Å; K1632-T1635 VanDerWaalsContact O-OG1 3.11Å; T1635-T1637 VanDerWaalsContact C-N 3.34Å; T1635-T1637 PolarHBondContact O-N 2.99Å; T1635-F1638 PolarHBondContact O-N 2.98Å; T1635-D1639 VanDerWaalsContact O-CB 3.27Å; T1635-D1639 WeakPolarHBondContact O-CB 3.38Å; T1635-D1639 VanDerWaalsContact O-CG 3.32Å; T1635-D1639 PolarHBondContact O-N 3.11Å
1636L46.3Very low46.2Very low59.2 Ų59.271.3 Ų71.331%0.3136%0.358SS..Hα-helixtrans-65.6-39.5176.3-71169.2000111.8K1632 L1633 I1634 Q1640 L1654 I1675K1632-L1636 HydrophobicContact CB-CD1 4.38Å; K1632-L1636 WeakPolarHBondContact O-CA 3.42Å; K1632-L1636 VanDerWaalsContact O-CB 3.27Å; K1632-L1636 WeakPolarHBondContact O-CB 3.37Å; K1632-L1636 WeakPolarHBondContact O-CD1 3.32Å; K1632-L1636 VanDerWaalsContact O-CG 3.25Å; K1632-L1636 WeakPolarHBondContact O-CG 3.27Å; K1632-L1636 PolarHBondContact O-N 3.28Å; L1633-L1636 CarbonylContact O-C 3.55Å; L1633-L1636 PolarHBondContact O-N 3.03Å; I1634-L1636 VanDerWaalsContact C-N 3.34Å; I1634-L1636 PolarHBondContact O-N 3.35Å; L1636-Q1640 VanDerWaalsContact CD2-NE2 3.31Å; L1636-Q1640 WeakPolarHBondContact O-CA 3.3Å; L1636-Q1640 VanDerWaalsContact O-CB 3.26Å; L1636-Q1640 WeakPolarHBondContact O-CB 3.34Å; L1636-Q1640 VanDerWaalsContact O-CD 3.26Å; L1636-Q1640 WeakPolarHBondContact O-CG 3.32Å; L1636-Q1640 PolarHBondContact O-N 3.18Å; L1636-Q1640 PolarHBondContact O-OE1 2.95Å; L1636-L1654 HydrophobicContact CD1-CD1 4.21Å; L1636-L1654 HydrophobicContact CD1-CD2 4.46Å; L1636-L1654 HydrophobicContact CD2-CD1 3.74Å; L1636-L1654 HydrophobicContact CD2-CD2 4.37Å; L1636-L1654 HydrophobicContact CD2-CG 4.16Å; L1636-I1675 HydrophobicContact CB-CD1 4.26Å; L1636-I1675 HydrophobicContact CD1-CD1 3.81Å
1637T46.5Very low45.4Very low9.2 Ų9.270.9 Ų70.96%0.05636%0.355CS..Hα-helixtrans-72.7-41.2176.656.90000111.8L1608 F1612 L1633 I1634 T1635 V1641 F1642 I1675 I1678L1608-T1637 HydrophobicContact CD2-CG2 3.04Å; F1612-T1637 HydrophobicContact CB-CG2 4.34Å; F1612-T1637 HydrophobicContact CD2-CG2 4.44Å; F1612-T1637 HydrophobicContact CE2-CG2 4.33Å; F1612-T1637 HydrophobicContact CG-CG2 4.34Å; F1612-T1637 HydrophobicContact CZ-CG2 4.32Å; L1633-T1637 HydrophobicContact CD2-CG2 3.86Å; L1633-T1637 VanDerWaalsContact CD2-CG2 3.5Å; L1633-T1637 HydrophobicContact CG-CG2 4.32Å; L1633-T1637 WeakPolarHBondContact O-CA 3.25Å; L1633-T1637 VanDerWaalsContact O-CB 3.28Å; L1633-T1637 WeakPolarHBondContact O-CB 3.39Å; L1633-T1637 VanDerWaalsContact O-CG2 3.25Å; L1633-T1637 WeakPolarHBondContact O-CG2 3.32Å; L1633-T1637 PolarHBondContact O-N 3.22Å; L1633-T1637 PolarHBondContact O-OG1 3.15Å; I1634-T1637 WeakPolarHBondContact CA-OG1 3.44Å; I1634-T1637 CarbonylContact O-C 3.59Å; I1634-T1637 PolarHBondContact O-N 3.17Å; I1634-T1637 VanDerWaalsContact O-N 3.16Å; I1634-T1637 PolarHBondContact O-OG1 3.19Å; T1635-T1637 VanDerWaalsContact C-N 3.34Å; T1635-T1637 PolarHBondContact O-N 2.99Å; T1637-V1641 HydrophobicContact CG2-CG2 4.39Å; T1637-V1641 WeakPolarHBondContact O-CA 3.41Å; T1637-V1641 VanDerWaalsContact O-CB 3.25Å; T1637-V1641 WeakPolarHBondContact O-CB 3.35Å; T1637-V1641 WeakPolarHBondContact O-CG2 3.39Å; T1637-V1641 PolarHBondContact O-N 3.1Å; T1637-F1642 WeakPolarHBondContact O-CD2 3.38Å; T1637-F1642 WeakPolarHBondContact O-CE2 3.5Å; T1637-I1675 HydrophobicContact CG2-CG1 4.41Å; T1637-I1675 HydrophobicContact CG2-CG2 4.48Å; T1637-I1678 HydrophobicContact CG2-CB 4.35Å; T1637-I1678 HydrophobicContact CG2-CD1 4.32Å; T1637-I1678 HydrophobicContact CG2-CG2 4.02Å
1638F44.9Very low45Very low53.8 Ų53.870.4 Ų70.424%0.23637%0.365CS..Hα-helixtrans-71.3-43-179.2-90.8-91.6000113.2M1284 L1608 M1609 I1634 T1635 Q1640 V1641 F1642M1284-F1638 HydrophobicContact CE-CD1 4.21Å; M1284-F1638 HydrophobicContact CE-CD2 3.33Å; M1284-F1638 HydrophobicContact CE-CE1 3.79Å; M1284-F1638 HydrophobicContact CE-CE2 2.93Å; M1284-F1638 HydrophobicContact CE-CG 3.96Å; M1284-F1638 HydrophobicContact CE-CZ 3.4Å; M1284-F1638 HydrophobicContact CG-CE1 4.31Å; M1284-F1638 HydrophobicContact SD-CB 3.9Å; M1284-F1638 HydrophobicContact SD-CD1 3.41Å; M1284-F1638 WeakPolarHBondContact SD-CD1 3.48Å; M1284-F1638 HydrophobicContact SD-CD2 3.24Å; M1284-F1638 WeakPolarHBondContact SD-CD2 3.39Å; M1284-F1638 HydrophobicContact SD-CE1 3.77Å; M1284-F1638 HydrophobicContact SD-CE2 3.45Å; M1284-F1638 WeakPolarHBondContact SD-CE2 3.36Å; M1284-F1638 HydrophobicContact SD-CG 3.21Å; M1284-F1638 WeakPolarHBondContact SD-CG 3.48Å; M1284-F1638 HydrophobicContact SD-CZ 4.02Å; L1608-F1638 HydrophobicContact CD1-CD2 4.24Å; L1608-F1638 HydrophobicContact CD1-CE2 3.66Å; L1608-F1638 HydrophobicContact CD1-CZ 3.93Å; L1608-F1638 HydrophobicContact CD2-CD1 4.37Å; L1608-F1638 HydrophobicContact CD2-CD2 4.22Å; L1608-F1638 HydrophobicContact CD2-CE1 3.8Å; L1608-F1638 HydrophobicContact CD2-CE2 3.34Å; L1608-F1638 HydrophobicContact CD2-CG 4.4Å; L1608-F1638 HydrophobicContact CD2-CZ 3.48Å; L1608-F1638 HydrophobicContact CG-CE2 4.05Å; L1608-F1638 HydrophobicContact CG-CZ 4.2Å; M1609-F1638 HydrophobicContact CE-CD2 4.01Å; M1609-F1638 HydrophobicContact CE-CE1 4.31Å; M1609-F1638 HydrophobicContact CE-CE2 3.24Å; M1609-F1638 HydrophobicContact CE-CZ 4.12Å; M1609-F1638 VanDerWaalsContact CE-CZ 3.43Å; M1609-F1638 HydrophobicContact SD-CE2 4.46Å; I1634-F1638 HydrophobicContact CB-CD2 4.39Å; I1634-F1638 HydrophobicContact CG2-CD2 3.61Å; I1634-F1638 HydrophobicContact CG2-CE2 3.93Å; I1634-F1638 VanDerWaalsContact O-CB 3.24Å; I1634-F1638 WeakPolarHBondContact O-CB 3.35Å; I1634-F1638 VanDerWaalsContact O-CD2 3.29Å; I1634-F1638 WeakPolarHBondContact O-CD2 3.3Å; I1634-F1638 PolarHBondContact O-N 3.19Å; T1635-F1638 PolarHBondContact O-N 2.98Å; F1638-Q1640 VanDerWaalsContact C-N 3.32Å; F1638-Q1640 PolarHBondContact O-N 3.3Å; F1638-V1641 PolarHBondContact O-N 2.9Å; F1638-F1642 VanDerWaalsContact CA-CD2 3.42Å; F1638-F1642 HydrophobicContact CB-CE2 4.39Å; F1638-F1642 AromaticContact CD1-CE2 3.77Å; F1638-F1642 HydrophobicContact CD1-CE2 4.17Å; F1638-F1642 HydrophobicContact CD1-CZ 4.24Å; F1638-F1642 HydrophobicContact CE1-CZ 4.49Å; F1638-F1642 HydrophobicContact CG-CE2 4.42Å; F1638-F1642 VanDerWaalsContact O-CB 3.29Å; F1638-F1642 WeakPolarHBondContact O-CB 3.32Å; F1638-F1642 WeakPolarHBondContact O-CD2 3.31Å; F1638-F1642 WeakPolarHBondContact O-CG 3.42Å; F1638-F1642 PolarHBondContact O-N 2.93Å
1639D44.7Very low44.3Very low106.6 Ų106.672.4 Ų72.457%0.5737%0.369SS*.Hα-helixtrans-73.7-36.3178-71.1-18.6000111.1T1635 V1641 D1643T1635-D1639 VanDerWaalsContact O-CB 3.27Å; T1635-D1639 WeakPolarHBondContact O-CB 3.38Å; T1635-D1639 VanDerWaalsContact O-CG 3.32Å; T1635-D1639 PolarHBondContact O-N 3.11Å; D1639-V1641 VanDerWaalsContact C-N 3.34Å; D1639-D1643 PolarHBondContact O-N 2.84Å
1640Q42Very low43.6Very low52.6 Ų52.673.6 Ų73.625%0.24637%0.373CS..Hα-helixtrans-83-22.9-179.5-60.9176.4-6.800113.7L1636 F1638 F1642 D1643 I1644 H1650 I1653 R1682L1636-Q1640 VanDerWaalsContact CD2-NE2 3.31Å; L1636-Q1640 WeakPolarHBondContact O-CA 3.3Å; L1636-Q1640 VanDerWaalsContact O-CB 3.26Å; L1636-Q1640 WeakPolarHBondContact O-CB 3.34Å; L1636-Q1640 VanDerWaalsContact O-CD 3.26Å; L1636-Q1640 WeakPolarHBondContact O-CG 3.32Å; L1636-Q1640 PolarHBondContact O-N 3.18Å; L1636-Q1640 PolarHBondContact O-OE1 2.95Å; F1638-Q1640 VanDerWaalsContact C-N 3.32Å; F1638-Q1640 PolarHBondContact O-N 3.3Å; Q1640-F1642 PolarHBondContact O-N 2.87Å; Q1640-D1643 CarbonylContact O-C 3.59Å; Q1640-D1643 PolarHBondContact O-N 2.87Å; Q1640-I1644 HydrophobicContact CB-CD1 4.41Å; Q1640-I1644 WeakPolarHBondContact O-CB 3.5Å; Q1640-I1644 WeakPolarHBondContact O-CD1 3.26Å; Q1640-I1644 WeakPolarHBondContact O-CG1 3.43Å; Q1640-I1644 PolarHBondContact O-N 3.43Å; Q1640-H1650 WeakPolarHBondContact O-CB 3.27Å; Q1640-H1650 PolarHBondContact O-CE1 2.88Å; Q1640-H1650 PolarHBondContact O-ND1 3.41Å; Q1640-I1653 HydrophobicContact CB-CD1 4Å; Q1640-I1653 HydrophobicContact CB-CG2 4.29Å; Q1640-I1653 HydrophobicContact CG-CD1 4.41Å; Q1640-R1682 PolarHBondContact O-NH1 3.27Å
1641V42.2Very low43.1Very low29.6 Ų29.675.8 Ų75.818%0.17938%0.384CS..Hα-helixtrans-77.2-27.9179169.30000111.7F1604 K1605 L1608 T1637 F1638 D1639 I1644 R1682F1604-V1641 HydrophobicContact CD1-CG1 4.13Å; F1604-V1641 HydrophobicContact CD1-CG2 3.81Å; F1604-V1641 HydrophobicContact CE1-CG1 3.81Å; F1604-V1641 HydrophobicContact CE1-CG2 3.82Å; F1604-V1641 VanDerWaalsContact CE1-CG2 3.44Å; F1604-V1641 HydrophobicContact CZ-CG1 4.25Å; K1605-V1641 HydrophobicContact CD-CB 4.43Å; K1605-V1641 HydrophobicContact CD-CG2 4.1Å; K1605-V1641 VanDerWaalsContact CE-CA 3.47Å; K1605-V1641 VanDerWaalsContact CE-CG1 3.41Å; K1605-V1641 WeakPolarHBondContact CE-O 3.42Å; K1605-V1641 HydrophobicContact CG-CG2 3.84Å; K1605-V1641 PolarHBondContact NZ-O 3.48Å; L1608-V1641 HydrophobicContact CD1-CG1 3.92Å; L1608-V1641 HydrophobicContact CD1-CG2 4.5Å; L1608-V1641 HydrophobicContact CD2-CG1 4.26Å; T1637-V1641 HydrophobicContact CG2-CG2 4.39Å; T1637-V1641 WeakPolarHBondContact O-CA 3.41Å; T1637-V1641 VanDerWaalsContact O-CB 3.25Å; T1637-V1641 WeakPolarHBondContact O-CB 3.35Å; T1637-V1641 WeakPolarHBondContact O-CG2 3.39Å; T1637-V1641 PolarHBondContact O-N 3.1Å; F1638-V1641 PolarHBondContact O-N 2.9Å; D1639-V1641 VanDerWaalsContact C-N 3.34Å; V1641-I1644 HydrophobicContact CB-CD1 4.45Å; V1641-I1644 HydrophobicContact CG2-CD1 4.21Å; V1641-I1644 VanDerWaalsContact O-CG1 3.29Å; V1641-I1644 WeakPolarHBondContact O-CG1 3.25Å; V1641-R1682 PolarHBondContact O-NH2 3.19Å; V1641-R1682 VanDerWaalsContact O-NH2 3.1Å
1642F42.2Very low42.6Very low78.2 Ų78.275.6 Ų75.634%0.34339%0.387SS..Hα-helixtrans-88.5-23.7-174-75.4-80.6000114.9E1280 Y1313 K1605 M1609 T1637 F1638 Q1640 I1644E1280-F1642 HydrophobicContact CB-CE2 4.4Å; E1280-F1642 HydrophobicContact CG-CD2 4.34Å; E1280-F1642 HydrophobicContact CG-CE2 4.1Å; Y1313-F1642 HydrophobicContact CE1-CD1 4.19Å; Y1313-F1642 PolarHBondContact OH-O 3.12Å; Y1313-F1642 VanDerWaalsContact OH-O 3.09Å; K1605-F1642 HydrophobicContact CB-CZ 3.9Å; K1605-F1642 HydrophobicContact CD-CD1 3.68Å; K1605-F1642 HydrophobicContact CD-CE1 4Å; K1605-F1642 VanDerWaalsContact CD-CE1 3.41Å; K1605-F1642 HydrophobicContact CD-CZ 3.68Å; K1605-F1642 HydrophobicContact CG-CD1 4.01Å; K1605-F1642 HydrophobicContact CG-CE1 3.33Å; K1605-F1642 HydrophobicContact CG-CE2 4.5Å; K1605-F1642 HydrophobicContact CG-CZ 3.97Å; M1609-F1642 HydrophobicContact CE-CZ 4.4Å; T1637-F1642 WeakPolarHBondContact O-CD2 3.38Å; T1637-F1642 WeakPolarHBondContact O-CE2 3.5Å; F1638-F1642 VanDerWaalsContact CA-CD2 3.42Å; F1638-F1642 HydrophobicContact CB-CE2 4.39Å; F1638-F1642 AromaticContact CD1-CE2 3.77Å; F1638-F1642 HydrophobicContact CD1-CE2 4.17Å; F1638-F1642 HydrophobicContact CD1-CZ 4.24Å; F1638-F1642 HydrophobicContact CE1-CZ 4.49Å; F1638-F1642 HydrophobicContact CG-CE2 4.42Å; F1638-F1642 VanDerWaalsContact O-CB 3.29Å; F1638-F1642 WeakPolarHBondContact O-CB 3.32Å; F1638-F1642 WeakPolarHBondContact O-CD2 3.31Å; F1638-F1642 WeakPolarHBondContact O-CG 3.42Å; F1638-F1642 PolarHBondContact O-N 2.93Å; Q1640-F1642 PolarHBondContact O-N 2.87Å; F1642-I1644 PolarHBondContact O-N 3.17Å
1643D38.3Very low42Very low93.2 Ų93.273.4 Ų73.450%0.49838%0.38SS..  trans-95.662.9177.4-91.4-14.6000112.9D1639 Q1640 N1645 R1646 S1647 H1650D1639-D1643 PolarHBondContact O-N 2.84Å; Q1640-D1643 CarbonylContact O-C 3.59Å; Q1640-D1643 PolarHBondContact O-N 2.87Å; D1643-N1645 PolarHBondContact O-N 3.09Å; D1643-N1645 VanDerWaalsContact O-N 3.12Å; D1643-R1646 HydrophobicContact CB-CB 3.68Å; D1643-R1646 CarbonylContact O-C 3.53Å; D1643-R1646 PolarHBondContact O-N 3.05Å; D1643-R1646 WeakPolarHBondContact OD2-CD 3.35Å; D1643-S1647 PolarHBondContact O-N 3.16Å; D1643-H1650 WeakPolarHBondContact CB-NE2 3.31Å
1644I39.4Very low41.4Very low82.4 Ų82.475 Ų7542%0.42339%0.388SS..G310 helixtrans-60.2-25.8-176.1-72.2167.7000112.8N1311 Q1640 V1641 F1642 R1646 S1647N1311-I1644 HydrophobicContact CB-CD1 4.22Å; N1311-I1644 VanDerWaalsContact ND2-CB 3.3Å; N1311-I1644 WeakPolarHBondContact ND2-CB 3.48Å; N1311-I1644 WeakPolarHBondContact ND2-CG2 3.11Å; N1311-I1644 WeakPolarHBondContact OD1-CB 3.4Å; N1311-I1644 WeakPolarHBondContact OD1-CD1 3.19Å; Q1640-I1644 HydrophobicContact CB-CD1 4.41Å; Q1640-I1644 WeakPolarHBondContact O-CB 3.5Å; Q1640-I1644 WeakPolarHBondContact O-CD1 3.26Å; Q1640-I1644 WeakPolarHBondContact O-CG1 3.43Å; Q1640-I1644 PolarHBondContact O-N 3.43Å; V1641-I1644 HydrophobicContact CB-CD1 4.45Å; V1641-I1644 HydrophobicContact CG2-CD1 4.21Å; V1641-I1644 VanDerWaalsContact O-CG1 3.29Å; V1641-I1644 WeakPolarHBondContact O-CG1 3.25Å; F1642-I1644 PolarHBondContact O-N 3.17Å; I1644-R1646 VanDerWaalsContact C-N 3.32Å; I1644-R1646 PolarHBondContact O-N 3.24Å; I1644-R1646 VanDerWaalsContact O-N 3.16Å; I1644-S1647 VanDerWaalsContact CA-OG 3.29Å; I1644-S1647 WeakPolarHBondContact CA-OG 3.41Å; I1644-S1647 WeakPolarHBondContact CG1-OG 3.29Å; I1644-S1647 WeakPolarHBondContact CG2-OG 3.35Å; I1644-S1647 PolarHBondContact O-N 3.15Å; I1644-S1647 PolarHBondContact O-OG 3.07Å; I1644-S1647 VanDerWaalsContact O-OG 3.08Å
1645N40.3Very low40.9Very low132 Ų13280.4 Ų80.471%0.70641%0.413SS*.G310 helixtrans-82.8-7.6179.9-73.8-15.2000114.4N1311 D1643 R1682N1311-N1645 VanDerWaalsContact ND2-CB 3.26Å; N1311-N1645 WeakPolarHBondContact ND2-CB 3.3Å; N1311-N1645 PolarHBondContact ND2-ND2 3.31Å; N1311-N1645 PolarHBondContact ND2-OD1 3.42Å; N1311-N1645 PolarHBondContact OD1-ND2 2.87Å; D1643-N1645 PolarHBondContact O-N 3.09Å; D1643-N1645 VanDerWaalsContact O-N 3.12Å; N1645-R1682 PolarHBondContact ND2-NH2 3.38Å; N1645-R1682 PolarHBondContact OD1-NH1 3.34Å; N1645-R1682 PolarHBondContact OD1-NH2 2.9Å
1646R37.3Very low40.5Very low168.2 Ų168.282.1 Ų82.164%0.63542%0.423SS*.G310 helixtrans-112.910.1178.1-136.5176-173.4163.92.5114.2D1643 I1644 A1648 Y1649 H1650D1643-R1646 HydrophobicContact CB-CB 3.68Å; D1643-R1646 CarbonylContact O-C 3.53Å; D1643-R1646 PolarHBondContact O-N 3.05Å; D1643-R1646 WeakPolarHBondContact OD2-CD 3.35Å; I1644-R1646 VanDerWaalsContact C-N 3.32Å; I1644-R1646 PolarHBondContact O-N 3.24Å; I1644-R1646 VanDerWaalsContact O-N 3.16Å; R1646-A1648 VanDerWaalsContact C-N 3.29Å; R1646-A1648 PolarHBondContact O-N 3.23Å; R1646-A1648 VanDerWaalsContact O-N 3.1Å; R1646-Y1649 CarbonylContact O-C 3.57Å; R1646-Y1649 PolarHBondContact O-N 3.24Å; R1646-H1650 PolarHBondContact O-N 3.24Å
1647S38.9Very low39.8Very low43.8 Ų43.885.8 Ų85.831%0.30644%0.437SS..Hα-helixtrans-67.2-11.6-176.364.20000115D1643 I1644 Y1649 H1650 L1651 R1682D1643-S1647 PolarHBondContact O-N 3.16Å; I1644-S1647 VanDerWaalsContact CA-OG 3.29Å; I1644-S1647 WeakPolarHBondContact CA-OG 3.41Å; I1644-S1647 WeakPolarHBondContact CG1-OG 3.29Å; I1644-S1647 WeakPolarHBondContact CG2-OG 3.35Å; I1644-S1647 PolarHBondContact O-N 3.15Å; I1644-S1647 PolarHBondContact O-OG 3.07Å; I1644-S1647 VanDerWaalsContact O-OG 3.08Å; S1647-Y1649 VanDerWaalsContact C-N 3.34Å; S1647-Y1649 PolarHBondContact O-N 3.28Å; S1647-H1650 PolarHBondContact O-N 3.34Å; S1647-L1651 WeakPolarHBondContact O-CB 3.32Å; S1647-L1651 WeakPolarHBondContact O-CD1 3.33Å; S1647-L1651 PolarHBondContact O-N 3.18Å; S1647-R1682 PolarHBondContact O-NH1 2.9Å; S1647-R1682 PolarHBondContact OG-NH2 3.08Å
1648A39.9Very low39.4Very low89.2 Ų89.290.8 Ų90.874%0.73746%0.463SS*.Hα-helixtrans-70.7-34167.600000112.3R1646R1646-A1648 VanDerWaalsContact C-N 3.29Å; R1646-A1648 PolarHBondContact O-N 3.23Å; R1646-A1648 VanDerWaalsContact O-N 3.1Å
1649Y37.6Very low38.8Very low163 Ų16393.6 Ų93.664%0.63949%0.485SS*.Hα-helixtrans-82.8-27.1-178.9-159.6-93.4000113R1646 S1647 S1652 I1653R1646-Y1649 CarbonylContact O-C 3.57Å; R1646-Y1649 PolarHBondContact O-N 3.24Å; S1647-Y1649 VanDerWaalsContact C-N 3.34Å; S1647-Y1649 PolarHBondContact O-N 3.28Å; Y1649-S1652 WeakPolarHBondContact O-CB 3.4Å; Y1649-S1652 PolarHBondContact O-N 2.9Å; Y1649-S1652 PolarHBondContact O-OG 2.97Å; Y1649-I1653 HydrophobicContact CD1-CD1 4.36Å; Y1649-I1653 HydrophobicContact CE1-CD1 4.35Å; Y1649-I1653 PolarHBondContact O-N 3.34Å
1650H36.2Very low38.5Very low67.4 Ų67.492 Ų9231%0.31248%0.482SS..Hα-helixtrans-85.3-21.7-178.3-108.5-78.9000114.1Y1277 Q1640 D1643 R1646 S1647 S1652 I1653 L1654Y1277-H1650 PolarHBondContact OH-NE2 2.95Å; Q1640-H1650 WeakPolarHBondContact O-CB 3.27Å; Q1640-H1650 PolarHBondContact O-CE1 2.88Å; Q1640-H1650 PolarHBondContact O-ND1 3.41Å; D1643-H1650 WeakPolarHBondContact CB-NE2 3.31Å; R1646-H1650 PolarHBondContact O-N 3.24Å; S1647-H1650 PolarHBondContact O-N 3.34Å; H1650-S1652 VanDerWaalsContact C-N 3.27Å; H1650-S1652 PolarHBondContact O-N 2.98Å; H1650-I1653 WeakPolarHBondContact O-CB 3.34Å; H1650-I1653 PolarHBondContact O-N 3.09Å; H1650-I1653 VanDerWaalsContact O-N 3.1Å; H1650-L1654 PolarHBondContact O-N 3.22Å; H1650-L1654 VanDerWaalsContact O-N 3.1Å
1651L39.1Very low38.2Very low91 Ų9199.4 Ų99.448%0.47651%0.509SS..Hα-helixtrans-65.2-31.9170.3-100.2145.2000112.1S1647 I1653 L1654 E1655 I1675S1647-L1651 WeakPolarHBondContact O-CB 3.32Å; S1647-L1651 WeakPolarHBondContact O-CD1 3.33Å; S1647-L1651 PolarHBondContact O-N 3.18Å; L1651-I1653 VanDerWaalsContact C-N 3.31Å; L1651-I1653 PolarHBondContact O-N 3.04Å; L1651-L1654 HydrophobicContact CD2-CD1 4.3Å; L1651-L1654 WeakPolarHBondContact O-CB 3.39Å; L1651-L1654 PolarHBondContact O-N 3.16Å; L1651-E1655 PolarHBondContact O-N 3.22Å; L1651-I1675 HydrophobicContact CB-CG2 4.1Å; L1651-I1675 HydrophobicContact CD1-CG2 3.87Å; L1651-I1675 HydrophobicContact CD2-CB 4.06Å; L1651-I1675 HydrophobicContact CD2-CD1 4.39Å; L1651-I1675 HydrophobicContact CD2-CG1 3.89Å; L1651-I1675 HydrophobicContact CD2-CG2 3.41Å; L1651-I1675 VanDerWaalsContact CD2-CG2 3.41Å; L1651-I1675 HydrophobicContact CG-CG2 3.97Å; L1651-I1675 WeakPolarHBondContact O-CD1 3.49Å
1652S41.5Very low37.8Very low54 Ų54104.2 Ų104.238%0.37853%0.533SS..Hα-helixtrans-68-27.7171.964.40000112.6Y1649 H1650 L1654 E1655 V1656Y1649-S1652 WeakPolarHBondContact O-CB 3.4Å; Y1649-S1652 PolarHBondContact O-N 2.9Å; Y1649-S1652 PolarHBondContact O-OG 2.97Å; H1650-S1652 VanDerWaalsContact C-N 3.27Å; H1650-S1652 PolarHBondContact O-N 2.98Å; S1652-L1654 VanDerWaalsContact C-N 3.31Å; S1652-L1654 PolarHBondContact O-N 3.26Å; S1652-E1655 WeakPolarHBondContact O-CB 3.49Å; S1652-E1655 PolarHBondContact O-N 3.27Å; S1652-V1656 WeakPolarHBondContact O-CG2 3.43Å; S1652-V1656 PolarHBondContact O-N 3.32Å; S1652-V1656 VanDerWaalsContact O-N 3.14Å
1653I37.9Very low37.3Very low50.4 Ų50.4106.3 Ų106.326%0.25856%0.557SS.*Hα-helixtrans-69.6-28.9175.3-65.5173.3000111.2Q1640 Y1649 H1650 L1651 E1655 V1656 F1657Q1640-I1653 HydrophobicContact CB-CD1 4Å; Q1640-I1653 HydrophobicContact CB-CG2 4.29Å; Q1640-I1653 HydrophobicContact CG-CD1 4.41Å; Y1649-I1653 HydrophobicContact CD1-CD1 4.36Å; Y1649-I1653 HydrophobicContact CE1-CD1 4.35Å; Y1649-I1653 PolarHBondContact O-N 3.34Å; H1650-I1653 WeakPolarHBondContact O-CB 3.34Å; H1650-I1653 PolarHBondContact O-N 3.09Å; H1650-I1653 VanDerWaalsContact O-N 3.1Å; L1651-I1653 VanDerWaalsContact C-N 3.31Å; L1651-I1653 PolarHBondContact O-N 3.04Å; I1653-E1655 VanDerWaalsContact C-N 3.32Å; I1653-E1655 PolarHBondContact O-N 2.97Å; I1653-E1655 VanDerWaalsContact O-N 3.15Å; I1653-V1656 HydrophobicContact CG2-CG2 4.36Å; I1653-V1656 VanDerWaalsContact O-CB 3.28Å; I1653-V1656 WeakPolarHBondContact O-CB 3.48Å; I1653-V1656 PolarHBondContact O-N 3.23Å; I1653-F1657 HydrophobicContact CG2-CD2 3.78Å; I1653-F1657 HydrophobicContact CG2-CE2 4.08Å; I1653-F1657 WeakPolarHBondContact O-CD2 3.18Å; I1653-F1657 PolarHBondContact O-N 3.3Å
1654L36.8Very low37.2Very low59.6 Ų59.6106.5 Ų106.531%0.31257%0.566SS.*Hα-helixtrans-66-33171.8-85.7167.7000112.8L1636 H1650 L1651 S1652 V1656 F1657 N1658 I1675L1636-L1654 HydrophobicContact CD1-CD1 4.21Å; L1636-L1654 HydrophobicContact CD1-CD2 4.46Å; L1636-L1654 HydrophobicContact CD2-CD1 3.74Å; L1636-L1654 HydrophobicContact CD2-CD2 4.37Å; L1636-L1654 HydrophobicContact CD2-CG 4.16Å; H1650-L1654 PolarHBondContact O-N 3.22Å; H1650-L1654 VanDerWaalsContact O-N 3.1Å; L1651-L1654 HydrophobicContact CD2-CD1 4.3Å; L1651-L1654 WeakPolarHBondContact O-CB 3.39Å; L1651-L1654 PolarHBondContact O-N 3.16Å; S1652-L1654 VanDerWaalsContact C-N 3.31Å; S1652-L1654 PolarHBondContact O-N 3.26Å; L1654-V1656 VanDerWaalsContact C-N 3.3Å; L1654-V1656 PolarHBondContact O-N 3.31Å; L1654-F1657 PolarHBondContact O-N 3.2Å; L1654-N1658 PolarHBondContact O-N 3.14Å; L1654-N1658 VanDerWaalsContact O-N 3.11Å; L1654-I1675 HydrophobicContact CB-CD1 4.2Å; L1654-I1675 HydrophobicContact CD1-CD1 4.34Å; L1654-I1675 HydrophobicContact CD1-CG1 3.93Å; L1654-I1675 HydrophobicContact CD1-CG2 4.13Å; L1654-I1675 HydrophobicContact CD2-CD1 4.44Å
1655E39.4Very low36.9Very low145.6 Ų145.6107.4 Ų107.468%0.6858%0.58SS**Hα-helixtrans-66.1-33.4171.5-70.5-172.8154.500111.8L1651 S1652 I1653 F1657 N1658 T1659L1651-E1655 PolarHBondContact O-N 3.22Å; S1652-E1655 WeakPolarHBondContact O-CB 3.49Å; S1652-E1655 PolarHBondContact O-N 3.27Å; I1653-E1655 VanDerWaalsContact C-N 3.32Å; I1653-E1655 PolarHBondContact O-N 2.97Å; I1653-E1655 VanDerWaalsContact O-N 3.15Å; E1655-F1657 PolarHBondContact O-N 3.11Å; E1655-N1658 VanDerWaalsContact O-CB 3.28Å; E1655-N1658 WeakPolarHBondContact O-CB 3.19Å; E1655-N1658 PolarHBondContact O-N 3.41Å; E1655-T1659 PolarHBondContact O-OG1 3.38Å
1656V38.2Very low37.1Very low94.8 Ų94.8106.5 Ų106.558%0.57558%0.584SS**Hα-helixtrans-69.9-37.2177.3177.90000111.7S1652 I1653 L1654 N1658 T1659S1652-V1656 WeakPolarHBondContact O-CG2 3.43Å; S1652-V1656 PolarHBondContact O-N 3.32Å; S1652-V1656 VanDerWaalsContact O-N 3.14Å; I1653-V1656 HydrophobicContact CG2-CG2 4.36Å; I1653-V1656 VanDerWaalsContact O-CB 3.28Å; I1653-V1656 WeakPolarHBondContact O-CB 3.48Å; I1653-V1656 PolarHBondContact O-N 3.23Å; L1654-V1656 VanDerWaalsContact C-N 3.3Å; L1654-V1656 PolarHBondContact O-N 3.31Å; V1656-N1658 VanDerWaalsContact C-N 3.32Å; V1656-N1658 PolarHBondContact O-N 3.15Å; V1656-N1658 VanDerWaalsContact O-N 3.15Å; V1656-T1659 PolarHBondContact O-N 3.13Å; V1656-T1659 PolarHBondContact O-OG1 2.97Å; V1656-T1659 VanDerWaalsContact O-OG1 3.09Å
1657F31.7Very low37.4Very low137.6 Ų137.6101.5 Ų101.560%0.60458%0.575SS**Hα-helixtrans-71.2-24.6178.1-95.7-79.8000114L1633 I1653 L1654 E1655 T1659L1633-F1657 HydrophobicContact CD1-CE1 3.9Å; L1633-F1657 HydrophobicContact CD1-CZ 4.29Å; L1633-F1657 HydrophobicContact CD2-CE1 3.74Å; L1633-F1657 HydrophobicContact CD2-CE2 4.05Å; L1633-F1657 HydrophobicContact CD2-CZ 3.23Å; L1633-F1657 HydrophobicContact CG-CE1 3.55Å; L1633-F1657 HydrophobicContact CG-CZ 3.49Å; L1633-F1657 VanDerWaalsContact CG-CZ 3.49Å; I1653-F1657 HydrophobicContact CG2-CD2 3.78Å; I1653-F1657 HydrophobicContact CG2-CE2 4.08Å; I1653-F1657 WeakPolarHBondContact O-CD2 3.18Å; I1653-F1657 PolarHBondContact O-N 3.3Å; L1654-F1657 PolarHBondContact O-N 3.2Å; E1655-F1657 PolarHBondContact O-N 3.11Å; F1657-T1659 PolarHBondContact O-N 3.29Å; F1657-T1659 VanDerWaalsContact O-N 3.11Å
1658N38.4Very low37.6Very low113.4 Ų113.4103.3 Ų103.361%0.60658%0.584SS**Hα-helixtrans-68.5-15.8175-97.1-14.4000113.7L1654 E1655 V1656 S1660 L1662L1654-N1658 PolarHBondContact O-N 3.14Å; L1654-N1658 VanDerWaalsContact O-N 3.11Å; E1655-N1658 VanDerWaalsContact O-CB 3.28Å; E1655-N1658 WeakPolarHBondContact O-CB 3.19Å; E1655-N1658 PolarHBondContact O-N 3.41Å; V1656-N1658 VanDerWaalsContact C-N 3.32Å; V1656-N1658 PolarHBondContact O-N 3.15Å; V1656-N1658 VanDerWaalsContact O-N 3.15Å; N1658-S1660 PolarHBondContact O-N 3.24Å; N1658-L1662 WeakPolarHBondContact O-CD1 3.37Å
1659T33.9Very low38Very low113.8 Ų113.8104 Ų10470%0.69858%0.579SS**Hα-helixtrans-99.9-5.7-172.557.90000114.9E1655 V1656 F1657E1655-T1659 PolarHBondContact O-OG1 3.38Å; V1656-T1659 PolarHBondContact O-N 3.13Å; V1656-T1659 PolarHBondContact O-OG1 2.97Å; V1656-T1659 VanDerWaalsContact O-OG1 3.09Å; F1657-T1659 PolarHBondContact O-N 3.29Å; F1657-T1659 VanDerWaalsContact O-N 3.11Å
1660S36.9Very low39Very low71.8 Ų71.899.3 Ų99.350%0.50257%0.568SS.*Hα-helixtrans-111.9-6.8-175.1630000116N1658N1658-S1660 PolarHBondContact O-N 3.24Å
1661Y35.2Very low39.9Very low208 Ų20897.4 Ų97.482%0.81656%0.56SS**SBendtrans-157.538.8178.7-73.4-78.4000116.7S1663Y1661-S1663 VanDerWaalsContact C-N 3.3Å; Y1661-S1663 PolarHBondContact O-N 3.01Å; Y1661-S1663 VanDerWaalsContact O-N 3.1Å
1662L33.8Very low40.9Very low130.4 Ų130.496.4 Ų96.468%0.68356%0.561SS**  trans-126.381167.8-78.7122.4000112.2N1658 S1664 T1668N1658-L1662 WeakPolarHBondContact O-CD1 3.37Å; L1662-S1664 VanDerWaalsContact C-N 3.26Å; L1662-S1664 PolarHBondContact O-N 3.1Å; L1662-T1668 HydrophobicContact CD2-CG2 4.32Å
1663S33.5Very low42Very low121.8 Ų121.895.8 Ų95.885%0.85256%0.559SS**  trans-105.271164.2-20.90000110.6Y1661Y1661-S1663 VanDerWaalsContact C-N 3.3Å; Y1661-S1663 PolarHBondContact O-N 3.01Å; Y1661-S1663 VanDerWaalsContact O-N 3.1Å
1664S34.6Very low43.3Very low97.8 Ų97.894.8 Ų94.868%0.68455%0.554SS**  trans-172.1122.3154.750.40000111.4L1662 S1666L1662-S1664 VanDerWaalsContact C-N 3.26Å; L1662-S1664 PolarHBondContact O-N 3.1Å; S1664-S1666 PolarHBondContact O-N 3.15Å
1665S34.3Very low44.6Very low102 Ų10293.7 Ų93.771%0.71355%0.548SS*.  trans-104.2132.1176.539.30000114.1S1667S1665-S1667 PolarHBondContact O-N 3.21Å; S1665-S1667 VanDerWaalsContact O-N 3.16Å
1666S44Very low46.1Very low112.6 Ų112.693.1 Ų93.179%0.78754%0.544SS*.SBendtrans177.2-3.2169.1-45.80000117.5S1664S1664-S1666 PolarHBondContact O-N 3.15Å
1667S44.3Very low47.7Very low63.8 Ų63.890.1 Ų90.145%0.44652%0.523SS..SBendtrans-94.9-13.1-18053.20000115S1665 T1669 T1670S1665-S1667 PolarHBondContact O-N 3.21Å; S1665-S1667 VanDerWaalsContact O-N 3.16Å; S1667-T1669 VanDerWaalsContact C-N 3.31Å; S1667-T1669 PolarHBondContact O-N 3.24Å; S1667-T1670 PolarHBondContact O-N 3.37Å; S1667-T1670 PolarHBondContact O-OG1 2.96Å
1668T42.3Very low49.5Very low82.2 Ų82.284.4 Ų84.450%0.50450%0.499SS..Hα-helixtrans-71.3-23.7-173.652.50000114.3L1662 T1670 V1671 S1672L1662-T1668 HydrophobicContact CD2-CG2 4.32Å; T1668-T1670 VanDerWaalsContact C-N 3.31Å; T1668-T1670 PolarHBondContact O-N 3.12Å; T1668-V1671 PolarHBondContact O-N 3.43Å; T1668-S1672 PolarHBondContact O-N 3.12Å
1669T47.4Very low51Low104 Ų10481.2 Ų81.264%0.63849%0.485SS*.Hα-helixtrans-67.5-25.5179.950.40000113.1S1667 S1672 A1673S1667-T1669 VanDerWaalsContact C-N 3.31Å; S1667-T1669 PolarHBondContact O-N 3.24Å; T1669-S1672 PolarHBondContact O-OG 3.26Å; T1669-A1673 WeakPolarHBondContact O-CB 3.33Å; T1669-A1673 PolarHBondContact O-N 3.35Å
1670T60Low53Low64 Ų6479 Ų7939%0.39347%0.469SS..Hα-helixtrans-79.6-37.5-179.759.90000112.3S1667 T1668 A1673 L1674S1667-T1670 PolarHBondContact O-N 3.37Å; S1667-T1670 PolarHBondContact O-OG1 2.96Å; T1668-T1670 VanDerWaalsContact C-N 3.31Å; T1668-T1670 PolarHBondContact O-N 3.12Å; T1670-A1673 PolarHBondContact O-N 3.01Å; T1670-L1674 WeakPolarHBondContact O-CB 3.4Å; T1670-L1674 PolarHBondContact O-N 3.08Å
1671V55Low54.9Low26.8 Ų26.875.7 Ų75.716%0.16245%0.446CS..Hα-helixtrans-67.9-46.1-179.5-179.40000111.2D1629 L1633 T1668 A1673 L1674 I1675D1629-V1671 HydrophobicContact CB-CG2 3.99Å; L1633-V1671 HydrophobicContact CB-CG1 4.17Å; L1633-V1671 HydrophobicContact CD1-CG1 4.15Å; L1633-V1671 HydrophobicContact CG-CG1 4.37Å; T1668-V1671 PolarHBondContact O-N 3.43Å; V1671-A1673 VanDerWaalsContact C-N 3.3Å; V1671-A1673 PolarHBondContact O-N 3.2Å; V1671-L1674 WeakPolarHBondContact O-CB 3.1Å; V1671-L1674 PolarHBondContact O-N 2.99Å; V1671-L1674 VanDerWaalsContact O-N 3.13Å; V1671-I1675 HydrophobicContact CG1-CD1 4.04Å; V1671-I1675 HydrophobicContact CG1-CG1 4.48Å; V1671-I1675 WeakPolarHBondContact O-CG1 3.43Å; V1671-I1675 PolarHBondContact O-N 3.06Å
1672S59.4Low56.7Low71 Ų7168.2 Ų68.250%0.49742%0.416SS..Hα-helixtrans-60.1-40.1175.6164.80000111.7T1668 T1669 L1674 I1675 K1676T1668-S1672 PolarHBondContact O-N 3.12Å; T1669-S1672 PolarHBondContact O-OG 3.26Å; S1672-L1674 VanDerWaalsContact C-N 3.34Å; S1672-L1674 PolarHBondContact O-N 3.26Å; S1672-I1675 PolarHBondContact O-N 3.21Å; S1672-K1676 WeakPolarHBondContact O-CB 3.41Å; S1672-K1676 PolarHBondContact O-N 3.33Å; S1672-K1676 VanDerWaalsContact O-N 3.1Å
1673A65.5Low58.7Low40.6 Ų40.667.1 Ų67.134%0.33641%0.408SS..Hα-helixtrans-65.4-37.4175.200000112.7L1568 T1669 T1670 V1671 Q1677L1568-A1673 HydrophobicContact CD1-CB 4.37Å; T1669-A1673 WeakPolarHBondContact O-CB 3.33Å; T1669-A1673 PolarHBondContact O-N 3.35Å; T1670-A1673 PolarHBondContact O-N 3.01Å; V1671-A1673 VanDerWaalsContact C-N 3.3Å; V1671-A1673 PolarHBondContact O-N 3.2Å; A1673-Q1677 WeakPolarHBondContact O-CG 3.28Å; A1673-Q1677 PolarHBondContact O-N 3.21Å; A1673-Q1677 VanDerWaalsContact O-N 3.08Å
1674L65Low60.9Low29.4 Ų29.463.4 Ų63.415%0.15438%0.375CS..Hα-helixtrans-69.1-44.6177.8-165.5161.5000111.4L1568 F1569 L1633 T1670 V1671 S1672 K1676 Q1677 I1678L1568-L1674 HydrophobicContact CD1-CB 4.36Å; L1568-L1674 HydrophobicContact CD1-CG 4.48Å; F1569-L1674 HydrophobicContact CZ-CD2 4.37Å; L1633-L1674 HydrophobicContact CD1-CB 4.1Å; L1633-L1674 HydrophobicContact CD1-CD1 3.9Å; L1633-L1674 HydrophobicContact CD1-CD2 3.71Å; L1633-L1674 VanDerWaalsContact CD1-CD2 3.41Å; L1633-L1674 HydrophobicContact CD1-CG 3.96Å; L1633-L1674 HydrophobicContact CD2-CD2 4Å; L1633-L1674 HydrophobicContact CG-CD2 4.21Å; T1670-L1674 WeakPolarHBondContact O-CB 3.4Å; T1670-L1674 PolarHBondContact O-N 3.08Å; V1671-L1674 WeakPolarHBondContact O-CB 3.1Å; V1671-L1674 PolarHBondContact O-N 2.99Å; V1671-L1674 VanDerWaalsContact O-N 3.13Å; S1672-L1674 VanDerWaalsContact C-N 3.34Å; S1672-L1674 PolarHBondContact O-N 3.26Å; L1674-K1676 VanDerWaalsContact C-N 3.32Å; L1674-K1676 PolarHBondContact O-N 3.31Å; L1674-Q1677 PolarHBondContact O-N 3.29Å; L1674-Q1677 VanDerWaalsContact O-N 3.14Å; L1674-I1678 HydrophobicContact CD2-CD1 3.36Å; L1674-I1678 VanDerWaalsContact CD2-CD1 3.41Å; L1674-I1678 HydrophobicContact CD2-CG1 3.92Å; L1674-I1678 WeakPolarHBondContact O-CG1 3.25Å; L1674-I1678 PolarHBondContact O-N 3.08Å
1675I64.6Low63Low36.8 Ų36.858.8 Ų58.819%0.18934%0.343CS..Hα-helixtrans-57.9-47.5175.7-69.4170.2000110.4L1633 L1636 T1637 L1651 L1654 V1671 S1672 Q1677 I1678 S1679L1633-I1675 HydrophobicContact CD2-CG1 4.3Å; L1633-I1675 HydrophobicContact CG-CD1 4.47Å; L1633-I1675 HydrophobicContact CG-CG1 3.84Å; L1636-I1675 HydrophobicContact CB-CD1 4.26Å; L1636-I1675 HydrophobicContact CD1-CD1 3.81Å; T1637-I1675 HydrophobicContact CG2-CG1 4.41Å; T1637-I1675 HydrophobicContact CG2-CG2 4.48Å; L1651-I1675 HydrophobicContact CB-CG2 4.1Å; L1651-I1675 HydrophobicContact CD1-CG2 3.87Å; L1651-I1675 HydrophobicContact CD2-CB 4.06Å; L1651-I1675 HydrophobicContact CD2-CD1 4.39Å; L1651-I1675 HydrophobicContact CD2-CG1 3.89Å; L1651-I1675 HydrophobicContact CD2-CG2 3.41Å; L1651-I1675 VanDerWaalsContact CD2-CG2 3.41Å; L1651-I1675 HydrophobicContact CG-CG2 3.97Å; L1651-I1675 WeakPolarHBondContact O-CD1 3.49Å; L1654-I1675 HydrophobicContact CB-CD1 4.2Å; L1654-I1675 HydrophobicContact CD1-CD1 4.34Å; L1654-I1675 HydrophobicContact CD1-CG1 3.93Å; L1654-I1675 HydrophobicContact CD1-CG2 4.13Å; L1654-I1675 HydrophobicContact CD2-CD1 4.44Å; V1671-I1675 HydrophobicContact CG1-CD1 4.04Å; V1671-I1675 HydrophobicContact CG1-CG1 4.48Å; V1671-I1675 WeakPolarHBondContact O-CG1 3.43Å; V1671-I1675 PolarHBondContact O-N 3.06Å; S1672-I1675 PolarHBondContact O-N 3.21Å; I1675-Q1677 VanDerWaalsContact C-N 3.3Å; I1675-Q1677 PolarHBondContact O-N 3.18Å; I1675-I1678 PolarHBondContact O-N 3.27Å; I1675-I1678 VanDerWaalsContact O-N 3.15Å; I1675-S1679 PolarHBondContact O-N 3.15Å; I1675-S1679 PolarHBondContact O-OG 3.08Å
1676K70.3Confident65Low133.4 Ų133.455.2 Ų55.258%0.5832%0.316SS*.Hα-helixtrans-59.7-41.3176.6-173.7175.4179.2175.90111.9S1672 L1674 I1678 S1679 D1680S1672-K1676 WeakPolarHBondContact O-CB 3.41Å; S1672-K1676 PolarHBondContact O-N 3.33Å; S1672-K1676 VanDerWaalsContact O-N 3.1Å; L1674-K1676 VanDerWaalsContact C-N 3.32Å; L1674-K1676 PolarHBondContact O-N 3.31Å; K1676-I1678 VanDerWaalsContact C-N 3.35Å; K1676-I1678 PolarHBondContact O-N 3.13Å; K1676-S1679 WeakPolarHBondContact CA-OG 3.36Å; K1676-S1679 PolarHBondContact O-N 3.37Å; K1676-S1679 PolarHBondContact O-OG 3.23Å; K1676-D1680 WeakPolarHBondContact O-CB 3.28Å; K1676-D1680 PolarHBondContact O-N 3.14Å
1677Q70.9Confident66.6Low30.4 Ų30.453.5 Ų53.514%0.14230%0.295CS..Hα-helixtrans-67.1-35.2176.4-76.9-172.117.600113.5L1568 A1673 L1674 I1675 S1679 D1680 L1681L1568-Q1677 VanDerWaalsContact CB-OE1 3.26Å; L1568-Q1677 VanDerWaalsContact CD1-CD 3.42Å; L1568-Q1677 HydrophobicContact CD1-CG 4.38Å; L1568-Q1677 VanDerWaalsContact CG-NE2 3.33Å; A1673-Q1677 WeakPolarHBondContact O-CG 3.28Å; A1673-Q1677 PolarHBondContact O-N 3.21Å; A1673-Q1677 VanDerWaalsContact O-N 3.08Å; L1674-Q1677 PolarHBondContact O-N 3.29Å; L1674-Q1677 VanDerWaalsContact O-N 3.14Å; I1675-Q1677 VanDerWaalsContact C-N 3.3Å; I1675-Q1677 PolarHBondContact O-N 3.18Å; Q1677-S1679 VanDerWaalsContact C-N 3.35Å; Q1677-D1680 PolarHBondContact O-N 3.02Å; Q1677-L1681 VanDerWaalsContact O-CB 3.26Å; Q1677-L1681 WeakPolarHBondContact O-CB 3.27Å; Q1677-L1681 PolarHBondContact O-N 2.97Å
1678I70.5Confident68.4Low17.8 Ų17.853.4 Ų53.49%0.09129%0.285CS..Hα-helixtrans-66.7-39.8174.4-69.5177.2000110.6F1604 L1633 T1637 L1674 I1675 K1676 L1681 R1682F1604-I1678 HydrophobicContact CZ-CG2 3.95Å; L1633-I1678 HydrophobicContact CD2-CD1 3.92Å; T1637-I1678 HydrophobicContact CG2-CB 4.35Å; T1637-I1678 HydrophobicContact CG2-CD1 4.32Å; T1637-I1678 HydrophobicContact CG2-CG2 4.02Å; L1674-I1678 HydrophobicContact CD2-CD1 3.36Å; L1674-I1678 VanDerWaalsContact CD2-CD1 3.41Å; L1674-I1678 HydrophobicContact CD2-CG1 3.92Å; L1674-I1678 WeakPolarHBondContact O-CG1 3.25Å; L1674-I1678 PolarHBondContact O-N 3.08Å; I1675-I1678 PolarHBondContact O-N 3.27Å; I1675-I1678 VanDerWaalsContact O-N 3.15Å; K1676-I1678 VanDerWaalsContact C-N 3.35Å; K1676-I1678 PolarHBondContact O-N 3.13Å; I1678-L1681 PolarHBondContact O-N 3.37Å; I1678-R1682 WeakPolarHBondContact O-CB 3.4Å; I1678-R1682 PolarHBondContact O-N 3.1Å
1679S70.6Confident70.3Confident46.8 Ų46.850 Ų5033%0.32726%0.264SS..Hα-helixtrans-65.1-44.4174.958.70000111.9I1675 K1676 Q1677 L1681 R1682 E1683I1675-S1679 PolarHBondContact O-N 3.15Å; I1675-S1679 PolarHBondContact O-OG 3.08Å; K1676-S1679 WeakPolarHBondContact CA-OG 3.36Å; K1676-S1679 PolarHBondContact O-N 3.37Å; K1676-S1679 PolarHBondContact O-OG 3.23Å; Q1677-S1679 VanDerWaalsContact C-N 3.35Å; S1679-L1681 VanDerWaalsContact C-N 3.29Å; S1679-L1681 PolarHBondContact O-N 3.18Å; S1679-R1682 WeakPolarHBondContact O-CB 3.36Å; S1679-R1682 PolarHBondContact O-N 3.2Å; S1679-R1682 VanDerWaalsContact O-N 3.16Å; S1679-E1683 PolarHBondContact O-N 3.07Å
1680D74.4Confident71.8Confident66.6 Ų66.646.6 Ų46.636%0.35624%0.241SC..Hα-helixtrans-62.5-39.6177.5-62.6-11.2000110.7F1564 K1676 Q1677 E1683 W1684F1564-D1680 HydrophobicContact CE2-CB 4.27Å; K1676-D1680 WeakPolarHBondContact O-CB 3.28Å; K1676-D1680 PolarHBondContact O-N 3.14Å; Q1677-D1680 PolarHBondContact O-N 3.02Å; D1680-E1683 PolarHBondContact O-N 3.25Å; D1680-W1684 WeakPolarHBondContact O-CB 3.39Å; D1680-W1684 PolarHBondContact O-N 3.24Å
1681L76.7Confident72.7Confident3.2 Ų3.244.6 Ų44.62%0.01723%0.228CC..Hα-helixtrans-67.5-38.7176.1-176.7123.4000112.2F1564 L1574 F1604 F1607 Q1677 I1678 S1679 E1683 W1684 I1685F1564-L1681 HydrophobicContact CB-CD1 4.33Å; F1564-L1681 HydrophobicContact CD1-CD1 3.91Å; F1564-L1681 HydrophobicContact CD2-CD1 4.1Å; F1564-L1681 HydrophobicContact CE1-CB 4.21Å; F1564-L1681 HydrophobicContact CE1-CD1 3.79Å; F1564-L1681 VanDerWaalsContact CE1-CD1 3.47Å; F1564-L1681 HydrophobicContact CE1-CG 4.39Å; F1564-L1681 HydrophobicContact CE2-CB 4.13Å; F1564-L1681 HydrophobicContact CE2-CD1 4.19Å; F1564-L1681 HydrophobicContact CG-CD1 3.81Å; F1564-L1681 HydrophobicContact CZ-CB 3.82Å; F1564-L1681 HydrophobicContact CZ-CD1 4.19Å; F1564-L1681 HydrophobicContact CZ-CG 4.47Å; L1574-L1681 HydrophobicContact CD1-CD1 3.93Å; L1574-L1681 HydrophobicContact CD1-CD2 4.01Å; L1574-L1681 HydrophobicContact CD2-CD1 4.26Å; F1604-L1681 HydrophobicContact CD2-CD2 4.43Å; F1604-L1681 HydrophobicContact CE2-CD2 3.92Å; F1607-L1681 HydrophobicContact CD1-CD2 3.97Å; F1607-L1681 HydrophobicContact CE1-CD1 4.03Å; F1607-L1681 HydrophobicContact CE1-CD2 3.26Å; F1607-L1681 HydrophobicContact CE1-CG 4.36Å; F1607-L1681 HydrophobicContact CE2-CD2 4.3Å; F1607-L1681 HydrophobicContact CZ-CD1 3.73Å; F1607-L1681 HydrophobicContact CZ-CD2 3.59Å; F1607-L1681 HydrophobicContact CZ-CG 4.45Å; Q1677-L1681 VanDerWaalsContact O-CB 3.26Å; Q1677-L1681 WeakPolarHBondContact O-CB 3.27Å; Q1677-L1681 PolarHBondContact O-N 2.97Å; I1678-L1681 PolarHBondContact O-N 3.37Å; S1679-L1681 VanDerWaalsContact C-N 3.29Å; S1679-L1681 PolarHBondContact O-N 3.18Å; L1681-E1683 VanDerWaalsContact C-N 3.33Å; L1681-W1684 HydrophobicContact CD1-CE3 4.19Å; L1681-W1684 PolarHBondContact O-N 3.26Å; L1681-I1685 HydrophobicContact CD1-CD1 4.44Å; L1681-I1685 HydrophobicContact CD2-CD1 3.52Å; L1681-I1685 VanDerWaalsContact CD2-CD1 3.41Å; L1681-I1685 HydrophobicContact CD2-CG1 4.18Å; L1681-I1685 HydrophobicContact CG-CD1 4.22Å; L1681-I1685 HydrophobicContact CG-CG1 4.49Å; L1681-I1685 WeakPolarHBondContact O-CB 3.41Å; L1681-I1685 VanDerWaalsContact O-CG1 3.3Å; L1681-I1685 WeakPolarHBondContact O-CG1 3.41Å; L1681-I1685 PolarHBondContact O-N 3.32Å
1682R73.7Confident74Confident49.8 Ų49.844 Ų4419%0.18822%0.223CC..Hα-helixtrans-60.5-49.7174.3-178.4-173.8172.2-167.35.4110.3F1604 Q1640 V1641 N1645 S1647 I1678 S1679 W1684 I1685 D1686F1604-R1682 HydrophobicContact CD1-CG 4.22Å; F1604-R1682 HydrophobicContact CD2-CB 4.04Å; F1604-R1682 HydrophobicContact CD2-CG 4.06Å; F1604-R1682 HydrophobicContact CE1-CB 4.29Å; F1604-R1682 HydrophobicContact CE1-CG 4.11Å; F1604-R1682 VanDerWaalsContact CE2-CA 3.49Å; F1604-R1682 HydrophobicContact CE2-CB 3.52Å; F1604-R1682 VanDerWaalsContact CE2-CB 3.47Å; F1604-R1682 HydrophobicContact CE2-CG 3.95Å; F1604-R1682 HydrophobicContact CG-CG 4.2Å; F1604-R1682 HydrophobicContact CZ-CB 3.66Å; F1604-R1682 HydrophobicContact CZ-CG 3.98Å; Q1640-R1682 PolarHBondContact O-NH1 3.27Å; V1641-R1682 PolarHBondContact O-NH2 3.19Å; V1641-R1682 VanDerWaalsContact O-NH2 3.1Å; N1645-R1682 PolarHBondContact ND2-NH2 3.38Å; N1645-R1682 PolarHBondContact OD1-NH1 3.34Å; N1645-R1682 PolarHBondContact OD1-NH2 2.9Å; S1647-R1682 PolarHBondContact O-NH1 2.9Å; S1647-R1682 PolarHBondContact OG-NH2 3.08Å; I1678-R1682 WeakPolarHBondContact O-CB 3.4Å; I1678-R1682 PolarHBondContact O-N 3.1Å; S1679-R1682 WeakPolarHBondContact O-CB 3.36Å; S1679-R1682 PolarHBondContact O-N 3.2Å; S1679-R1682 VanDerWaalsContact O-N 3.16Å; R1682-W1684 VanDerWaalsContact C-N 3.29Å; R1682-W1684 PolarHBondContact O-N 3.29Å; R1682-I1685 PolarHBondContact O-N 3.14Å; R1682-I1685 VanDerWaalsContact O-N 3.11Å; R1682-D1686 IonicContact NE-OD2 2.76Å; R1682-D1686 PolarHBondContact O-N 3.06Å
1683E75.6Confident75Confident108.8 Ų108.840.9 Ų40.951%0.50820%0.201SC..Hα-helixtrans-59.8-42.3178.5-154.1176.9-172.400110.8R1460 S1679 D1680 L1681 I1685 D1686 H1687R1460-E1683 IonicContact NH2-OE1 3.59Å; R1460-E1683 PolarHBondContact NH2-OE1 3.49Å; R1460-E1683 VanDerWaalsContact NH2-OE1 3.15Å; S1679-E1683 PolarHBondContact O-N 3.07Å; D1680-E1683 PolarHBondContact O-N 3.25Å; L1681-E1683 VanDerWaalsContact C-N 3.33Å; E1683-I1685 PolarHBondContact O-N 3.07Å; E1683-D1686 PolarHBondContact O-N 3.14Å; E1683-H1687 VanDerWaalsContact CG-CE1 3.42Å; E1683-H1687 WeakPolarHBondContact CG-CE1 3.35Å; E1683-H1687 VanDerWaalsContact CG-ND1 3.33Å; E1683-H1687 WeakPolarHBondContact CG-ND1 3.35Å; E1683-H1687 WeakPolarHBondContact O-CB 3.42Å; E1683-H1687 PolarHBondContact O-N 3.23Å; E1683-H1687 PolarHBondContact O-ND1 3.04Å; E1683-H1687 IonicContact OE1-CE1 3.32Å; E1683-H1687 PolarHBondContact OE1-CE1 3.31Å
1684W80Confident75.7Confident43.8 Ų43.839.7 Ų39.717%0.16619%0.189CC..Hα-helixtrans-61.9-42.9174.3-178.191.4000112.9N1562 F1564 L1578 I1602 D1680 L1681 R1682 D1686 H1687 R1688N1562-W1684 PolarHBondContact O-NE1 3.16Å; F1564-W1684 HydrophobicContact CB-CD2 4.02Å; F1564-W1684 HydrophobicContact CB-CE3 4.42Å; F1564-W1684 HydrophobicContact CB-CG 4.32Å; F1564-W1684 HydrophobicContact CB-CZ2 4.33Å; F1564-W1684 HydrophobicContact CD2-CB 4.09Å; F1564-W1684 HydrophobicContact CD2-CD2 4.39Å; F1564-W1684 AromaticContact CD2-CG 3.92Å; F1564-W1684 HydrophobicContact CD2-CG 4.04Å; F1564-W1684 HydrophobicContact CE2-CB 4.47Å; L1578-W1684 HydrophobicContact CD1-CH2 4.45Å; L1578-W1684 HydrophobicContact CD1-CZ3 4.21Å; L1578-W1684 HydrophobicContact CD2-CZ3 4.44Å; I1602-W1684 HydrophobicContact CD1-CZ3 4.36Å; D1680-W1684 WeakPolarHBondContact O-CB 3.39Å; D1680-W1684 PolarHBondContact O-N 3.24Å; L1681-W1684 HydrophobicContact CD1-CE3 4.19Å; L1681-W1684 PolarHBondContact O-N 3.26Å; R1682-W1684 VanDerWaalsContact C-N 3.29Å; R1682-W1684 PolarHBondContact O-N 3.29Å; W1684-D1686 VanDerWaalsContact C-N 3.31Å; W1684-D1686 PolarHBondContact O-N 3.23Å; W1684-H1687 PolarHBondContact O-N 3.37Å; W1684-R1688 VanDerWaalsContact CH2-NH1 3.33Å; W1684-R1688 VanDerWaalsContact O-CB 3.27Å; W1684-R1688 WeakPolarHBondContact O-CB 3.33Å; W1684-R1688 PolarHBondContact O-N 3.23Å
1685I78.9Confident76.5Confident0 Ų038.7 Ų38.70%018%0.183CC..Hα-helixtrans-61.9-44.2176.1-76.1171.3000110.8L1578 I1602 F1604 F1607 L1681 R1682 E1683 R1688 N1689L1578-I1685 HydrophobicContact CD2-CD1 4.06Å; L1578-I1685 HydrophobicContact CD2-CG1 4.41Å; I1602-I1685 HydrophobicContact CB-CG1 4.46Å; I1602-I1685 HydrophobicContact CB-CG2 3.93Å; I1602-I1685 HydrophobicContact CD1-CG1 4.36Å; I1602-I1685 HydrophobicContact CG2-CD1 3.78Å; I1602-I1685 HydrophobicContact CG2-CG1 4.11Å; I1602-I1685 HydrophobicContact CG2-CG2 3.88Å; F1604-I1685 HydrophobicContact CB-CG2 4.39Å; F1604-I1685 HydrophobicContact CD2-CD1 3.78Å; F1604-I1685 HydrophobicContact CE2-CD1 4.3Å; F1607-I1685 HydrophobicContact CD1-CD1 4.34Å; F1607-I1685 HydrophobicContact CG-CD1 4.36Å; L1681-I1685 HydrophobicContact CD1-CD1 4.44Å; L1681-I1685 HydrophobicContact CD2-CD1 3.52Å; L1681-I1685 VanDerWaalsContact CD2-CD1 3.41Å; L1681-I1685 HydrophobicContact CD2-CG1 4.18Å; L1681-I1685 HydrophobicContact CG-CD1 4.22Å; L1681-I1685 HydrophobicContact CG-CG1 4.49Å; L1681-I1685 WeakPolarHBondContact O-CB 3.41Å; L1681-I1685 VanDerWaalsContact O-CG1 3.3Å; L1681-I1685 WeakPolarHBondContact O-CG1 3.41Å; L1681-I1685 PolarHBondContact O-N 3.32Å; R1682-I1685 PolarHBondContact O-N 3.14Å; R1682-I1685 VanDerWaalsContact O-N 3.11Å; E1683-I1685 PolarHBondContact O-N 3.07Å; I1685-R1688 PolarHBondContact O-N 3.21Å; I1685-N1689 WeakPolarHBondContact CG2-ND2 3.42Å; I1685-N1689 VanDerWaalsContact O-CB 3.3Å; I1685-N1689 WeakPolarHBondContact O-CB 3.36Å; I1685-N1689 VanDerWaalsContact O-CG 3.25Å; I1685-N1689 PolarHBondContact O-N 3.29Å; I1685-N1689 PolarHBondContact O-ND2 3.02Å
1686D76Confident77.3Confident27.4 Ų27.438.6 Ų38.615%0.14718%0.181CC..Hα-helixtrans-64.5-47179.8-76.8-20.5000111.1R1460 R1682 E1683 W1684 R1688 N1689 I1690R1460-D1686 IonicContact CZ-OD1 3.58Å; R1460-D1686 IonicContact CZ-OD2 3.07Å; R1460-D1686 IonicContact NH1-OD1 2.68Å; R1460-D1686 PolarHBondContact NH1-OD1 3.29Å; R1460-D1686 IonicContact NH1-OD2 3.46Å; R1460-D1686 PolarHBondContact NH1-OD2 3.34Å; R1460-D1686 IonicContact NH2-OD1 2.83Å; R1460-D1686 IonicContact NH2-OD2 3.33Å; R1460-D1686 PolarHBondContact NH2-OD2 3.05Å; R1682-D1686 IonicContact NE-OD2 2.76Å; R1682-D1686 PolarHBondContact O-N 3.06Å; E1683-D1686 PolarHBondContact O-N 3.14Å; W1684-D1686 VanDerWaalsContact C-N 3.31Å; W1684-D1686 PolarHBondContact O-N 3.23Å; D1686-R1688 VanDerWaalsContact C-N 3.34Å; D1686-R1688 PolarHBondContact O-N 3.12Å; D1686-N1689 PolarHBondContact O-N 3.19Å; D1686-I1690 WeakPolarHBondContact O-CB 3.48Å; D1686-I1690 VanDerWaalsContact O-CD1 3.23Å; D1686-I1690 WeakPolarHBondContact O-CD1 3.46Å; D1686-I1690 VanDerWaalsContact O-CG1 3.27Å; D1686-I1690 WeakPolarHBondContact O-CG1 3.38Å; D1686-I1690 PolarHBondContact O-N 3.35Å
1687H78Confident77.7Confident77.8 Ų77.832.3 Ų32.336%0.3615%0.154SC..Hα-helixtrans-59.7-44.8174.7-74.897.7000111.9R1460 E1683 W1684 N1689 I1690 H1691R1460-H1687 PolarHBondContact NH2-CE1 3.01Å; R1460-H1687 PolarHBondContact NH2-NE2 3.08Å; E1683-H1687 VanDerWaalsContact CG-CE1 3.42Å; E1683-H1687 WeakPolarHBondContact CG-CE1 3.35Å; E1683-H1687 VanDerWaalsContact CG-ND1 3.33Å; E1683-H1687 WeakPolarHBondContact CG-ND1 3.35Å; E1683-H1687 WeakPolarHBondContact O-CB 3.42Å; E1683-H1687 PolarHBondContact O-N 3.23Å; E1683-H1687 PolarHBondContact O-ND1 3.04Å; E1683-H1687 IonicContact OE1-CE1 3.32Å; E1683-H1687 PolarHBondContact OE1-CE1 3.31Å; W1684-H1687 PolarHBondContact O-N 3.37Å; H1687-N1689 VanDerWaalsContact C-N 3.34Å; H1687-N1689 PolarHBondContact O-N 2.96Å; H1687-I1690 PolarHBondContact O-N 3.17Å; H1687-H1691 VanDerWaalsContact O-CB 3.26Å; H1687-H1691 WeakPolarHBondContact O-CB 3.32Å; H1687-H1691 PolarHBondContact O-N 3.1Å
1688R81.1Confident78.2Confident59.8 Ų59.830.8 Ų30.823%0.22615%0.147CC..Hα-helixtrans-61-44176.1177.3-176.4167.8-113.70.1111.8T1600 I1602 W1684 I1685 D1686 H1691 N1692T1600-R1688 PolarHBondContact O-NH1 3.19Å; T1600-R1688 VanDerWaalsContact O-NH1 3.14Å; T1600-R1688 PolarHBondContact O-NH2 3.28Å; I1602-R1688 VanDerWaalsContact CD1-CZ 3.47Å; I1602-R1688 VanDerWaalsContact CD1-NH1 3.26Å; W1684-R1688 VanDerWaalsContact CH2-NH1 3.33Å; W1684-R1688 VanDerWaalsContact O-CB 3.27Å; W1684-R1688 WeakPolarHBondContact O-CB 3.33Å; W1684-R1688 PolarHBondContact O-N 3.23Å; I1685-R1688 PolarHBondContact O-N 3.21Å; D1686-R1688 VanDerWaalsContact C-N 3.34Å; D1686-R1688 PolarHBondContact O-N 3.12Å; R1688-H1691 PolarHBondContact O-N 3.42Å; R1688-N1692 PolarHBondContact NH1-ND2 2.85Å; R1688-N1692 PolarHBondContact NH2-ND2 3.06Å; R1688-N1692 VanDerWaalsContact O-CB 3.29Å; R1688-N1692 WeakPolarHBondContact O-CB 3.37Å; R1688-N1692 VanDerWaalsContact O-CG 3.31Å; R1688-N1692 PolarHBondContact O-N 2.95Å
1689N81.8Confident78.9Confident12.8 Ų12.830.2 Ų30.27%0.06814%0.143CC..Hα-helixtrans-66.5-42-179.5-75.5-16.2000111.4M1601 I1602 I1685 D1686 H1687 H1691 N1692 L1693M1601-N1689 WeakPolarHBondContact CA-OD1 3.5Å; M1601-N1689 HydrophobicContact SD-CB 4Å; I1602-N1689 PolarHBondContact N-OD1 3.13Å; I1602-N1689 PolarHBondContact O-ND2 3.17Å; I1685-N1689 WeakPolarHBondContact CG2-ND2 3.42Å; I1685-N1689 VanDerWaalsContact O-CB 3.3Å; I1685-N1689 WeakPolarHBondContact O-CB 3.36Å; I1685-N1689 VanDerWaalsContact O-CG 3.25Å; I1685-N1689 PolarHBondContact O-N 3.29Å; I1685-N1689 PolarHBondContact O-ND2 3.02Å; D1686-N1689 PolarHBondContact O-N 3.19Å; H1687-N1689 VanDerWaalsContact C-N 3.34Å; H1687-N1689 PolarHBondContact O-N 2.96Å; N1689-H1691 VanDerWaalsContact C-N 3.35Å; N1689-N1692 PolarHBondContact O-N 3.06Å; N1689-L1693 VanDerWaalsContact O-CB 3.28Å; N1689-L1693 WeakPolarHBondContact O-CB 3.25Å; N1689-L1693 PolarHBondContact O-N 3.11Å
1690I80.4Confident79.6Confident31.4 Ų31.428.7 Ų28.716%0.16113%0.131CC..Hα-helixtrans-62-47.2174.7-67.4163.9000110.4R1460 A1463 D1686 H1687 N1692 L1693 H1694R1460-I1690 HydrophobicContact CB-CD1 3.98Å; R1460-I1690 VanDerWaalsContact CD-CD1 3.42Å; R1460-I1690 HydrophobicContact CG-CD1 3.71Å; R1460-I1690 VanDerWaalsContact CG-CD1 3.5Å; R1460-I1690 HydrophobicContact CG-CG1 4.32Å; A1463-I1690 HydrophobicContact CB-CG1 4.48Å; A1463-I1690 HydrophobicContact CB-CG2 3.81Å; D1686-I1690 WeakPolarHBondContact O-CB 3.48Å; D1686-I1690 VanDerWaalsContact O-CD1 3.23Å; D1686-I1690 WeakPolarHBondContact O-CD1 3.46Å; D1686-I1690 VanDerWaalsContact O-CG1 3.27Å; D1686-I1690 WeakPolarHBondContact O-CG1 3.38Å; D1686-I1690 PolarHBondContact O-N 3.35Å; H1687-I1690 PolarHBondContact O-N 3.17Å; I1690-N1692 PolarHBondContact O-N 3.42Å; I1690-L1693 WeakPolarHBondContact O-CB 3.43Å; I1690-L1693 PolarHBondContact O-N 3.22Å; I1690-H1694 WeakPolarHBondContact O-CB 3.39Å; I1690-H1694 PolarHBondContact O-N 3.21Å
1691H79.3Confident80.1Confident22.4 Ų22.425.9 Ų25.910%0.10412%0.117CC..Hα-helixtrans-58.2-50.2176.4176.995000111.3L1557 V1558 D1560 H1687 R1688 N1689 L1693 H1694 L1695L1557-H1691 PolarHBondContact O-CE1 2.97Å; V1558-H1691 PolarHBondContact O-CE1 3.24Å; V1558-H1691 PolarHBondContact O-ND1 2.96Å; D1560-H1691 IonicContact OD1-CE1 3.21Å; H1687-H1691 VanDerWaalsContact O-CB 3.26Å; H1687-H1691 WeakPolarHBondContact O-CB 3.32Å; H1687-H1691 PolarHBondContact O-N 3.1Å; R1688-H1691 PolarHBondContact O-N 3.42Å; N1689-H1691 VanDerWaalsContact C-N 3.35Å; H1691-L1693 VanDerWaalsContact C-N 3.31Å; H1691-L1693 PolarHBondContact O-N 3.1Å; H1691-H1694 PolarHBondContact O-N 3.21Å; H1691-L1695 VanDerWaalsContact O-CB 3.25Å; H1691-L1695 WeakPolarHBondContact O-CB 3.34Å; H1691-L1695 PolarHBondContact O-N 3.1Å
1692N80.7Confident80.6Confident14.4 Ų14.425.8 Ų25.88%0.07712%0.116CC..Hα-helixtrans-62.6-37.5178.5-80.14.3000112.2L1598 T1600 M1601 R1688 N1689 I1690 Y1696 A1697L1598-N1692 PolarHBondContact O-ND2 3.02Å; T1600-N1692 PolarHBondContact O-ND2 2.76Å; M1601-N1692 HydrophobicContact CE-CB 4.12Å; M1601-N1692 HydrophobicContact SD-CB 4.17Å; R1688-N1692 PolarHBondContact NH1-ND2 2.85Å; R1688-N1692 PolarHBondContact NH2-ND2 3.06Å; R1688-N1692 VanDerWaalsContact O-CB 3.29Å; R1688-N1692 WeakPolarHBondContact O-CB 3.37Å; R1688-N1692 VanDerWaalsContact O-CG 3.31Å; R1688-N1692 PolarHBondContact O-N 2.95Å; N1689-N1692 PolarHBondContact O-N 3.06Å; I1690-N1692 PolarHBondContact O-N 3.42Å; N1692-Y1696 HydrophobicContact CB-CD2 3.95Å; N1692-Y1696 HydrophobicContact CB-CE2 4.34Å; N1692-Y1696 WeakPolarHBondContact O-CA 3.42Å; N1692-Y1696 VanDerWaalsContact O-CB 3.27Å; N1692-Y1696 WeakPolarHBondContact O-CB 3.27Å; N1692-Y1696 VanDerWaalsContact O-CD2 3.3Å; N1692-Y1696 WeakPolarHBondContact O-CD2 3.31Å; N1692-Y1696 PolarHBondContact O-N 3.07Å; N1692-Y1696 WeakPolarHBondContact OD1-CE2 3.23Å; N1692-A1697 PolarHBondContact O-N 2.87Å
1693L81.3Confident81.2Confident5.6 Ų5.623.7 Ų23.73%0.02911%0.109CC..Iπ-helixtrans-64.3-50.3178.1-178.494.9000110F1305 V1464 A1467 L1587 M1601 N1689 I1690 H1691 L1695 A1697 G1698F1305-L1693 HydrophobicContact CE1-CD1 3.49Å; F1305-L1693 VanDerWaalsContact CE1-CD1 3.46Å; F1305-L1693 HydrophobicContact CE1-CD2 4.3Å; F1305-L1693 HydrophobicContact CE2-CD1 4.23Å; F1305-L1693 HydrophobicContact CZ-CD1 3.4Å; F1305-L1693 VanDerWaalsContact CZ-CD1 3.44Å; F1305-L1693 HydrophobicContact CZ-CD2 4.1Å; F1305-L1693 HydrophobicContact CZ-CG 4.28Å; V1464-L1693 HydrophobicContact CB-CD2 4.36Å; V1464-L1693 HydrophobicContact CG1-CD2 4.37Å; V1464-L1693 HydrophobicContact CG2-CD2 4.01Å; A1467-L1693 HydrophobicContact CB-CD1 4.27Å; A1467-L1693 HydrophobicContact CB-CD2 3.8Å; A1467-L1693 HydrophobicContact CB-CG 3.85Å; L1587-L1693 HydrophobicContact CD1-CD1 4.24Å; M1601-L1693 VanDerWaalsContact CE-CA 3.5Å; M1601-L1693 HydrophobicContact CE-CB 3.72Å; M1601-L1693 HydrophobicContact CE-CD1 4.03Å; M1601-L1693 HydrophobicContact CE-CG 4.27Å; N1689-L1693 VanDerWaalsContact O-CB 3.28Å; N1689-L1693 WeakPolarHBondContact O-CB 3.25Å; N1689-L1693 PolarHBondContact O-N 3.11Å; I1690-L1693 WeakPolarHBondContact O-CB 3.43Å; I1690-L1693 PolarHBondContact O-N 3.22Å; H1691-L1693 VanDerWaalsContact C-N 3.31Å; H1691-L1693 PolarHBondContact O-N 3.1Å; L1693-L1695 PolarHBondContact O-N 2.93Å; L1693-A1697 HydrophobicContact CD1-CB 4.02Å; L1693-A1697 HydrophobicContact CG-CB 4.36Å; L1693-A1697 CarbonylContact O-C 3.53Å; L1693-A1697 VanDerWaalsContact O-CA 3.28Å; L1693-A1697 WeakPolarHBondContact O-CA 3.37Å; L1693-A1697 VanDerWaalsContact O-CB 3.24Å; L1693-A1697 WeakPolarHBondContact O-CB 3.35Å; L1693-A1697 PolarHBondContact O-N 3.29Å; L1693-A1697 VanDerWaalsContact O-N 3.1Å; L1693-G1698 PolarHBondContact O-N 2.92Å; L1693-G1698 VanDerWaalsContact O-N 3.08Å
1694H80.9Confident81.8Confident14.8 Ų14.820 Ų207%0.0699%0.091CC..Iπ-helixtrans-63.9-46.5-179.4-169.5-104.6000112A1463 E1466 E1556 L1557 I1690 H1691 G1698 K1699A1463-H1694 PolarHBondContact O-CD2 3.07Å; E1466-H1694 IonicContact OE1-CD2 3.2Å; E1466-H1694 IonicContact OE1-CE1 2.68Å; E1466-H1694 IonicContact OE1-NE2 3.11Å; E1466-H1694 PolarHBondContact OE1-NE2 3.09Å; E1466-H1694 IonicContact OE2-CD2 3.13Å; E1466-H1694 PolarHBondContact OE2-CD2 3.49Å; E1466-H1694 VanDerWaalsContact OE2-CD2 3.27Å; E1466-H1694 IonicContact OE2-CE1 3.49Å; E1466-H1694 IonicContact OE2-NE2 3.12Å; E1466-H1694 PolarHBondContact OE2-NE2 3.24Å; E1556-H1694 IonicContact OE2-CE1 3.1Å; L1557-H1694 HydrophobicContact CD2-CB 4.38Å; L1557-H1694 WeakPolarHBondContact CD2-ND1 2.96Å; I1690-H1694 WeakPolarHBondContact O-CB 3.39Å; I1690-H1694 PolarHBondContact O-N 3.21Å; H1691-H1694 PolarHBondContact O-N 3.21Å; H1694-G1698 CarbonylContact O-C 3.52Å; H1694-G1698 WeakPolarHBondContact O-CA 3.32Å; H1694-G1698 PolarHBondContact O-N 3.06Å; H1694-K1699 VanDerWaalsContact CE1-CE 3.44Å; H1694-K1699 WeakPolarHBondContact CE1-CE 3.4Å; H1694-K1699 PolarHBondContact CE1-NZ 3.09Å; H1694-K1699 PolarHBondContact O-N 3.12Å
1695L81.5Confident82.3Confident8 Ų817.9 Ų17.94%0.0428%0.083CC..Iπ-helixtrans-70-55.7-178.2-18074.4000112.3L1557 H1691 L1693 K1699 Q1700 P1802 I1805L1557-L1695 HydrophobicContact CD1-CD1 4.25Å; L1557-L1695 HydrophobicContact CD2-CB 4.29Å; L1557-L1695 HydrophobicContact CD2-CD1 4.42Å; H1691-L1695 VanDerWaalsContact O-CB 3.25Å; H1691-L1695 WeakPolarHBondContact O-CB 3.34Å; H1691-L1695 PolarHBondContact O-N 3.1Å; L1693-L1695 PolarHBondContact O-N 2.93Å; L1695-K1699 PolarHBondContact O-N 3.09Å; L1695-Q1700 VanDerWaalsContact O-CB 3.3Å; L1695-Q1700 WeakPolarHBondContact O-CB 3.36Å; L1695-Q1700 PolarHBondContact O-N 3.17Å; L1695-P1802 HydrophobicContact CD1-CB 3.75Å; L1695-P1802 VanDerWaalsContact CD1-CB 3.48Å; L1695-P1802 HydrophobicContact CD1-CG 3.46Å; L1695-P1802 VanDerWaalsContact CD1-CG 3.42Å; L1695-P1802 HydrophobicContact CD2-CB 4.12Å; L1695-P1802 HydrophobicContact CD2-CG 4.27Å; L1695-P1802 HydrophobicContact CG-CB 4.47Å; L1695-P1802 HydrophobicContact CG-CG 4.28Å; L1695-I1805 HydrophobicContact CD1-CD1 4.02Å; L1695-I1805 HydrophobicContact CD1-CG1 4.32Å
1696Y81.8Confident82.9Confident35.4 Ų35.418.1 Ų18.114%0.1398%0.084CC..Iπ-helixtrans-86.8-51.4-171.2-61.2-66.1000112.2L1588 L1598 N1692 G1698 V1701 T1804L1588-Y1696 WeakPolarHBondContact CD1-O 3.49Å; L1598-Y1696 HydrophobicContact CB-CD1 4.14Å; L1598-Y1696 HydrophobicContact CB-CE1 3.72Å; L1598-Y1696 HydrophobicContact CB-CE2 4.35Å; L1598-Y1696 HydrophobicContact CD1-CE1 4.16Å; L1598-Y1696 HydrophobicContact CG-CE1 4.43Å; L1598-Y1696 WeakPolarHBondContact O-CD2 3.38Å; L1598-Y1696 WeakPolarHBondContact O-CE2 3.39Å; N1692-Y1696 HydrophobicContact CB-CD2 3.95Å; N1692-Y1696 HydrophobicContact CB-CE2 4.34Å; N1692-Y1696 WeakPolarHBondContact O-CA 3.42Å; N1692-Y1696 VanDerWaalsContact O-CB 3.27Å; N1692-Y1696 WeakPolarHBondContact O-CB 3.27Å; N1692-Y1696 VanDerWaalsContact O-CD2 3.3Å; N1692-Y1696 WeakPolarHBondContact O-CD2 3.31Å; N1692-Y1696 PolarHBondContact O-N 3.07Å; N1692-Y1696 WeakPolarHBondContact OD1-CE2 3.23Å; Y1696-G1698 VanDerWaalsContact C-N 3.34Å; Y1696-V1701 WeakPolarHBondContact O-CG1 3.44Å; Y1696-V1701 WeakPolarHBondContact O-CG2 3.28Å; Y1696-V1701 PolarHBondContact O-N 3.31Å; Y1696-T1804 HydrophobicContact CE1-CG2 4.2Å
1697A76.8Confident83.7Confident1.2 Ų1.219.3 Ų19.31%0.019%0.086CC..Iπ-helixtrans-77.4-24.2-177.100000113.3N1471 L1587 L1588 N1692 L1693 V1701N1471-A1697 WeakPolarHBondContact CB-O 3.43Å; N1471-A1697 PolarHBondContact ND2-O 3.42Å; L1587-A1697 HydrophobicContact CB-CB 4.15Å; L1588-A1697 HydrophobicContact CD1-CB 3.69Å; L1588-A1697 VanDerWaalsContact CD1-CB 3.49Å; L1588-A1697 VanDerWaalsContact CD2-CA 3.41Å; L1588-A1697 HydrophobicContact CD2-CB 4.11Å; L1588-A1697 HydrophobicContact CG-CB 3.67Å; N1692-A1697 PolarHBondContact O-N 2.87Å; L1693-A1697 HydrophobicContact CD1-CB 4.02Å; L1693-A1697 HydrophobicContact CG-CB 4.36Å; L1693-A1697 CarbonylContact O-C 3.53Å; L1693-A1697 VanDerWaalsContact O-CA 3.28Å; L1693-A1697 WeakPolarHBondContact O-CA 3.37Å; L1693-A1697 VanDerWaalsContact O-CB 3.24Å; L1693-A1697 WeakPolarHBondContact O-CB 3.35Å; L1693-A1697 PolarHBondContact O-N 3.29Å; L1693-A1697 VanDerWaalsContact O-N 3.1Å; A1697-V1701 WeakPolarHBondContact O-CG2 3.47Å
1698G83.2Confident84.4Confident0 Ų017.7 Ų17.70%08%0.079CC..Iπ-helixtrans-96.1-86174.100000112.5L1693 H1694 Y1696 Q1700 V1701 A1702L1693-G1698 PolarHBondContact O-N 2.92Å; L1693-G1698 VanDerWaalsContact O-N 3.08Å; H1694-G1698 CarbonylContact O-C 3.52Å; H1694-G1698 WeakPolarHBondContact O-CA 3.32Å; H1694-G1698 PolarHBondContact O-N 3.06Å; Y1696-G1698 VanDerWaalsContact C-N 3.34Å; G1698-Q1700 PolarHBondContact O-N 3.32Å; G1698-V1701 VanDerWaalsContact O-CG2 3.3Å; G1698-V1701 WeakPolarHBondContact O-CG2 3.18Å; G1698-A1702 WeakPolarHBondContact O-CB 3.38Å; G1698-A1702 PolarHBondContact O-N 3.26Å; G1698-A1702 VanDerWaalsContact O-N 3.09Å
1699K84.3Confident84.9Confident3.4 Ų3.414.9 Ų14.92%0.0157%0.068CC..Iπ-helixtrans-63.5-48.1-165.4-70-172.7172.5-178.30113.8L1470 N1552 T1553 L1557 H1694 L1695 V1701 A1702 I1703 I1805L1470-K1699 HydrophobicContact CD1-CG 3.9Å; N1552-K1699 PolarHBondContact O-NZ 2.91Å; T1553-K1699 HydrophobicContact CG2-CD 4.18Å; L1557-K1699 HydrophobicContact CD1-CD 4Å; L1557-K1699 HydrophobicContact CD2-CD 4.18Å; H1694-K1699 VanDerWaalsContact CE1-CE 3.44Å; H1694-K1699 WeakPolarHBondContact CE1-CE 3.4Å; H1694-K1699 PolarHBondContact CE1-NZ 3.09Å; H1694-K1699 PolarHBondContact O-N 3.12Å; L1695-K1699 PolarHBondContact O-N 3.09Å; K1699-V1701 VanDerWaalsContact C-N 3.3Å; K1699-V1701 PolarHBondContact O-N 3.08Å; K1699-A1702 WeakPolarHBondContact O-CB 3.39Å; K1699-A1702 PolarHBondContact O-N 3Å; K1699-I1703 HydrophobicContact CB-CD1 4.36Å; K1699-I1703 WeakPolarHBondContact O-CB 3.35Å; K1699-I1703 VanDerWaalsContact O-CD1 3.24Å; K1699-I1703 WeakPolarHBondContact O-CD1 3.27Å; K1699-I1703 VanDerWaalsContact O-CG1 3.3Å; K1699-I1703 WeakPolarHBondContact O-CG1 3.31Å; K1699-I1703 PolarHBondContact O-N 2.93Å; K1699-I1805 HydrophobicContact CB-CD1 4.22Å
1700Q84.9Confident85.4Confident15.8 Ų15.814.2 Ų14.27%0.0747%0.065CC..Iπ-helixtrans-63.6-44.7-176.2-179.8170.7-23.800112.2T1595 L1695 G1698 A1702 I1703 E1704 T1804 L1808T1595-Q1700 VanDerWaalsContact CG2-NE2 3.32Å; L1695-Q1700 VanDerWaalsContact O-CB 3.3Å; L1695-Q1700 WeakPolarHBondContact O-CB 3.36Å; L1695-Q1700 PolarHBondContact O-N 3.17Å; G1698-Q1700 PolarHBondContact O-N 3.32Å; Q1700-A1702 VanDerWaalsContact C-N 3.32Å; Q1700-I1703 PolarHBondContact O-N 3.14Å; Q1700-E1704 WeakPolarHBondContact O-CB 3.2Å; Q1700-E1704 PolarHBondContact O-N 3.05Å; Q1700-T1804 VanDerWaalsContact OE1-CB 3.27Å; Q1700-T1804 PolarHBondContact OE1-OG1 3.29Å; Q1700-T1804 VanDerWaalsContact OE1-OG1 3.05Å; Q1700-L1808 HydrophobicContact CG-CD1 4.06Å
1701V84.9Confident86Confident8.6 Ų8.614.1 Ų14.15%0.0526%0.064CC..Hα-helixtrans-69.8-36.2179.1-170.10000111.8N1474 L1588 Y1696 A1697 G1698 K1699 I1703 E1704 A1705N1474-V1701 HydrophobicContact CB-CB 4.39Å; N1474-V1701 HydrophobicContact CB-CG1 3.91Å; N1474-V1701 HydrophobicContact CB-CG2 4.17Å; N1474-V1701 VanDerWaalsContact ND2-CG1 3.26Å; N1474-V1701 WeakPolarHBondContact ND2-CG1 3.38Å; N1474-V1701 VanDerWaalsContact OD1-CG1 3.27Å; N1474-V1701 WeakPolarHBondContact OD1-CG1 3.37Å; N1474-V1701 PolarHBondContact OD1-O 3.23Å; N1474-V1701 VanDerWaalsContact OD1-O 3.08Å; L1588-V1701 HydrophobicContact CD1-CG2 3.51Å; L1588-V1701 HydrophobicContact CD2-CB 4.29Å; L1588-V1701 HydrophobicContact CD2-CG1 3.89Å; L1588-V1701 HydrophobicContact CD2-CG2 3.75Å; L1588-V1701 HydrophobicContact CG-CG2 4.34Å; Y1696-V1701 WeakPolarHBondContact O-CG1 3.44Å; Y1696-V1701 WeakPolarHBondContact O-CG2 3.28Å; Y1696-V1701 PolarHBondContact O-N 3.31Å; A1697-V1701 WeakPolarHBondContact O-CG2 3.47Å; G1698-V1701 VanDerWaalsContact O-CG2 3.3Å; G1698-V1701 WeakPolarHBondContact O-CG2 3.18Å; K1699-V1701 VanDerWaalsContact C-N 3.3Å; K1699-V1701 PolarHBondContact O-N 3.08Å; V1701-I1703 VanDerWaalsContact C-N 3.35Å; V1701-E1704 PolarHBondContact O-N 3.11Å; V1701-A1705 PolarHBondContact O-N 3.19Å; V1701-A1705 VanDerWaalsContact O-N 3.14Å
1702A87.3Confident86.6Confident0 Ų015.3 Ų15.30%07%0.071CC..Hα-helixtrans-61.6-43.5172.200000112.4L1470 F1547 L1551 G1698 K1699 Q1700 E1704 A1705 W1706L1470-A1702 HydrophobicContact CB-CB 4.34Å; L1470-A1702 HydrophobicContact CD2-CB 4.31Å; F1547-A1702 HydrophobicContact CE1-CB 4.07Å; F1547-A1702 WeakPolarHBondContact CE1-O 3.3Å; F1547-A1702 HydrophobicContact CZ-CB 3.94Å; L1551-A1702 HydrophobicContact CD2-CB 3.72Å; G1698-A1702 WeakPolarHBondContact O-CB 3.38Å; G1698-A1702 PolarHBondContact O-N 3.26Å; G1698-A1702 VanDerWaalsContact O-N 3.09Å; K1699-A1702 WeakPolarHBondContact O-CB 3.39Å; K1699-A1702 PolarHBondContact O-N 3Å; Q1700-A1702 VanDerWaalsContact C-N 3.32Å; A1702-E1704 VanDerWaalsContact C-N 3.34Å; A1702-A1705 PolarHBondContact O-N 3.05Å; A1702-W1706 WeakPolarHBondContact O-CB 3.38Å; A1702-W1706 PolarHBondContact O-N 3.04Å
1703I87.2Confident87.1Confident6.6 Ų6.614.6 Ų14.63%0.0347%0.067CC..Hα-helixtrans-65.5-39.8176.1-71.9160.1000111.5L1551 T1553 K1699 Q1700 V1701 A1705 W1706 R1707 I1805 L1808L1551-I1703 HydrophobicContact CB-CD1 4.25Å; L1551-I1703 HydrophobicContact CB-CG1 4.25Å; L1551-I1703 HydrophobicContact CD1-CB 4.46Å; L1551-I1703 HydrophobicContact CD1-CD1 4.31Å; L1551-I1703 HydrophobicContact CD1-CG1 3.4Å; L1551-I1703 VanDerWaalsContact CD1-CG1 3.43Å; L1551-I1703 HydrophobicContact CD2-CD1 4.23Å; L1551-I1703 HydrophobicContact CD2-CG1 3.78Å; L1551-I1703 HydrophobicContact CG-CD1 4.38Å; L1551-I1703 HydrophobicContact CG-CG1 4.02Å; T1553-I1703 HydrophobicContact CG2-CD1 4.42Å; K1699-I1703 HydrophobicContact CB-CD1 4.36Å; K1699-I1703 WeakPolarHBondContact O-CB 3.35Å; K1699-I1703 VanDerWaalsContact O-CD1 3.24Å; K1699-I1703 WeakPolarHBondContact O-CD1 3.27Å; K1699-I1703 VanDerWaalsContact O-CG1 3.3Å; K1699-I1703 WeakPolarHBondContact O-CG1 3.31Å; K1699-I1703 PolarHBondContact O-N 2.93Å; Q1700-I1703 PolarHBondContact O-N 3.14Å; V1701-I1703 VanDerWaalsContact C-N 3.35Å; I1703-A1705 VanDerWaalsContact C-N 3.33Å; I1703-A1705 PolarHBondContact O-N 3.05Å; I1703-W1706 PolarHBondContact O-N 3.14Å; I1703-R1707 VanDerWaalsContact O-CB 3.31Å; I1703-R1707 WeakPolarHBondContact O-CB 3.37Å; I1703-R1707 PolarHBondContact O-N 3.14Å; I1703-I1805 HydrophobicContact CD1-CB 4.12Å; I1703-I1805 HydrophobicContact CD1-CD1 3.62Å; I1703-I1805 HydrophobicContact CD1-CG1 3.65Å; I1703-I1805 HydrophobicContact CD1-CG2 3.48Å; I1703-I1805 HydrophobicContact CG1-CG2 4.47Å; I1703-L1808 HydrophobicContact CG2-CB 4.25Å; I1703-L1808 HydrophobicContact CG2-CD1 4.16Å
1704E88.3Confident87.5Confident30.4 Ų30.414.4 Ų14.414%0.1427%0.066CC..Hα-helixtrans-62.1-41.7176.3-179.556.1-157.800111.6Q1700 V1701 A1702 R1707 Q1708 L1808Q1700-E1704 WeakPolarHBondContact O-CB 3.2Å; Q1700-E1704 PolarHBondContact O-N 3.05Å; V1701-E1704 PolarHBondContact O-N 3.11Å; A1702-E1704 VanDerWaalsContact C-N 3.34Å; E1704-R1707 WeakPolarHBondContact O-CB 3.38Å; E1704-R1707 PolarHBondContact O-N 3.2Å; E1704-R1707 IonicContact OE1-CZ 3.03Å; E1704-R1707 IonicContact OE1-NE 3.05Å; E1704-R1707 PolarHBondContact OE1-NE 3.31Å; E1704-R1707 IonicContact OE1-NH2 3.28Å; E1704-R1707 PolarHBondContact OE1-NH2 3.29Å; E1704-R1707 IonicContact OE2-CZ 3.48Å; E1704-R1707 IonicContact OE2-NE 3.32Å; E1704-R1707 PolarHBondContact OE2-NE 3.15Å; E1704-R1707 IonicContact OE2-NH2 3.09Å; E1704-Q1708 VanDerWaalsContact O-CG 3.31Å; E1704-Q1708 WeakPolarHBondContact O-CG 3.4Å; E1704-Q1708 PolarHBondContact O-N 2.84Å; E1704-Q1708 PolarHBondContact OE1-NE2 3.07Å; E1704-L1808 HydrophobicContact CB-CD1 4.06Å; E1704-L1808 VanDerWaalsContact OE2-CD2 3.28Å; E1704-L1808 WeakPolarHBondContact OE2-CD2 3.29Å
1705A90.3Very high87.8Confident0 Ų014.3 Ų14.30%07%0.069CC..Hα-helixtrans-67.5-41.6175.600000112.8N1474 L1477 R1478 V1701 A1702 I1703 R1707 Q1708 A1709N1474-A1705 HydrophobicContact CB-CB 4.09Å; N1474-A1705 VanDerWaalsContact O-CB 3.31Å; N1474-A1705 WeakPolarHBondContact O-CB 3.33Å; N1474-A1705 WeakPolarHBondContact OD1-CB 3.33Å; L1477-A1705 HydrophobicContact CB-CB 3.75Å; L1477-A1705 HydrophobicContact CD1-CB 4.38Å; R1478-A1705 HydrophobicContact CG-CB 3.75Å; V1701-A1705 PolarHBondContact O-N 3.19Å; V1701-A1705 VanDerWaalsContact O-N 3.14Å; A1702-A1705 PolarHBondContact O-N 3.05Å; I1703-A1705 VanDerWaalsContact C-N 3.33Å; I1703-A1705 PolarHBondContact O-N 3.05Å; A1705-R1707 VanDerWaalsContact C-N 3.33Å; A1705-R1707 PolarHBondContact O-N 3.31Å; A1705-Q1708 PolarHBondContact O-N 3.07Å; A1705-A1709 WeakPolarHBondContact O-CB 3.38Å; A1705-A1709 PolarHBondContact O-N 3.25Å
1706W91.4Very high87.9Confident3.4 Ų3.415.3 Ų15.31%0.0137%0.074CC..Hα-helixtrans-59.1-46.2174.2177.291.5000111.1L1477 L1544 F1547 L1548 L1551 A1702 I1703 Q1708 A1709 V1710 V1787 L1791 T1812L1477-W1706 HydrophobicContact CD1-CB 4.23Å; L1544-W1706 HydrophobicContact CD2-CZ2 3.99Å; L1544-W1706 HydrophobicContact CG-CZ2 4.07Å; L1544-W1706 PolarHBondContact O-NE1 3.15Å; F1547-W1706 HydrophobicContact CD1-CB 3.84Å; F1547-W1706 AromaticContact CD1-CD1 3.52Å; F1547-W1706 VanDerWaalsContact CD1-CD1 3.46Å; F1547-W1706 AromaticContact CD1-CG 3.92Å; F1547-W1706 HydrophobicContact CD1-CG 3.94Å; F1547-W1706 HydrophobicContact CE1-CB 3.93Å; F1547-W1706 HydrophobicContact CE1-CG 4.47Å; F1547-W1706 AromaticContact CG-CD1 3.96Å; L1548-W1706 HydrophobicContact CD1-CH2 4.01Å; L1548-W1706 HydrophobicContact CD1-CZ2 3.55Å; L1548-W1706 VanDerWaalsContact CD1-CZ2 3.46Å; L1548-W1706 HydrophobicContact CD2-CD2 4.09Å; L1548-W1706 HydrophobicContact CD2-CE3 4.31Å; L1548-W1706 HydrophobicContact CD2-CH2 3.98Å; L1548-W1706 HydrophobicContact CD2-CZ2 3.7Å; L1548-W1706 HydrophobicContact CD2-CZ3 4.27Å; L1548-W1706 HydrophobicContact CG-CD2 4.46Å; L1548-W1706 HydrophobicContact CG-CH2 4.32Å; L1548-W1706 HydrophobicContact CG-CZ2 3.63Å; L1551-W1706 HydrophobicContact CD1-CB 4.44Å; L1551-W1706 HydrophobicContact CD1-CG 4.48Å; A1702-W1706 WeakPolarHBondContact O-CB 3.38Å; A1702-W1706 PolarHBondContact O-N 3.04Å; I1703-W1706 PolarHBondContact O-N 3.14Å; W1706-Q1708 VanDerWaalsContact C-N 3.35Å; W1706-Q1708 PolarHBondContact O-N 3.34Å; W1706-A1709 PolarHBondContact O-N 3.16Å; W1706-V1710 HydrophobicContact CD2-CG2 3.87Å; W1706-V1710 HydrophobicContact CE3-CG2 4.22Å; W1706-V1710 HydrophobicContact CG-CG2 4.44Å; W1706-V1710 HydrophobicContact CH2-CG2 3.99Å; W1706-V1710 HydrophobicContact CZ2-CG2 3.64Å; W1706-V1710 HydrophobicContact CZ3-CG2 4.27Å; W1706-V1710 WeakPolarHBondContact O-CB 3.38Å; W1706-V1710 VanDerWaalsContact O-CG2 3.3Å; W1706-V1710 WeakPolarHBondContact O-CG2 3.32Å; W1706-V1710 PolarHBondContact O-N 3.12Å; W1706-V1787 HydrophobicContact CH2-CG1 4.19Å; W1706-V1787 HydrophobicContact CZ2-CG1 4.35Å; W1706-L1791 HydrophobicContact CH2-CB 4.42Å; W1706-L1791 HydrophobicContact CH2-CD1 3.94Å; W1706-L1791 HydrophobicContact CZ3-CD1 3.78Å; W1706-L1791 HydrophobicContact CZ3-CD2 4.48Å; W1706-T1812 HydrophobicContact CZ3-CG2 4.4Å
1707R91.7Very high87.8Confident53 Ų5314 Ų1420%0.27%0.07CC..Hα-helixtrans-55.1-50174.5155.1173.7116.565.920.8111.2I1703 E1704 A1705 A1709 V1710 E1711 T1812I1703-R1707 VanDerWaalsContact O-CB 3.31Å; I1703-R1707 WeakPolarHBondContact O-CB 3.37Å; I1703-R1707 PolarHBondContact O-N 3.14Å; E1704-R1707 WeakPolarHBondContact O-CB 3.38Å; E1704-R1707 PolarHBondContact O-N 3.2Å; E1704-R1707 IonicContact OE1-CZ 3.03Å; E1704-R1707 IonicContact OE1-NE 3.05Å; E1704-R1707 PolarHBondContact OE1-NE 3.31Å; E1704-R1707 IonicContact OE1-NH2 3.28Å; E1704-R1707 PolarHBondContact OE1-NH2 3.29Å; E1704-R1707 IonicContact OE2-CZ 3.48Å; E1704-R1707 IonicContact OE2-NE 3.32Å; E1704-R1707 PolarHBondContact OE2-NE 3.15Å; E1704-R1707 IonicContact OE2-NH2 3.09Å; A1705-R1707 VanDerWaalsContact C-N 3.33Å; A1705-R1707 PolarHBondContact O-N 3.31Å; R1707-A1709 VanDerWaalsContact C-N 3.34Å; R1707-A1709 PolarHBondContact O-N 3.13Å; R1707-V1710 PolarHBondContact O-N 3.19Å; R1707-E1711 WeakPolarHBondContact CD-OE1 3.43Å; R1707-E1711 HydrophobicContact CG-CG 4.37Å; R1707-E1711 VanDerWaalsContact CG-OE1 3.23Å; R1707-E1711 WeakPolarHBondContact CG-OE1 3.3Å; R1707-E1711 IonicContact CZ-OE1 3.23Å; R1707-E1711 IonicContact CZ-OE2 3.13Å; R1707-E1711 IonicContact NH1-OE1 3.62Å; R1707-E1711 PolarHBondContact NH1-OE1 3.1Å; R1707-E1711 IonicContact NH1-OE2 3.07Å; R1707-E1711 PolarHBondContact NH1-OE2 3.17Å; R1707-E1711 WeakPolarHBondContact O-CB 3.32Å; R1707-E1711 VanDerWaalsContact O-CG 3.3Å; R1707-E1711 WeakPolarHBondContact O-CG 3.38Å; R1707-E1711 PolarHBondContact O-N 3.04Å; R1707-T1812 HydrophobicContact CB-CG2 3.48Å; R1707-T1812 VanDerWaalsContact CB-CG2 3.45Å; R1707-T1812 HydrophobicContact CG-CG2 3.22Å
1708Q92.6Very high87.6Confident44.8 Ų44.814.2 Ų14.221%0.2097%0.071CC..Hα-helixtrans-60.8-43.9179.3-70.9172.314.500111.5A1481 E1704 A1705 W1706 V1710 I1712A1481-Q1708 HydrophobicContact CB-CB 4.48Å; E1704-Q1708 VanDerWaalsContact O-CG 3.31Å; E1704-Q1708 WeakPolarHBondContact O-CG 3.4Å; E1704-Q1708 PolarHBondContact O-N 2.84Å; E1704-Q1708 PolarHBondContact OE1-NE2 3.07Å; A1705-Q1708 PolarHBondContact O-N 3.07Å; W1706-Q1708 VanDerWaalsContact C-N 3.35Å; W1706-Q1708 PolarHBondContact O-N 3.34Å; Q1708-V1710 PolarHBondContact O-N 3.47Å; Q1708-I1712 VanDerWaalsContact O-CB 3.26Å; Q1708-I1712 WeakPolarHBondContact O-CB 3.44Å; Q1708-I1712 WeakPolarHBondContact O-CD1 3.3Å; Q1708-I1712 VanDerWaalsContact O-CG1 3.25Å; Q1708-I1712 WeakPolarHBondContact O-CG1 3.36Å; Q1708-I1712 PolarHBondContact O-N 3.03Å
1709A92.8Very high86.4Confident0 Ų016.3 Ų16.30%08%0.082CC..Hα-helixtrans-61.9-43.917700000112.3L1477 Y1480 F1503 A1705 W1706 R1707 S1713L1477-A1709 HydrophobicContact CD2-CB 4.21Å; Y1480-A1709 HydrophobicContact CD1-CB 3.75Å; Y1480-A1709 HydrophobicContact CE1-CB 3.88Å; F1503-A1709 HydrophobicContact CE1-CB 4.33Å; F1503-A1709 HydrophobicContact CE2-CB 3.93Å; F1503-A1709 HydrophobicContact CZ-CB 3.62Å; A1705-A1709 WeakPolarHBondContact O-CB 3.38Å; A1705-A1709 PolarHBondContact O-N 3.25Å; W1706-A1709 PolarHBondContact O-N 3.16Å; R1707-A1709 VanDerWaalsContact C-N 3.34Å; R1707-A1709 PolarHBondContact O-N 3.13Å; A1709-S1713 VanDerWaalsContact O-CB 3.22Å; A1709-S1713 WeakPolarHBondContact O-CB 3.42Å; A1709-S1713 PolarHBondContact O-N 3.18Å; A1709-S1713 PolarHBondContact O-OG 3.3Å
1710V92.5Very high84.7Confident0 Ų022.2 Ų22.20%011%0.109CC..Hα-helixtrans-67.4-49.8177.9171.50000111.8F1503 L1544 W1706 R1707 Q1708 I1712 S1713 L1714 V1787 L1816F1503-V1710 HydrophobicContact CE1-CG2 4.01Å; F1503-V1710 HydrophobicContact CZ-CG2 3.87Å; L1544-V1710 HydrophobicContact CD1-CG1 4.4Å; L1544-V1710 HydrophobicContact CD1-CG2 3.76Å; L1544-V1710 HydrophobicContact CG-CG2 3.98Å; W1706-V1710 HydrophobicContact CD2-CG2 3.87Å; W1706-V1710 HydrophobicContact CE3-CG2 4.22Å; W1706-V1710 HydrophobicContact CG-CG2 4.44Å; W1706-V1710 HydrophobicContact CH2-CG2 3.99Å; W1706-V1710 HydrophobicContact CZ2-CG2 3.64Å; W1706-V1710 HydrophobicContact CZ3-CG2 4.27Å; W1706-V1710 WeakPolarHBondContact O-CB 3.38Å; W1706-V1710 VanDerWaalsContact O-CG2 3.3Å; W1706-V1710 WeakPolarHBondContact O-CG2 3.32Å; W1706-V1710 PolarHBondContact O-N 3.12Å; R1707-V1710 PolarHBondContact O-N 3.19Å; Q1708-V1710 PolarHBondContact O-N 3.47Å; V1710-I1712 VanDerWaalsContact C-N 3.34Å; V1710-I1712 PolarHBondContact O-N 3.17Å; V1710-S1713 WeakPolarHBondContact CA-OG 3.37Å; V1710-S1713 PolarHBondContact O-N 3.12Å; V1710-S1713 PolarHBondContact O-OG 3.19Å; V1710-S1713 VanDerWaalsContact O-OG 3.05Å; V1710-L1714 HydrophobicContact CG1-CD1 3.89Å; V1710-L1714 HydrophobicContact CG1-CG 4.4Å; V1710-L1714 WeakPolarHBondContact O-CB 3.3Å; V1710-L1714 WeakPolarHBondContact O-CG 3.39Å; V1710-L1714 PolarHBondContact O-N 3.2Å; V1710-V1787 HydrophobicContact CG1-CG1 3.95Å; V1710-L1816 HydrophobicContact CG1-CD1 4.49Å; V1710-L1816 HydrophobicContact CG1-CD2 4.23Å
1711E92.8Very high82.6Confident28.8 Ų28.823.4 Ų23.414%0.13513%0.126CC..Hα-helixtrans-63.4-40.2-178.9-72.8177.9-175.700111.8R1707 G1715 T1812 T1815 F1819R1707-E1711 WeakPolarHBondContact CD-OE1 3.43Å; R1707-E1711 HydrophobicContact CG-CG 4.37Å; R1707-E1711 VanDerWaalsContact CG-OE1 3.23Å; R1707-E1711 WeakPolarHBondContact CG-OE1 3.3Å; R1707-E1711 IonicContact CZ-OE1 3.23Å; R1707-E1711 IonicContact CZ-OE2 3.13Å; R1707-E1711 IonicContact NH1-OE1 3.62Å; R1707-E1711 PolarHBondContact NH1-OE1 3.1Å; R1707-E1711 IonicContact NH1-OE2 3.07Å; R1707-E1711 PolarHBondContact NH1-OE2 3.17Å; R1707-E1711 WeakPolarHBondContact O-CB 3.32Å; R1707-E1711 VanDerWaalsContact O-CG 3.3Å; R1707-E1711 WeakPolarHBondContact O-CG 3.38Å; R1707-E1711 PolarHBondContact O-N 3.04Å; E1711-G1715 VanDerWaalsContact O-CA 3.3Å; E1711-G1715 WeakPolarHBondContact O-CA 3.37Å; E1711-G1715 PolarHBondContact O-N 3.15Å; E1711-T1812 HydrophobicContact CG-CG2 4.2Å; E1711-T1812 WeakPolarHBondContact OE1-CA 3.33Å; E1711-T1812 VanDerWaalsContact OE1-CG2 3.3Å; E1711-T1812 WeakPolarHBondContact OE1-CG2 3.36Å; E1711-T1815 HydrophobicContact CB-CG2 4.35Å; E1711-T1815 HydrophobicContact CG-CG2 3.88Å; E1711-T1815 WeakPolarHBondContact CG-OG1 3.23Å; E1711-T1815 PolarHBondContact OE1-OG1 3.15Å; E1711-T1815 VanDerWaalsContact OE1-OG1 3.05Å; E1711-F1819 VanDerWaalsContact O-CE2 3.24Å; E1711-F1819 WeakPolarHBondContact O-CE2 3.25Å; E1711-F1819 WeakPolarHBondContact O-CZ 3.36Å
1712I92.1Very high80.2Confident47.6 Ų47.630.4 Ų30.424%0.24416%0.158CC..Hα-helixtrans-71.6-45.7178-68.4169.4000110.6A1481 I1484 R1485 Q1708 V1710 L1714 G1715 L1716A1481-I1712 HydrophobicContact CB-CD1 3.7Å; I1484-I1712 HydrophobicContact CG2-CG2 3.83Å; R1485-I1712 HydrophobicContact CB-CG2 4.01Å; Q1708-I1712 VanDerWaalsContact O-CB 3.26Å; Q1708-I1712 WeakPolarHBondContact O-CB 3.44Å; Q1708-I1712 WeakPolarHBondContact O-CD1 3.3Å; Q1708-I1712 VanDerWaalsContact O-CG1 3.25Å; Q1708-I1712 WeakPolarHBondContact O-CG1 3.36Å; Q1708-I1712 PolarHBondContact O-N 3.03Å; V1710-I1712 VanDerWaalsContact C-N 3.34Å; V1710-I1712 PolarHBondContact O-N 3.17Å; I1712-L1714 PolarHBondContact O-N 3.16Å; I1712-G1715 PolarHBondContact O-N 3.08Å; I1712-L1716 HydrophobicContact CG2-CD1 4.11Å; I1712-L1716 HydrophobicContact CG2-CG 4.43Å; I1712-L1716 WeakPolarHBondContact O-CB 3.28Å; I1712-L1716 WeakPolarHBondContact O-CG 3.27Å; I1712-L1716 PolarHBondContact O-N 3.13Å
1713S90.5Very high77.6Confident0 Ų040.5 Ų40.50%020%0.198CC..Hα-helixtrans-62.2-47.4-179.5550000112.5A1709 V1710 L1716 M1717A1709-S1713 VanDerWaalsContact O-CB 3.22Å; A1709-S1713 WeakPolarHBondContact O-CB 3.42Å; A1709-S1713 PolarHBondContact O-N 3.18Å; A1709-S1713 PolarHBondContact O-OG 3.3Å; V1710-S1713 WeakPolarHBondContact CA-OG 3.37Å; V1710-S1713 PolarHBondContact O-N 3.12Å; V1710-S1713 PolarHBondContact O-OG 3.19Å; V1710-S1713 VanDerWaalsContact O-OG 3.05Å; S1713-L1716 PolarHBondContact O-N 3.25Å; S1713-M1717 WeakPolarHBondContact O-CG 3.3Å; S1713-M1717 PolarHBondContact O-N 2.99Å
1714L88.9Confident74.8Confident0 Ų046.9 Ų46.90%023%0.232CC..Hα-helixtrans-73-35.1177-67.5175.9000112.1L1504 V1710 I1712 L1716 M1717 T1718 L1783 V1787 L1816 F1819L1504-L1714 HydrophobicContact CD2-CD2 4Å; V1710-L1714 HydrophobicContact CG1-CD1 3.89Å; V1710-L1714 HydrophobicContact CG1-CG 4.4Å; V1710-L1714 WeakPolarHBondContact O-CB 3.3Å; V1710-L1714 WeakPolarHBondContact O-CG 3.39Å; V1710-L1714 PolarHBondContact O-N 3.2Å; I1712-L1714 PolarHBondContact O-N 3.16Å; L1714-L1716 VanDerWaalsContact C-N 3.31Å; L1714-L1716 PolarHBondContact O-N 3.13Å; L1714-M1717 HydrophobicContact CD2-SD 4.27Å; L1714-M1717 CarbonylContact O-C 3.55Å; L1714-M1717 WeakPolarHBondContact O-CA 3.26Å; L1714-M1717 WeakPolarHBondContact O-CB 3.38Å; L1714-M1717 PolarHBondContact O-N 3.21Å; L1714-T1718 VanDerWaalsContact O-CG2 3.25Å; L1714-T1718 WeakPolarHBondContact O-CG2 3.41Å; L1714-T1718 PolarHBondContact O-N 3.11Å; L1714-T1718 PolarHBondContact O-OG1 3.05Å; L1714-L1783 HydrophobicContact CD1-CD2 4.19Å; L1714-L1783 HydrophobicContact CD2-CB 4.29Å; L1714-L1783 HydrophobicContact CD2-CD2 3.09Å; L1714-L1783 HydrophobicContact CG-CD2 4.28Å; L1714-V1787 HydrophobicContact CD1-CG2 4.31Å; L1714-L1816 HydrophobicContact CB-CD2 4.42Å; L1714-L1816 HydrophobicContact CD1-CD2 3.39Å; L1714-L1816 VanDerWaalsContact CD1-CD2 3.42Å; L1714-F1819 HydrophobicContact CB-CD2 4.18Å; L1714-F1819 HydrophobicContact CB-CE2 4.39Å
1715G87.2Confident72.1Confident13.6 Ų13.650.4 Ų50.414%0.1426%0.26CS..Hα-helixtrans-59.7-40.1174.600000112.6E1711 I1712 M1717 T1718 N1719 F1819E1711-G1715 VanDerWaalsContact O-CA 3.3Å; E1711-G1715 WeakPolarHBondContact O-CA 3.37Å; E1711-G1715 PolarHBondContact O-N 3.15Å; I1712-G1715 PolarHBondContact O-N 3.08Å; G1715-M1717 VanDerWaalsContact C-N 3.28Å; G1715-M1717 PolarHBondContact O-N 3.14Å; G1715-T1718 WeakPolarHBondContact CA-OG1 3.32Å; G1715-T1718 PolarHBondContact O-N 3.1Å; G1715-T1718 VanDerWaalsContact O-N 3.15Å; G1715-T1718 PolarHBondContact O-OG1 3.26Å; G1715-N1719 VanDerWaalsContact O-CB 3.32Å; G1715-N1719 WeakPolarHBondContact O-CB 3.14Å; G1715-N1719 PolarHBondContact O-N 3.12Å; G1715-N1719 PolarHBondContact O-ND2 2.92Å; G1715-N1719 PolarHBondContact O-OD1 3.24Å; G1715-F1819 VanDerWaalsContact CA-CE2 3.45Å; G1715-F1819 VanDerWaalsContact N-CE2 3.34Å
1716L84.6Confident69.2Low29.2 Ų29.253.3 Ų53.315%0.15329%0.29CS..Hα-helixtrans-63.4-30173.6-72.6171.2000112.7I1484 A1488 I1712 S1713 L1714 T1718 V1743I1484-L1716 HydrophobicContact CB-CD1 4.49Å; I1484-L1716 HydrophobicContact CD1-CD1 4.31Å; I1484-L1716 HydrophobicContact CG1-CD1 3.88Å; I1484-L1716 HydrophobicContact CG2-CD1 4.17Å; A1488-L1716 HydrophobicContact CB-CD1 3.91Å; A1488-L1716 HydrophobicContact CB-CD2 3.6Å; A1488-L1716 HydrophobicContact CB-CG 4.35Å; I1712-L1716 HydrophobicContact CG2-CD1 4.11Å; I1712-L1716 HydrophobicContact CG2-CG 4.43Å; I1712-L1716 WeakPolarHBondContact O-CB 3.28Å; I1712-L1716 WeakPolarHBondContact O-CG 3.27Å; I1712-L1716 PolarHBondContact O-N 3.13Å; S1713-L1716 PolarHBondContact O-N 3.25Å; L1714-L1716 VanDerWaalsContact C-N 3.31Å; L1714-L1716 PolarHBondContact O-N 3.13Å; L1716-T1718 VanDerWaalsContact C-N 3.32Å; L1716-V1743 HydrophobicContact CB-CG2 4.2Å; L1716-V1743 HydrophobicContact CD2-CG1 4.4Å; L1716-V1743 HydrophobicContact CD2-CG2 4.42Å; L1716-V1743 VanDerWaalsContact O-CB 3.26Å; L1716-V1743 WeakPolarHBondContact O-CB 3.35Å; L1716-V1743 VanDerWaalsContact O-CG2 3.27Å; L1716-V1743 WeakPolarHBondContact O-CG2 3.46Å
1717M79.4Confident66.3Low8.4 Ų8.458.8 Ų58.84%0.04132%0.32CS..Hα-helixtrans-82.7-19.6176.8-61.9177.473.500112.8L1500 L1504 L1508 S1713 L1714 G1715 P1744 L1747 L1751 V1780 L1783L1500-M1717 HydrophobicContact CD1-CG 4.41Å; L1500-M1717 HydrophobicContact CD1-SD 4.5Å; L1500-M1717 HydrophobicContact CD2-SD 4.43Å; L1504-M1717 HydrophobicContact CD2-SD 4.43Å; L1508-M1717 HydrophobicContact CD2-CE 3.93Å; L1508-M1717 HydrophobicContact CD2-SD 4.36Å; S1713-M1717 WeakPolarHBondContact O-CG 3.3Å; S1713-M1717 PolarHBondContact O-N 2.99Å; L1714-M1717 HydrophobicContact CD2-SD 4.27Å; L1714-M1717 CarbonylContact O-C 3.55Å; L1714-M1717 WeakPolarHBondContact O-CA 3.26Å; L1714-M1717 WeakPolarHBondContact O-CB 3.38Å; L1714-M1717 PolarHBondContact O-N 3.21Å; G1715-M1717 VanDerWaalsContact C-N 3.28Å; G1715-M1717 PolarHBondContact O-N 3.14Å; M1717-P1744 WeakPolarHBondContact O-CB 3.37Å; M1717-P1744 WeakPolarHBondContact O-CG 3.38Å; M1717-L1747 HydrophobicContact CE-CD1 4.07Å; M1717-L1747 HydrophobicContact CG-CD1 4.15Å; M1717-L1747 HydrophobicContact SD-CD1 4.4Å; M1717-L1751 HydrophobicContact CE-CD1 4.33Å; M1717-V1780 HydrophobicContact CB-CG1 4.18Å; M1717-V1780 HydrophobicContact CB-CG2 4.08Å; M1717-V1780 HydrophobicContact CE-CG2 4.11Å; M1717-L1783 HydrophobicContact CE-CD1 3.79Å
1718T72.7Confident63.4Low5.2 Ų5.262.8 Ų62.83%0.03235%0.345CS..SBendtrans-90.592.2179.362.20000111.8L1714 G1715 L1716 Q1720 V1780 F1819 Q1823L1714-T1718 VanDerWaalsContact O-CG2 3.25Å; L1714-T1718 WeakPolarHBondContact O-CG2 3.41Å; L1714-T1718 PolarHBondContact O-N 3.11Å; L1714-T1718 PolarHBondContact O-OG1 3.05Å; G1715-T1718 WeakPolarHBondContact CA-OG1 3.32Å; G1715-T1718 PolarHBondContact O-N 3.1Å; G1715-T1718 VanDerWaalsContact O-N 3.15Å; G1715-T1718 PolarHBondContact O-OG1 3.26Å; L1716-T1718 VanDerWaalsContact C-N 3.32Å; T1718-Q1720 PolarHBondContact O-N 3.1Å; T1718-V1780 HydrophobicContact CG2-CG1 3.74Å; T1718-F1819 HydrophobicContact CG2-CB 3.55Å; T1718-F1819 VanDerWaalsContact CG2-CB 3.48Å; T1718-F1819 HydrophobicContact CG2-CD1 4.32Å; T1718-F1819 HydrophobicContact CG2-CD2 4.25Å; T1718-F1819 HydrophobicContact CG2-CG 3.87Å; T1718-F1819 WeakPolarHBondContact OG1-CD1 3.19Å; T1718-F1819 WeakPolarHBondContact OG1-CG 3.42Å; T1718-Q1823 PolarHBondContact O-NE2 2.95Å
1719N58.4Low60.5Low43.4 Ų43.467.1 Ų67.123%0.23237%0.37CS..  trans-52.888.1172.4-82.7-18.9000110.1G1715 G1721 S1742 P1744 Y1826G1715-N1719 VanDerWaalsContact O-CB 3.32Å; G1715-N1719 WeakPolarHBondContact O-CB 3.14Å; G1715-N1719 PolarHBondContact O-N 3.12Å; G1715-N1719 PolarHBondContact O-ND2 2.92Å; G1715-N1719 PolarHBondContact O-OD1 3.24Å; N1719-G1721 VanDerWaalsContact C-N 3.31Å; N1719-G1721 PolarHBondContact O-N 3.26Å; N1719-S1742 PolarHBondContact ND2-OG 3.4Å; N1719-S1742 WeakPolarHBondContact OD1-CB 3.35Å; N1719-S1742 PolarHBondContact OD1-OG 2.96Å; N1719-P1744 HydrophobicContact CB-CG 4.03Å; N1719-P1744 WeakPolarHBondContact OD1-CB 3.34Å; N1719-P1744 WeakPolarHBondContact OD1-CD 3.34Å; N1719-P1744 WeakPolarHBondContact OD1-CG 3.35Å; N1719-Y1826 HydrophobicContact CB-CD2 4.36Å; N1719-Y1826 HydrophobicContact CB-CE1 4.41Å; N1719-Y1826 HydrophobicContact CB-CE2 3.78Å; N1719-Y1826 VanDerWaalsContact CB-CE2 3.47Å; N1719-Y1826 VanDerWaalsContact CB-CZ 3.5Å; N1719-Y1826 VanDerWaalsContact CB-OH 3.3Å; N1719-Y1826 WeakPolarHBondContact CB-OH 3.44Å; N1719-Y1826 WeakPolarHBondContact ND2-CD1 3.37Å; N1719-Y1826 WeakPolarHBondContact ND2-CE1 3.33Å; N1719-Y1826 WeakPolarHBondContact ND2-CE2 3.37Å; N1719-Y1826 PolarHBondContact ND2-OH 3.27Å
1720Q47.8Very low57.6Low127.6 Ų127.672.9 Ų72.960%0.59640%0.4SS*.  trans-7968.3159.4-67.7-166.5-13.300108.4T1718 Q1722 S1742 P1744 Y1826T1718-Q1720 PolarHBondContact O-N 3.1Å; Q1720-Q1722 PolarHBondContact O-N 3.26Å; Q1720-S1742 PolarHBondContact NE2-OG 3.3Å; Q1720-P1744 HydrophobicContact CG-CG 3.84Å; Q1720-Y1826 HydrophobicContact CB-CE1 4.28Å
1721G41.1Very low54.6Low40.8 Ų40.879.1 Ų79.142%0.42144%0.439SS..  trans-67.2115-179.800000111N1719 Y1723N1719-G1721 VanDerWaalsContact C-N 3.31Å; N1719-G1721 PolarHBondContact O-N 3.26Å; G1721-Y1723 VanDerWaalsContact C-N 3.25Å; G1721-Y1723 PolarHBondContact O-N 3.15Å
1722Q34Very low51.6Low155.8 Ų155.883.6 Ų83.673%0.72847%0.468SS*.  trans-39.9102.7135.1-75175.5-26.400106.1Q1720 D1724Q1720-Q1722 PolarHBondContact O-N 3.26Å; Q1722-D1724 PolarHBondContact O-N 3.09Å
1723Y32.5Very low48.4Very low211.2 Ų211.290.7 Ų90.783%0.82850%0.5SS*.  trans-4684.7144.4-82-87.6000106.2G1721 S1725G1721-Y1723 VanDerWaalsContact C-N 3.25Å; G1721-Y1723 PolarHBondContact O-N 3.15Å; Y1723-S1725 VanDerWaalsContact C-N 3.26Å; Y1723-S1725 PolarHBondContact O-N 3.2Å
1724D29.9Very low45.5Very low141.2 Ų141.2101.8 Ų101.876%0.75554%0.542SS*.  trans-63.6100.6162.7-84.6-25.8000105.2Q1722 G1726Q1722-D1724 PolarHBondContact O-N 3.09Å; D1724-G1726 PolarHBondContact O-N 3.05Å
1725S30.5Very low42.6Very low104.2 Ų104.2106.8 Ų106.873%0.72958%0.576SS**  trans-52.290.6165.9-178.50000107.3Y1723 N1727Y1723-S1725 VanDerWaalsContact C-N 3.26Å; Y1723-S1725 PolarHBondContact O-N 3.2Å; S1725-N1727 VanDerWaalsContact C-N 3.25Å; S1725-N1727 PolarHBondContact O-N 3.22Å
1726G29.7Very low39.8Very low62 Ų62111.3 Ų111.364%0.63961%0.606SS**  trans-69.484.7176.700000110D1724D1724-G1726 PolarHBondContact O-N 3.05Å
1727N29.9Very low37.3Very low118 Ų118117.4 Ų117.463%0.63164%0.639SS**  trans175.176.2158.6-120-8.4000110.3S1725 E2174S1725-N1727 VanDerWaalsContact C-N 3.25Å; S1725-N1727 PolarHBondContact O-N 3.22Å; N1727-E2174 PolarHBondContact ND2-OE2 3.29Å
1728N31.7Very low34.9Very low136.2 Ų136.2125.2 Ų125.273%0.72868%0.675SS**  trans-156.977.7150.9-89.8-21.7000109.8N1730 F2140N1728-N1730 PolarHBondContact O-N 3.21Å; N1728-F2140 HydrophobicContact CB-CE1 4.36Å; N1728-F2140 HydrophobicContact CB-CE2 3.96Å; N1728-F2140 HydrophobicContact CB-CZ 3.62Å; N1728-F2140 WeakPolarHBondContact ND2-CE2 3.44Å; N1728-F2140 WeakPolarHBondContact OD1-CE1 3.2Å; N1728-F2140 WeakPolarHBondContact OD1-CZ 3.48Å
1729N31.7Very low33Very low136 Ų136130.4 Ų130.473%0.72771%0.709SS**  trans-68.784.8158.5-76.1-24.3000108.4K2163N1729-K2163 HydrophobicContact CB-CD 4.19Å
1730N31.7Very low31.8Very low121.6 Ų121.6134.8 Ų134.865%0.6573%0.73SS**  trans-168.1109.1156.1-86.5-26.1000111.4N1728 V1732 R2147N1728-N1730 PolarHBondContact O-N 3.21Å; N1730-V1732 PolarHBondContact O-N 3.3Å; N1730-V1732 VanDerWaalsContact O-N 3.11Å; N1730-R2147 VanDerWaalsContact ND2-CZ 3.26Å; N1730-R2147 PolarHBondContact ND2-NH1 3.28Å; N1730-R2147 PolarHBondContact ND2-NH2 3.34Å; N1730-R2147 PolarHBondContact OD1-NH1 3.1Å; N1730-R2147 PolarHBondContact OD1-NH2 3.28Å
1731T29.2Very low31.6Very low130.4 Ų130.4132.5 Ų132.580%0.872%0.721SS**  trans-27.1107.717259.50000113.9
1732V29.8Very low32.3Very low122.8 Ų122.8132.6 Ų132.674%0.74472%0.715SS**  -148111123.71790000110.5N1730 R1734N1730-V1732 PolarHBondContact O-N 3.3Å; N1730-V1732 VanDerWaalsContact O-N 3.11Å; V1732-R1734 VanDerWaalsContact C-N 3.25Å; V1732-R1734 HydrophobicContact CG1-CG 3.99Å; V1732-R1734 PolarHBondContact O-N 3.17Å
1733Q26Very low33.5Very low197.2 Ų197.2126.6 Ų126.692%0.92169%0.689SS**  trans-6298.3161.8-74.5175.7-15.600110.6S1735Q1733-S1735 PolarHBondContact O-N 3.08Å
1734R28.5Very low34.8Very low232.6 Ų232.6117.4 Ų117.488%0.87866%0.655SS**  trans-84.6112.2163-85.1179.4175.9-178.1-0.5108.7V1732 S1736V1732-R1734 VanDerWaalsContact C-N 3.25Å; V1732-R1734 HydrophobicContact CG1-CG 3.99Å; V1732-R1734 PolarHBondContact O-N 3.17Å; R1734-S1736 PolarHBondContact O-N 3.3Å
1735S28.6Very low36.2Very low104.4 Ų104.4112.8 Ų112.873%0.7363%0.634SS**  trans-18.5119.3158.454.60000113.8Q1733 N1737Q1733-S1735 PolarHBondContact O-N 3.08Å; S1735-N1737 VanDerWaalsContact C-N 3.34Å; S1735-N1737 PolarHBondContact O-N 3.09Å
1736S28.9Very low38.1Very low109 Ų109107.9 Ų107.976%0.76260%0.599SS**  trans-999160.3580000114.6R1734 Q1738R1734-S1736 PolarHBondContact O-N 3.3Å; S1736-Q1738 PolarHBondContact O-N 3.03Å; S1736-Q1738 VanDerWaalsContact O-N 3.17Å
1737N30.8Very low39.9Very low156.4 Ų156.4105.1 Ų105.184%0.83657%0.57SS**  trans-146.6112.1145.4-78.7-18.1000109.1S1735S1735-N1737 VanDerWaalsContact C-N 3.34Å; S1735-N1737 PolarHBondContact O-N 3.09Å
1738Q29.4Very low41.7Very low174.2 Ų174.2103 Ų10381%0.81455%0.553SS**  trans-36.2116.9173.3-65.5-177.1-15.300112.5S1736 M1740S1736-Q1738 PolarHBondContact O-N 3.03Å; S1736-Q1738 VanDerWaalsContact O-N 3.17Å; Q1738-M1740 PolarHBondContact O-N 3.13Å; Q1738-M1740 VanDerWaalsContact O-N 3.14Å
1739P32.8Very low43.3Very low112.6 Ų112.699.6 Ų99.673%0.73154%0.54SS*.  trans-61.4125.5170.526.4-31.4000108.2I1741P1739-I1741 VanDerWaalsContact C-N 3.35Å; P1739-I1741 WeakPolarHBondContact O-CG1 3.1Å; P1739-I1741 PolarHBondContact O-N 3.16Å
1740M33.2Very low45.1Very low137 Ų13795.2 Ų95.268%0.67552%0.515SS*.  trans-58.4101.1173.7-92.2-83.2-178.700108.4M1489 N1491 Q1738 S1742M1489-M1740 WeakPolarHBondContact O-CE 3.4Å; N1491-M1740 PolarHBondContact OD1-SD 3.48Å; Q1738-M1740 PolarHBondContact O-N 3.13Å; Q1738-M1740 VanDerWaalsContact O-N 3.14Å; M1740-S1742 PolarHBondContact O-N 3.15Å; M1740-S1742 VanDerWaalsContact O-N 3.13Å
1741I44.3Very low46.8Very low79.4 Ų79.489.5 Ų89.541%0.40749%0.485SS..  trans-59.5114.5171.3-67.1171000106.5R1493 P1739 S1745 Y1746R1493-I1741 VanDerWaalsContact NH2-CD1 3.28Å; P1739-I1741 VanDerWaalsContact C-N 3.35Å; P1739-I1741 WeakPolarHBondContact O-CG1 3.1Å; P1739-I1741 PolarHBondContact O-N 3.16Å; I1741-S1745 WeakPolarHBondContact CG2-OG 3.35Å; I1741-Y1746 HydrophobicContact CG2-CD1 4.28Å; I1741-Y1746 VanDerWaalsContact CG2-N 3.3Å; I1741-Y1746 WeakPolarHBondContact O-CD1 3.44Å
1742S54.9Low48.5Very low43 Ų4386.9 Ų86.930%0.30147%0.465SS..  trans-55.8145.3-177.6640000111.1N1719 Q1720 M1740 P1744 S1745 Y1746N1719-S1742 PolarHBondContact ND2-OG 3.4Å; N1719-S1742 WeakPolarHBondContact OD1-CB 3.35Å; N1719-S1742 PolarHBondContact OD1-OG 2.96Å; Q1720-S1742 PolarHBondContact NE2-OG 3.3Å; M1740-S1742 PolarHBondContact O-N 3.15Å; M1740-S1742 VanDerWaalsContact O-N 3.13Å; S1742-P1744 VanDerWaalsContact C-CD 3.4Å; S1742-P1744 VanDerWaalsContact C-N 3.28Å; S1742-P1744 VanDerWaalsContact O-N 3.11Å; S1742-S1745 PolarHBondContact N-OG 3.29Å; S1742-S1745 PolarHBondContact O-N 3.13Å; S1742-S1745 PolarHBondContact O-OG 3.33Å; S1742-S1745 PolarHBondContact OG-OG 3.34Å; S1742-Y1746 WeakPolarHBondContact O-CD1 3.48Å; S1742-Y1746 PolarHBondContact O-N 3.08Å
1743V58.6Low50.2Low30.2 Ų30.283.5 Ų83.518%0.18345%0.447CS..Hα-helixtrans-45.5-43.7-176178.40000113.9A1488 V1496 L1500 L1716 S1745 Y1746 L1747A1488-V1743 HydrophobicContact CB-CG1 4.31Å; A1488-V1743 HydrophobicContact CB-CG2 4.26Å; V1496-V1743 HydrophobicContact CG1-CG1 4.23Å; L1500-V1743 HydrophobicContact CD1-CG1 4.25Å; L1716-V1743 HydrophobicContact CB-CG2 4.2Å; L1716-V1743 HydrophobicContact CD2-CG1 4.4Å; L1716-V1743 HydrophobicContact CD2-CG2 4.42Å; L1716-V1743 VanDerWaalsContact O-CB 3.26Å; L1716-V1743 WeakPolarHBondContact O-CB 3.35Å; L1716-V1743 VanDerWaalsContact O-CG2 3.27Å; L1716-V1743 WeakPolarHBondContact O-CG2 3.46Å; V1743-S1745 VanDerWaalsContact C-N 3.3Å; V1743-S1745 PolarHBondContact O-N 2.97Å; V1743-Y1746 VanDerWaalsContact CA-CE1 3.41Å; V1743-Y1746 HydrophobicContact CB-CE1 4.11Å; V1743-Y1746 HydrophobicContact CG1-CE1 4.23Å; V1743-Y1746 HydrophobicContact CG1-CE2 4.1Å; V1743-Y1746 WeakPolarHBondContact CG1-OH 3.46Å; V1743-Y1746 HydrophobicContact CG2-CE1 4.11Å; V1743-Y1746 WeakPolarHBondContact CG2-OH 3.28Å; V1743-Y1746 VanDerWaalsContact O-CD1 3.3Å; V1743-Y1746 WeakPolarHBondContact O-CD1 3.32Å; V1743-Y1746 WeakPolarHBondContact O-CE1 3.31Å; V1743-Y1746 PolarHBondContact O-N 3.23Å; V1743-L1747 HydrophobicContact CG1-CD1 3.76Å; V1743-L1747 HydrophobicContact CG1-CG 4.26Å; V1743-L1747 WeakPolarHBondContact O-CB 3.37Å; V1743-L1747 WeakPolarHBondContact O-CD1 3.49Å; V1743-L1747 VanDerWaalsContact O-CG 3.24Å; V1743-L1747 WeakPolarHBondContact O-CG 3.41Å; V1743-L1747 PolarHBondContact O-N 3.22Å
1744P59.6Low51.9Low16.2 Ų16.276.7 Ų76.711%0.10542%0.417CS..Hα-helixtrans-63.8-37.1-180-26.138.3000114.3M1717 N1719 Q1720 S1742 Y1746 L1747 Y1748 V1780 L1842M1717-P1744 WeakPolarHBondContact O-CB 3.37Å; M1717-P1744 WeakPolarHBondContact O-CG 3.38Å; N1719-P1744 HydrophobicContact CB-CG 4.03Å; N1719-P1744 WeakPolarHBondContact OD1-CB 3.34Å; N1719-P1744 WeakPolarHBondContact OD1-CD 3.34Å; N1719-P1744 WeakPolarHBondContact OD1-CG 3.35Å; Q1720-P1744 HydrophobicContact CG-CG 3.84Å; S1742-P1744 VanDerWaalsContact C-CD 3.4Å; S1742-P1744 VanDerWaalsContact C-N 3.28Å; S1742-P1744 VanDerWaalsContact O-N 3.11Å; P1744-Y1746 PolarHBondContact O-N 3.05Å; P1744-L1747 PolarHBondContact O-N 3.03Å; P1744-Y1748 WeakPolarHBondContact O-CB 3.38Å; P1744-Y1748 PolarHBondContact O-N 3.11Å; P1744-V1780 HydrophobicContact CG-CG2 4.5Å; P1744-L1842 HydrophobicContact CB-CD2 3.16Å
1745S61.3Low53.2Low44.8 Ų44.867.7 Ų67.731%0.31339%0.386SS..Hα-helixtrans-69.3-38.4-17358.30000112.5I1741 S1742 V1743 S1749I1741-S1745 WeakPolarHBondContact CG2-OG 3.35Å; S1742-S1745 PolarHBondContact N-OG 3.29Å; S1742-S1745 PolarHBondContact O-N 3.13Å; S1742-S1745 PolarHBondContact O-OG 3.33Å; S1742-S1745 PolarHBondContact OG-OG 3.34Å; V1743-S1745 VanDerWaalsContact C-N 3.3Å; V1743-S1745 PolarHBondContact O-N 2.97Å; S1745-S1749 WeakPolarHBondContact O-CB 3.26Å; S1745-S1749 PolarHBondContact O-N 3.1Å; S1745-S1749 PolarHBondContact O-OG 3.01Å
1746Y69.2Low54.6Low2.4 Ų2.473 Ų731%0.00939%0.39CS..Hα-helixtrans-78-36.1174.172.2-110.5000112.3A1488 N1491 R1493 I1741 S1742 V1743 P1744 Y1748 S1749 E1750A1488-Y1746 WeakPolarHBondContact CA-OH 3.46Å; A1488-Y1746 PolarHBondContact O-OH 3.24Å; N1491-Y1746 WeakPolarHBondContact OD1-CE1 3.15Å; R1493-Y1746 HydrophobicContact CB-CD2 3.58Å; R1493-Y1746 HydrophobicContact CB-CE2 3.66Å; R1493-Y1746 HydrophobicContact CB-CG 4.03Å; R1493-Y1746 HydrophobicContact CG-CD1 3.81Å; R1493-Y1746 HydrophobicContact CG-CD2 3.43Å; R1493-Y1746 VanDerWaalsContact CG-CD2 3.4Å; R1493-Y1746 HydrophobicContact CG-CE1 3.88Å; R1493-Y1746 HydrophobicContact CG-CE2 3.52Å; R1493-Y1746 VanDerWaalsContact CG-CE2 3.46Å; R1493-Y1746 HydrophobicContact CG-CG 3.92Å; R1493-Y1746 VanDerWaalsContact NE-CG 3.29Å; I1741-Y1746 HydrophobicContact CG2-CD1 4.28Å; I1741-Y1746 VanDerWaalsContact CG2-N 3.3Å; I1741-Y1746 WeakPolarHBondContact O-CD1 3.44Å; S1742-Y1746 WeakPolarHBondContact O-CD1 3.48Å; S1742-Y1746 PolarHBondContact O-N 3.08Å; V1743-Y1746 VanDerWaalsContact CA-CE1 3.41Å; V1743-Y1746 HydrophobicContact CB-CE1 4.11Å; V1743-Y1746 HydrophobicContact CG1-CE1 4.23Å; V1743-Y1746 HydrophobicContact CG1-CE2 4.1Å; V1743-Y1746 WeakPolarHBondContact CG1-OH 3.46Å; V1743-Y1746 HydrophobicContact CG2-CE1 4.11Å; V1743-Y1746 WeakPolarHBondContact CG2-OH 3.28Å; V1743-Y1746 VanDerWaalsContact O-CD1 3.3Å; V1743-Y1746 WeakPolarHBondContact O-CD1 3.32Å; V1743-Y1746 WeakPolarHBondContact O-CE1 3.31Å; V1743-Y1746 PolarHBondContact O-N 3.23Å; P1744-Y1746 PolarHBondContact O-N 3.05Å; Y1746-Y1748 VanDerWaalsContact C-N 3.27Å; Y1746-Y1748 PolarHBondContact O-N 3.31Å; Y1746-S1749 WeakPolarHBondContact CA-OG 3.27Å; Y1746-S1749 PolarHBondContact O-N 3.1Å; Y1746-S1749 VanDerWaalsContact O-N 3.14Å; Y1746-S1749 PolarHBondContact O-OG 3.05Å; Y1746-S1749 VanDerWaalsContact O-OG 3.05Å; Y1746-E1750 VanDerWaalsContact O-CB 3.32Å; Y1746-E1750 WeakPolarHBondContact O-CB 3.37Å; Y1746-E1750 PolarHBondContact O-N 3.16Å
1747L68.3Low55.6Low2.6 Ų2.673.2 Ų73.21%0.01438%0.382CS..Hα-helixtrans-57.8-43.2178.3-93173000110.6V1496 T1497 L1500 M1717 V1743 P1744 E1750 L1751 L1777V1496-L1747 HydrophobicContact CB-CD2 3.97Å; V1496-L1747 HydrophobicContact CG1-CD1 4.34Å; V1496-L1747 HydrophobicContact CG1-CD2 3.53Å; V1496-L1747 VanDerWaalsContact CG1-CD2 3.47Å; T1497-L1747 HydrophobicContact CG2-CD2 3.72Å; T1497-L1747 HydrophobicContact CG2-CG 4.43Å; L1500-L1747 HydrophobicContact CD1-CD1 4.12Å; L1500-L1747 HydrophobicContact CD1-CD2 4.38Å; L1500-L1747 HydrophobicContact CD1-CG 4.44Å; M1717-L1747 HydrophobicContact CE-CD1 4.07Å; M1717-L1747 HydrophobicContact CG-CD1 4.15Å; M1717-L1747 HydrophobicContact SD-CD1 4.4Å; V1743-L1747 HydrophobicContact CG1-CD1 3.76Å; V1743-L1747 HydrophobicContact CG1-CG 4.26Å; V1743-L1747 WeakPolarHBondContact O-CB 3.37Å; V1743-L1747 WeakPolarHBondContact O-CD1 3.49Å; V1743-L1747 VanDerWaalsContact O-CG 3.24Å; V1743-L1747 WeakPolarHBondContact O-CG 3.41Å; V1743-L1747 PolarHBondContact O-N 3.22Å; P1744-L1747 PolarHBondContact O-N 3.03Å; L1747-E1750 PolarHBondContact O-N 3.18Å; L1747-L1751 HydrophobicContact CD2-CD1 3.87Å; L1747-L1751 HydrophobicContact CD2-CG 3.86Å; L1747-L1751 VanDerWaalsContact O-CB 3.29Å; L1747-L1751 WeakPolarHBondContact O-CB 3.37Å; L1747-L1751 VanDerWaalsContact O-CG 3.26Å; L1747-L1751 WeakPolarHBondContact O-CG 3.31Å; L1747-L1751 PolarHBondContact O-N 3.06Å; L1747-L1777 HydrophobicContact CD2-CD1 3.84Å; L1747-L1777 HydrophobicContact CD2-CD2 3.71Å; L1747-L1777 HydrophobicContact CD2-CG 4.42Å
1748Y66.1Low56.2Low73.8 Ų73.871.4 Ų71.429%0.28937%0.373SS..Hα-helixtrans-62.5-47.1177.3-167.3-94.9000112.1P1744 Y1746 E1750 L1751 I1752 L1777 G1841 L1842P1744-Y1748 WeakPolarHBondContact O-CB 3.38Å; P1744-Y1748 PolarHBondContact O-N 3.11Å; Y1746-Y1748 VanDerWaalsContact C-N 3.27Å; Y1746-Y1748 PolarHBondContact O-N 3.31Å; Y1748-E1750 VanDerWaalsContact C-N 3.31Å; Y1748-E1750 PolarHBondContact O-N 3.14Å; Y1748-L1751 PolarHBondContact O-N 2.98Å; Y1748-I1752 HydrophobicContact CD1-CD1 3.59Å; Y1748-I1752 HydrophobicContact CD1-CG1 4.43Å; Y1748-I1752 HydrophobicContact CE1-CD1 3.2Å; Y1748-I1752 HydrophobicContact CE1-CG1 4.32Å; Y1748-I1752 HydrophobicContact CE2-CD1 4.25Å; Y1748-I1752 HydrophobicContact CG-CD1 4.44Å; Y1748-I1752 VanDerWaalsContact O-CG1 3.3Å; Y1748-I1752 WeakPolarHBondContact O-CG1 3.34Å; Y1748-I1752 PolarHBondContact O-N 3.02Å; Y1748-I1752 VanDerWaalsContact O-N 3.09Å; Y1748-L1777 VanDerWaalsContact CA-CD1 3.44Å; Y1748-L1777 HydrophobicContact CD2-CB 4.31Å; Y1748-L1777 HydrophobicContact CD2-CD1 3.4Å; Y1748-L1777 VanDerWaalsContact CD2-CD1 3.4Å; Y1748-L1777 HydrophobicContact CD2-CD2 3.45Å; Y1748-L1777 VanDerWaalsContact CD2-CD2 3.45Å; Y1748-L1777 HydrophobicContact CD2-CG 4.37Å; Y1748-L1777 HydrophobicContact CE2-CB 4.37Å; Y1748-L1777 HydrophobicContact CE2-CD1 4.34Å; Y1748-L1777 HydrophobicContact CE2-CD2 3.44Å; Y1748-L1777 VanDerWaalsContact CE2-CD2 3.44Å; Y1748-L1777 HydrophobicContact CE2-CG 4.35Å; Y1748-L1777 HydrophobicContact CG-CD1 3.98Å; Y1748-L1777 HydrophobicContact CG-CD2 4.22Å; Y1748-G1841 WeakPolarHBondContact CD1-O 3.45Å; Y1748-G1841 WeakPolarHBondContact CE1-O 3.09Å; Y1748-L1842 HydrophobicContact CD1-CD1 4Å; Y1748-L1842 HydrophobicContact CD2-CD1 4.44Å; Y1748-L1842 HydrophobicContact CE1-CD1 3.98Å; Y1748-L1842 HydrophobicContact CG-CD1 3.96Å
1749S66.8Low56.7Low64.2 Ų64.266.2 Ų66.245%0.44937%0.365SS..Hα-helixtrans-62.8-38.1178.7670000112.7S1745 Y1746 I1752 S1753S1745-S1749 WeakPolarHBondContact O-CB 3.26Å; S1745-S1749 PolarHBondContact O-N 3.1Å; S1745-S1749 PolarHBondContact O-OG 3.01Å; Y1746-S1749 WeakPolarHBondContact CA-OG 3.27Å; Y1746-S1749 PolarHBondContact O-N 3.1Å; Y1746-S1749 VanDerWaalsContact O-N 3.14Å; Y1746-S1749 PolarHBondContact O-OG 3.05Å; Y1746-S1749 VanDerWaalsContact O-OG 3.05Å; S1749-I1752 PolarHBondContact O-N 3.45Å; S1749-S1753 PolarHBondContact O-N 3.3Å
1750E68.6Low56.8Low43.4 Ų43.468.8 Ų68.820%0.20337%0.373CS..Hα-helixtrans-79.1-35.8-177.3-151.9168.9-150.300112.1R1493 S1494 T1497 Y1746 L1747 Y1748 I1752 S1753 L1754R1493-E1750 VanDerWaalsContact C-CD 3.42Å; R1493-E1750 VanDerWaalsContact CA-OE2 3.28Å; R1493-E1750 WeakPolarHBondContact CA-OE2 3.33Å; R1493-E1750 HydrophobicContact CB-CG 4.34Å; R1493-E1750 WeakPolarHBondContact CB-OE2 3.35Å; S1494-E1750 WeakPolarHBondContact CA-OE1 3.45Å; S1494-E1750 VanDerWaalsContact CB-OE1 3.32Å; S1494-E1750 WeakPolarHBondContact CB-OE1 3.25Å; S1494-E1750 PolarHBondContact N-OE1 3.12Å; S1494-E1750 PolarHBondContact N-OE2 3.19Å; T1497-E1750 HydrophobicContact CG2-CB 3.81Å; T1497-E1750 HydrophobicContact CG2-CG 3.89Å; T1497-E1750 VanDerWaalsContact CG2-OE2 3.25Å; T1497-E1750 WeakPolarHBondContact CG2-OE2 3.3Å; T1497-E1750 WeakPolarHBondContact OG1-CB 3.01Å; T1497-E1750 PolarHBondContact OG1-OE2 2.8Å; Y1746-E1750 VanDerWaalsContact O-CB 3.32Å; Y1746-E1750 WeakPolarHBondContact O-CB 3.37Å; Y1746-E1750 PolarHBondContact O-N 3.16Å; L1747-E1750 PolarHBondContact O-N 3.18Å; Y1748-E1750 VanDerWaalsContact C-N 3.31Å; Y1748-E1750 PolarHBondContact O-N 3.14Å; E1750-I1752 VanDerWaalsContact C-N 3.31Å; E1750-I1752 PolarHBondContact O-N 3.16Å; E1750-S1753 WeakPolarHBondContact CA-OG 3.36Å; E1750-S1753 WeakPolarHBondContact O-CB 3.25Å; E1750-S1753 PolarHBondContact O-N 3.11Å; E1750-S1753 VanDerWaalsContact O-N 3.11Å; E1750-S1753 PolarHBondContact O-OG 3.16Å; E1750-S1753 PolarHBondContact OE2-OG 2.81Å; E1750-L1754 WeakPolarHBondContact O-CB 3.33Å; E1750-L1754 VanDerWaalsContact O-CG 3.28Å; E1750-L1754 WeakPolarHBondContact O-CG 3.3Å; E1750-L1754 PolarHBondContact O-N 3.23Å; E1750-L1754 VanDerWaalsContact O-N 3.12Å
1751L67.8Low57Low3.6 Ų3.665.3 Ų65.32%0.01937%0.373CS..Hα-helixtrans-64.3-37.1170.8-74.8174000111.9T1497 K1501 F1509 M1717 L1747 Y1748 S1753 L1754 L1755 L1777T1497-L1751 HydrophobicContact CG2-CD2 3.95Å; T1497-L1751 VanDerWaalsContact CG2-CD2 3.5Å; T1497-L1751 HydrophobicContact CG2-CG 3.82Å; K1501-L1751 HydrophobicContact CB-CD2 4.32Å; K1501-L1751 HydrophobicContact CD-CD2 4.27Å; F1509-L1751 HydrophobicContact CE1-CD1 3.93Å; F1509-L1751 HydrophobicContact CZ-CD1 4.08Å; F1509-L1751 HydrophobicContact CZ-CD2 4.24Å; M1717-L1751 HydrophobicContact CE-CD1 4.33Å; L1747-L1751 HydrophobicContact CD2-CD1 3.87Å; L1747-L1751 HydrophobicContact CD2-CG 3.86Å; L1747-L1751 VanDerWaalsContact O-CB 3.29Å; L1747-L1751 WeakPolarHBondContact O-CB 3.37Å; L1747-L1751 VanDerWaalsContact O-CG 3.26Å; L1747-L1751 WeakPolarHBondContact O-CG 3.31Å; L1747-L1751 PolarHBondContact O-N 3.06Å; Y1748-L1751 PolarHBondContact O-N 2.98Å; L1751-S1753 VanDerWaalsContact C-N 3.26Å; L1751-S1753 PolarHBondContact O-N 3.08Å; L1751-L1754 HydrophobicContact CD2-CD1 4.4Å; L1751-L1754 PolarHBondContact O-N 3.04Å; L1751-L1755 WeakPolarHBondContact O-CB 3.33Å; L1751-L1755 VanDerWaalsContact O-CG 3.26Å; L1751-L1755 WeakPolarHBondContact O-CG 3.36Å; L1751-L1755 PolarHBondContact O-N 3.08Å; L1751-L1777 HydrophobicContact CB-CD1 3.91Å; L1751-L1777 HydrophobicContact CB-CD2 3.95Å; L1751-L1777 HydrophobicContact CD1-CD1 4.04Å; L1751-L1777 VanDerWaalsContact CD1-CD1 3.49Å; L1751-L1777 HydrophobicContact CD1-CD2 3.94Å; L1751-L1777 HydrophobicContact CD1-CG 4.25Å
1752I65.3Low56.5Low74.8 Ų74.869.5 Ų69.538%0.38440%0.396SS..Hα-helixtrans-66-39173.2-72.1174.1000111.4Y1748 S1749 E1750 L1754 L1755 R1756 L1777Y1748-I1752 HydrophobicContact CD1-CD1 3.59Å; Y1748-I1752 HydrophobicContact CD1-CG1 4.43Å; Y1748-I1752 HydrophobicContact CE1-CD1 3.2Å; Y1748-I1752 HydrophobicContact CE1-CG1 4.32Å; Y1748-I1752 HydrophobicContact CE2-CD1 4.25Å; Y1748-I1752 HydrophobicContact CG-CD1 4.44Å; Y1748-I1752 VanDerWaalsContact O-CG1 3.3Å; Y1748-I1752 WeakPolarHBondContact O-CG1 3.34Å; Y1748-I1752 PolarHBondContact O-N 3.02Å; Y1748-I1752 VanDerWaalsContact O-N 3.09Å; S1749-I1752 PolarHBondContact O-N 3.45Å; E1750-I1752 VanDerWaalsContact C-N 3.31Å; E1750-I1752 PolarHBondContact O-N 3.16Å; I1752-L1754 VanDerWaalsContact C-N 3.32Å; I1752-L1754 PolarHBondContact O-N 3.21Å; I1752-L1755 WeakPolarHBondContact O-CB 3.4Å; I1752-L1755 PolarHBondContact O-N 3.04Å; I1752-R1756 WeakPolarHBondContact O-CB 3.01Å; I1752-R1756 PolarHBondContact O-N 3.22Å; I1752-R1756 VanDerWaalsContact O-N 3.1Å; I1752-L1777 HydrophobicContact CG1-CB 4.44Å; I1752-L1777 HydrophobicContact CG1-CD2 4.48Å
1753S64.9Low55.4Low51.6 Ų51.675.3 Ų75.336%0.36142%0.422SS..Hα-helixtrans-65.3-40177.473.70000112S1749 E1750 L1751 L1755 R1756 N1757S1749-S1753 PolarHBondContact O-N 3.3Å; E1750-S1753 WeakPolarHBondContact CA-OG 3.36Å; E1750-S1753 WeakPolarHBondContact O-CB 3.25Å; E1750-S1753 PolarHBondContact O-N 3.11Å; E1750-S1753 VanDerWaalsContact O-N 3.11Å; E1750-S1753 PolarHBondContact O-OG 3.16Å; E1750-S1753 PolarHBondContact OE2-OG 2.81Å; L1751-S1753 VanDerWaalsContact C-N 3.26Å; L1751-S1753 PolarHBondContact O-N 3.08Å; S1753-L1755 VanDerWaalsContact C-N 3.32Å; S1753-L1755 PolarHBondContact O-N 3.14Å; S1753-R1756 WeakPolarHBondContact O-CB 3.36Å; S1753-R1756 PolarHBondContact O-N 3.02Å; S1753-R1756 VanDerWaalsContact O-N 3.12Å; S1753-N1757 PolarHBondContact O-N 2.97Å
1754L61.3Low54.1Low55.4 Ų55.476.9 Ų76.929%0.2945%0.445SS..Hα-helixtrans-62.1-41.7175.9-75.4169.3000112T1497 E1750 L1751 I1752 R1756 N1757 D1758T1497-L1754 HydrophobicContact CG2-CD1 4.07Å; E1750-L1754 WeakPolarHBondContact O-CB 3.33Å; E1750-L1754 VanDerWaalsContact O-CG 3.28Å; E1750-L1754 WeakPolarHBondContact O-CG 3.3Å; E1750-L1754 PolarHBondContact O-N 3.23Å; E1750-L1754 VanDerWaalsContact O-N 3.12Å; L1751-L1754 HydrophobicContact CD2-CD1 4.4Å; L1751-L1754 PolarHBondContact O-N 3.04Å; I1752-L1754 VanDerWaalsContact C-N 3.32Å; I1752-L1754 PolarHBondContact O-N 3.21Å; L1754-R1756 VanDerWaalsContact C-N 3.25Å; L1754-R1756 PolarHBondContact O-N 3.24Å; L1754-N1757 PolarHBondContact O-N 3.13Å; L1754-N1757 VanDerWaalsContact O-N 3.1Å; L1754-D1758 PolarHBondContact O-N 3.13Å; L1754-D1758 VanDerWaalsContact O-N 3.15Å
1755L57.3Low52.8Low42.2 Ų42.284.9 Ų84.922%0.22149%0.485CS..Hα-helixtrans-63.1-26.1176.5-75.3172.6000113.6F1509 L1751 I1752 S1753 N1757 F1775 L1777F1509-L1755 HydrophobicContact CD1-CD1 3.86Å; F1509-L1755 HydrophobicContact CD1-CD2 3.4Å; F1509-L1755 VanDerWaalsContact CD1-CD2 3.44Å; F1509-L1755 HydrophobicContact CD1-CG 3.98Å; F1509-L1755 HydrophobicContact CE1-CD1 3.84Å; F1509-L1755 HydrophobicContact CE1-CD2 3.19Å; F1509-L1755 HydrophobicContact CE1-CG 3.58Å; F1509-L1755 HydrophobicContact CG-CD2 4.24Å; F1509-L1755 HydrophobicContact CZ-CD1 4.36Å; F1509-L1755 HydrophobicContact CZ-CD2 3.89Å; F1509-L1755 HydrophobicContact CZ-CG 4.49Å; L1751-L1755 WeakPolarHBondContact O-CB 3.33Å; L1751-L1755 VanDerWaalsContact O-CG 3.26Å; L1751-L1755 WeakPolarHBondContact O-CG 3.36Å; L1751-L1755 PolarHBondContact O-N 3.08Å; I1752-L1755 WeakPolarHBondContact O-CB 3.4Å; I1752-L1755 PolarHBondContact O-N 3.04Å; S1753-L1755 VanDerWaalsContact C-N 3.32Å; S1753-L1755 PolarHBondContact O-N 3.14Å; L1755-N1757 VanDerWaalsContact C-N 3.33Å; L1755-F1775 HydrophobicContact CD1-CB 4.01Å; L1755-F1775 HydrophobicContact CD1-CD2 3.98Å; L1755-F1775 HydrophobicContact CD1-CG 3.92Å; L1755-F1775 HydrophobicContact CD2-CB 3.55Å; L1755-F1775 VanDerWaalsContact CD2-CB 3.46Å; L1755-F1775 HydrophobicContact CD2-CD2 3.91Å; L1755-F1775 HydrophobicContact CD2-CE2 4.44Å; L1755-F1775 HydrophobicContact CD2-CG 4.19Å; L1755-F1775 HydrophobicContact CG-CB 4.39Å; L1755-L1777 HydrophobicContact CD1-CB 4.32Å
1756R57.2Low51.4Low215.8 Ų215.886.2 Ų86.281%0.81451%0.505SS*.Hα-helixtrans-78.5-26.8177.1-164.6176.6162.4-168.1-0.9112.4I1752 S1753 L1754I1752-R1756 WeakPolarHBondContact O-CB 3.01Å; I1752-R1756 PolarHBondContact O-N 3.22Å; I1752-R1756 VanDerWaalsContact O-N 3.1Å; S1753-R1756 WeakPolarHBondContact O-CB 3.36Å; S1753-R1756 PolarHBondContact O-N 3.02Å; S1753-R1756 VanDerWaalsContact O-N 3.12Å; L1754-R1756 VanDerWaalsContact C-N 3.25Å; L1754-R1756 PolarHBondContact O-N 3.24Å
1757N50.1Low49.6Very low113.4 Ų113.491.3 Ų91.361%0.60654%0.541SS*.Hα-helixtrans-90.1-21.7-174.1-69.6-4.9000113.8S1753 L1754 L1755 G1759 D1760S1753-N1757 PolarHBondContact O-N 2.97Å; L1754-N1757 PolarHBondContact O-N 3.13Å; L1754-N1757 VanDerWaalsContact O-N 3.1Å; L1755-N1757 VanDerWaalsContact C-N 3.33Å; N1757-G1759 PolarHBondContact O-N 3.29Å; N1757-D1760 PolarHBondContact O-N 2.86Å
1758D43.9Very low47.8Very low119.2 Ų119.297.6 Ų97.664%0.63757%0.574SS**THydrogen-bonded Turntrans-69.410.7177.1-80-18.2000113.8K1501 L1754K1501-D1758 IonicContact NZ-OD1 3.23Å; K1501-D1758 IonicContact NZ-OD2 3.46Å; K1501-D1758 PolarHBondContact NZ-OD2 3Å; K1501-D1758 VanDerWaalsContact NZ-OD2 3.13Å; L1754-D1758 PolarHBondContact O-N 3.13Å; L1754-D1758 VanDerWaalsContact O-N 3.15Å
1759G39.9Very low46.4Very low63.6 Ų63.6101.6 Ų101.666%0.65660%0.601SS**THydrogen-bonded Turntrans-104.5-5.2-177.800000116.9N1757 G1761N1757-G1759 PolarHBondContact O-N 3.29Å; G1759-G1761 VanDerWaalsContact C-N 3.35Å; G1759-G1761 PolarHBondContact O-N 3.11Å; G1759-G1761 VanDerWaalsContact O-N 3.17Å
1760D33.1Very low44.6Very low167.2 Ų167.2105.7 Ų105.789%0.89462%0.615SS**  trans-9377.3-179.1-98.7-12.9000111.1N1757N1757-D1760 PolarHBondContact O-N 2.86Å
1761G38.4Very low42.9Very low65 Ų65109 Ų10967%0.6764%0.643SS**  trans-111103.8162.100000109G1759 I1763G1759-G1761 VanDerWaalsContact C-N 3.35Å; G1759-G1761 PolarHBondContact O-N 3.11Å; G1759-G1761 VanDerWaalsContact O-N 3.17Å; G1761-I1763 PolarHBondContact O-N 3.26Å; G1761-I1763 VanDerWaalsContact O-N 3.08Å
1762D33.3Very low41.4Very low167.6 Ų167.6117.6 Ų117.690%0.89668%0.683SS**  trans-43.4102.1174.8-79.8-42000113.1
1763I32.7Very low40.1Very low164.6 Ų164.6121 Ų12184%0.84469%0.692SS**  trans-143.1111.5155.7-61.8170000108.3G1761G1761-I1763 PolarHBondContact O-N 3.26Å; G1761-I1763 VanDerWaalsContact O-N 3.08Å
1764G31.5Very low39.3Very low64 Ų64126.8 Ų126.866%0.6671%0.71SS**  trans-46.8138.6173.600000115.5G1766G1764-G1766 PolarHBondContact O-N 3.2Å
1765I31Very low38.8Very low184.4 Ų184.4128.3 Ų128.395%0.94672%0.715SS**  trans4089.2147.2-47.2175.7000114.7
1766G32.1Very low39.1Very low71.8 Ų71.8131.4 Ų131.474%0.7473%0.726SS**  trans-165.285.6166.900000110.7G1764 N1768G1764-G1766 PolarHBondContact O-N 3.2Å; G1766-N1768 PolarHBondContact O-N 3.08Å; G1766-N1768 VanDerWaalsContact O-N 3.14Å
1767S31.3Very low39.7Very low109.4 Ų109.4121.9 Ų121.977%0.76569%0.692SS**  trans-53.3114.3166.91610000109.4
1768N31.6Very low40.9Very low133.8 Ų133.8118.7 Ų118.772%0.71667%0.671SS**SBendtrans164.6106.3136.8-77.9-16.4000111.5G1766 M1770G1766-N1768 PolarHBondContact O-N 3.08Å; G1766-N1768 VanDerWaalsContact O-N 3.14Å; N1768-M1770 PolarHBondContact O-N 3.22Å
1769N35.4Very low42.4Very low158.4 Ų158.4114.2 Ų114.285%0.84765%0.649SS**SBendtrans59.636.2143.6-62.5-6.7000121.8
1770M28.9Very low44.3Very low151 Ų151111.9 Ų111.974%0.74462%0.622SS**  trans-13650.8169-153.578.793.800114.5N1768 Y1773N1768-M1770 PolarHBondContact O-N 3.22Å; M1770-Y1773 HydrophobicContact CG-CE2 4.28Å; M1770-Y1773 HydrophobicContact SD-CE2 3.98Å; M1770-Y1773 PolarHBondContact SD-OH 3.43Å
1771S34.4Very low46.6Very low112.2 Ų112.2104.2 Ų104.279%0.78558%0.581SS**  trans-140.752.2175.258.90000114.4
1772Q35.2Very low48.6Very low183.6 Ų183.6101.4 Ų101.486%0.85855%0.551SS**  trans-136.540.1170-68.9-168.13.300114.1K1774Q1772-K1774 VanDerWaalsContact C-N 3.28Å; Q1772-K1774 PolarHBondContact O-N 3.13Å; Q1772-K1774 VanDerWaalsContact O-N 3.08Å
1773Y38.8Very low51Low147.4 Ų147.493.5 Ų93.558%0.57851%0.508SS*.  trans-77.385.8164.6-65.8-74.4000109.3L1514 M1770 F1775L1514-Y1773 HydrophobicContact CD2-CD1 3.97Å; L1514-Y1773 HydrophobicContact CD2-CE1 4.16Å; L1514-Y1773 HydrophobicContact CD2-CG 4.33Å; M1770-Y1773 HydrophobicContact CG-CE2 4.28Å; M1770-Y1773 HydrophobicContact SD-CE2 3.98Å; M1770-Y1773 PolarHBondContact SD-OH 3.43Å; Y1773-F1775 PolarHBondContact O-N 2.98Å
1774K47.4Very low53.7Low172 Ų17285.7 Ų85.775%0.74847%0.468SS*.  trans-80.494.4176.5-145.2176.9-175.8177.80108.9L1513 Q1772 K1776L1513-K1774 WeakPolarHBondContact CD1-O 3.49Å; Q1772-K1774 VanDerWaalsContact C-N 3.28Å; Q1772-K1774 PolarHBondContact O-N 3.13Å; Q1772-K1774 VanDerWaalsContact O-N 3.08Å; K1774-K1776 PolarHBondContact O-N 3.03Å
1775F51.7Low56.4Low88.2 Ų88.282.7 Ų82.739%0.38744%0.437SS..  trans-57.9132169.9-72.1-84.4000109.7F1509 L1514 L1755 Y1773F1509-F1775 HydrophobicContact CB-CD1 4.37Å; F1509-F1775 HydrophobicContact CD1-CB 4.27Å; F1509-F1775 HydrophobicContact CD1-CD1 4.32Å; F1509-F1775 HydrophobicContact CG-CD1 4.37Å; L1514-F1775 HydrophobicContact CD1-CE1 4.24Å; L1514-F1775 HydrophobicContact CD1-CZ 4.24Å; L1514-F1775 HydrophobicContact CG-CE1 4.47Å; L1755-F1775 HydrophobicContact CD1-CB 4.01Å; L1755-F1775 HydrophobicContact CD1-CD2 3.98Å; L1755-F1775 HydrophobicContact CD1-CG 3.92Å; L1755-F1775 HydrophobicContact CD2-CB 3.55Å; L1755-F1775 VanDerWaalsContact CD2-CB 3.46Å; L1755-F1775 HydrophobicContact CD2-CD2 3.91Å; L1755-F1775 HydrophobicContact CD2-CE2 4.44Å; L1755-F1775 HydrophobicContact CD2-CG 4.19Å; L1755-F1775 HydrophobicContact CG-CB 4.39Å; Y1773-F1775 PolarHBondContact O-N 2.98Å
1776K62.6Low59Low107 Ų10774.6 Ų74.647%0.46540%0.396SS..  trans-108.4141.4173.5-87.6-171.5179.2-172.50109.2F1509 D1510 L1513 K1774F1509-K1776 WeakPolarHBondContact CA-O 3.25Å; D1510-K1776 HydrophobicContact CB-CB 4.36Å; D1510-K1776 WeakPolarHBondContact CB-O 3.32Å; D1510-K1776 PolarHBondContact N-O 3.14Å; L1513-K1776 HydrophobicContact CD1-CB 4.2Å; L1513-K1776 HydrophobicContact CD1-CD 4.22Å; L1513-K1776 HydrophobicContact CD1-CG 4.03Å; K1774-K1776 PolarHBondContact O-N 3.03Å
1777L69.6Low61.7Low16.4 Ų16.471.2 Ų71.29%0.08636%0.361CS..BIsolated β-bridgetrans-70.5133.2174.6-154.588.6000109.7L1508 F1509 L1747 Y1748 L1751 I1752 L1755L1508-L1777 HydrophobicContact CB-CD1 4.35Å; L1508-L1777 WeakPolarHBondContact O-CD1 3.36Å; L1508-L1777 WeakPolarHBondContact O-CD2 3.48Å; F1509-L1777 HydrophobicContact CD1-CD1 4.21Å; F1509-L1777 HydrophobicContact CE1-CD1 4.05Å; L1747-L1777 HydrophobicContact CD2-CD1 3.84Å; L1747-L1777 HydrophobicContact CD2-CD2 3.71Å; L1747-L1777 HydrophobicContact CD2-CG 4.42Å; Y1748-L1777 VanDerWaalsContact CA-CD1 3.44Å; Y1748-L1777 HydrophobicContact CD2-CB 4.31Å; Y1748-L1777 HydrophobicContact CD2-CD1 3.4Å; Y1748-L1777 VanDerWaalsContact CD2-CD1 3.4Å; Y1748-L1777 HydrophobicContact CD2-CD2 3.45Å; Y1748-L1777 VanDerWaalsContact CD2-CD2 3.45Å; Y1748-L1777 HydrophobicContact CD2-CG 4.37Å; Y1748-L1777 HydrophobicContact CE2-CB 4.37Å; Y1748-L1777 HydrophobicContact CE2-CD1 4.34Å; Y1748-L1777 HydrophobicContact CE2-CD2 3.44Å; Y1748-L1777 VanDerWaalsContact CE2-CD2 3.44Å; Y1748-L1777 HydrophobicContact CE2-CG 4.35Å; Y1748-L1777 HydrophobicContact CG-CD1 3.98Å; Y1748-L1777 HydrophobicContact CG-CD2 4.22Å; L1751-L1777 HydrophobicContact CB-CD1 3.91Å; L1751-L1777 HydrophobicContact CB-CD2 3.95Å; L1751-L1777 HydrophobicContact CD1-CD1 4.04Å; L1751-L1777 VanDerWaalsContact CD1-CD1 3.49Å; L1751-L1777 HydrophobicContact CD1-CD2 3.94Å; L1751-L1777 HydrophobicContact CD1-CG 4.25Å; I1752-L1777 HydrophobicContact CG1-CB 4.44Å; I1752-L1777 HydrophobicContact CG1-CD2 4.48Å; L1755-L1777 HydrophobicContact CD1-CB 4.32Å
1778R75.2Confident64.5Low46.4 Ų46.466.1 Ų66.118%0.17533%0.325CS..PPolyproline II helixtrans-71133.7178.7-165157.1-166.7-175.2-8.1110.1L1507 L1508 D1510 V1780 V1782 L1783 D1786L1507-R1778 VanDerWaalsContact O-CD 3.25Å; L1507-R1778 WeakPolarHBondContact O-CD 3.18Å; L1508-R1778 WeakPolarHBondContact O-CB 3.24Å; L1508-R1778 PolarHBondContact O-N 3.09Å; D1510-R1778 VanDerWaalsContact OD1-CG 3.31Å; D1510-R1778 WeakPolarHBondContact OD1-CG 3.29Å; D1510-R1778 IonicContact OD1-NE 3.31Å; R1778-V1780 PolarHBondContact O-N 2.83Å; R1778-V1782 HydrophobicContact CG-CB 4.22Å; R1778-V1782 HydrophobicContact CG-CG1 4.14Å; R1778-V1782 VanDerWaalsContact NE-CG1 3.28Å; R1778-V1782 VanDerWaalsContact NH2-CG1 3.34Å; R1778-L1783 HydrophobicContact CB-CD2 3.96Å; R1778-L1783 HydrophobicContact CB-CG 4.12Å; R1778-L1783 HydrophobicContact CG-CD2 4.04Å; R1778-L1783 HydrophobicContact CG-CG 4.14Å; R1778-D1786 VanDerWaalsContact CZ-CG 3.43Å; R1778-D1786 IonicContact CZ-OD1 3.18Å; R1778-D1786 IonicContact CZ-OD2 3.26Å; R1778-D1786 IonicContact NE-OD2 3.2Å; R1778-D1786 PolarHBondContact NE-OD2 3.3Å; R1778-D1786 VanDerWaalsContact NH1-CG 3.3Å; R1778-D1786 IonicContact NH1-OD1 3.3Å; R1778-D1786 PolarHBondContact NH1-OD1 2.91Å; R1778-D1786 IonicContact NH1-OD2 3.6Å; R1778-D1786 PolarHBondContact NH1-OD2 3.09Å; R1778-D1786 IonicContact NH2-OD1 3.11Å; R1778-D1786 PolarHBondContact NH2-OD1 3.27Å; R1778-D1786 IonicContact NH2-OD2 3.19Å; R1778-D1786 PolarHBondContact NH2-OD2 3.14Å
1779P76.3Confident67.2Low25.2 Ų25.260.6 Ų60.616%0.16430%0.295CS..PPolyproline II helixtrans-61.4139.3179.1-23.933.9000112.3P1781 V1782 L1783 C1845 Y1847 W1851P1779-P1781 VanDerWaalsContact C-CD 3.45Å; P1779-P1781 VanDerWaalsContact C-N 3.35Å; P1779-V1782 HydrophobicContact CB-CB 4.35Å; P1779-V1782 HydrophobicContact CB-CG2 4.02Å; P1779-V1782 HydrophobicContact CG-CG2 4.21Å; P1779-V1782 WeakPolarHBondContact O-CA 3.29Å; P1779-V1782 WeakPolarHBondContact O-CB 3.36Å; P1779-V1782 PolarHBondContact O-N 3.07Å; P1779-L1783 PolarHBondContact O-N 3.28Å; P1779-L1783 VanDerWaalsContact O-N 3.08Å; P1779-C1845 WeakPolarHBondContact CB-SG 3.07Å; P1779-C1845 VanDerWaalsContact CG-SG 3.53Å; P1779-Y1847 HydrophobicContact CG-CD1 4.49Å; P1779-Y1847 HydrophobicContact CG-CE1 4.17Å; P1779-W1851 HydrophobicContact CB-CH2 4.22Å; P1779-W1851 HydrophobicContact CB-CZ2 4.04Å; P1779-W1851 HydrophobicContact CG-CZ2 3.95Å
1780V80.3Confident69.6Low14 Ų1453.7 Ų53.79%0.08526%0.258CS..Hα-helixtrans-53.5-42.6-179.1-176.10000113.5M1717 T1718 P1744 R1778 V1782 L1783 C1784M1717-V1780 HydrophobicContact CB-CG1 4.18Å; M1717-V1780 HydrophobicContact CB-CG2 4.08Å; M1717-V1780 HydrophobicContact CE-CG2 4.11Å; T1718-V1780 HydrophobicContact CG2-CG1 3.74Å; P1744-V1780 HydrophobicContact CG-CG2 4.5Å; R1778-V1780 PolarHBondContact O-N 2.83Å; V1780-V1782 VanDerWaalsContact C-N 3.29Å; V1780-V1782 PolarHBondContact O-N 3.08Å; V1780-L1783 WeakPolarHBondContact O-CB 3.31Å; V1780-L1783 PolarHBondContact O-N 3.18Å; V1780-C1784 PolarHBondContact O-N 3.31Å; V1780-C1784 PolarHBondContact O-SG 3.05Å; V1780-C1784 VanDerWaalsContact O-SG 3.4Å
1781P80.9Confident72.5Confident5.6 Ų5.646.6 Ų46.64%0.03622%0.224CC..Hα-helixtrans-59.4-38.8175.7-25.535.8000113P1779 C1784 L1785 F1820 Q1823 V1827 W1851 F1890P1779-P1781 VanDerWaalsContact C-CD 3.45Å; P1779-P1781 VanDerWaalsContact C-N 3.35Å; P1781-C1784 PolarHBondContact O-N 3.11Å; P1781-L1785 WeakPolarHBondContact O-CG 3.3Å; P1781-L1785 PolarHBondContact O-N 3.23Å; P1781-L1785 VanDerWaalsContact O-N 3.09Å; P1781-F1820 HydrophobicContact CB-CB 4.04Å; P1781-F1820 HydrophobicContact CB-CD2 3.72Å; P1781-F1820 HydrophobicContact CB-CE2 3.9Å; P1781-Q1823 HydrophobicContact CG-CB 3.8Å; P1781-Q1823 HydrophobicContact CG-CG 4.36Å; P1781-V1827 HydrophobicContact CG-CG2 4.14Å; P1781-W1851 HydrophobicContact CB-CH2 4.25Å; P1781-W1851 HydrophobicContact CB-CZ3 3.96Å; P1781-W1851 HydrophobicContact CG-CH2 4.29Å; P1781-W1851 HydrophobicContact CG-CZ3 4.24Å; P1781-F1890 HydrophobicContact CB-CZ 4.35Å
1782V81.2Confident75Confident6.2 Ų6.241.3 Ų41.34%0.03819%0.186CC..Hα-helixtrans-68.5-43.7178.4-175.40000110.3R1778 P1779 V1780 C1784 L1785 D1786 W1851 L1854R1778-V1782 HydrophobicContact CG-CB 4.22Å; R1778-V1782 HydrophobicContact CG-CG1 4.14Å; R1778-V1782 VanDerWaalsContact NE-CG1 3.28Å; R1778-V1782 VanDerWaalsContact NH2-CG1 3.34Å; P1779-V1782 HydrophobicContact CB-CB 4.35Å; P1779-V1782 HydrophobicContact CB-CG2 4.02Å; P1779-V1782 HydrophobicContact CG-CG2 4.21Å; P1779-V1782 WeakPolarHBondContact O-CA 3.29Å; P1779-V1782 WeakPolarHBondContact O-CB 3.36Å; P1779-V1782 PolarHBondContact O-N 3.07Å; V1780-V1782 VanDerWaalsContact C-N 3.29Å; V1780-V1782 PolarHBondContact O-N 3.08Å; V1782-C1784 VanDerWaalsContact C-N 3.29Å; V1782-C1784 PolarHBondContact O-N 2.97Å; V1782-L1785 CarbonylContact O-C 3.57Å; V1782-L1785 WeakPolarHBondContact O-CA 3.36Å; V1782-L1785 WeakPolarHBondContact O-CB 3.21Å; V1782-L1785 PolarHBondContact O-N 3.18Å; V1782-L1785 VanDerWaalsContact O-N 3.07Å; V1782-D1786 VanDerWaalsContact O-CG 3.28Å; V1782-D1786 PolarHBondContact O-N 3.11Å; V1782-D1786 VanDerWaalsContact O-OD2 3.06Å; V1782-W1851 HydrophobicContact CG2-CD2 3.81Å; V1782-W1851 HydrophobicContact CG2-CE3 4.28Å; V1782-W1851 HydrophobicContact CG2-CG 4.1Å; V1782-W1851 HydrophobicContact CG2-CH2 4.14Å; V1782-W1851 HydrophobicContact CG2-CZ2 3.62Å; V1782-W1851 VanDerWaalsContact CG2-CZ2 3.48Å; V1782-W1851 HydrophobicContact CG2-CZ3 4.43Å; V1782-W1851 VanDerWaalsContact CG2-NE1 3.28Å; V1782-L1854 HydrophobicContact CG1-CD1 3.81Å
1783L83.5Confident77.4Confident1.8 Ų1.834.1 Ų34.11%0.00916%0.156CC..Hα-helixtrans-56.8-43.6175.2-85.1167000111.6L1504 L1507 L1508 L1714 M1717 R1778 P1779 V1780 L1785 D1786 V1787L1504-L1783 HydrophobicContact CD2-CD1 3.75Å; L1504-L1783 HydrophobicContact CD2-CD2 3.57Å; L1504-L1783 HydrophobicContact CD2-CG 4.25Å; L1507-L1783 HydrophobicContact CB-CD1 4.46Å; L1507-L1783 HydrophobicContact CB-CD2 4.29Å; L1507-L1783 WeakPolarHBondContact O-CD1 3.41Å; L1507-L1783 WeakPolarHBondContact O-CD2 3.38Å; L1508-L1783 HydrophobicContact CD2-CD1 4.18Å; L1714-L1783 HydrophobicContact CD1-CD2 4.19Å; L1714-L1783 HydrophobicContact CD2-CB 4.29Å; L1714-L1783 HydrophobicContact CD2-CD2 3.09Å; L1714-L1783 HydrophobicContact CG-CD2 4.28Å; M1717-L1783 HydrophobicContact CE-CD1 3.79Å; R1778-L1783 HydrophobicContact CB-CD2 3.96Å; R1778-L1783 HydrophobicContact CB-CG 4.12Å; R1778-L1783 HydrophobicContact CG-CD2 4.04Å; R1778-L1783 HydrophobicContact CG-CG 4.14Å; P1779-L1783 PolarHBondContact O-N 3.28Å; P1779-L1783 VanDerWaalsContact O-N 3.08Å; V1780-L1783 WeakPolarHBondContact O-CB 3.31Å; V1780-L1783 PolarHBondContact O-N 3.18Å; L1783-L1785 VanDerWaalsContact C-N 3.34Å; L1783-L1785 PolarHBondContact O-N 3.29Å; L1783-D1786 PolarHBondContact O-N 3.21Å; L1783-V1787 HydrophobicContact CD2-CG2 4.41Å; L1783-V1787 VanDerWaalsContact O-CG2 3.32Å; L1783-V1787 WeakPolarHBondContact O-CG2 3.15Å; L1783-V1787 PolarHBondContact O-N 3.23Å; L1783-V1787 VanDerWaalsContact O-N 3.09Å
1784C88.8Confident79.4Confident0.6 Ų0.628.8 Ų28.80%0.00414%0.136CC..Hα-helixtrans-60.5-43.5174.5-66.60000111.6V1780 P1781 V1782 V1787 L1788 F1820V1780-C1784 PolarHBondContact O-N 3.31Å; V1780-C1784 PolarHBondContact O-SG 3.05Å; V1780-C1784 VanDerWaalsContact O-SG 3.4Å; P1781-C1784 PolarHBondContact O-N 3.11Å; V1782-C1784 VanDerWaalsContact C-N 3.29Å; V1782-C1784 PolarHBondContact O-N 2.97Å; C1784-V1787 PolarHBondContact O-N 3.15Å; C1784-L1788 VanDerWaalsContact O-CB 3.29Å; C1784-L1788 WeakPolarHBondContact O-CB 3.36Å; C1784-L1788 WeakPolarHBondContact O-CD1 3.44Å; C1784-L1788 WeakPolarHBondContact O-CG 3.4Å; C1784-L1788 PolarHBondContact O-N 3.3Å; C1784-F1820 HydrophobicContact CB-CB 4.02Å; C1784-F1820 HydrophobicContact CB-CD1 4.28Å
1785L88Confident80.9Confident1 Ų121 Ų211%0.00510%0.103CC..Hα-helixtrans-64.1-41.3177.1-67.4171.9000112.3P1781 V1782 L1783 V1787 L1788 I1789 F1820 L1854 L1855 V1858P1781-L1785 WeakPolarHBondContact O-CG 3.3Å; P1781-L1785 PolarHBondContact O-N 3.23Å; P1781-L1785 VanDerWaalsContact O-N 3.09Å; V1782-L1785 CarbonylContact O-C 3.57Å; V1782-L1785 WeakPolarHBondContact O-CA 3.36Å; V1782-L1785 WeakPolarHBondContact O-CB 3.21Å; V1782-L1785 PolarHBondContact O-N 3.18Å; V1782-L1785 VanDerWaalsContact O-N 3.07Å; L1783-L1785 VanDerWaalsContact C-N 3.34Å; L1783-L1785 PolarHBondContact O-N 3.29Å; L1785-V1787 PolarHBondContact O-N 3.37Å; L1785-L1788 HydrophobicContact CD2-CD1 4.44Å; L1785-L1788 WeakPolarHBondContact O-CB 3.42Å; L1785-L1788 PolarHBondContact O-N 3.01Å; L1785-I1789 VanDerWaalsContact O-CG1 3.25Å; L1785-I1789 WeakPolarHBondContact O-CG1 3.41Å; L1785-I1789 PolarHBondContact O-N 3.22Å; L1785-F1820 HydrophobicContact CD1-CE2 3.8Å; L1785-F1820 HydrophobicContact CD1-CZ 4.28Å; L1785-F1820 HydrophobicContact CD2-CD1 4.43Å; L1785-F1820 HydrophobicContact CD2-CD2 4.3Å; L1785-F1820 HydrophobicContact CD2-CE1 4.09Å; L1785-F1820 HydrophobicContact CD2-CE2 3.99Å; L1785-F1820 HydrophobicContact CD2-CZ 4.21Å; L1785-F1820 HydrophobicContact CG-CD2 4.12Å; L1785-F1820 HydrophobicContact CG-CE2 3.83Å; L1785-F1820 HydrophobicContact CG-CZ 4.39Å; L1785-L1854 HydrophobicContact CB-CB 4.31Å; L1785-L1854 HydrophobicContact CD1-CB 4.1Å; L1785-L1855 HydrophobicContact CD1-CD2 3.88Å; L1785-L1855 HydrophobicContact CD1-CG 4.07Å; L1785-L1855 HydrophobicContact CD2-CD1 4.26Å; L1785-L1855 HydrophobicContact CD2-CD2 3.87Å; L1785-L1855 HydrophobicContact CG-CD2 4.45Å; L1785-V1858 HydrophobicContact CB-CG2 4.48Å; L1785-V1858 HydrophobicContact CD2-CB 4.32Å; L1785-V1858 HydrophobicContact CD2-CG1 4.41Å; L1785-V1858 HydrophobicContact CD2-CG2 3.79Å
1786D85.4Confident82.2Confident14.6 Ų14.617.3 Ų17.38%0.0789%0.088CC..Hα-helixtrans-62.2-47.3178.1-62.8-52.5000111.5L1507 R1778 V1782 L1783 L1788 I1789 L1790L1507-D1786 HydrophobicContact CD2-CB 4.48Å; R1778-D1786 VanDerWaalsContact CZ-CG 3.43Å; R1778-D1786 IonicContact CZ-OD1 3.18Å; R1778-D1786 IonicContact CZ-OD2 3.26Å; R1778-D1786 IonicContact NE-OD2 3.2Å; R1778-D1786 PolarHBondContact NE-OD2 3.3Å; R1778-D1786 VanDerWaalsContact NH1-CG 3.3Å; R1778-D1786 IonicContact NH1-OD1 3.3Å; R1778-D1786 PolarHBondContact NH1-OD1 2.91Å; R1778-D1786 IonicContact NH1-OD2 3.6Å; R1778-D1786 PolarHBondContact NH1-OD2 3.09Å; R1778-D1786 IonicContact NH2-OD1 3.11Å; R1778-D1786 PolarHBondContact NH2-OD1 3.27Å; R1778-D1786 IonicContact NH2-OD2 3.19Å; R1778-D1786 PolarHBondContact NH2-OD2 3.14Å; V1782-D1786 VanDerWaalsContact O-CG 3.28Å; V1782-D1786 PolarHBondContact O-N 3.11Å; V1782-D1786 VanDerWaalsContact O-OD2 3.06Å; L1783-D1786 PolarHBondContact O-N 3.21Å; D1786-L1788 VanDerWaalsContact C-N 3.31Å; D1786-L1788 PolarHBondContact O-N 3.13Å; D1786-I1789 PolarHBondContact O-N 3Å; D1786-L1790 WeakPolarHBondContact O-CB 3.3Å; D1786-L1790 VanDerWaalsContact O-CG 3.29Å; D1786-L1790 WeakPolarHBondContact O-CG 3.31Å; D1786-L1790 PolarHBondContact O-N 3.01Å
1787V88.8Confident82.6Confident1.2 Ų1.214.8 Ų14.81%0.0078%0.084CC..Hα-helixtrans-64.7-37.8178.1178.10000110.7L1507 L1544 W1706 V1710 L1714 L1783 C1784 L1785 L1790 L1791 L1816L1507-V1787 HydrophobicContact CD1-CG2 4.43Å; L1544-V1787 HydrophobicContact CD1-CG1 4.47Å; L1544-V1787 HydrophobicContact CD1-CG2 3.87Å; L1544-V1787 HydrophobicContact CD2-CG1 4.36Å; L1544-V1787 HydrophobicContact CD2-CG2 4.04Å; W1706-V1787 HydrophobicContact CH2-CG1 4.19Å; W1706-V1787 HydrophobicContact CZ2-CG1 4.35Å; V1710-V1787 HydrophobicContact CG1-CG1 3.95Å; L1714-V1787 HydrophobicContact CD1-CG2 4.31Å; L1783-V1787 HydrophobicContact CD2-CG2 4.41Å; L1783-V1787 VanDerWaalsContact O-CG2 3.32Å; L1783-V1787 WeakPolarHBondContact O-CG2 3.15Å; L1783-V1787 PolarHBondContact O-N 3.23Å; L1783-V1787 VanDerWaalsContact O-N 3.09Å; C1784-V1787 PolarHBondContact O-N 3.15Å; L1785-V1787 PolarHBondContact O-N 3.37Å; V1787-L1790 PolarHBondContact O-N 3.22Å; V1787-L1791 VanDerWaalsContact O-CB 3.27Å; V1787-L1791 WeakPolarHBondContact O-CB 3.35Å; V1787-L1791 PolarHBondContact O-N 3.34Å; V1787-L1816 HydrophobicContact CB-CD1 4.22Å; V1787-L1816 HydrophobicContact CG1-CD1 3.7Å
1788L90.4Very high82.6Confident0.8 Ų0.815.5 Ų15.50%0.0049%0.089CC..Hα-helixtrans-63.1-45.2174.5-111.4139000112C1784 L1785 D1786 L1790 L1791 L1792 S1813 L1816 F1820 V1858C1784-L1788 VanDerWaalsContact O-CB 3.29Å; C1784-L1788 WeakPolarHBondContact O-CB 3.36Å; C1784-L1788 WeakPolarHBondContact O-CD1 3.44Å; C1784-L1788 WeakPolarHBondContact O-CG 3.4Å; C1784-L1788 PolarHBondContact O-N 3.3Å; L1785-L1788 HydrophobicContact CD2-CD1 4.44Å; L1785-L1788 WeakPolarHBondContact O-CB 3.42Å; L1785-L1788 PolarHBondContact O-N 3.01Å; D1786-L1788 VanDerWaalsContact C-N 3.31Å; D1786-L1788 PolarHBondContact O-N 3.13Å; L1788-L1790 VanDerWaalsContact C-N 3.34Å; L1788-L1790 PolarHBondContact O-N 3.37Å; L1788-L1791 PolarHBondContact O-N 3.14Å; L1788-L1792 HydrophobicContact CD2-CD1 3.75Å; L1788-L1792 VanDerWaalsContact CD2-CD1 3.47Å; L1788-L1792 HydrophobicContact CD2-CG 4.47Å; L1788-L1792 HydrophobicContact CG-CD1 3.77Å; L1788-L1792 HydrophobicContact CG-CG 4.27Å; L1788-L1792 VanDerWaalsContact O-CB 3.28Å; L1788-L1792 WeakPolarHBondContact O-CB 3.39Å; L1788-L1792 VanDerWaalsContact O-CG 3.25Å; L1788-L1792 WeakPolarHBondContact O-CG 3.35Å; L1788-L1792 PolarHBondContact O-N 2.98Å; L1788-S1813 WeakPolarHBondContact CD1-O 3.4Å; L1788-L1816 HydrophobicContact CD1-CB 4Å; L1788-L1816 HydrophobicContact CD1-CD1 4.22Å; L1788-L1816 HydrophobicContact CD2-CB 3.84Å; L1788-L1816 HydrophobicContact CD2-CD1 4.13Å; L1788-L1816 HydrophobicContact CG-CB 3.8Å; L1788-L1816 HydrophobicContact CG-CD1 4.03Å; L1788-F1820 HydrophobicContact CD1-CD1 4.22Å; L1788-F1820 HydrophobicContact CD1-CE1 3.9Å; L1788-V1858 HydrophobicContact CB-CG2 4.12Å; L1788-V1858 HydrophobicContact CD1-CG1 4.39Å; L1788-V1858 HydrophobicContact CD2-CB 3.86Å; L1788-V1858 HydrophobicContact CD2-CG1 3.17Å; L1788-V1858 HydrophobicContact CD2-CG2 3.49Å; L1788-V1858 VanDerWaalsContact CD2-CG2 3.49Å
1789I89.2Confident82.3Confident18.6 Ų18.621.1 Ų21.110%0.09511%0.114CC..Hα-helixtrans-61.9-46.2177.2-69.5164.8000110.1F1530 L1785 D1786 L1791 L1792 S1793 L1854 V1858 L1861F1530-I1789 HydrophobicContact CE2-CG2 4.06Å; F1530-I1789 HydrophobicContact CZ-CG2 4.24Å; L1785-I1789 VanDerWaalsContact O-CG1 3.25Å; L1785-I1789 WeakPolarHBondContact O-CG1 3.41Å; L1785-I1789 PolarHBondContact O-N 3.22Å; D1786-I1789 PolarHBondContact O-N 3Å; I1789-L1791 PolarHBondContact O-N 3.24Å; I1789-L1792 PolarHBondContact O-N 2.93Å; I1789-S1793 VanDerWaalsContact O-CB 3.22Å; I1789-S1793 WeakPolarHBondContact O-CB 3.39Å; I1789-S1793 PolarHBondContact O-N 3.01Å; I1789-S1793 PolarHBondContact O-OG 3.05Å; I1789-L1854 HydrophobicContact CD1-CB 4.1Å; I1789-L1854 HydrophobicContact CD1-CD2 3.49Å; I1789-L1854 VanDerWaalsContact CD1-CD2 3.48Å; I1789-L1854 HydrophobicContact CD1-CG 4.4Å; I1789-V1858 HydrophobicContact CD1-CG2 4.16Å; I1789-V1858 HydrophobicContact CG1-CG2 3.55Å; I1789-L1861 HydrophobicContact CB-CD1 4.49Å; I1789-L1861 HydrophobicContact CG2-CD1 4.28Å
1790L85.5Confident81.9Confident14.2 Ų14.225.9 Ų25.97%0.07414%0.135CC..Hα-helixtrans-57.5-49.3177-74.8168000111.4F1530 F1533 L1544 V1545 L1548 D1786 V1787 L1788 S1793 Q1794F1530-L1790 HydrophobicContact CE1-CD2 3.48Å; F1530-L1790 VanDerWaalsContact CE1-CD2 3.48Å; F1530-L1790 HydrophobicContact CE1-CG 4.45Å; F1530-L1790 HydrophobicContact CZ-CD2 3.58Å; F1530-L1790 HydrophobicContact CZ-CG 4.07Å; F1533-L1790 HydrophobicContact CD1-CD2 4.45Å; F1533-L1790 HydrophobicContact CD2-CD2 4.16Å; F1533-L1790 HydrophobicContact CE1-CD1 4.19Å; F1533-L1790 HydrophobicContact CE1-CD2 4.23Å; F1533-L1790 HydrophobicContact CE2-CD2 3.84Å; F1533-L1790 HydrophobicContact CE2-CG 4.4Å; F1533-L1790 HydrophobicContact CG-CD2 4.37Å; F1533-L1790 HydrophobicContact CZ-CD1 4.04Å; F1533-L1790 HydrophobicContact CZ-CD2 3.78Å; F1533-L1790 HydrophobicContact CZ-CG 4.3Å; L1544-L1790 HydrophobicContact CD2-CD1 4.39Å; V1545-L1790 HydrophobicContact CG1-CD1 4.42Å; V1545-L1790 HydrophobicContact CG1-CD2 4.44Å; V1545-L1790 HydrophobicContact CG2-CD1 3.81Å; L1548-L1790 HydrophobicContact CD1-CB 4.28Å; D1786-L1790 WeakPolarHBondContact O-CB 3.3Å; D1786-L1790 VanDerWaalsContact O-CG 3.29Å; D1786-L1790 WeakPolarHBondContact O-CG 3.31Å; D1786-L1790 PolarHBondContact O-N 3.01Å; V1787-L1790 PolarHBondContact O-N 3.22Å; L1788-L1790 VanDerWaalsContact C-N 3.34Å; L1788-L1790 PolarHBondContact O-N 3.37Å; L1790-S1793 PolarHBondContact O-OG 3.08Å; L1790-S1793 VanDerWaalsContact O-OG 3.1Å; L1790-Q1794 VanDerWaalsContact O-CB 3.29Å; L1790-Q1794 WeakPolarHBondContact O-CB 3.21Å; L1790-Q1794 WeakPolarHBondContact O-CG 3.42Å; L1790-Q1794 PolarHBondContact O-N 3.2Å
1791L88.3Confident81.7Confident2.4 Ų2.425.5 Ų25.51%0.01313%0.132CC..Hα-helixtrans-65.7-48.2-178.9-178.6115.6000112.2L1548 W1706 V1787 L1788 I1789 S1793 Q1794 I1795 C1796 A1809 T1812 S1813L1548-L1791 HydrophobicContact CD1-CD1 4.24Å; W1706-L1791 HydrophobicContact CH2-CB 4.42Å; W1706-L1791 HydrophobicContact CH2-CD1 3.94Å; W1706-L1791 HydrophobicContact CZ3-CD1 3.78Å; W1706-L1791 HydrophobicContact CZ3-CD2 4.48Å; V1787-L1791 VanDerWaalsContact O-CB 3.27Å; V1787-L1791 WeakPolarHBondContact O-CB 3.35Å; V1787-L1791 PolarHBondContact O-N 3.34Å; L1788-L1791 PolarHBondContact O-N 3.14Å; I1789-L1791 PolarHBondContact O-N 3.24Å; L1791-S1793 VanDerWaalsContact C-N 3.33Å; L1791-S1793 PolarHBondContact O-N 2.75Å; L1791-Q1794 PolarHBondContact O-N 2.84Å; L1791-I1795 HydrophobicContact CD1-CD1 3.96Å; L1791-I1795 HydrophobicContact CG-CD1 3.8Å; L1791-I1795 WeakPolarHBondContact O-CA 3.26Å; L1791-I1795 WeakPolarHBondContact O-CB 3.36Å; L1791-I1795 VanDerWaalsContact O-CD1 3.26Å; L1791-I1795 WeakPolarHBondContact O-CD1 3.33Å; L1791-I1795 VanDerWaalsContact O-CG1 3.29Å; L1791-I1795 WeakPolarHBondContact O-CG1 3.32Å; L1791-I1795 PolarHBondContact O-N 3.11Å; L1791-I1795 VanDerWaalsContact O-N 3.13Å; L1791-C1796 PolarHBondContact O-N 3.16Å; L1791-C1796 VanDerWaalsContact O-N 3.16Å; L1791-A1809 HydrophobicContact CD1-CB 4.11Å; L1791-A1809 HydrophobicContact CD2-CB 3.99Å; L1791-A1809 VanDerWaalsContact CD2-O 3.29Å; L1791-A1809 WeakPolarHBondContact CD2-O 3.26Å; L1791-A1809 HydrophobicContact CG-CB 4.17Å; L1791-T1812 HydrophobicContact CD1-CG2 4.5Å; L1791-T1812 WeakPolarHBondContact CD1-OG1 3.34Å; L1791-T1812 WeakPolarHBondContact CD2-OG1 3.47Å; L1791-S1813 VanDerWaalsContact CD2-OG 3.22Å; L1791-S1813 WeakPolarHBondContact CD2-OG 3.41Å
1792L88.6Confident81.6Confident0.4 Ų0.426.3 Ų26.30%0.00214%0.138CC..Iπ-helixtrans-68.9-38.5-176.8-68.9170.1000111.8L1788 I1789 Q1794 I1795 C1796 S1797 V1858 L1861 L1862 Y1880L1788-L1792 HydrophobicContact CD2-CD1 3.75Å; L1788-L1792 VanDerWaalsContact CD2-CD1 3.47Å; L1788-L1792 HydrophobicContact CD2-CG 4.47Å; L1788-L1792 HydrophobicContact CG-CD1 3.77Å; L1788-L1792 HydrophobicContact CG-CG 4.27Å; L1788-L1792 VanDerWaalsContact O-CB 3.28Å; L1788-L1792 WeakPolarHBondContact O-CB 3.39Å; L1788-L1792 VanDerWaalsContact O-CG 3.25Å; L1788-L1792 WeakPolarHBondContact O-CG 3.35Å; L1788-L1792 PolarHBondContact O-N 2.98Å; I1789-L1792 PolarHBondContact O-N 2.93Å; L1792-Q1794 VanDerWaalsContact C-N 3.34Å; L1792-Q1794 PolarHBondContact O-N 2.71Å; L1792-I1795 PolarHBondContact O-N 3.35Å; L1792-C1796 HydrophobicContact CD2-CB 4.01Å; L1792-C1796 CarbonylContact O-C 3.58Å; L1792-C1796 VanDerWaalsContact O-CB 3.32Å; L1792-C1796 WeakPolarHBondContact O-CB 3.31Å; L1792-C1796 PolarHBondContact O-N 3.22Å; L1792-C1796 PolarHBondContact O-SG 3.15Å; L1792-S1797 VanDerWaalsContact O-CB 3.28Å; L1792-S1797 WeakPolarHBondContact O-CB 3.44Å; L1792-S1797 PolarHBondContact O-N 3.4Å; L1792-V1858 HydrophobicContact CD1-CG1 4.27Å; L1792-L1861 HydrophobicContact CB-CB 3.84Å; L1792-L1861 HydrophobicContact CB-CD1 4.04Å; L1792-L1861 HydrophobicContact CB-CG 4.42Å; L1792-L1861 HydrophobicContact CD1-CB 3.95Å; L1792-L1861 HydrophobicContact CG-CB 4.49Å; L1792-L1862 HydrophobicContact CD1-CD2 3.86Å; L1792-L1862 HydrophobicContact CD1-CG 3.85Å; L1792-L1862 HydrophobicContact CD2-CD2 4Å; L1792-Y1880 HydrophobicContact CD2-CE1 4.18Å
1793S84.2Confident81.5Confident31.6 Ų31.629.9 Ų29.922%0.22115%0.154CC..Iπ-helixtrans-68.6-44.5178.361.60000112.1I1789 L1790 L1791 I1795 C1796 S1797I1789-S1793 VanDerWaalsContact O-CB 3.22Å; I1789-S1793 WeakPolarHBondContact O-CB 3.39Å; I1789-S1793 PolarHBondContact O-N 3.01Å; I1789-S1793 PolarHBondContact O-OG 3.05Å; L1790-S1793 PolarHBondContact O-OG 3.08Å; L1790-S1793 VanDerWaalsContact O-OG 3.1Å; L1791-S1793 VanDerWaalsContact C-N 3.33Å; L1791-S1793 PolarHBondContact O-N 2.75Å; S1793-I1795 VanDerWaalsContact C-N 3.35Å; S1793-I1795 PolarHBondContact O-N 3.46Å; S1793-C1796 PolarHBondContact O-N 3.46Å; S1793-S1797 VanDerWaalsContact O-CB 3.28Å; S1793-S1797 WeakPolarHBondContact O-CB 3.29Å; S1793-S1797 PolarHBondContact O-N 3.08Å; S1793-S1797 PolarHBondContact O-OG 3.14Å
1794Q80.7Confident81.3Confident36 Ų3631.3 Ų31.317%0.16816%0.162CC..Iπ-helixtrans-76.7-35.9-177.8-80.4-175.27.500113L1548 N1552 L1790 L1791 L1792 C1796 S1797 V1798L1548-Q1794 HydrophobicContact CD2-CB 4.03Å; L1548-Q1794 HydrophobicContact CD2-CG 4.18Å; L1548-Q1794 PolarHBondContact O-NE2 2.86Å; L1548-Q1794 PolarHBondContact O-OE1 3.48Å; N1552-Q1794 PolarHBondContact ND2-OE1 2.86Å; N1552-Q1794 PolarHBondContact OD1-NE2 3.21Å; L1790-Q1794 VanDerWaalsContact O-CB 3.29Å; L1790-Q1794 WeakPolarHBondContact O-CB 3.21Å; L1790-Q1794 WeakPolarHBondContact O-CG 3.42Å; L1790-Q1794 PolarHBondContact O-N 3.2Å; L1791-Q1794 PolarHBondContact O-N 2.84Å; L1792-Q1794 VanDerWaalsContact C-N 3.34Å; L1792-Q1794 PolarHBondContact O-N 2.71Å; Q1794-C1796 VanDerWaalsContact C-N 3.29Å; Q1794-C1796 PolarHBondContact O-N 2.78Å; Q1794-S1797 PolarHBondContact O-N 3.31Å; Q1794-S1797 PolarHBondContact O-OG 3.01Å; Q1794-V1798 WeakPolarHBondContact O-CG2 3.45Å; Q1794-V1798 PolarHBondContact O-N 3.19Å
1795I79.4Confident81.1Confident8.6 Ų8.631.4 Ų31.44%0.04416%0.163CC..Iπ-helixtrans-93-48.6-177.5-62.6169.1000111.5L1548 L1791 L1792 S1793 S1797 V1801 I1805 R1806 A1809L1548-I1795 HydrophobicContact CD2-CD1 3.62Å; L1791-I1795 HydrophobicContact CD1-CD1 3.96Å; L1791-I1795 HydrophobicContact CG-CD1 3.8Å; L1791-I1795 WeakPolarHBondContact O-CA 3.26Å; L1791-I1795 WeakPolarHBondContact O-CB 3.36Å; L1791-I1795 VanDerWaalsContact O-CD1 3.26Å; L1791-I1795 WeakPolarHBondContact O-CD1 3.33Å; L1791-I1795 VanDerWaalsContact O-CG1 3.29Å; L1791-I1795 WeakPolarHBondContact O-CG1 3.32Å; L1791-I1795 PolarHBondContact O-N 3.11Å; L1791-I1795 VanDerWaalsContact O-N 3.13Å; L1792-I1795 PolarHBondContact O-N 3.35Å; S1793-I1795 VanDerWaalsContact C-N 3.35Å; S1793-I1795 PolarHBondContact O-N 3.46Å; I1795-S1797 VanDerWaalsContact C-N 3.33Å; I1795-S1797 PolarHBondContact O-N 3.05Å; I1795-V1801 HydrophobicContact CG2-CG1 4.09Å; I1795-I1805 HydrophobicContact CG2-CG2 3.8Å; I1795-R1806 HydrophobicContact CG2-CG 4.19Å; I1795-R1806 WeakPolarHBondContact O-CG 3.32Å; I1795-A1809 HydrophobicContact CB-CB 4.29Å; I1795-A1809 HydrophobicContact CD1-CB 3.16Å; I1795-A1809 HydrophobicContact CG1-CB 4.23Å; I1795-A1809 HydrophobicContact CG2-CB 3.63Å
1796C79.2Confident81Confident9.8 Ų9.833 Ų337%0.06617%0.169CC..Iπ-helixtrans-73.3-33-175.3-64.60000112.8L1791 L1792 S1793 Q1794 V1798 L1861 S1865 R1868 Y1880L1791-C1796 PolarHBondContact O-N 3.16Å; L1791-C1796 VanDerWaalsContact O-N 3.16Å; L1792-C1796 HydrophobicContact CD2-CB 4.01Å; L1792-C1796 CarbonylContact O-C 3.58Å; L1792-C1796 VanDerWaalsContact O-CB 3.32Å; L1792-C1796 WeakPolarHBondContact O-CB 3.31Å; L1792-C1796 PolarHBondContact O-N 3.22Å; L1792-C1796 PolarHBondContact O-SG 3.15Å; S1793-C1796 PolarHBondContact O-N 3.46Å; Q1794-C1796 VanDerWaalsContact C-N 3.29Å; Q1794-C1796 PolarHBondContact O-N 2.78Å; C1796-V1798 VanDerWaalsContact C-N 3.34Å; C1796-V1798 PolarHBondContact O-N 2.96Å; C1796-L1861 HydrophobicContact CB-CD2 4.29Å; C1796-S1865 PolarHBondContact SG-OG 3.43Å; C1796-R1868 PolarHBondContact O-NH1 2.88Å; C1796-R1868 PolarHBondContact O-NH2 3.12Å; C1796-Y1880 HydrophobicContact CB-CE1 4.47Å; C1796-Y1880 WeakPolarHBondContact CB-OH 3.41Å; C1796-Y1880 PolarHBondContact SG-OH 3.4Å
1797S71Confident81.1Confident55.4 Ų55.435 Ų3539%0.38718%0.179SC..SBendtrans-75.1-26.2-175.883.60000113.7L1792 S1793 Q1794 I1795 R1868L1792-S1797 VanDerWaalsContact O-CB 3.28Å; L1792-S1797 WeakPolarHBondContact O-CB 3.44Å; L1792-S1797 PolarHBondContact O-N 3.4Å; S1793-S1797 VanDerWaalsContact O-CB 3.28Å; S1793-S1797 WeakPolarHBondContact O-CB 3.29Å; S1793-S1797 PolarHBondContact O-N 3.08Å; S1793-S1797 PolarHBondContact O-OG 3.14Å; Q1794-S1797 PolarHBondContact O-N 3.31Å; Q1794-S1797 PolarHBondContact O-OG 3.01Å; I1795-S1797 VanDerWaalsContact C-N 3.33Å; I1795-S1797 PolarHBondContact O-N 3.05Å; S1797-R1868 VanDerWaalsContact C-NH1 3.34Å; S1797-R1868 PolarHBondContact O-NE 3.22Å; S1797-R1868 PolarHBondContact O-NH1 2.79Å; S1797-R1868 PolarHBondContact O-NH2 3.13Å
1798V70.2Confident81.1Confident30.2 Ų30.236.5 Ų36.518%0.18319%0.187CC..  trans-85.8124.9-174.5179.10000110.3T1553 Q1794 C1796 E1800 V1801 R1868T1553-V1798 VanDerWaalsContact OG1-CG2 3.29Å; T1553-V1798 WeakPolarHBondContact OG1-CG2 3.37Å; Q1794-V1798 WeakPolarHBondContact O-CG2 3.45Å; Q1794-V1798 PolarHBondContact O-N 3.19Å; C1796-V1798 VanDerWaalsContact C-N 3.34Å; C1796-V1798 PolarHBondContact O-N 2.96Å; V1798-E1800 VanDerWaalsContact C-N 3.31Å; V1798-E1800 HydrophobicContact CG1-CB 4.22Å; V1798-E1800 WeakPolarHBondContact CG1-OE2 3.23Å; V1798-E1800 PolarHBondContact O-N 3.01Å; V1798-V1801 HydrophobicContact CB-CG2 3.59Å; V1798-V1801 VanDerWaalsContact CB-CG2 3.48Å; V1798-V1801 HydrophobicContact CG1-CG2 3.76Å; V1798-V1801 HydrophobicContact CG2-CG2 4.41Å; V1798-V1801 PolarHBondContact O-N 3.46Å; V1798-R1868 PolarHBondContact O-NH2 3.4Å
1799K68.2Low81.1Confident164.6 Ų164.636.6 Ų36.672%0.71619%0.188SC*.THydrogen-bonded Turntrans-65.2-38.4-174.8-81.4178.9-177.4177.20112.3V1801 R1806K1799-V1801 PolarHBondContact O-N 3.31Å; K1799-R1806 PolarHBondContact O-NH2 3Å
1800E69.2Low81.3Confident126.4 Ų126.435.7 Ų35.759%0.59118%0.184SC*.THydrogen-bonded Turntrans-9418.2-176.3-64.7150.8-177.400111.8V1798 P1802V1798-E1800 VanDerWaalsContact C-N 3.31Å; V1798-E1800 HydrophobicContact CG1-CB 4.22Å; V1798-E1800 WeakPolarHBondContact CG1-OE2 3.23Å; V1798-E1800 PolarHBondContact O-N 3.01Å; E1800-P1802 WeakPolarHBondContact O-CD 3.44Å
1801V74.9Confident81.6Confident4.75 Ų4.7535.9 Ų35.93%0.02919%0.189CC..SBendtrans-73.3128.2172.4-176.20000109.4T1553 I1795 V1798 K1799 Q1803 I1805 R1806T1553-V1801 HydrophobicContact CG2-CG1 4.23Å; T1553-V1801 HydrophobicContact CG2-CG2 4.39Å; T1553-V1801 VanDerWaalsContact OG1-CA 3.29Å; T1553-V1801 WeakPolarHBondContact OG1-CA 3.33Å; T1553-V1801 WeakPolarHBondContact OG1-CG2 3.28Å; I1795-V1801 HydrophobicContact CG2-CG1 4.09Å; V1798-V1801 HydrophobicContact CB-CG2 3.59Å; V1798-V1801 VanDerWaalsContact CB-CG2 3.48Å; V1798-V1801 HydrophobicContact CG1-CG2 3.76Å; V1798-V1801 HydrophobicContact CG2-CG2 4.41Å; V1798-V1801 PolarHBondContact O-N 3.46Å; K1799-V1801 PolarHBondContact O-N 3.31Å; V1801-Q1803 PolarHBondContact O-N 3.08Å; V1801-I1805 HydrophobicContact CG1-CB 3.91Å; V1801-I1805 HydrophobicContact CG1-CG2 3.6Å; V1801-I1805 VanDerWaalsContact CG1-CG2 3.46Å; V1801-R1806 HydrophobicContact CB-CG 3.86Å; V1801-R1806 HydrophobicContact CG1-CG 3.68Å; V1801-R1806 VanDerWaalsContact O-CZ 3.28Å; V1801-R1806 PolarHBondContact O-NE 3.08Å; V1801-R1806 PolarHBondContact O-NH2 3.39Å
1802P78.4Confident81.9Confident23.75 Ų23.7535.8 Ų35.815%0.15419%0.188CC..  trans-50.8141.3174.5-29.736.3000112.5L1557 L1695 E1800 T1804 I1805 R1806L1557-P1802 HydrophobicContact CD1-CG 3.77Å; L1557-P1802 VanDerWaalsContact CD1-CG 3.44Å; L1695-P1802 HydrophobicContact CD1-CB 3.75Å; L1695-P1802 VanDerWaalsContact CD1-CB 3.48Å; L1695-P1802 HydrophobicContact CD1-CG 3.46Å; L1695-P1802 VanDerWaalsContact CD1-CG 3.42Å; L1695-P1802 HydrophobicContact CD2-CB 4.12Å; L1695-P1802 HydrophobicContact CD2-CG 4.27Å; L1695-P1802 HydrophobicContact CG-CB 4.47Å; L1695-P1802 HydrophobicContact CG-CG 4.28Å; E1800-P1802 WeakPolarHBondContact O-CD 3.44Å; P1802-T1804 VanDerWaalsContact C-N 3.26Å; P1802-T1804 PolarHBondContact O-N 3.15Å; P1802-I1805 HydrophobicContact CB-CD1 4.24Å; P1802-I1805 HydrophobicContact CB-CG1 4.37Å; P1802-I1805 HydrophobicContact CG-CD1 4.09Å; P1802-I1805 PolarHBondContact O-N 3.12Å; P1802-I1805 VanDerWaalsContact O-N 3.16Å; P1802-R1806 PolarHBondContact O-N 3.09Å
1803Q80.2Confident82.2Confident82 Ų8235.8 Ų35.838%0.38319%0.188SC..Hα-helixtrans-61.7-33.7-175.1-68.2-177.1-3.500112.8V1801 I1805 R1806 L1807 T1873V1801-Q1803 PolarHBondContact O-N 3.08Å; Q1803-I1805 VanDerWaalsContact C-N 3.34Å; Q1803-I1805 PolarHBondContact O-N 3.04Å; Q1803-R1806 PolarHBondContact O-N 3.04Å; Q1803-L1807 WeakPolarHBondContact O-CB 3.36Å; Q1803-L1807 PolarHBondContact O-N 3.14Å; Q1803-T1873 HydrophobicContact CG-CG2 4.45Å
1804T79.5Confident82.7Confident30 Ų3036.5 Ų36.518%0.18419%0.189CC..Hα-helixtrans-62.6-41.1178.3530000112L1598 Y1696 Q1700 P1802 L1807 L1808L1598-T1804 HydrophobicContact CD1-CG2 4.13Å; Y1696-T1804 HydrophobicContact CE1-CG2 4.2Å; Q1700-T1804 VanDerWaalsContact OE1-CB 3.27Å; Q1700-T1804 PolarHBondContact OE1-OG1 3.29Å; Q1700-T1804 VanDerWaalsContact OE1-OG1 3.05Å; P1802-T1804 VanDerWaalsContact C-N 3.26Å; P1802-T1804 PolarHBondContact O-N 3.15Å; T1804-L1807 PolarHBondContact O-N 3.23Å; T1804-L1808 WeakPolarHBondContact O-CG 3.2Å; T1804-L1808 PolarHBondContact O-N 3.39Å; T1804-L1808 VanDerWaalsContact O-N 3.17Å
1805I83.6Confident83.3Confident2.75 Ų2.7536.5 Ų36.51%0.01419%0.191CC..Hα-helixtrans-67.1-47.4177-68.3175.7000110.8T1553 L1695 K1699 I1703 I1795 V1801 P1802 Q1803 L1807 L1808 A1809T1553-I1805 HydrophobicContact CG2-CD1 4.11Å; T1553-I1805 HydrophobicContact CG2-CG2 4.19Å; L1695-I1805 HydrophobicContact CD1-CD1 4.02Å; L1695-I1805 HydrophobicContact CD1-CG1 4.32Å; K1699-I1805 HydrophobicContact CB-CD1 4.22Å; I1703-I1805 HydrophobicContact CD1-CB 4.12Å; I1703-I1805 HydrophobicContact CD1-CD1 3.62Å; I1703-I1805 HydrophobicContact CD1-CG1 3.65Å; I1703-I1805 HydrophobicContact CD1-CG2 3.48Å; I1703-I1805 HydrophobicContact CG1-CG2 4.47Å; I1795-I1805 HydrophobicContact CG2-CG2 3.8Å; V1801-I1805 HydrophobicContact CG1-CB 3.91Å; V1801-I1805 HydrophobicContact CG1-CG2 3.6Å; V1801-I1805 VanDerWaalsContact CG1-CG2 3.46Å; P1802-I1805 HydrophobicContact CB-CD1 4.24Å; P1802-I1805 HydrophobicContact CB-CG1 4.37Å; P1802-I1805 HydrophobicContact CG-CD1 4.09Å; P1802-I1805 PolarHBondContact O-N 3.12Å; P1802-I1805 VanDerWaalsContact O-N 3.16Å; Q1803-I1805 VanDerWaalsContact C-N 3.34Å; Q1803-I1805 PolarHBondContact O-N 3.04Å; I1805-L1807 VanDerWaalsContact C-N 3.27Å; I1805-L1807 PolarHBondContact O-N 3.28Å; I1805-L1808 PolarHBondContact O-N 3.3Å; I1805-L1808 VanDerWaalsContact O-N 3.14Å; I1805-A1809 PolarHBondContact O-N 3.26Å
1806R86.1Confident84Confident34.5 Ų34.536.1 Ų36.113%0.1319%0.189CC..Hα-helixtrans-61.4-34.4177.5-71.5-172.2-82.6177.7-12.3112.5I1795 K1799 V1801 P1802 Q1803 A1809 S1810 M1876I1795-R1806 HydrophobicContact CG2-CG 4.19Å; I1795-R1806 WeakPolarHBondContact O-CG 3.32Å; K1799-R1806 PolarHBondContact O-NH2 3Å; V1801-R1806 HydrophobicContact CB-CG 3.86Å; V1801-R1806 HydrophobicContact CG1-CG 3.68Å; V1801-R1806 VanDerWaalsContact O-CZ 3.28Å; V1801-R1806 PolarHBondContact O-NE 3.08Å; V1801-R1806 PolarHBondContact O-NH2 3.39Å; P1802-R1806 PolarHBondContact O-N 3.09Å; Q1803-R1806 PolarHBondContact O-N 3.04Å; R1806-A1809 PolarHBondContact O-N 3.17Å; R1806-S1810 WeakPolarHBondContact O-CB 3.38Å; R1806-S1810 PolarHBondContact O-N 3.09Å; R1806-M1876 HydrophobicContact CB-SD 3.56Å; R1806-M1876 WeakPolarHBondContact CB-SD 3.25Å
1807L88.6Confident84.7Confident57.5 Ų57.535.6 Ų35.630%0.30119%0.186SC..Hα-helixtrans-63-46.5175.1-17865.9000111.6Q1803 T1804 I1805 A1809 S1810 G1811 R1875 M1876Q1803-L1807 WeakPolarHBondContact O-CB 3.36Å; Q1803-L1807 PolarHBondContact O-N 3.14Å; T1804-L1807 PolarHBondContact O-N 3.23Å; I1805-L1807 VanDerWaalsContact C-N 3.27Å; I1805-L1807 PolarHBondContact O-N 3.28Å; L1807-A1809 VanDerWaalsContact C-N 3.33Å; L1807-A1809 PolarHBondContact O-N 3.15Å; L1807-S1810 PolarHBondContact O-N 3.24Å; L1807-S1810 PolarHBondContact O-OG 3.34Å; L1807-G1811 PolarHBondContact O-N 3.14Å; L1807-R1875 HydrophobicContact CD1-CB 4.13Å; L1807-R1875 HydrophobicContact CD1-CG 3.98Å; L1807-M1876 HydrophobicContact CD1-CB 4Å
1808L88.4Confident85.6Confident33.25 Ų33.2534 Ų3417%0.17418%0.175CC..Hα-helixtrans-61-44.6176.3-65.3-178.4000111.5Q1700 I1703 E1704 T1804 I1805 S1810 G1811 T1812Q1700-L1808 HydrophobicContact CG-CD1 4.06Å; I1703-L1808 HydrophobicContact CG2-CB 4.25Å; I1703-L1808 HydrophobicContact CG2-CD1 4.16Å; E1704-L1808 HydrophobicContact CB-CD1 4.06Å; E1704-L1808 VanDerWaalsContact OE2-CD2 3.28Å; E1704-L1808 WeakPolarHBondContact OE2-CD2 3.29Å; T1804-L1808 WeakPolarHBondContact O-CG 3.2Å; T1804-L1808 PolarHBondContact O-N 3.39Å; T1804-L1808 VanDerWaalsContact O-N 3.17Å; I1805-L1808 PolarHBondContact O-N 3.3Å; I1805-L1808 VanDerWaalsContact O-N 3.14Å; L1808-S1810 VanDerWaalsContact C-N 3.32Å; L1808-S1810 PolarHBondContact O-N 3.04Å; L1808-G1811 WeakPolarHBondContact O-CA 3.27Å; L1808-G1811 PolarHBondContact O-N 3Å; L1808-G1811 VanDerWaalsContact O-N 3.11Å; L1808-T1812 PolarHBondContact O-N 3.03Å; L1808-T1812 VanDerWaalsContact O-N 3.1Å; L1808-T1812 PolarHBondContact O-OG1 2.95Å
1809A89.7Confident86.4Confident2.5 Ų2.533.6 Ų33.62%0.02117%0.171CC..Hα-helixtrans-64.6-33.8178.600000113.4L1791 I1795 I1805 R1806 L1807 G1811 T1812 S1813L1791-A1809 HydrophobicContact CD1-CB 4.11Å; L1791-A1809 HydrophobicContact CD2-CB 3.99Å; L1791-A1809 VanDerWaalsContact CD2-O 3.29Å; L1791-A1809 WeakPolarHBondContact CD2-O 3.26Å; L1791-A1809 HydrophobicContact CG-CB 4.17Å; I1795-A1809 HydrophobicContact CB-CB 4.29Å; I1795-A1809 HydrophobicContact CD1-CB 3.16Å; I1795-A1809 HydrophobicContact CG1-CB 4.23Å; I1795-A1809 HydrophobicContact CG2-CB 3.63Å; I1805-A1809 PolarHBondContact O-N 3.26Å; R1806-A1809 PolarHBondContact O-N 3.17Å; L1807-A1809 VanDerWaalsContact C-N 3.33Å; L1807-A1809 PolarHBondContact O-N 3.15Å; A1809-G1811 VanDerWaalsContact C-N 3.3Å; A1809-G1811 PolarHBondContact O-N 3.07Å; A1809-T1812 VanDerWaalsContact C-OG1 3.28Å; A1809-T1812 VanDerWaalsContact CA-OG1 3.23Å; A1809-T1812 WeakPolarHBondContact CA-OG1 3.42Å; A1809-T1812 PolarHBondContact O-N 3.22Å; A1809-T1812 PolarHBondContact O-OG1 3.11Å; A1809-S1813 WeakPolarHBondContact O-CB 3.31Å; A1809-S1813 PolarHBondContact O-N 3.05Å; A1809-S1813 PolarHBondContact O-OG 3.37Å
1810S92.8Very high87.2Confident0 Ų025.7 Ų25.70%014%0.137CC..Hα-helixtrans-65-36.1172.7750000112R1806 L1807 L1808 S1813 L1814 N1879R1806-S1810 WeakPolarHBondContact O-CB 3.38Å; R1806-S1810 PolarHBondContact O-N 3.09Å; L1807-S1810 PolarHBondContact O-N 3.24Å; L1807-S1810 PolarHBondContact O-OG 3.34Å; L1808-S1810 VanDerWaalsContact C-N 3.32Å; L1808-S1810 PolarHBondContact O-N 3.04Å; S1810-S1813 WeakPolarHBondContact O-CB 3.37Å; S1810-S1813 PolarHBondContact O-N 2.99Å; S1810-L1814 PolarHBondContact O-N 3.35Å; S1810-L1814 VanDerWaalsContact O-N 3.12Å; S1810-N1879 WeakPolarHBondContact O-CB 3.36Å; S1810-N1879 PolarHBondContact OG-ND2 3.06Å
1811G93.6Very high87.9Confident17.5 Ų17.521 Ų2118%0.1812%0.115CC..Hα-helixtrans-64-47.8174.800000112.1L1807 L1808 A1809 S1813 L1814 T1815 N1879L1807-G1811 PolarHBondContact O-N 3.14Å; L1808-G1811 WeakPolarHBondContact O-CA 3.27Å; L1808-G1811 PolarHBondContact O-N 3Å; L1808-G1811 VanDerWaalsContact O-N 3.11Å; A1809-G1811 VanDerWaalsContact C-N 3.3Å; A1809-G1811 PolarHBondContact O-N 3.07Å; G1811-S1813 VanDerWaalsContact C-N 3.27Å; G1811-S1813 PolarHBondContact O-N 3.23Å; G1811-L1814 WeakPolarHBondContact O-CB 3.24Å; G1811-L1814 PolarHBondContact O-N 3.24Å; G1811-T1815 PolarHBondContact O-N 3.21Å; G1811-T1815 VanDerWaalsContact O-N 3.09Å; G1811-T1815 PolarHBondContact O-OG1 3.15Å; G1811-T1815 VanDerWaalsContact O-OG1 3.1Å; G1811-N1879 PolarHBondContact N-ND2 3.14Å
1812T93.6Very high88.1Confident1 Ų123.7 Ų23.71%0.00613%0.133CC..Hα-helixtrans-59.7-37.8172.538.30000112.4W1706 R1707 E1711 L1791 L1808 A1809 L1814 T1815 L1816W1706-T1812 HydrophobicContact CZ3-CG2 4.4Å; R1707-T1812 HydrophobicContact CB-CG2 3.48Å; R1707-T1812 VanDerWaalsContact CB-CG2 3.45Å; R1707-T1812 HydrophobicContact CG-CG2 3.22Å; E1711-T1812 HydrophobicContact CG-CG2 4.2Å; E1711-T1812 WeakPolarHBondContact OE1-CA 3.33Å; E1711-T1812 VanDerWaalsContact OE1-CG2 3.3Å; E1711-T1812 WeakPolarHBondContact OE1-CG2 3.36Å; L1791-T1812 HydrophobicContact CD1-CG2 4.5Å; L1791-T1812 WeakPolarHBondContact CD1-OG1 3.34Å; L1791-T1812 WeakPolarHBondContact CD2-OG1 3.47Å; L1808-T1812 PolarHBondContact O-N 3.03Å; L1808-T1812 VanDerWaalsContact O-N 3.1Å; L1808-T1812 PolarHBondContact O-OG1 2.95Å; A1809-T1812 VanDerWaalsContact C-OG1 3.28Å; A1809-T1812 VanDerWaalsContact CA-OG1 3.23Å; A1809-T1812 WeakPolarHBondContact CA-OG1 3.42Å; A1809-T1812 PolarHBondContact O-N 3.22Å; A1809-T1812 PolarHBondContact O-OG1 3.11Å; T1812-L1814 VanDerWaalsContact C-N 3.28Å; T1812-L1814 PolarHBondContact O-N 3.11Å; T1812-T1815 VanDerWaalsContact CA-OG1 3.27Å; T1812-T1815 WeakPolarHBondContact CA-OG1 3.42Å; T1812-T1815 PolarHBondContact O-N 3.26Å; T1812-T1815 PolarHBondContact O-OG1 3.19Å; T1812-L1816 WeakPolarHBondContact O-CB 3.42Å; T1812-L1816 VanDerWaalsContact O-CG 3.22Å; T1812-L1816 WeakPolarHBondContact O-CG 3.4Å; T1812-L1816 PolarHBondContact O-N 3.17Å
1813S94.6Very high88.1Confident0 Ų023.3 Ų23.30%013%0.129CC..Hα-helixtrans-61.5-41.8178.9-57.40000110.9L1788 L1791 A1809 S1810 G1811 L1816 C1817 S1883L1788-S1813 WeakPolarHBondContact CD1-O 3.4Å; L1791-S1813 VanDerWaalsContact CD2-OG 3.22Å; L1791-S1813 WeakPolarHBondContact CD2-OG 3.41Å; A1809-S1813 WeakPolarHBondContact O-CB 3.31Å; A1809-S1813 PolarHBondContact O-N 3.05Å; A1809-S1813 PolarHBondContact O-OG 3.37Å; S1810-S1813 WeakPolarHBondContact O-CB 3.37Å; S1810-S1813 PolarHBondContact O-N 2.99Å; G1811-S1813 VanDerWaalsContact C-N 3.27Å; G1811-S1813 PolarHBondContact O-N 3.23Å; S1813-L1816 PolarHBondContact O-N 3.35Å; S1813-C1817 VanDerWaalsContact O-CB 3.29Å; S1813-C1817 WeakPolarHBondContact O-CB 3.42Å; S1813-C1817 PolarHBondContact O-N 3.07Å; S1813-C1817 PolarHBondContact O-SG 3.17Å; S1813-S1883 PolarHBondContact O-OG 3.34Å
1814L95.2Very high87.7Confident46 Ų4620.2 Ų20.224%0.24112%0.116CC..Hα-helixtrans-64.2-47.4176.8-178.267.1000111.7S1810 G1811 T1812 C1817 S1818 N1879 G1882 S1883 Y1886S1810-L1814 PolarHBondContact O-N 3.35Å; S1810-L1814 VanDerWaalsContact O-N 3.12Å; G1811-L1814 WeakPolarHBondContact O-CB 3.24Å; G1811-L1814 PolarHBondContact O-N 3.24Å; T1812-L1814 VanDerWaalsContact C-N 3.28Å; T1812-L1814 PolarHBondContact O-N 3.11Å; L1814-C1817 PolarHBondContact O-N 3.3Å; L1814-S1818 PolarHBondContact O-N 2.9Å; L1814-N1879 HydrophobicContact CB-CB 4.38Å; L1814-G1882 VanDerWaalsContact CD1-C 3.43Å; L1814-S1883 VanDerWaalsContact CA-OG 3.24Å; L1814-S1883 WeakPolarHBondContact CA-OG 3.38Å; L1814-S1883 PolarHBondContact N-OG 3.07Å; L1814-S1883 VanDerWaalsContact N-OG 3.14Å; L1814-Y1886 HydrophobicContact CD1-CD2 3.92Å; L1814-Y1886 HydrophobicContact CD1-CE2 3.67Å; L1814-Y1886 HydrophobicContact CG-CE2 4.41Å
1815T93.7Very high87Confident35.25 Ų35.2522.1 Ų22.122%0.21613%0.131CC..Hα-helixtrans-64.2-43.5179.60.20000112E1711 G1811 T1812 C1817 S1818 F1819E1711-T1815 HydrophobicContact CB-CG2 4.35Å; E1711-T1815 HydrophobicContact CG-CG2 3.88Å; E1711-T1815 WeakPolarHBondContact CG-OG1 3.23Å; E1711-T1815 PolarHBondContact OE1-OG1 3.15Å; E1711-T1815 VanDerWaalsContact OE1-OG1 3.05Å; G1811-T1815 PolarHBondContact O-N 3.21Å; G1811-T1815 VanDerWaalsContact O-N 3.09Å; G1811-T1815 PolarHBondContact O-OG1 3.15Å; G1811-T1815 VanDerWaalsContact O-OG1 3.1Å; T1812-T1815 VanDerWaalsContact CA-OG1 3.27Å; T1812-T1815 WeakPolarHBondContact CA-OG1 3.42Å; T1812-T1815 PolarHBondContact O-N 3.26Å; T1812-T1815 PolarHBondContact O-OG1 3.19Å; T1815-C1817 VanDerWaalsContact C-N 3.3Å; T1815-C1817 PolarHBondContact O-N 3.26Å; T1815-S1818 WeakPolarHBondContact O-CB 3.31Å; T1815-S1818 PolarHBondContact O-N 3.05Å; T1815-S1818 VanDerWaalsContact O-N 3.14Å; T1815-S1818 PolarHBondContact O-OG 3.38Å; T1815-F1819 HydrophobicContact CG2-CD1 4.35Å; T1815-F1819 HydrophobicContact CG2-CD2 4.35Å; T1815-F1819 HydrophobicContact CG2-CE1 3.71Å; T1815-F1819 HydrophobicContact CG2-CE2 3.73Å; T1815-F1819 HydrophobicContact CG2-CZ 3.38Å; T1815-F1819 WeakPolarHBondContact O-CB 3.29Å; T1815-F1819 VanDerWaalsContact O-CD1 3.32Å; T1815-F1819 WeakPolarHBondContact O-CD1 3.37Å; T1815-F1819 VanDerWaalsContact O-CG 3.26Å; T1815-F1819 WeakPolarHBondContact O-CG 3.34Å; T1815-F1819 PolarHBondContact O-N 3.27Å
1816L93.2Very high86.1Confident0 Ų026.5 Ų26.50%015%0.148CC..Hα-helixtrans-65.3-37.9176.3-67.4177.9000112V1710 L1714 V1787 L1788 T1812 S1813 S1818 F1819 F1820V1710-L1816 HydrophobicContact CG1-CD1 4.49Å; V1710-L1816 HydrophobicContact CG1-CD2 4.23Å; L1714-L1816 HydrophobicContact CB-CD2 4.42Å; L1714-L1816 HydrophobicContact CD1-CD2 3.39Å; L1714-L1816 VanDerWaalsContact CD1-CD2 3.42Å; V1787-L1816 HydrophobicContact CB-CD1 4.22Å; V1787-L1816 HydrophobicContact CG1-CD1 3.7Å; L1788-L1816 HydrophobicContact CD1-CB 4Å; L1788-L1816 HydrophobicContact CD1-CD1 4.22Å; L1788-L1816 HydrophobicContact CD2-CB 3.84Å; L1788-L1816 HydrophobicContact CD2-CD1 4.13Å; L1788-L1816 HydrophobicContact CG-CB 3.8Å; L1788-L1816 HydrophobicContact CG-CD1 4.03Å; T1812-L1816 WeakPolarHBondContact O-CB 3.42Å; T1812-L1816 VanDerWaalsContact O-CG 3.22Å; T1812-L1816 WeakPolarHBondContact O-CG 3.4Å; T1812-L1816 PolarHBondContact O-N 3.17Å; S1813-L1816 PolarHBondContact O-N 3.35Å; L1816-S1818 VanDerWaalsContact C-N 3.34Å; L1816-F1819 HydrophobicContact CD2-CD2 4.28Å; L1816-F1819 PolarHBondContact O-N 3.15Å; L1816-F1820 WeakPolarHBondContact O-CB 3.48Å; L1816-F1820 VanDerWaalsContact O-CD1 3.26Å; L1816-F1820 WeakPolarHBondContact O-CD1 3.42Å; L1816-F1820 PolarHBondContact O-N 3.27Å
1817C94.1Very high85Confident0 Ų025.6 Ų25.60%015%0.146CC..Hα-helixtrans-66.8-37.5175.1-68.10000112.3S1813 L1814 T1815 F1820 H1821 Y1886 V1887S1813-C1817 VanDerWaalsContact O-CB 3.29Å; S1813-C1817 WeakPolarHBondContact O-CB 3.42Å; S1813-C1817 PolarHBondContact O-N 3.07Å; S1813-C1817 PolarHBondContact O-SG 3.17Å; L1814-C1817 PolarHBondContact O-N 3.3Å; T1815-C1817 VanDerWaalsContact C-N 3.3Å; T1815-C1817 PolarHBondContact O-N 3.26Å; C1817-F1820 HydrophobicContact CB-CD1 4.45Å; C1817-F1820 HydrophobicContact CB-CE1 3.85Å; C1817-F1820 HydrophobicContact CB-CZ 4.47Å; C1817-F1820 WeakPolarHBondContact O-CD1 3.19Å; C1817-H1821 WeakPolarHBondContact O-CB 3.31Å; C1817-H1821 PolarHBondContact O-N 3.19Å; C1817-H1821 VanDerWaalsContact O-N 3.1Å; C1817-Y1886 HydrophobicContact CB-CD2 4.18Å; C1817-Y1886 HydrophobicContact CB-CG 4.4Å; C1817-Y1886 WeakPolarHBondContact O-CB 3.23Å; C1817-V1887 HydrophobicContact CB-CG2 4.37Å
1818S90.9Very high83.5Confident22.5 Ų22.524.6 Ų24.616%0.15714%0.142CC..Hα-helixtrans-66.6-4317574.90000111.6L1814 T1815 L1816 F1820 H1821 C1822L1814-S1818 PolarHBondContact O-N 2.9Å; T1815-S1818 WeakPolarHBondContact O-CB 3.31Å; T1815-S1818 PolarHBondContact O-N 3.05Å; T1815-S1818 VanDerWaalsContact O-N 3.14Å; T1815-S1818 PolarHBondContact O-OG 3.38Å; L1816-S1818 VanDerWaalsContact C-N 3.34Å; S1818-F1820 VanDerWaalsContact C-N 3.32Å; S1818-F1820 PolarHBondContact O-N 3.05Å; S1818-H1821 PolarHBondContact O-N 3.2Å; S1818-H1821 VanDerWaalsContact O-N 3.13Å; S1818-C1822 WeakPolarHBondContact O-CB 3.33Å; S1818-C1822 PolarHBondContact O-N 3.15Å; S1818-C1822 PolarHBondContact O-SG 3.1Å
1819F87.2Confident81.6Confident20.5 Ų20.526 Ų269%0.0916%0.158CC..Hα-helixtrans-57.4-47.7176.4-75.4-5.4000112.7E1711 L1714 G1715 T1718 T1815 L1816 H1821 C1822 Q1823E1711-F1819 VanDerWaalsContact O-CE2 3.24Å; E1711-F1819 WeakPolarHBondContact O-CE2 3.25Å; E1711-F1819 WeakPolarHBondContact O-CZ 3.36Å; L1714-F1819 HydrophobicContact CB-CD2 4.18Å; L1714-F1819 HydrophobicContact CB-CE2 4.39Å; G1715-F1819 VanDerWaalsContact CA-CE2 3.45Å; G1715-F1819 VanDerWaalsContact N-CE2 3.34Å; T1718-F1819 HydrophobicContact CG2-CB 3.55Å; T1718-F1819 VanDerWaalsContact CG2-CB 3.48Å; T1718-F1819 HydrophobicContact CG2-CD1 4.32Å; T1718-F1819 HydrophobicContact CG2-CD2 4.25Å; T1718-F1819 HydrophobicContact CG2-CG 3.87Å; T1718-F1819 WeakPolarHBondContact OG1-CD1 3.19Å; T1718-F1819 WeakPolarHBondContact OG1-CG 3.42Å; T1815-F1819 HydrophobicContact CG2-CD1 4.35Å; T1815-F1819 HydrophobicContact CG2-CD2 4.35Å; T1815-F1819 HydrophobicContact CG2-CE1 3.71Å; T1815-F1819 HydrophobicContact CG2-CE2 3.73Å; T1815-F1819 HydrophobicContact CG2-CZ 3.38Å; T1815-F1819 WeakPolarHBondContact O-CB 3.29Å; T1815-F1819 VanDerWaalsContact O-CD1 3.32Å; T1815-F1819 WeakPolarHBondContact O-CD1 3.37Å; T1815-F1819 VanDerWaalsContact O-CG 3.26Å; T1815-F1819 WeakPolarHBondContact O-CG 3.34Å; T1815-F1819 PolarHBondContact O-N 3.27Å; L1816-F1819 HydrophobicContact CD2-CD2 4.28Å; L1816-F1819 PolarHBondContact O-N 3.15Å; F1819-H1821 PolarHBondContact O-N 3.33Å; F1819-C1822 PolarHBondContact O-N 3.28Å; F1819-Q1823 WeakPolarHBondContact O-CG 3.33Å; F1819-Q1823 PolarHBondContact O-N 3.02Å
1820F83.3Confident79.3Confident0.25 Ų0.2529.1 Ų29.10%0.00118%0.179CC..Hα-helixtrans-66-38.8176.1124.5-105.7000112.1P1781 C1784 L1785 L1788 L1816 C1817 S1818 Q1823 L1855 V1887 F1890P1781-F1820 HydrophobicContact CB-CB 4.04Å; P1781-F1820 HydrophobicContact CB-CD2 3.72Å; P1781-F1820 HydrophobicContact CB-CE2 3.9Å; C1784-F1820 HydrophobicContact CB-CB 4.02Å; C1784-F1820 HydrophobicContact CB-CD1 4.28Å; L1785-F1820 HydrophobicContact CD1-CE2 3.8Å; L1785-F1820 HydrophobicContact CD1-CZ 4.28Å; L1785-F1820 HydrophobicContact CD2-CD1 4.43Å; L1785-F1820 HydrophobicContact CD2-CD2 4.3Å; L1785-F1820 HydrophobicContact CD2-CE1 4.09Å; L1785-F1820 HydrophobicContact CD2-CE2 3.99Å; L1785-F1820 HydrophobicContact CD2-CZ 4.21Å; L1785-F1820 HydrophobicContact CG-CD2 4.12Å; L1785-F1820 HydrophobicContact CG-CE2 3.83Å; L1785-F1820 HydrophobicContact CG-CZ 4.39Å; L1788-F1820 HydrophobicContact CD1-CD1 4.22Å; L1788-F1820 HydrophobicContact CD1-CE1 3.9Å; L1816-F1820 WeakPolarHBondContact O-CB 3.48Å; L1816-F1820 VanDerWaalsContact O-CD1 3.26Å; L1816-F1820 WeakPolarHBondContact O-CD1 3.42Å; L1816-F1820 PolarHBondContact O-N 3.27Å; C1817-F1820 HydrophobicContact CB-CD1 4.45Å; C1817-F1820 HydrophobicContact CB-CE1 3.85Å; C1817-F1820 HydrophobicContact CB-CZ 4.47Å; C1817-F1820 WeakPolarHBondContact O-CD1 3.19Å; S1818-F1820 VanDerWaalsContact C-N 3.32Å; S1818-F1820 PolarHBondContact O-N 3.05Å; F1820-Q1823 WeakPolarHBondContact O-CB 3.32Å; F1820-Q1823 PolarHBondContact O-N 3.24Å; F1820-Q1823 VanDerWaalsContact O-N 3.12Å; F1820-L1855 HydrophobicContact CE1-CD1 4.1Å; F1820-L1855 HydrophobicContact CE1-CD2 4.1Å; F1820-L1855 HydrophobicContact CE2-CD2 4.15Å; F1820-L1855 HydrophobicContact CZ-CD1 3.74Å; F1820-L1855 HydrophobicContact CZ-CD2 3.38Å; F1820-V1887 HydrophobicContact CE1-CG1 4.33Å; F1820-V1887 HydrophobicContact CE1-CG2 4.23Å; F1820-V1887 HydrophobicContact CZ-CB 3.99Å; F1820-V1887 HydrophobicContact CZ-CG1 4.18Å; F1820-V1887 HydrophobicContact CZ-CG2 3.59Å; F1820-F1890 HydrophobicContact CD1-CB 4.13Å; F1820-F1890 HydrophobicContact CD1-CD1 4.35Å; F1820-F1890 HydrophobicContact CD1-CD2 4.17Å; F1820-F1890 AromaticContact CD1-CG 3.95Å; F1820-F1890 HydrophobicContact CD1-CG 3.98Å; F1820-F1890 HydrophobicContact CD2-CB 4.1Å; F1820-F1890 AromaticContact CD2-CD1 3.78Å; F1820-F1890 HydrophobicContact CD2-CD1 3.9Å; F1820-F1890 AromaticContact CD2-CD2 3.68Å; F1820-F1890 HydrophobicContact CD2-CD2 3.68Å; F1820-F1890 HydrophobicContact CD2-CE1 4.15Å; F1820-F1890 AromaticContact CD2-CE2 3.96Å; F1820-F1890 HydrophobicContact CD2-CE2 4.17Å; F1820-F1890 AromaticContact CD2-CG 3.63Å; F1820-F1890 HydrophobicContact CD2-CG 3.63Å; F1820-F1890 HydrophobicContact CD2-CZ 4.26Å; F1820-F1890 HydrophobicContact CE1-CB 3.58Å; F1820-F1890 AromaticContact CE1-CD1 3.27Å; F1820-F1890 HydrophobicContact CE1-CD1 3.27Å; F1820-F1890 AromaticContact CE1-CD2 3.83Å; F1820-F1890 HydrophobicContact CE1-CD2 3.83Å; F1820-F1890 AromaticContact CE1-CE1 3.75Å; F1820-F1890 HydrophobicContact CE1-CE1 3.75Å; F1820-F1890 HydrophobicContact CE1-CE2 4.27Å; F1820-F1890 AromaticContact CE1-CG 3.27Å; F1820-F1890 HydrophobicContact CE1-CG 3.27Å; F1820-F1890 HydrophobicContact CE1-CZ 4.21Å; F1820-F1890 HydrophobicContact CE2-CB 3.54Å; F1820-F1890 AromaticContact CE2-CD1 3.71Å; F1820-F1890 HydrophobicContact CE2-CD1 3.8Å; F1820-F1890 AromaticContact CE2-CD2 3.95Å; F1820-F1890 HydrophobicContact CE2-CD2 4.15Å; F1820-F1890 AromaticContact CE2-CE1 3.56Å; F1820-F1890 HydrophobicContact CE2-CE1 3.89Å; F1820-F1890 AromaticContact CE2-CE2 3.94Å; F1820-F1890 HydrophobicContact CE2-CE2 3.94Å; F1820-F1890 AromaticContact CE2-CG 3.44Å; F1820-F1890 HydrophobicContact CE2-CG 3.89Å; F1820-F1890 VanDerWaalsContact CE2-CG 3.44Å; F1820-F1890 AromaticContact CE2-CZ 3.51Å; F1820-F1890 HydrophobicContact CE2-CZ 3.51Å; F1820-F1890 VanDerWaalsContact CE2-CZ 3.42Å; F1820-F1890 HydrophobicContact CZ-CB 4.28Å; F1820-F1890 AromaticContact CZ-CD1 3.06Å; F1820-F1890 HydrophobicContact CZ-CD1 3.06Å; F1820-F1890 AromaticContact CZ-CD2 3.92Å; F1820-F1890 HydrophobicContact CZ-CD2 3.92Å; F1820-F1890 AromaticContact CZ-CE1 3.01Å; F1820-F1890 HydrophobicContact CZ-CE1 3.01Å; F1820-F1890 AromaticContact CZ-CE2 3.91Å; F1820-F1890 HydrophobicContact CZ-CE2 3.91Å; F1820-F1890 AromaticContact CZ-CG 3.5Å; F1820-F1890 HydrophobicContact CZ-CG 3.5Å; F1820-F1890 AromaticContact CZ-CZ 3.45Å; F1820-F1890 HydrophobicContact CZ-CZ 3.45Å; F1820-F1890 WeakPolarHBondContact O-CD2 3.45Å; F1820-F1890 WeakPolarHBondContact O-CE2 2.97Å
1821H84.1Confident76.9Confident27 Ų2734.4 Ų34.413%0.12520%0.202CC..Hα-helixtrans-64-42.5176.2178.560.2000112.5C1817 S1818 F1819 Q1823 S1824 Y1886 R1889 F1890 D1893C1817-H1821 WeakPolarHBondContact O-CB 3.31Å; C1817-H1821 PolarHBondContact O-N 3.19Å; C1817-H1821 VanDerWaalsContact O-N 3.1Å; S1818-H1821 PolarHBondContact O-N 3.2Å; S1818-H1821 VanDerWaalsContact O-N 3.13Å; F1819-H1821 PolarHBondContact O-N 3.33Å; H1821-Q1823 PolarHBondContact O-N 3.18Å; H1821-Q1823 VanDerWaalsContact O-N 3.1Å; H1821-S1824 VanDerWaalsContact O-CB 3.25Å; H1821-S1824 WeakPolarHBondContact O-CB 3.3Å; H1821-S1824 PolarHBondContact O-N 3.2Å; H1821-S1824 PolarHBondContact O-OG 3.22Å; H1821-S1824 VanDerWaalsContact O-OG 3.04Å; H1821-Y1886 HydrophobicContact CB-CD1 3.88Å; H1821-Y1886 HydrophobicContact CB-CG 4.35Å; H1821-Y1886 AromaticContact CD2-CD1 3.61Å; H1821-Y1886 AromaticContact CD2-CE1 3.97Å; H1821-Y1886 AromaticContact CG-CD1 3.88Å; H1821-R1889 VanDerWaalsContact CE1-CB 3.47Å; H1821-R1889 WeakPolarHBondContact CE1-CB 3.37Å; H1821-F1890 HydrophobicContact CB-CB 4.42Å; H1821-F1890 PolarHBondContact ND1-N 3.29Å; H1821-D1893 IonicContact CE1-OD2 3.06Å; H1821-D1893 PolarHBondContact CE1-OD2 3.27Å; H1821-D1893 VanDerWaalsContact CE1-OD2 3.26Å; H1821-D1893 IonicContact ND1-OD2 3.07Å
1822C80.3Confident74.4Confident60.5 Ų60.537.9 Ų37.941%0.40922%0.223SC..Hα-helixtrans-59.3-20.1175.5-68.50000113.2S1818 F1819 S1824 S1825S1818-C1822 WeakPolarHBondContact O-CB 3.33Å; S1818-C1822 PolarHBondContact O-N 3.15Å; S1818-C1822 PolarHBondContact O-SG 3.1Å; F1819-C1822 PolarHBondContact O-N 3.28Å; C1822-S1824 VanDerWaalsContact C-N 3.34Å; C1822-S1825 PolarHBondContact O-OG 3.01Å
1823Q76.7Confident71.6Confident16.5 Ų16.543.7 Ų43.78%0.07726%0.255CS..THydrogen-bonded Turntrans-84-5.5175.6-66-62.4-54.300113.8T1718 P1781 F1819 F1820 H1821 S1825 Y1826 V1827T1718-Q1823 PolarHBondContact O-NE2 2.95Å; P1781-Q1823 HydrophobicContact CG-CB 3.8Å; P1781-Q1823 HydrophobicContact CG-CG 4.36Å; F1819-Q1823 WeakPolarHBondContact O-CG 3.33Å; F1819-Q1823 PolarHBondContact O-N 3.02Å; F1820-Q1823 WeakPolarHBondContact O-CB 3.32Å; F1820-Q1823 PolarHBondContact O-N 3.24Å; F1820-Q1823 VanDerWaalsContact O-N 3.12Å; H1821-Q1823 PolarHBondContact O-N 3.18Å; H1821-Q1823 VanDerWaalsContact O-N 3.1Å; Q1823-S1825 VanDerWaalsContact C-N 3.32Å; Q1823-S1825 PolarHBondContact O-N 3.23Å; Q1823-Y1826 PolarHBondContact O-N 3.17Å; Q1823-Y1826 VanDerWaalsContact O-N 3.16Å; Q1823-V1827 VanDerWaalsContact O-CG2 3.29Å; Q1823-V1827 WeakPolarHBondContact O-CG2 3.34Å; Q1823-V1827 PolarHBondContact O-N 3.21Å; Q1823-V1827 VanDerWaalsContact O-N 3.14Å
1824S73.1Confident68.8Low16 Ų1651.4 Ų51.411%0.11229%0.294CS..Hα-helixtrans-57.4-41-178.961.50000113.1H1821 C1822 Y1826 V1827 N1828H1821-S1824 VanDerWaalsContact O-CB 3.25Å; H1821-S1824 WeakPolarHBondContact O-CB 3.3Å; H1821-S1824 PolarHBondContact O-N 3.2Å; H1821-S1824 PolarHBondContact O-OG 3.22Å; H1821-S1824 VanDerWaalsContact O-OG 3.04Å; C1822-S1824 VanDerWaalsContact C-N 3.34Å; S1824-Y1826 VanDerWaalsContact C-N 3.33Å; S1824-Y1826 PolarHBondContact O-N 3.23Å; S1824-V1827 PolarHBondContact O-N 3.13Å; S1824-N1828 WeakPolarHBondContact O-CB 3.49Å; S1824-N1828 VanDerWaalsContact O-CG 3.28Å; S1824-N1828 PolarHBondContact O-N 3.29Å
1825S65.4Low66.1Low71.25 Ų71.2553.7 Ų53.750%0.49831%0.314SS..Hα-helixtrans-64.6-40.9179.957.60000112.2C1822 Q1823 V1827 N1828 A1829C1822-S1825 PolarHBondContact O-OG 3.01Å; Q1823-S1825 VanDerWaalsContact C-N 3.32Å; Q1823-S1825 PolarHBondContact O-N 3.23Å; S1825-V1827 VanDerWaalsContact C-N 3.32Å; S1825-V1827 PolarHBondContact O-N 3.37Å; S1825-N1828 CarbonylContact O-C 3.45Å; S1825-N1828 PolarHBondContact O-N 3.15Å; S1825-A1829 WeakPolarHBondContact O-CB 3.41Å; S1825-A1829 PolarHBondContact O-N 3.14Å
1826Y63.3Low63.3Low95 Ų9560.9 Ų60.937%0.37335%0.346SS..Hα-helixtrans-70.2-34.5179-64.4-80.2000112.6N1719 Q1720 Q1823 S1824 N1828 A1829 S1830N1719-Y1826 HydrophobicContact CB-CD2 4.36Å; N1719-Y1826 HydrophobicContact CB-CE1 4.41Å; N1719-Y1826 HydrophobicContact CB-CE2 3.78Å; N1719-Y1826 VanDerWaalsContact CB-CE2 3.47Å; N1719-Y1826 VanDerWaalsContact CB-CZ 3.5Å; N1719-Y1826 VanDerWaalsContact CB-OH 3.3Å; N1719-Y1826 WeakPolarHBondContact CB-OH 3.44Å; N1719-Y1826 WeakPolarHBondContact ND2-CD1 3.37Å; N1719-Y1826 WeakPolarHBondContact ND2-CE1 3.33Å; N1719-Y1826 WeakPolarHBondContact ND2-CE2 3.37Å; N1719-Y1826 PolarHBondContact ND2-OH 3.27Å; Q1720-Y1826 HydrophobicContact CB-CE1 4.28Å; Q1823-Y1826 PolarHBondContact O-N 3.17Å; Q1823-Y1826 VanDerWaalsContact O-N 3.16Å; S1824-Y1826 VanDerWaalsContact C-N 3.33Å; S1824-Y1826 PolarHBondContact O-N 3.23Å; Y1826-N1828 VanDerWaalsContact C-N 3.34Å; Y1826-N1828 PolarHBondContact O-N 3.26Å; Y1826-A1829 PolarHBondContact O-N 2.98Å; Y1826-S1830 PolarHBondContact O-N 3.28Å
1827V63.7Low60.2Low15 Ų1567.7 Ų67.79%0.09138%0.379CS..Hα-helixtrans-64.6-29.6177.3172.30000111.3P1781 Q1823 S1824 S1825 S1830 K1844 C1845 V1846 Y1847 W1851 L1894P1781-V1827 HydrophobicContact CG-CG2 4.14Å; Q1823-V1827 VanDerWaalsContact O-CG2 3.29Å; Q1823-V1827 WeakPolarHBondContact O-CG2 3.34Å; Q1823-V1827 PolarHBondContact O-N 3.21Å; Q1823-V1827 VanDerWaalsContact O-N 3.14Å; S1824-V1827 PolarHBondContact O-N 3.13Å; S1825-V1827 VanDerWaalsContact C-N 3.32Å; S1825-V1827 PolarHBondContact O-N 3.37Å; V1827-S1830 PolarHBondContact O-OG 3.26Å; V1827-K1844 WeakPolarHBondContact O-CE 3.38Å; V1827-K1844 PolarHBondContact O-NZ 3.35Å; V1827-C1845 CarbonylContact C-O 3.54Å; V1827-C1845 WeakPolarHBondContact CA-O 3.19Å; V1827-C1845 WeakPolarHBondContact CB-O 3.43Å; V1827-C1845 VanDerWaalsContact CG1-O 3.23Å; V1827-C1845 WeakPolarHBondContact CG1-O 3.44Å; V1827-C1845 HydrophobicContact CG2-CB 4.46Å; V1827-C1845 CarbonylContact O-C 3.47Å; V1827-V1846 WeakPolarHBondContact O-CA 3.46Å; V1827-Y1847 HydrophobicContact CB-CE2 3.87Å; V1827-Y1847 HydrophobicContact CG1-CD2 3.72Å; V1827-Y1847 HydrophobicContact CG1-CE1 4.28Å; V1827-Y1847 HydrophobicContact CG1-CE2 3.08Å; V1827-Y1847 WeakPolarHBondContact CG1-OH 3.47Å; V1827-Y1847 HydrophobicContact CG2-CE2 3.47Å; V1827-Y1847 VanDerWaalsContact CG2-CE2 3.47Å; V1827-Y1847 WeakPolarHBondContact CG2-OH 3.4Å; V1827-W1851 HydrophobicContact CG1-CH2 4.16Å; V1827-W1851 HydrophobicContact CG1-CZ3 4.18Å; V1827-W1851 HydrophobicContact CG2-CH2 4.08Å; V1827-W1851 HydrophobicContact CG2-CZ3 4.24Å; V1827-L1894 HydrophobicContact CB-CD2 4.02Å; V1827-L1894 HydrophobicContact CG1-CD2 3.82Å
1828N57.2Low57.3Low37.5 Ų37.573.8 Ų73.820%0.20142%0.418CS..Hα-helixtrans-96.8-15.2-176-70.1-22.1000114.5S1824 S1825 Y1826 S1830 K1831 K1844 D1893 L1894 S1897S1824-N1828 WeakPolarHBondContact O-CB 3.49Å; S1824-N1828 VanDerWaalsContact O-CG 3.28Å; S1824-N1828 PolarHBondContact O-N 3.29Å; S1825-N1828 CarbonylContact O-C 3.45Å; S1825-N1828 PolarHBondContact O-N 3.15Å; Y1826-N1828 VanDerWaalsContact C-N 3.34Å; Y1826-N1828 PolarHBondContact O-N 3.26Å; N1828-S1830 VanDerWaalsContact C-N 3.32Å; N1828-S1830 PolarHBondContact O-N 3.24Å; N1828-K1831 PolarHBondContact O-N 3.37Å; N1828-K1844 PolarHBondContact O-NZ 3.28Å; N1828-D1893 PolarHBondContact ND2-O 2.81Å; N1828-D1893 VanDerWaalsContact ND2-O 3.09Å; N1828-L1894 WeakPolarHBondContact ND2-CD2 3.18Å; N1828-S1897 VanDerWaalsContact CB-OG 3.29Å; N1828-S1897 WeakPolarHBondContact CB-OG 3.31Å; N1828-S1897 WeakPolarHBondContact ND2-CB 3.49Å; N1828-S1897 PolarHBondContact ND2-OG 3.15Å; N1828-S1897 VanDerWaalsContact OD1-CB 3.29Å; N1828-S1897 WeakPolarHBondContact OD1-CB 3.43Å; N1828-S1897 PolarHBondContact OD1-OG 3.25Å
1829A47.2Very low54.6Low61.75 Ų61.7577.5 Ų77.551%0.5144%0.44SS..Hα-helixtrans-726.9-178.100000114.4S1825 Y1826 K1831 S1832S1825-A1829 WeakPolarHBondContact O-CB 3.41Å; S1825-A1829 PolarHBondContact O-N 3.14Å; Y1826-A1829 PolarHBondContact O-N 2.98Å; A1829-K1831 PolarHBondContact O-N 3.06Å; A1829-S1832 PolarHBondContact O-N 2.95Å; A1829-S1832 PolarHBondContact O-OG 3.33Å
1830S42.5Very low52.2Low66.75 Ų66.7580.5 Ų80.547%0.46746%0.463SS..THydrogen-bonded Turntrans-74.212.1178.261.90000113.9Y1826 V1827 N1828 K1844Y1826-S1830 PolarHBondContact O-N 3.28Å; V1827-S1830 PolarHBondContact O-OG 3.26Å; N1828-S1830 VanDerWaalsContact C-N 3.32Å; N1828-S1830 PolarHBondContact O-N 3.24Å; S1830-K1844 PolarHBondContact O-NZ 3.47Å; S1830-K1844 VanDerWaalsContact O-NZ 3.12Å
1831K42.8Very low50Low112 Ų11283.1 Ų83.149%0.48749%0.491SS..  trans-109.6-3.3175.4-74.8179.6-176.9-178.20114.9N1828 A1829 N1833 S1897 D1901N1828-K1831 PolarHBondContact O-N 3.37Å; A1829-K1831 PolarHBondContact O-N 3.06Å; K1831-N1833 PolarHBondContact O-N 2.77Å; K1831-S1897 WeakPolarHBondContact CE-OG 3.34Å; K1831-S1897 PolarHBondContact NZ-O 3.08Å; K1831-S1897 PolarHBondContact NZ-OG 3.43Å; K1831-S1897 VanDerWaalsContact NZ-OG 3.07Å; K1831-D1901 WeakPolarHBondContact CE-OD2 3.36Å; K1831-D1901 IonicContact NZ-OD1 3.08Å; K1831-D1901 PolarHBondContact NZ-OD1 2.99Å; K1831-D1901 IonicContact NZ-OD2 3.29Å; K1831-D1901 PolarHBondContact NZ-OD2 3.18Å
1832S39.6Very low47.9Very low90.25 Ų90.2586 Ų8663%0.63151%0.507SS*.SBendtrans-105.394.9173.454.40000112A1829 I1834A1829-S1832 PolarHBondContact O-N 2.95Å; A1829-S1832 PolarHBondContact O-OG 3.33Å; S1832-I1834 PolarHBondContact O-N 3.12Å
1833N36.5Very low46.1Very low124.5 Ų124.588.1 Ų88.167%0.66651%0.514SS*.  trans74.4102163.2-56.4-17.9000116.5K1831 S1835 V2561K1831-N1833 PolarHBondContact O-N 2.77Å; N1833-S1835 PolarHBondContact O-N 2.89Å; N1833-S1835 VanDerWaalsContact O-N 3.16Å; N1833-V2561 HydrophobicContact CB-CG1 4.39Å; N1833-V2561 WeakPolarHBondContact OD1-CB 3.36Å; N1833-V2561 VanDerWaalsContact OD1-CG1 3.24Å; N1833-V2561 WeakPolarHBondContact OD1-CG1 3.43Å; N1833-V2561 VanDerWaalsContact OD1-CG2 3.22Å; N1833-V2561 WeakPolarHBondContact OD1-CG2 3.43Å
1834I36Very low44.6Very low160 Ų16093.6 Ų93.682%0.82154%0.538SS*.  trans-83.397.7151-64159.6000109.6S1832 M1837S1832-I1834 PolarHBondContact O-N 3.12Å; I1834-M1837 HydrophobicContact CG2-CB 4.38Å
1835S37.5Very low43.5Very low96 Ų9695.3 Ų95.367%0.67155%0.549SS*.  trans-129.7115.8153.6171.50000107.5N1833 M1837N1833-S1835 PolarHBondContact O-N 2.89Å; N1833-S1835 VanDerWaalsContact O-N 3.16Å; S1835-M1837 VanDerWaalsContact C-N 3.28Å; S1835-M1837 PolarHBondContact O-N 3.03Å
1836E34.7Very low43Very low186.5 Ų186.595.9 Ų95.987%0.87155%0.549SS*.SBendtrans-2.576.4167.3-63178.8165.200113.8
1837M28.4Very low43Very low142.75 Ų142.7592.2 Ų92.270%0.70354%0.535SS*.  trans-142.1122.6150.6-156.869.482.700107.7I1834 S1835 T1839I1834-M1837 HydrophobicContact CG2-CB 4.38Å; S1835-M1837 VanDerWaalsContact C-N 3.28Å; S1835-M1837 PolarHBondContact O-N 3.03Å; M1837-T1839 VanDerWaalsContact C-N 3.29Å; M1837-T1839 HydrophobicContact CG-CG2 4.26Å; M1837-T1839 PolarHBondContact O-N 3.15Å
1838P33.8Very low43Very low126.5 Ų126.593.5 Ų93.582%0.82154%0.541SS*.  trans-78.772.1-176.833.3-32.7000109.1S1840P1838-S1840 VanDerWaalsContact C-N 3.27Å; P1838-S1840 PolarHBondContact O-N 3.21Å; P1838-S1840 VanDerWaalsContact O-N 3.14Å
1839T34.3Very low43.4Very low101.5 Ų101.597.2 Ų97.262%0.62356%0.556SS**  trans-78.394.8166.251.40000107.8M1837 G1841M1837-T1839 VanDerWaalsContact C-N 3.29Å; M1837-T1839 HydrophobicContact CG-CG2 4.26Å; M1837-T1839 PolarHBondContact O-N 3.15Å; T1839-G1841 PolarHBondContact O-N 3.13Å; T1839-G1841 VanDerWaalsContact O-N 3.07Å
1840S36.6Very low44.3Very low82.25 Ų82.25100.2 Ų100.258%0.57556%0.559SS**  trans-4.7107.7165.855.50000114.3P1838 L1842P1838-S1840 VanDerWaalsContact C-N 3.27Å; P1838-S1840 PolarHBondContact O-N 3.21Å; P1838-S1840 VanDerWaalsContact O-N 3.14Å; S1840-L1842 VanDerWaalsContact C-N 3.29Å; S1840-L1842 WeakPolarHBondContact O-CA 3.24Å; S1840-L1842 PolarHBondContact O-N 3.32Å
1841G37Very low45.9Very low56.25 Ų56.2597.9 Ų97.958%0.5854%0.54SS*.THydrogen-bonded Turntrans2.419.5165.300000115.6Y1748 T1839 D1843Y1748-G1841 WeakPolarHBondContact CD1-O 3.45Å; Y1748-G1841 WeakPolarHBondContact CE1-O 3.09Å; T1839-G1841 PolarHBondContact O-N 3.13Å; T1839-G1841 VanDerWaalsContact O-N 3.07Å; G1841-D1843 PolarHBondContact O-N 3.3Å
1842L40.6Very low47.6Very low88.25 Ų88.2593 Ų9346%0.46252%0.52SS..  trans-93.738.3177.1-154.878.6000110.2P1744 Y1748 S1840 K1844 Y1847P1744-L1842 HydrophobicContact CB-CD2 3.16Å; Y1748-L1842 HydrophobicContact CD1-CD1 4Å; Y1748-L1842 HydrophobicContact CD2-CD1 4.44Å; Y1748-L1842 HydrophobicContact CE1-CD1 3.98Å; Y1748-L1842 HydrophobicContact CG-CD1 3.96Å; S1840-L1842 VanDerWaalsContact C-N 3.29Å; S1840-L1842 WeakPolarHBondContact O-CA 3.24Å; S1840-L1842 PolarHBondContact O-N 3.32Å; L1842-K1844 PolarHBondContact O-N 3.08Å; L1842-K1844 VanDerWaalsContact O-N 3.09Å; L1842-Y1847 HydrophobicContact CD1-CE2 3.78Å; L1842-Y1847 HydrophobicContact CG-CE2 4.12Å
1843D41.3Very low49.5Very low104.25 Ų104.2591.4 Ų91.456%0.55751%0.507SS*.SBendtrans-44.868.1165.3-76.5-25000111.7G1841 C1845 V1846 Y1847G1841-D1843 PolarHBondContact O-N 3.3Å; D1843-C1845 PolarHBondContact O-N 3.31Å; D1843-V1846 HydrophobicContact CB-CB 3.87Å; D1843-V1846 HydrophobicContact CB-CG2 3.76Å; D1843-V1846 PolarHBondContact O-N 3.16Å; D1843-Y1847 HydrophobicContact CB-CD2 4.21Å; D1843-Y1847 HydrophobicContact CB-CE2 4.29Å; D1843-Y1847 WeakPolarHBondContact O-CD2 3.48Å; D1843-Y1847 PolarHBondContact O-N 3.09Å
1844K46Very low51.7Low132.25 Ų132.2586.9 Ų86.958%0.57548%0.483SS*.  trans-5266.6176.5-85.7173.3174.4175.50110.5V1827 N1828 S1830 L1842 V1846 N1848V1827-K1844 WeakPolarHBondContact O-CE 3.38Å; V1827-K1844 PolarHBondContact O-NZ 3.35Å; N1828-K1844 PolarHBondContact O-NZ 3.28Å; S1830-K1844 PolarHBondContact O-NZ 3.47Å; S1830-K1844 VanDerWaalsContact O-NZ 3.12Å; L1842-K1844 PolarHBondContact O-N 3.08Å; L1842-K1844 VanDerWaalsContact O-N 3.09Å; K1844-V1846 VanDerWaalsContact C-N 3.28Å; K1844-V1846 WeakPolarHBondContact O-CG2 3.46Å; K1844-V1846 PolarHBondContact O-N 3.21Å; K1844-N1848 PolarHBondContact O-N 3.1Å
1845C50.1Low54.2Low50 Ų5079.4 Ų79.434%0.33844%0.444SS..  trans-71.780.4169.9-89.10000109.6P1779 V1827 D1843 Y1847P1779-C1845 WeakPolarHBondContact CB-SG 3.07Å; P1779-C1845 VanDerWaalsContact CG-SG 3.53Å; V1827-C1845 CarbonylContact C-O 3.54Å; V1827-C1845 WeakPolarHBondContact CA-O 3.19Å; V1827-C1845 WeakPolarHBondContact CB-O 3.43Å; V1827-C1845 VanDerWaalsContact CG1-O 3.23Å; V1827-C1845 WeakPolarHBondContact CG1-O 3.44Å; V1827-C1845 HydrophobicContact CG2-CB 4.46Å; V1827-C1845 CarbonylContact O-C 3.47Å; D1843-C1845 PolarHBondContact O-N 3.31Å; C1845-Y1847 HydrophobicContact CB-CD2 4.38Å; C1845-Y1847 WeakPolarHBondContact O-CB 3.35Å; C1845-Y1847 PolarHBondContact O-N 3.12Å
1846V54.7Low56.4Low84.25 Ų84.2575.9 Ų75.951%0.51142%0.418SS..  trans-79103.2177-1770000108.6V1827 D1843 K1844 N1848 H1850V1827-V1846 WeakPolarHBondContact O-CA 3.46Å; D1843-V1846 HydrophobicContact CB-CB 3.87Å; D1843-V1846 HydrophobicContact CB-CG2 3.76Å; D1843-V1846 PolarHBondContact O-N 3.16Å; K1844-V1846 VanDerWaalsContact C-N 3.28Å; K1844-V1846 WeakPolarHBondContact O-CG2 3.46Å; K1844-V1846 PolarHBondContact O-N 3.21Å; V1846-N1848 VanDerWaalsContact C-N 3.33Å; V1846-N1848 PolarHBondContact O-N 3.35Å; V1846-H1850 PolarHBondContact O-CD2 3.25Å
1847Y63.3Low58.9Low17.25 Ų17.2567.5 Ų67.57%0.06838%0.38CS..  trans-62.555-177.3-156.5-88.2000112P1779 V1827 L1842 D1843 C1845 K1849 H1850 W1851 L1855 F1890 L1894 L1898 D1907 S1910 L1911P1779-Y1847 HydrophobicContact CG-CD1 4.49Å; P1779-Y1847 HydrophobicContact CG-CE1 4.17Å; V1827-Y1847 HydrophobicContact CB-CE2 3.87Å; V1827-Y1847 HydrophobicContact CG1-CD2 3.72Å; V1827-Y1847 HydrophobicContact CG1-CE1 4.28Å; V1827-Y1847 HydrophobicContact CG1-CE2 3.08Å; V1827-Y1847 WeakPolarHBondContact CG1-OH 3.47Å; V1827-Y1847 HydrophobicContact CG2-CE2 3.47Å; V1827-Y1847 VanDerWaalsContact CG2-CE2 3.47Å; V1827-Y1847 WeakPolarHBondContact CG2-OH 3.4Å; L1842-Y1847 HydrophobicContact CD1-CE2 3.78Å; L1842-Y1847 HydrophobicContact CG-CE2 4.12Å; D1843-Y1847 HydrophobicContact CB-CD2 4.21Å; D1843-Y1847 HydrophobicContact CB-CE2 4.29Å; D1843-Y1847 WeakPolarHBondContact O-CD2 3.48Å; D1843-Y1847 PolarHBondContact O-N 3.09Å; C1845-Y1847 HydrophobicContact CB-CD2 4.38Å; C1845-Y1847 WeakPolarHBondContact O-CB 3.35Å; C1845-Y1847 PolarHBondContact O-N 3.12Å; Y1847-K1849 PolarHBondContact O-N 3.05Å; Y1847-H1850 WeakPolarHBondContact O-CA 3.48Å; Y1847-H1850 WeakPolarHBondContact O-CB 3.46Å; Y1847-H1850 PolarHBondContact O-N 3.03Å; Y1847-W1851 HydrophobicContact CD1-CE3 4.18Å; Y1847-W1851 HydrophobicContact CD1-CZ3 4.26Å; Y1847-W1851 AromaticContact CD1-NE1 3.98Å; Y1847-W1851 HydrophobicContact CD2-CB 4.49Å; Y1847-W1851 HydrophobicContact CD2-CD2 4.28Å; Y1847-W1851 AromaticContact CD2-CE3 3.72Å; Y1847-W1851 HydrophobicContact CD2-CE3 3.72Å; Y1847-W1851 AromaticContact CD2-CH2 3.69Å; Y1847-W1851 HydrophobicContact CD2-CH2 3.69Å; Y1847-W1851 HydrophobicContact CD2-CZ2 4.11Å; Y1847-W1851 AromaticContact CD2-CZ3 3.94Å; Y1847-W1851 HydrophobicContact CD2-CZ3 4.18Å; Y1847-W1851 AromaticContact CE1-CE3 3.68Å; Y1847-W1851 HydrophobicContact CE1-CE3 3.68Å; Y1847-W1851 HydrophobicContact CE1-CH2 4.33Å; Y1847-W1851 AromaticContact CE1-CZ3 3.59Å; Y1847-W1851 HydrophobicContact CE1-CZ3 3.59Å; Y1847-W1851 HydrophobicContact CE2-CB 3.94Å; Y1847-W1851 HydrophobicContact CE2-CE3 4.17Å; Y1847-W1851 AromaticContact CE2-CH2 3.16Å; Y1847-W1851 HydrophobicContact CE2-CH2 3.16Å; Y1847-W1851 HydrophobicContact CE2-CZ2 4.03Å; Y1847-W1851 AromaticContact CE2-CZ3 3.19Å; Y1847-W1851 HydrophobicContact CE2-CZ3 3.19Å; Y1847-W1851 HydrophobicContact CG-CH2 4.46Å; Y1847-W1851 HydrophobicContact CG-CZ3 4.43Å; Y1847-W1851 AromaticContact CZ-CE3 3.65Å; Y1847-W1851 AromaticContact CZ-CH2 3.59Å; Y1847-W1851 AromaticContact CZ-CZ3 3.03Å; Y1847-W1851 PolarHBondContact O-N 2.93Å; Y1847-W1851 VanDerWaalsContact O-N 3.12Å; Y1847-W1851 VanDerWaalsContact OH-CZ3 3.22Å; Y1847-W1851 WeakPolarHBondContact OH-CZ3 3.27Å; Y1847-L1855 HydrophobicContact CE2-CD1 4.12Å; Y1847-F1890 HydrophobicContact CE1-CZ 4.37Å; Y1847-F1890 WeakPolarHBondContact OH-CE2 3.45Å; Y1847-F1890 WeakPolarHBondContact OH-CZ 3.11Å; Y1847-L1894 HydrophobicContact CD1-CD2 3.98Å; Y1847-L1894 HydrophobicContact CD2-CD1 3.55Å; Y1847-L1894 HydrophobicContact CE1-CD1 3.59Å; Y1847-L1894 HydrophobicContact CE1-CD2 3.21Å; Y1847-L1894 HydrophobicContact CE1-CG 4.03Å; Y1847-L1894 HydrophobicContact CE2-CD1 4.12Å; Y1847-L1894 HydrophobicContact CG-CD1 4.16Å; Y1847-L1898 HydrophobicContact CD1-CD1 4.11Å; Y1847-D1907 HydrophobicContact CD1-CB 3.87Å; Y1847-D1907 HydrophobicContact CE1-CB 3.9Å; Y1847-S1910 PolarHBondContact OH-OG 3.11Å; Y1847-L1911 HydrophobicContact CE1-CB 4.46Å; Y1847-L1911 HydrophobicContact CE2-CD1 4.22Å
1848N63.5Low61.8Low43.25 Ų43.2560.7 Ų60.723%0.23135%0.346CS..  trans-105.349.3-174.2-124.6-23.5000111.2K1844 V1846 H1850 W1851 S1852 D1907 S1910K1844-N1848 PolarHBondContact O-N 3.1Å; V1846-N1848 VanDerWaalsContact C-N 3.33Å; V1846-N1848 PolarHBondContact O-N 3.35Å; N1848-H1850 PolarHBondContact O-N 3.16Å; N1848-H1850 PolarHBondContact OD1-CD2 3.03Å; N1848-H1850 PolarHBondContact OD1-N 3.3Å; N1848-H1850 VanDerWaalsContact OD1-N 3.09Å; N1848-W1851 WeakPolarHBondContact O-CB 3.29Å; N1848-W1851 PolarHBondContact O-N 3.06Å; N1848-S1852 PolarHBondContact O-N 3.48Å; N1848-D1907 HydrophobicContact CB-CB 3.63Å; N1848-D1907 WeakPolarHBondContact CB-OD2 3.3Å; N1848-D1907 WeakPolarHBondContact ND2-CB 3.08Å; N1848-D1907 VanDerWaalsContact ND2-CG 3.31Å; N1848-D1907 PolarHBondContact ND2-OD2 2.61Å; N1848-S1910 PolarHBondContact O-OG 2.66Å
1849K64.5Low64.5Low114.75 Ų114.7554.6 Ų54.650%0.49931%0.307SS..G310 helixtrans-60.7-25.1176.9-3.4-178.1-178.2178.80114.6Y1847 W1851 S1852 T1906 D1907 S1910Y1847-K1849 PolarHBondContact O-N 3.05Å; K1849-W1851 PolarHBondContact O-N 3.27Å; K1849-W1851 VanDerWaalsContact O-N 3.15Å; K1849-S1852 WeakPolarHBondContact O-CB 3.43Å; K1849-S1852 PolarHBondContact O-N 3.34Å; K1849-S1852 VanDerWaalsContact O-N 3.11Å; K1849-T1906 WeakPolarHBondContact CE-OG1 3.35Å; K1849-D1907 VanDerWaalsContact CB-OD1 3.32Å; K1849-D1907 WeakPolarHBondContact CB-OD1 3.42Å; K1849-D1907 WeakPolarHBondContact CE-OD1 3.35Å; K1849-D1907 PolarHBondContact N-OD1 2.83Å; K1849-D1907 VanDerWaalsContact N-OD1 3.1Å; K1849-S1910 WeakPolarHBondContact CB-OG 3.4Å
1850H66.9Low67.2Low124.25 Ų124.2550.9 Ų50.958%0.57528%0.282SS*.G310 helixtrans-77.7-17.6178.1-70.4-63.3000114V1846 Y1847 N1848 P1853V1846-H1850 PolarHBondContact O-CD2 3.25Å; Y1847-H1850 WeakPolarHBondContact O-CA 3.48Å; Y1847-H1850 WeakPolarHBondContact O-CB 3.46Å; Y1847-H1850 PolarHBondContact O-N 3.03Å; N1848-H1850 PolarHBondContact O-N 3.16Å; N1848-H1850 PolarHBondContact OD1-CD2 3.03Å; N1848-H1850 PolarHBondContact OD1-N 3.3Å; N1848-H1850 VanDerWaalsContact OD1-N 3.09Å; H1850-P1853 WeakPolarHBondContact O-CD 3.23Å
1851W76.5Confident69.8Low19.75 Ų19.7547.2 Ų47.28%0.07526%0.256CS..G310 helixtrans-88.9-24-179.3-58.33.9000112.7P1779 P1781 V1782 V1827 Y1847 N1848 K1849 P1853 L1854 L1855 F1890 L1894P1779-W1851 HydrophobicContact CB-CH2 4.22Å; P1779-W1851 HydrophobicContact CB-CZ2 4.04Å; P1779-W1851 HydrophobicContact CG-CZ2 3.95Å; P1781-W1851 HydrophobicContact CB-CH2 4.25Å; P1781-W1851 HydrophobicContact CB-CZ3 3.96Å; P1781-W1851 HydrophobicContact CG-CH2 4.29Å; P1781-W1851 HydrophobicContact CG-CZ3 4.24Å; V1782-W1851 HydrophobicContact CG2-CD2 3.81Å; V1782-W1851 HydrophobicContact CG2-CE3 4.28Å; V1782-W1851 HydrophobicContact CG2-CG 4.1Å; V1782-W1851 HydrophobicContact CG2-CH2 4.14Å; V1782-W1851 HydrophobicContact CG2-CZ2 3.62Å; V1782-W1851 VanDerWaalsContact CG2-CZ2 3.48Å; V1782-W1851 HydrophobicContact CG2-CZ3 4.43Å; V1782-W1851 VanDerWaalsContact CG2-NE1 3.28Å; V1827-W1851 HydrophobicContact CG1-CH2 4.16Å; V1827-W1851 HydrophobicContact CG1-CZ3 4.18Å; V1827-W1851 HydrophobicContact CG2-CH2 4.08Å; V1827-W1851 HydrophobicContact CG2-CZ3 4.24Å; Y1847-W1851 HydrophobicContact CD1-CE3 4.18Å; Y1847-W1851 HydrophobicContact CD1-CZ3 4.26Å; Y1847-W1851 AromaticContact CD1-NE1 3.98Å; Y1847-W1851 HydrophobicContact CD2-CB 4.49Å; Y1847-W1851 HydrophobicContact CD2-CD2 4.28Å; Y1847-W1851 AromaticContact CD2-CE3 3.72Å; Y1847-W1851 HydrophobicContact CD2-CE3 3.72Å; Y1847-W1851 AromaticContact CD2-CH2 3.69Å; Y1847-W1851 HydrophobicContact CD2-CH2 3.69Å; Y1847-W1851 HydrophobicContact CD2-CZ2 4.11Å; Y1847-W1851 AromaticContact CD2-CZ3 3.94Å; Y1847-W1851 HydrophobicContact CD2-CZ3 4.18Å; Y1847-W1851 AromaticContact CE1-CE3 3.68Å; Y1847-W1851 HydrophobicContact CE1-CE3 3.68Å; Y1847-W1851 HydrophobicContact CE1-CH2 4.33Å; Y1847-W1851 AromaticContact CE1-CZ3 3.59Å; Y1847-W1851 HydrophobicContact CE1-CZ3 3.59Å; Y1847-W1851 HydrophobicContact CE2-CB 3.94Å; Y1847-W1851 HydrophobicContact CE2-CE3 4.17Å; Y1847-W1851 AromaticContact CE2-CH2 3.16Å; Y1847-W1851 HydrophobicContact CE2-CH2 3.16Å; Y1847-W1851 HydrophobicContact CE2-CZ2 4.03Å; Y1847-W1851 AromaticContact CE2-CZ3 3.19Å; Y1847-W1851 HydrophobicContact CE2-CZ3 3.19Å; Y1847-W1851 HydrophobicContact CG-CH2 4.46Å; Y1847-W1851 HydrophobicContact CG-CZ3 4.43Å; Y1847-W1851 AromaticContact CZ-CE3 3.65Å; Y1847-W1851 AromaticContact CZ-CH2 3.59Å; Y1847-W1851 AromaticContact CZ-CZ3 3.03Å; Y1847-W1851 PolarHBondContact O-N 2.93Å; Y1847-W1851 VanDerWaalsContact O-N 3.12Å; Y1847-W1851 VanDerWaalsContact OH-CZ3 3.22Å; Y1847-W1851 WeakPolarHBondContact OH-CZ3 3.27Å; N1848-W1851 WeakPolarHBondContact O-CB 3.29Å; N1848-W1851 PolarHBondContact O-N 3.06Å; K1849-W1851 PolarHBondContact O-N 3.27Å; K1849-W1851 VanDerWaalsContact O-N 3.15Å; W1851-P1853 VanDerWaalsContact C-CD 3.48Å; W1851-P1853 VanDerWaalsContact C-N 3.3Å; W1851-L1854 WeakPolarHBondContact O-CB 3.37Å; W1851-L1854 PolarHBondContact O-N 3.01Å; W1851-L1854 VanDerWaalsContact O-N 3.1Å; W1851-L1855 HydrophobicContact CB-CD1 4.22Å; W1851-L1855 WeakPolarHBondContact O-CB 3.4Å; W1851-L1855 WeakPolarHBondContact O-CG 3.45Å; W1851-L1855 PolarHBondContact O-N 3.18Å; W1851-F1890 HydrophobicContact CE3-CE1 4.13Å; W1851-F1890 AromaticContact CE3-CZ 3.96Å; W1851-F1890 HydrophobicContact CE3-CZ 3.96Å; W1851-F1890 HydrophobicContact CZ3-CE1 4.27Å; W1851-F1890 AromaticContact CZ3-CZ 3.65Å; W1851-F1890 HydrophobicContact CZ3-CZ 4.13Å; W1851-L1894 HydrophobicContact CE3-CD1 4.46Å
1852S77.6Confident72.4Confident8.5 Ų8.544.5 Ų44.56%0.05923%0.228CC..Hα-helixtrans-54.4-44.7-179.4121.40000113N1848 K1849 L1854 L1855 I1856 S1910 C1914N1848-S1852 PolarHBondContact O-N 3.48Å; K1849-S1852 WeakPolarHBondContact O-CB 3.43Å; K1849-S1852 PolarHBondContact O-N 3.34Å; K1849-S1852 VanDerWaalsContact O-N 3.11Å; S1852-L1854 VanDerWaalsContact C-N 3.3Å; S1852-L1854 PolarHBondContact O-N 3.13Å; S1852-L1855 WeakPolarHBondContact O-CB 3.24Å; S1852-L1855 PolarHBondContact O-N 3.15Å; S1852-L1855 VanDerWaalsContact O-N 3.15Å; S1852-I1856 WeakPolarHBondContact O-CB 3.32Å; S1852-I1856 WeakPolarHBondContact O-CD1 3.42Å; S1852-I1856 VanDerWaalsContact O-CG1 3.28Å; S1852-I1856 WeakPolarHBondContact O-CG1 3.4Å; S1852-I1856 PolarHBondContact O-N 3.04Å; S1852-S1910 WeakPolarHBondContact CB-O 3.33Å; S1852-S1910 PolarHBondContact OG-O 3.16Å; S1852-C1914 PolarHBondContact OG-SG 3.26Å; S1852-C1914 VanDerWaalsContact OG-SG 3.4Å
1853P80.1Confident74.9Confident56.25 Ų56.2540.3 Ų40.337%0.36521%0.206SC..Hα-helixtrans-64.1-35.1177.4-21.134000113.4I1526 H1850 W1851 S1857I1526-P1853 HydrophobicContact CD1-CB 4Å; I1526-P1853 HydrophobicContact CG1-CB 4.37Å; H1850-P1853 WeakPolarHBondContact O-CD 3.23Å; W1851-P1853 VanDerWaalsContact C-CD 3.48Å; W1851-P1853 VanDerWaalsContact C-N 3.3Å; P1853-S1857 VanDerWaalsContact O-CB 3.28Å; P1853-S1857 WeakPolarHBondContact O-CB 3.36Å; P1853-S1857 PolarHBondContact O-N 3.21Å
1854L83.5Confident77.1Confident29.75 Ų29.7537.5 Ų37.516%0.15619%0.189CC..Hα-helixtrans-69.1-43.5176.9-62.4172.7000110.7V1782 L1785 I1789 W1851 S1852 S1857 V1858V1782-L1854 HydrophobicContact CG1-CD1 3.81Å; L1785-L1854 HydrophobicContact CB-CB 4.31Å; L1785-L1854 HydrophobicContact CD1-CB 4.1Å; I1789-L1854 HydrophobicContact CD1-CB 4.1Å; I1789-L1854 HydrophobicContact CD1-CD2 3.49Å; I1789-L1854 VanDerWaalsContact CD1-CD2 3.48Å; I1789-L1854 HydrophobicContact CD1-CG 4.4Å; W1851-L1854 WeakPolarHBondContact O-CB 3.37Å; W1851-L1854 PolarHBondContact O-N 3.01Å; W1851-L1854 VanDerWaalsContact O-N 3.1Å; S1852-L1854 VanDerWaalsContact C-N 3.3Å; S1852-L1854 PolarHBondContact O-N 3.13Å; L1854-S1857 PolarHBondContact O-N 3.15Å; L1854-V1858 WeakPolarHBondContact O-CB 3.09Å; L1854-V1858 WeakPolarHBondContact O-CG2 3.35Å; L1854-V1858 PolarHBondContact O-N 3.15Å
1855L86.7Confident79.2Confident2.25 Ų2.2531.5 Ų31.51%0.01216%0.164CC..Hα-helixtrans-62.2-45.9176.5-90.4147.7000111.4L1785 F1820 Y1847 W1851 S1852 S1857 V1858 M1859 V1887 F1890 C1891 C1914L1785-L1855 HydrophobicContact CD1-CD2 3.88Å; L1785-L1855 HydrophobicContact CD1-CG 4.07Å; L1785-L1855 HydrophobicContact CD2-CD1 4.26Å; L1785-L1855 HydrophobicContact CD2-CD2 3.87Å; L1785-L1855 HydrophobicContact CG-CD2 4.45Å; F1820-L1855 HydrophobicContact CE1-CD1 4.1Å; F1820-L1855 HydrophobicContact CE1-CD2 4.1Å; F1820-L1855 HydrophobicContact CE2-CD2 4.15Å; F1820-L1855 HydrophobicContact CZ-CD1 3.74Å; F1820-L1855 HydrophobicContact CZ-CD2 3.38Å; Y1847-L1855 HydrophobicContact CE2-CD1 4.12Å; W1851-L1855 HydrophobicContact CB-CD1 4.22Å; W1851-L1855 WeakPolarHBondContact O-CB 3.4Å; W1851-L1855 WeakPolarHBondContact O-CG 3.45Å; W1851-L1855 PolarHBondContact O-N 3.18Å; S1852-L1855 WeakPolarHBondContact O-CB 3.24Å; S1852-L1855 PolarHBondContact O-N 3.15Å; S1852-L1855 VanDerWaalsContact O-N 3.15Å; L1855-S1857 VanDerWaalsContact C-N 3.33Å; L1855-S1857 PolarHBondContact O-N 3.37Å; L1855-V1858 PolarHBondContact O-N 3.08Å; L1855-M1859 WeakPolarHBondContact O-CB 3.01Å; L1855-M1859 VanDerWaalsContact O-CG 3.29Å; L1855-M1859 WeakPolarHBondContact O-CG 3.3Å; L1855-M1859 PolarHBondContact O-N 2.94Å; L1855-V1887 HydrophobicContact CD1-CG1 3.62Å; L1855-V1887 HydrophobicContact CD2-CG1 4.11Å; L1855-V1887 HydrophobicContact CG-CG1 4.33Å; L1855-F1890 HydrophobicContact CD1-CE1 4.36Å; L1855-F1890 HydrophobicContact CD2-CD1 4.16Å; L1855-F1890 HydrophobicContact CD2-CE1 4.25Å; L1855-C1891 WeakPolarHBondContact CD2-SG 3.41Å; L1855-C1914 HydrophobicContact CD2-CB 4.11Å; L1855-C1914 VanDerWaalsContact CD2-SG 3.54Å
1856I85.2Confident81.2Confident22.75 Ų22.7529.1 Ų29.112%0.11715%0.148CC..Hα-helixtrans-57.2-51.5174.6-69.4162.6000109.6S1852 V1858 M1859 E1860 E1913 C1914 I1917S1852-I1856 WeakPolarHBondContact O-CB 3.32Å; S1852-I1856 WeakPolarHBondContact O-CD1 3.42Å; S1852-I1856 VanDerWaalsContact O-CG1 3.28Å; S1852-I1856 WeakPolarHBondContact O-CG1 3.4Å; S1852-I1856 PolarHBondContact O-N 3.04Å; I1856-V1858 VanDerWaalsContact C-N 3.32Å; I1856-V1858 PolarHBondContact O-N 3.21Å; I1856-M1859 PolarHBondContact O-N 3.09Å; I1856-M1859 VanDerWaalsContact O-N 3.14Å; I1856-E1860 HydrophobicContact CG2-CG 4.26Å; I1856-E1860 WeakPolarHBondContact O-CG 3.38Å; I1856-E1860 PolarHBondContact O-N 3.21Å; I1856-E1913 HydrophobicContact CD1-CB 4.39Å; I1856-E1913 HydrophobicContact CD1-CG 4.16Å; I1856-C1914 HydrophobicContact CG1-CB 4.31Å; I1856-I1917 HydrophobicContact CB-CD1 4.02Å; I1856-I1917 HydrophobicContact CG1-CD1 4.02Å; I1856-I1917 HydrophobicContact CG2-CD1 3.77Å; I1856-I1917 HydrophobicContact CG2-CG1 4.3Å
1857S86.4Confident82.8Confident9.75 Ų9.7526.1 Ų26.17%0.06813%0.13CC..Hα-helixtrans-58.6-41.9179.4-176.10000112.7P1853 L1854 L1855 E1860 L1861P1853-S1857 VanDerWaalsContact O-CB 3.28Å; P1853-S1857 WeakPolarHBondContact O-CB 3.36Å; P1853-S1857 PolarHBondContact O-N 3.21Å; L1854-S1857 PolarHBondContact O-N 3.15Å; L1855-S1857 VanDerWaalsContact C-N 3.33Å; L1855-S1857 PolarHBondContact O-N 3.37Å; S1857-E1860 PolarHBondContact O-N 2.82Å; S1857-L1861 VanDerWaalsContact O-CB 3.28Å; S1857-L1861 WeakPolarHBondContact O-CB 3.37Å; S1857-L1861 WeakPolarHBondContact O-CD1 3.4Å; S1857-L1861 VanDerWaalsContact O-CG 3.22Å; S1857-L1861 WeakPolarHBondContact O-CG 3.33Å; S1857-L1861 PolarHBondContact O-N 3.32Å
1858V90.4Very high83.8Confident0 Ų030.1 Ų30.10%015%0.145CC..Hα-helixtrans-64.5-46.2177166.60000110.9L1785 L1788 I1789 L1792 L1854 L1855 I1856 L1861 L1862 V1887L1785-V1858 HydrophobicContact CB-CG2 4.48Å; L1785-V1858 HydrophobicContact CD2-CB 4.32Å; L1785-V1858 HydrophobicContact CD2-CG1 4.41Å; L1785-V1858 HydrophobicContact CD2-CG2 3.79Å; L1788-V1858 HydrophobicContact CB-CG2 4.12Å; L1788-V1858 HydrophobicContact CD1-CG1 4.39Å; L1788-V1858 HydrophobicContact CD2-CB 3.86Å; L1788-V1858 HydrophobicContact CD2-CG1 3.17Å; L1788-V1858 HydrophobicContact CD2-CG2 3.49Å; L1788-V1858 VanDerWaalsContact CD2-CG2 3.49Å; I1789-V1858 HydrophobicContact CD1-CG2 4.16Å; I1789-V1858 HydrophobicContact CG1-CG2 3.55Å; L1792-V1858 HydrophobicContact CD1-CG1 4.27Å; L1854-V1858 WeakPolarHBondContact O-CB 3.09Å; L1854-V1858 WeakPolarHBondContact O-CG2 3.35Å; L1854-V1858 PolarHBondContact O-N 3.15Å; L1855-V1858 PolarHBondContact O-N 3.08Å; I1856-V1858 VanDerWaalsContact C-N 3.32Å; I1856-V1858 PolarHBondContact O-N 3.21Å; V1858-L1861 PolarHBondContact O-N 3.27Å; V1858-L1862 HydrophobicContact CG1-CD1 3.85Å; V1858-L1862 HydrophobicContact CG1-CG 4.33Å; V1858-L1862 WeakPolarHBondContact O-CB 3.36Å; V1858-L1862 VanDerWaalsContact O-CG 3.27Å; V1858-L1862 WeakPolarHBondContact O-CG 3.45Å; V1858-L1862 PolarHBondContact O-N 3.19Å; V1858-V1887 HydrophobicContact CG1-CG2 4.15Å
1859M90.6Very high84.9Confident0 Ų029 Ų290%014%0.139CC..Hα-helixtrans-61-47.3177.8-71.3-176.7150.700111.4L1855 I1856 L1861 L1862 V1863 L1884 V1887 I1888 C1891 F1915 I1917 F1918L1855-M1859 WeakPolarHBondContact O-CB 3.01Å; L1855-M1859 VanDerWaalsContact O-CG 3.29Å; L1855-M1859 WeakPolarHBondContact O-CG 3.3Å; L1855-M1859 PolarHBondContact O-N 2.94Å; I1856-M1859 PolarHBondContact O-N 3.09Å; I1856-M1859 VanDerWaalsContact O-N 3.14Å; M1859-L1861 PolarHBondContact O-N 3.16Å; M1859-L1862 PolarHBondContact O-N 3.14Å; M1859-V1863 VanDerWaalsContact O-CG2 3.32Å; M1859-V1863 WeakPolarHBondContact O-CG2 3.37Å; M1859-V1863 PolarHBondContact O-N 3.13Å; M1859-L1884 HydrophobicContact CB-CD1 4.28Å; M1859-L1884 HydrophobicContact CG-CD1 4.09Å; M1859-L1884 HydrophobicContact CG-CD2 4.45Å; M1859-V1887 HydrophobicContact CE-CB 4.36Å; M1859-V1887 HydrophobicContact CE-CG1 3.72Å; M1859-V1887 VanDerWaalsContact CE-CG1 3.45Å; M1859-V1887 HydrophobicContact CG-CG1 3.75Å; M1859-V1887 HydrophobicContact SD-CG1 4.24Å; M1859-I1888 HydrophobicContact CE-CB 4.46Å; M1859-I1888 HydrophobicContact CE-CD1 4.46Å; M1859-I1888 HydrophobicContact CE-CG1 3.83Å; M1859-I1888 VanDerWaalsContact CE-CG1 3.46Å; M1859-C1891 HydrophobicContact CE-CB 4.48Å; M1859-F1915 HydrophobicContact CE-CE1 4.45Å; M1859-I1917 HydrophobicContact CB-CD1 3.81Å; M1859-I1917 HydrophobicContact CG-CD1 4.48Å; M1859-I1917 HydrophobicContact SD-CD1 4.1Å; M1859-F1918 HydrophobicContact CE-CE2 3.73Å; M1859-F1918 HydrophobicContact CE-CZ 4.22Å; M1859-F1918 HydrophobicContact SD-CE2 4.13Å; M1859-F1918 HydrophobicContact SD-CZ 4.47Å
1860E90.1Very high85.8Confident22 Ų2229.6 Ų29.610%0.10314%0.142CC..Hα-helixtrans-59.7-45.8177.2-69.6-175.315200112I1856 S1857 L1862 V1863 K1864 I1917 N1935 A1936 L1937I1856-E1860 HydrophobicContact CG2-CG 4.26Å; I1856-E1860 WeakPolarHBondContact O-CG 3.38Å; I1856-E1860 PolarHBondContact O-N 3.21Å; S1857-E1860 PolarHBondContact O-N 2.82Å; E1860-L1862 VanDerWaalsContact C-N 3.34Å; E1860-L1862 PolarHBondContact O-N 3.28Å; E1860-V1863 PolarHBondContact O-N 3.16Å; E1860-K1864 WeakPolarHBondContact O-CB 3.41Å; E1860-K1864 WeakPolarHBondContact O-CG 3.3Å; E1860-K1864 PolarHBondContact O-N 3.35Å; E1860-I1917 HydrophobicContact CG-CD1 4.37Å; E1860-I1917 HydrophobicContact CG-CG2 4.36Å; E1860-N1935 VanDerWaalsContact OE2-C 3.26Å; E1860-A1936 WeakPolarHBondContact OE1-CA 3.35Å; E1860-L1937 HydrophobicContact CB-CG 4.33Å; E1860-L1937 HydrophobicContact CG-CD1 4.4Å; E1860-L1937 HydrophobicContact CG-CG 4.14Å
1861L90.3Very high86.2Confident5.25 Ų5.2529.1 Ų29.13%0.02715%0.148CC..Hα-helixtrans-65.7-37.1178.4-75.1171.2000112.3I1789 L1792 C1796 S1857 V1858 M1859 S1865I1789-L1861 HydrophobicContact CB-CD1 4.49Å; I1789-L1861 HydrophobicContact CG2-CD1 4.28Å; L1792-L1861 HydrophobicContact CB-CB 3.84Å; L1792-L1861 HydrophobicContact CB-CD1 4.04Å; L1792-L1861 HydrophobicContact CB-CG 4.42Å; L1792-L1861 HydrophobicContact CD1-CB 3.95Å; L1792-L1861 HydrophobicContact CG-CB 4.49Å; C1796-L1861 HydrophobicContact CB-CD2 4.29Å; S1857-L1861 VanDerWaalsContact O-CB 3.28Å; S1857-L1861 WeakPolarHBondContact O-CB 3.37Å; S1857-L1861 WeakPolarHBondContact O-CD1 3.4Å; S1857-L1861 VanDerWaalsContact O-CG 3.22Å; S1857-L1861 WeakPolarHBondContact O-CG 3.33Å; S1857-L1861 PolarHBondContact O-N 3.32Å; V1858-L1861 PolarHBondContact O-N 3.27Å; M1859-L1861 PolarHBondContact O-N 3.16Å; L1861-S1865 VanDerWaalsContact O-CB 3.3Å; L1861-S1865 WeakPolarHBondContact O-CB 3.24Å; L1861-S1865 PolarHBondContact O-N 3.13Å; L1861-S1865 PolarHBondContact O-OG 3.08Å
1862L93.3Very high86.3Confident0 Ų032.4 Ų32.40%017%0.174CC..Hα-helixtrans-65.7-44.4174-76.1172.5000111.5L1792 V1858 M1859 E1860 K1864 S1865 I1866 Y1880 L1884 V1887L1792-L1862 HydrophobicContact CD1-CD2 3.86Å; L1792-L1862 HydrophobicContact CD1-CG 3.85Å; L1792-L1862 HydrophobicContact CD2-CD2 4Å; V1858-L1862 HydrophobicContact CG1-CD1 3.85Å; V1858-L1862 HydrophobicContact CG1-CG 4.33Å; V1858-L1862 WeakPolarHBondContact O-CB 3.36Å; V1858-L1862 VanDerWaalsContact O-CG 3.27Å; V1858-L1862 WeakPolarHBondContact O-CG 3.45Å; V1858-L1862 PolarHBondContact O-N 3.19Å; M1859-L1862 PolarHBondContact O-N 3.14Å; E1860-L1862 VanDerWaalsContact C-N 3.34Å; E1860-L1862 PolarHBondContact O-N 3.28Å; L1862-K1864 PolarHBondContact O-N 3.19Å; L1862-S1865 WeakPolarHBondContact CA-OG 3.45Å; L1862-S1865 WeakPolarHBondContact O-CB 3.3Å; L1862-S1865 PolarHBondContact O-N 3.16Å; L1862-S1865 VanDerWaalsContact O-N 3.17Å; L1862-S1865 PolarHBondContact O-OG 3.48Å; L1862-I1866 WeakPolarHBondContact O-CD1 3.43Å; L1862-I1866 VanDerWaalsContact O-CG1 3.28Å; L1862-I1866 WeakPolarHBondContact O-CG1 3.33Å; L1862-I1866 PolarHBondContact O-N 3.04Å; L1862-Y1880 HydrophobicContact CD2-CD1 3.89Å; L1862-Y1880 HydrophobicContact CD2-CE1 4.49Å; L1862-L1884 HydrophobicContact CB-CD1 4.07Å; L1862-L1884 HydrophobicContact CB-CD2 3.75Å; L1862-L1884 HydrophobicContact CB-CG 3.94Å; L1862-L1884 HydrophobicContact CD1-CB 4.3Å; L1862-L1884 HydrophobicContact CD1-CD1 4.01Å; L1862-L1884 HydrophobicContact CD1-CD2 3.8Å; L1862-L1884 HydrophobicContact CD1-CG 4.05Å; L1862-L1884 HydrophobicContact CG-CD2 4.45Å; L1862-V1887 HydrophobicContact CD1-CG2 4.15Å
1863V91.4Very high86.6Confident0 Ų032.9 Ų32.90%018%0.177CC..Hα-helixtrans-61.4-46.5175.9171.90000110.6M1859 E1860 S1865 I1866 V1867 L1884 F1918 L1937 L1945M1859-V1863 VanDerWaalsContact O-CG2 3.32Å; M1859-V1863 WeakPolarHBondContact O-CG2 3.37Å; M1859-V1863 PolarHBondContact O-N 3.13Å; E1860-V1863 PolarHBondContact O-N 3.16Å; V1863-S1865 VanDerWaalsContact C-N 3.28Å; V1863-S1865 PolarHBondContact O-N 3.19Å; V1863-I1866 WeakPolarHBondContact O-CB 3.4Å; V1863-I1866 PolarHBondContact O-N 3.07Å; V1863-I1866 VanDerWaalsContact O-N 3.17Å; V1863-V1867 HydrophobicContact CG1-CG2 4.38Å; V1863-V1867 WeakPolarHBondContact O-CB 3.36Å; V1863-V1867 VanDerWaalsContact O-CG2 3.31Å; V1863-V1867 WeakPolarHBondContact O-CG2 3.26Å; V1863-V1867 PolarHBondContact O-N 3.2Å; V1863-L1884 HydrophobicContact CG2-CD1 4.12Å; V1863-L1884 HydrophobicContact CG2-CD2 4.14Å; V1863-F1918 HydrophobicContact CG2-CE1 4.07Å; V1863-L1937 HydrophobicContact CB-CD1 3.95Å; V1863-L1937 HydrophobicContact CB-CD2 3.9Å; V1863-L1937 HydrophobicContact CG1-CD1 3.78Å; V1863-L1937 HydrophobicContact CG1-CD2 3.58Å; V1863-L1937 HydrophobicContact CG1-CG 4.37Å; V1863-L1937 HydrophobicContact CG2-CD1 4.18Å; V1863-L1945 HydrophobicContact CB-CD1 4.1Å; V1863-L1945 HydrophobicContact CG1-CB 4.37Å; V1863-L1945 HydrophobicContact CG1-CD1 3.66Å; V1863-L1945 HydrophobicContact CG2-CD1 3.67Å
1864K88.5Confident87.1Confident45.25 Ų45.2532.2 Ų32.220%0.19717%0.169CC..Hα-helixtrans-60.7-37.5175.1-75.1-177.8174.2-179.30112.5E1860 L1862 V1867 R1868 N1935 A1936 L1937E1860-K1864 WeakPolarHBondContact O-CB 3.41Å; E1860-K1864 WeakPolarHBondContact O-CG 3.3Å; E1860-K1864 PolarHBondContact O-N 3.35Å; L1862-K1864 PolarHBondContact O-N 3.19Å; K1864-V1867 PolarHBondContact O-N 2.92Å; K1864-R1868 VanDerWaalsContact O-CB 3.23Å; K1864-R1868 WeakPolarHBondContact O-CB 3.35Å; K1864-R1868 VanDerWaalsContact O-CG 3.28Å; K1864-R1868 WeakPolarHBondContact O-CG 3.38Å; K1864-R1868 PolarHBondContact O-N 3.09Å; K1864-R1868 VanDerWaalsContact O-N 3.1Å; K1864-N1935 VanDerWaalsContact CE-O 3.25Å; K1864-N1935 WeakPolarHBondContact CE-O 3.33Å; K1864-N1935 VanDerWaalsContact NZ-CA 3.3Å; K1864-N1935 PolarHBondContact NZ-O 3.25Å; K1864-A1936 WeakPolarHBondContact CE-O 3.31Å; K1864-A1936 PolarHBondContact NZ-O 3Å; K1864-L1937 HydrophobicContact CD-CD2 4.43Å; K1864-L1937 HydrophobicContact CG-CD2 3.77Å
1865S89.9Confident87.4Confident5.75 Ų5.7539.7 Ų39.74%0.0420%0.195CC..Hα-helixtrans-65.4-42.3177.2-450000111.5C1796 L1861 L1862 V1863 R1868 T1869 Y1880C1796-S1865 PolarHBondContact SG-OG 3.43Å; L1861-S1865 VanDerWaalsContact O-CB 3.3Å; L1861-S1865 WeakPolarHBondContact O-CB 3.24Å; L1861-S1865 PolarHBondContact O-N 3.13Å; L1861-S1865 PolarHBondContact O-OG 3.08Å; L1862-S1865 WeakPolarHBondContact CA-OG 3.45Å; L1862-S1865 WeakPolarHBondContact O-CB 3.3Å; L1862-S1865 PolarHBondContact O-N 3.16Å; L1862-S1865 VanDerWaalsContact O-N 3.17Å; L1862-S1865 PolarHBondContact O-OG 3.48Å; V1863-S1865 VanDerWaalsContact C-N 3.28Å; V1863-S1865 PolarHBondContact O-N 3.19Å; S1865-R1868 PolarHBondContact O-N 3Å; S1865-T1869 WeakPolarHBondContact O-CG2 3.44Å; S1865-T1869 PolarHBondContact O-N 3.2Å; S1865-Y1880 WeakPolarHBondContact OG-CD1 3.4Å; S1865-Y1880 WeakPolarHBondContact OG-CD2 3.45Å
1866I91.5Very high87.6Confident0 Ų039.9 Ų39.90%020%0.195CC..Hα-helixtrans-60.1-53.1175-69.1162.1000110.6L1862 V1863 R1868 T1869 Y1880 Y1881 L1884 L1945L1862-I1866 WeakPolarHBondContact O-CD1 3.43Å; L1862-I1866 VanDerWaalsContact O-CG1 3.28Å; L1862-I1866 WeakPolarHBondContact O-CG1 3.33Å; L1862-I1866 PolarHBondContact O-N 3.04Å; V1863-I1866 WeakPolarHBondContact O-CB 3.4Å; V1863-I1866 PolarHBondContact O-N 3.07Å; V1863-I1866 VanDerWaalsContact O-N 3.17Å; I1866-R1868 VanDerWaalsContact C-N 3.25Å; I1866-R1868 PolarHBondContact O-N 2.9Å; I1866-T1869 WeakPolarHBondContact O-CB 3.23Å; I1866-T1869 WeakPolarHBondContact O-CG2 3.24Å; I1866-T1869 PolarHBondContact O-N 3.2Å; I1866-T1869 VanDerWaalsContact O-N 3.1Å; I1866-T1869 PolarHBondContact O-OG1 3.25Å; I1866-Y1880 VanDerWaalsContact CG1-CB 3.47Å; I1866-Y1880 HydrophobicContact CG1-CD2 4.27Å; I1866-Y1880 HydrophobicContact CG1-CG 4.24Å; I1866-Y1881 HydrophobicContact CD1-CD1 3.78Å; I1866-Y1881 HydrophobicContact CD1-CE1 3.93Å; I1866-Y1881 HydrophobicContact CG1-CD1 4.27Å; I1866-Y1881 HydrophobicContact CG1-CE1 4.17Å; I1866-Y1881 HydrophobicContact CG2-CD1 4.46Å; I1866-Y1881 HydrophobicContact CG2-CE1 3.67Å; I1866-L1884 HydrophobicContact CD1-CD1 3.7Å; I1866-L1884 HydrophobicContact CD1-CD2 4.3Å; I1866-L1884 HydrophobicContact CD1-CG 4.39Å; I1866-L1945 HydrophobicContact CD1-CD1 4.38Å
1867V88.9Confident87.9Confident21.25 Ų21.2539.2 Ų39.213%0.12919%0.191CC..Hα-helixtrans-60.1-33-175.9167.40000112.4V1863 K1864 T1869 D1941 Q1944 L1945V1863-V1867 HydrophobicContact CG1-CG2 4.38Å; V1863-V1867 WeakPolarHBondContact O-CB 3.36Å; V1863-V1867 VanDerWaalsContact O-CG2 3.31Å; V1863-V1867 WeakPolarHBondContact O-CG2 3.26Å; V1863-V1867 PolarHBondContact O-N 3.2Å; K1864-V1867 PolarHBondContact O-N 2.92Å; V1867-T1869 VanDerWaalsContact C-N 3.35Å; V1867-D1941 HydrophobicContact CG2-CB 4.43Å; V1867-D1941 VanDerWaalsContact CG2-O 3.32Å; V1867-D1941 WeakPolarHBondContact CG2-O 3.32Å; V1867-Q1944 HydrophobicContact CG1-CB 4.03Å; V1867-Q1944 VanDerWaalsContact CG1-CD 3.47Å; V1867-Q1944 HydrophobicContact CG1-CG 4.26Å; V1867-Q1944 HydrophobicContact CG2-CB 4.13Å; V1867-Q1944 HydrophobicContact CG2-CG 4.4Å; V1867-Q1944 PolarHBondContact O-NE2 3.36Å; V1867-Q1944 VanDerWaalsContact O-NE2 3.15Å; V1867-L1945 HydrophobicContact CG2-CB 4.28Å
1868R85.2Confident88.2Confident102.25 Ų102.2539.5 Ų39.539%0.38619%0.194SC..THydrogen-bonded Turntrans-85.6-4.2-179.5-117.4165.688.3107.10.5114.5C1796 S1797 V1798 K1864 S1865 I1866C1796-R1868 PolarHBondContact O-NH1 2.88Å; C1796-R1868 PolarHBondContact O-NH2 3.12Å; S1797-R1868 VanDerWaalsContact C-NH1 3.34Å; S1797-R1868 PolarHBondContact O-NE 3.22Å; S1797-R1868 PolarHBondContact O-NH1 2.79Å; S1797-R1868 PolarHBondContact O-NH2 3.13Å; V1798-R1868 PolarHBondContact O-NH2 3.4Å; K1864-R1868 VanDerWaalsContact O-CB 3.23Å; K1864-R1868 WeakPolarHBondContact O-CB 3.35Å; K1864-R1868 VanDerWaalsContact O-CG 3.28Å; K1864-R1868 WeakPolarHBondContact O-CG 3.38Å; K1864-R1868 PolarHBondContact O-N 3.09Å; K1864-R1868 VanDerWaalsContact O-N 3.1Å; S1865-R1868 PolarHBondContact O-N 3Å; I1866-R1868 VanDerWaalsContact C-N 3.25Å; I1866-R1868 PolarHBondContact O-N 2.9Å
1869T85.9Confident88.4Confident18.5 Ų18.540.7 Ų40.711%0.11320%0.201CC..SBendtrans-72.6147.7177.465.90000111.9S1865 I1866 V1867 M1876 R1877 Y1880S1865-T1869 WeakPolarHBondContact O-CG2 3.44Å; S1865-T1869 PolarHBondContact O-N 3.2Å; I1866-T1869 WeakPolarHBondContact O-CB 3.23Å; I1866-T1869 WeakPolarHBondContact O-CG2 3.24Å; I1866-T1869 PolarHBondContact O-N 3.2Å; I1866-T1869 VanDerWaalsContact O-N 3.1Å; I1866-T1869 PolarHBondContact O-OG1 3.25Å; V1867-T1869 VanDerWaalsContact C-N 3.35Å; T1869-M1876 HydrophobicContact CG2-CE 3.43Å; T1869-M1876 HydrophobicContact CG2-CG 4.43Å; T1869-M1876 HydrophobicContact CG2-SD 4.44Å; T1869-R1877 HydrophobicContact CG2-CG 3.76Å; T1869-R1877 WeakPolarHBondContact OG1-CD 3.31Å; T1869-R1877 WeakPolarHBondContact OG1-CG 3.4Å; T1869-R1877 PolarHBondContact OG1-NH1 3.26Å; T1869-Y1880 HydrophobicContact CG2-CD2 4.2Å; T1869-Y1880 HydrophobicContact CG2-CE2 4.01Å
1870K82.7Confident88.7Confident128.5 Ų128.540.8 Ų40.856%0.55920%0.202SC*.  trans-81.7152.8172.4-64.7-173.6-177.3-178.60109.7S1872 T1873 R1877K1870-S1872 PolarHBondContact O-N 3.08Å; K1870-S1872 VanDerWaalsContact O-N 3.12Å; K1870-T1873 PolarHBondContact N-OG1 3.36Å; K1870-T1873 PolarHBondContact O-N 3.25Å; K1870-T1873 PolarHBondContact O-OG1 2.84Å; K1870-R1877 PolarHBondContact O-NH1 3.19Å
1871T75.8Confident88.9Confident112.75 Ų112.7539.8 Ų39.869%0.69220%0.197SC*.THydrogen-bonded Turntrans-53.8-32.8178.650.30000113.7T1873 Q1874 R1877T1871-T1873 VanDerWaalsContact C-N 3.32Å; T1871-T1873 PolarHBondContact O-N 3.21Å; T1871-Q1874 WeakPolarHBondContact O-CG 3.29Å; T1871-R1877 PolarHBondContact O-NH2 3.21Å; T1871-R1877 VanDerWaalsContact O-NH2 3.16Å
1872S77.9Confident89.1Confident89.75 Ų89.7540.3 Ų40.363%0.62820%0.203SC*.THydrogen-bonded Turntrans-71.1-18.9177.3580000115K1870 Q1874K1870-S1872 PolarHBondContact O-N 3.08Å; K1870-S1872 VanDerWaalsContact O-N 3.12Å; S1872-Q1874 VanDerWaalsContact C-N 3.3Å; S1872-Q1874 PolarHBondContact O-N 3.42Å; S1872-Q1874 VanDerWaalsContact O-N 3.12Å
1873T84.9Confident89.3Confident19.75 Ų19.7540.3 Ų40.312%0.12120%0.203CC..  trans-92.651.5-174.8550000112.8Q1803 K1870 T1871 R1875 M1876 R1877Q1803-T1873 HydrophobicContact CG-CG2 4.45Å; K1870-T1873 PolarHBondContact N-OG1 3.36Å; K1870-T1873 PolarHBondContact O-N 3.25Å; K1870-T1873 PolarHBondContact O-OG1 2.84Å; T1871-T1873 VanDerWaalsContact C-N 3.32Å; T1871-T1873 PolarHBondContact O-N 3.21Å; T1873-R1875 PolarHBondContact O-N 3.35Å; T1873-M1876 HydrophobicContact CG2-CE 4.21Å; T1873-M1876 PolarHBondContact O-N 3.22Å; T1873-M1876 VanDerWaalsContact OG1-CE 3.24Å; T1873-M1876 WeakPolarHBondContact OG1-CE 3.33Å; T1873-R1877 PolarHBondContact O-N 2.94Å
1874Q89.9Confident89.4Confident41 Ų4140.3 Ų40.319%0.19220%0.203CC..Hα-helixtrans-61.2-43.3-172.9-65.4-171.316.800113.4T1871 S1872 M1876 R1877 A1878 H1957 I1960T1871-Q1874 WeakPolarHBondContact O-CG 3.29Å; S1872-Q1874 VanDerWaalsContact C-N 3.3Å; S1872-Q1874 PolarHBondContact O-N 3.42Å; S1872-Q1874 VanDerWaalsContact O-N 3.12Å; Q1874-M1876 VanDerWaalsContact C-N 3.28Å; Q1874-M1876 PolarHBondContact O-N 3.31Å; Q1874-R1877 WeakPolarHBondContact O-CB 3.22Å; Q1874-R1877 PolarHBondContact O-N 2.87Å; Q1874-R1877 VanDerWaalsContact O-N 3.12Å; Q1874-A1878 PolarHBondContact O-N 3.36Å; Q1874-H1957 PolarHBondContact OE1-CD2 3.02Å; Q1874-I1960 HydrophobicContact CB-CB 4.49Å; Q1874-I1960 HydrophobicContact CB-CD1 3.82Å; Q1874-I1960 HydrophobicContact CB-CG2 4.27Å; Q1874-I1960 HydrophobicContact CG-CD1 4.19Å; Q1874-I1960 HydrophobicContact CG-CG2 4.47Å; Q1874-I1960 WeakPolarHBondContact O-CD1 3.27Å; Q1874-I1960 VanDerWaalsContact OE1-CG2 3.32Å
1875R89.6Confident89.6Confident187 Ų18738.5 Ų38.571%0.70620%0.196SC*.Hα-helixtrans-58.1-39.7179.1-175.4176.4177.3178.50.7112.8L1807 T1873 A1878 N1879L1807-R1875 HydrophobicContact CD1-CB 4.13Å; L1807-R1875 HydrophobicContact CD1-CG 3.98Å; T1873-R1875 PolarHBondContact O-N 3.35Å; R1875-A1878 PolarHBondContact O-N 3.34Å; R1875-N1879 PolarHBondContact O-N 3.26Å
1876M90.6Very high89.8Confident5.5 Ų5.541.9 Ų41.93%0.02721%0.209CC..Hα-helixtrans-66.2-42.9178-177.6173.363.400111.2R1806 L1807 T1869 T1873 Q1874 N1879 Y1880R1806-M1876 HydrophobicContact CB-SD 3.56Å; R1806-M1876 WeakPolarHBondContact CB-SD 3.25Å; L1807-M1876 HydrophobicContact CD1-CB 4Å; T1869-M1876 HydrophobicContact CG2-CE 3.43Å; T1869-M1876 HydrophobicContact CG2-CG 4.43Å; T1869-M1876 HydrophobicContact CG2-SD 4.44Å; T1873-M1876 HydrophobicContact CG2-CE 4.21Å; T1873-M1876 PolarHBondContact O-N 3.22Å; T1873-M1876 VanDerWaalsContact OG1-CE 3.24Å; T1873-M1876 WeakPolarHBondContact OG1-CE 3.33Å; Q1874-M1876 VanDerWaalsContact C-N 3.28Å; Q1874-M1876 PolarHBondContact O-N 3.31Å; M1876-N1879 WeakPolarHBondContact O-CB 3.21Å; M1876-N1879 PolarHBondContact O-N 3.24Å; M1876-Y1880 HydrophobicContact CE-CE2 4.45Å; M1876-Y1880 HydrophobicContact CG-CD2 4.19Å; M1876-Y1880 HydrophobicContact CG-CE2 3.48Å; M1876-Y1880 VanDerWaalsContact CG-CE2 3.44Å; M1876-Y1880 VanDerWaalsContact O-CD2 3.29Å; M1876-Y1880 WeakPolarHBondContact O-CD2 3.38Å; M1876-Y1880 PolarHBondContact O-N 3.31Å; M1876-Y1880 HydrophobicContact SD-CE2 4.14Å
1877R92.6Very high89.7Confident8.5 Ų8.541.9 Ų41.93%0.03221%0.209CC..Hα-helixtrans-62-43.8173.8-78.9-159.1-65.7-92.21.6112.6T1869 K1870 T1871 T1873 Q1874 N1879 Y1880 Y1881 D1952 I1960T1869-R1877 HydrophobicContact CG2-CG 3.76Å; T1869-R1877 WeakPolarHBondContact OG1-CD 3.31Å; T1869-R1877 WeakPolarHBondContact OG1-CG 3.4Å; T1869-R1877 PolarHBondContact OG1-NH1 3.26Å; K1870-R1877 PolarHBondContact O-NH1 3.19Å; T1871-R1877 PolarHBondContact O-NH2 3.21Å; T1871-R1877 VanDerWaalsContact O-NH2 3.16Å; T1873-R1877 PolarHBondContact O-N 2.94Å; Q1874-R1877 WeakPolarHBondContact O-CB 3.22Å; Q1874-R1877 PolarHBondContact O-N 2.87Å; Q1874-R1877 VanDerWaalsContact O-N 3.12Å; R1877-N1879 VanDerWaalsContact C-N 3.26Å; R1877-N1879 PolarHBondContact O-N 3.1Å; R1877-Y1880 PolarHBondContact O-N 3.36Å; R1877-Y1881 HydrophobicContact CB-CE2 4.14Å; R1877-Y1881 WeakPolarHBondContact O-CD2 3.44Å; R1877-Y1881 VanDerWaalsContact O-CG 3.31Å; R1877-Y1881 PolarHBondContact O-N 3.27Å; R1877-D1952 WeakPolarHBondContact CD-OD2 3.31Å; R1877-D1952 IonicContact CZ-OD1 3.27Å; R1877-D1952 VanDerWaalsContact CZ-OD1 3.32Å; R1877-D1952 IonicContact CZ-OD2 3.31Å; R1877-D1952 IonicContact NE-OD1 3.61Å; R1877-D1952 PolarHBondContact NE-OD1 3.01Å; R1877-D1952 VanDerWaalsContact NE-OD1 3.15Å; R1877-D1952 IonicContact NE-OD2 3.07Å; R1877-D1952 PolarHBondContact NE-OD2 2.9Å; R1877-D1952 IonicContact NH2-OD1 3.02Å; R1877-D1952 PolarHBondContact NH2-OD1 3.2Å; R1877-D1952 IonicContact NH2-OD2 3.36Å; R1877-I1960 HydrophobicContact CB-CD1 3.73Å
1878A93.3Very high89.7Confident16 Ų1640.9 Ų40.913%0.13220%0.203CC..Hα-helixtrans-56.6-41.3177.500000111.8Q1874 R1875 Y1881 G1882 I1960 A1963Q1874-A1878 PolarHBondContact O-N 3.36Å; R1875-A1878 PolarHBondContact O-N 3.34Å; A1878-Y1881 PolarHBondContact O-N 2.93Å; A1878-G1882 PolarHBondContact O-N 3.44Å; A1878-I1960 HydrophobicContact CB-CB 4.16Å; A1878-I1960 HydrophobicContact CB-CG1 4.24Å; A1878-A1963 HydrophobicContact CB-CB 4.24Å
1879N94.6Very high89.8Confident26.25 Ų26.2540 Ų4014%0.1420%0.199CC..Hα-helixtrans-62.6-42.7174.3-70-15.4000112.3S1810 G1811 L1814 R1875 M1876 R1877 Y1881 G1882 S1883S1810-N1879 WeakPolarHBondContact O-CB 3.36Å; S1810-N1879 PolarHBondContact OG-ND2 3.06Å; G1811-N1879 PolarHBondContact N-ND2 3.14Å; L1814-N1879 HydrophobicContact CB-CB 4.38Å; R1875-N1879 PolarHBondContact O-N 3.26Å; M1876-N1879 WeakPolarHBondContact O-CB 3.21Å; M1876-N1879 PolarHBondContact O-N 3.24Å; R1877-N1879 VanDerWaalsContact C-N 3.26Å; R1877-N1879 PolarHBondContact O-N 3.1Å; N1879-Y1881 PolarHBondContact O-N 2.97Å; N1879-G1882 PolarHBondContact O-N 3.13Å; N1879-S1883 WeakPolarHBondContact O-CB 3.3Å; N1879-S1883 PolarHBondContact O-N 3.3Å; N1879-S1883 PolarHBondContact O-OG 3.13Å; N1879-S1883 VanDerWaalsContact O-OG 3.12Å
1880Y95.4Very high89.8Confident2.25 Ų2.2539.1 Ų39.11%0.00919%0.194CC..Hα-helixtrans-68.5-37.3177.2-62.9-45.1000113L1792 C1796 L1862 S1865 I1866 T1869 M1876 R1877 S1883 L1884L1792-Y1880 HydrophobicContact CD2-CE1 4.18Å; C1796-Y1880 HydrophobicContact CB-CE1 4.47Å; C1796-Y1880 WeakPolarHBondContact CB-OH 3.41Å; C1796-Y1880 PolarHBondContact SG-OH 3.4Å; L1862-Y1880 HydrophobicContact CD2-CD1 3.89Å; L1862-Y1880 HydrophobicContact CD2-CE1 4.49Å; S1865-Y1880 WeakPolarHBondContact OG-CD1 3.4Å; S1865-Y1880 WeakPolarHBondContact OG-CD2 3.45Å; I1866-Y1880 VanDerWaalsContact CG1-CB 3.47Å; I1866-Y1880 HydrophobicContact CG1-CD2 4.27Å; I1866-Y1880 HydrophobicContact CG1-CG 4.24Å; T1869-Y1880 HydrophobicContact CG2-CD2 4.2Å; T1869-Y1880 HydrophobicContact CG2-CE2 4.01Å; M1876-Y1880 HydrophobicContact CE-CE2 4.45Å; M1876-Y1880 HydrophobicContact CG-CD2 4.19Å; M1876-Y1880 HydrophobicContact CG-CE2 3.48Å; M1876-Y1880 VanDerWaalsContact CG-CE2 3.44Å; M1876-Y1880 VanDerWaalsContact O-CD2 3.29Å; M1876-Y1880 WeakPolarHBondContact O-CD2 3.38Å; M1876-Y1880 PolarHBondContact O-N 3.31Å; M1876-Y1880 HydrophobicContact SD-CE2 4.14Å; R1877-Y1880 PolarHBondContact O-N 3.36Å; Y1880-S1883 WeakPolarHBondContact O-CB 3.36Å; Y1880-S1883 PolarHBondContact O-N 3.1Å; Y1880-L1884 WeakPolarHBondContact O-CB 3.46Å; Y1880-L1884 PolarHBondContact O-N 3.27Å
1881Y95.7Very high89.9Confident0 Ų033 Ų330%017%0.167CC..Hα-helixtrans-59.8-49.8171.8-64-30.6000110.8I1866 R1877 A1878 N1879 S1883 L1884 C1885 L1949 D1952 I1960 A1963 A1964 L1967I1866-Y1881 HydrophobicContact CD1-CD1 3.78Å; I1866-Y1881 HydrophobicContact CD1-CE1 3.93Å; I1866-Y1881 HydrophobicContact CG1-CD1 4.27Å; I1866-Y1881 HydrophobicContact CG1-CE1 4.17Å; I1866-Y1881 HydrophobicContact CG2-CD1 4.46Å; I1866-Y1881 HydrophobicContact CG2-CE1 3.67Å; R1877-Y1881 HydrophobicContact CB-CE2 4.14Å; R1877-Y1881 WeakPolarHBondContact O-CD2 3.44Å; R1877-Y1881 VanDerWaalsContact O-CG 3.31Å; R1877-Y1881 PolarHBondContact O-N 3.27Å; A1878-Y1881 PolarHBondContact O-N 2.93Å; N1879-Y1881 PolarHBondContact O-N 2.97Å; Y1881-S1883 VanDerWaalsContact C-N 3.32Å; Y1881-S1883 PolarHBondContact O-N 3.02Å; Y1881-L1884 PolarHBondContact O-N 3.09Å; Y1881-C1885 PolarHBondContact O-N 3.08Å; Y1881-C1885 PolarHBondContact O-SG 2.99Å; Y1881-L1949 HydrophobicContact CD1-CD2 3.96Å; Y1881-L1949 HydrophobicContact CD2-CD2 4.43Å; Y1881-L1949 HydrophobicContact CE1-CD2 3.52Å; Y1881-L1949 VanDerWaalsContact CE1-CD2 3.48Å; Y1881-L1949 HydrophobicContact CE1-CG 4.15Å; Y1881-L1949 HydrophobicContact CE2-CD2 4.12Å; Y1881-L1949 HydrophobicContact CG-CD2 4.41Å; Y1881-D1952 HydrophobicContact CE2-CB 4.41Å; Y1881-D1952 VanDerWaalsContact CE2-OD2 3.31Å; Y1881-D1952 WeakPolarHBondContact CE2-OD2 3.47Å; Y1881-D1952 PolarHBondContact OH-OD2 3.17Å; Y1881-I1960 HydrophobicContact CD2-CG1 4.13Å; Y1881-I1960 HydrophobicContact CE2-CD1 4.09Å; Y1881-I1960 HydrophobicContact CE2-CG1 3.84Å; Y1881-A1963 HydrophobicContact CD2-CB 4.26Å; Y1881-A1964 HydrophobicContact CD2-CB 3.98Å; Y1881-A1964 HydrophobicContact CE2-CB 3.84Å; Y1881-L1967 HydrophobicContact CD1-CD2 3.56Å; Y1881-L1967 HydrophobicContact CE1-CD2 4.29Å; Y1881-L1967 HydrophobicContact CG-CD2 4.23Å
1882G94.6Very high90.1Very high15.25 Ų15.2530.7 Ų30.716%0.15715%0.146CC..Hα-helixtrans-59.9-40.1175.300000113.1L1814 A1878 N1879 L1884 C1885 Y1886L1814-G1882 VanDerWaalsContact CD1-C 3.43Å; A1878-G1882 PolarHBondContact O-N 3.44Å; N1879-G1882 PolarHBondContact O-N 3.13Å; G1882-L1884 VanDerWaalsContact C-N 3.34Å; G1882-L1884 PolarHBondContact O-N 2.91Å; G1882-C1885 WeakPolarHBondContact O-CB 3.34Å; G1882-C1885 PolarHBondContact O-N 3.33Å; G1882-Y1886 WeakPolarHBondContact O-CD2 3.32Å; G1882-Y1886 PolarHBondContact O-N 3.24Å
1883S96Very high90.1Very high0 Ų027.8 Ų27.80%012%0.124CC..Hα-helixtrans-59.2-48.6175-59.90000111.1S1813 L1814 N1879 Y1880 Y1881 C1885 Y1886 V1887S1813-S1883 PolarHBondContact O-OG 3.34Å; L1814-S1883 VanDerWaalsContact CA-OG 3.24Å; L1814-S1883 WeakPolarHBondContact CA-OG 3.38Å; L1814-S1883 PolarHBondContact N-OG 3.07Å; L1814-S1883 VanDerWaalsContact N-OG 3.14Å; N1879-S1883 WeakPolarHBondContact O-CB 3.3Å; N1879-S1883 PolarHBondContact O-N 3.3Å; N1879-S1883 PolarHBondContact O-OG 3.13Å; N1879-S1883 VanDerWaalsContact O-OG 3.12Å; Y1880-S1883 WeakPolarHBondContact O-CB 3.36Å; Y1880-S1883 PolarHBondContact O-N 3.1Å; Y1881-S1883 VanDerWaalsContact C-N 3.32Å; Y1881-S1883 PolarHBondContact O-N 3.02Å; S1883-C1885 VanDerWaalsContact C-N 3.33Å; S1883-C1885 PolarHBondContact O-N 3.2Å; S1883-Y1886 PolarHBondContact O-N 3.08Å; S1883-V1887 VanDerWaalsContact O-CG2 3.23Å; S1883-V1887 WeakPolarHBondContact O-CG2 3.31Å; S1883-V1887 PolarHBondContact O-N 3.34Å; S1883-V1887 VanDerWaalsContact O-N 3.09Å
1884L93.8Very high89.7Confident0 Ų027.1 Ų27.10%012%0.119CC..Hα-helixtrans-64.2-39.1178.2-122144.3000111.6M1859 L1862 V1863 I1866 Y1880 Y1881 G1882 Y1886 V1887 I1888 F1918 L1945 L1967M1859-L1884 HydrophobicContact CB-CD1 4.28Å; M1859-L1884 HydrophobicContact CG-CD1 4.09Å; M1859-L1884 HydrophobicContact CG-CD2 4.45Å; L1862-L1884 HydrophobicContact CB-CD1 4.07Å; L1862-L1884 HydrophobicContact CB-CD2 3.75Å; L1862-L1884 HydrophobicContact CB-CG 3.94Å; L1862-L1884 HydrophobicContact CD1-CB 4.3Å; L1862-L1884 HydrophobicContact CD1-CD1 4.01Å; L1862-L1884 HydrophobicContact CD1-CD2 3.8Å; L1862-L1884 HydrophobicContact CD1-CG 4.05Å; L1862-L1884 HydrophobicContact CG-CD2 4.45Å; V1863-L1884 HydrophobicContact CG2-CD1 4.12Å; V1863-L1884 HydrophobicContact CG2-CD2 4.14Å; I1866-L1884 HydrophobicContact CD1-CD1 3.7Å; I1866-L1884 HydrophobicContact CD1-CD2 4.3Å; I1866-L1884 HydrophobicContact CD1-CG 4.39Å; Y1880-L1884 WeakPolarHBondContact O-CB 3.46Å; Y1880-L1884 PolarHBondContact O-N 3.27Å; Y1881-L1884 PolarHBondContact O-N 3.09Å; G1882-L1884 VanDerWaalsContact C-N 3.34Å; G1882-L1884 PolarHBondContact O-N 2.91Å; L1884-Y1886 VanDerWaalsContact C-N 3.32Å; L1884-Y1886 PolarHBondContact O-N 3.15Å; L1884-V1887 PolarHBondContact O-N 3.11Å; L1884-I1888 HydrophobicContact CB-CD1 4.49Å; L1884-I1888 HydrophobicContact CD2-CD1 3.38Å; L1884-I1888 HydrophobicContact CD2-CG1 4.04Å; L1884-I1888 HydrophobicContact CG-CD1 4.19Å; L1884-I1888 HydrophobicContact CG-CG1 4.45Å; L1884-I1888 VanDerWaalsContact O-CB 3.31Å; L1884-I1888 WeakPolarHBondContact O-CB 3.35Å; L1884-I1888 VanDerWaalsContact O-CG1 3.25Å; L1884-I1888 WeakPolarHBondContact O-CG1 3.25Å; L1884-I1888 PolarHBondContact O-N 3.14Å; L1884-F1918 HydrophobicContact CD1-CZ 4.28Å; L1884-F1918 HydrophobicContact CD2-CE1 4.38Å; L1884-F1918 HydrophobicContact CD2-CZ 4.18Å; L1884-F1918 HydrophobicContact CG-CZ 4.43Å; L1884-L1945 HydrophobicContact CD1-CD1 4.49Å; L1884-L1967 HydrophobicContact CB-CD1 3.93Å; L1884-L1967 HydrophobicContact CB-CD2 4.28Å; L1884-L1967 HydrophobicContact CD1-CD1 4.49Å; L1884-L1967 HydrophobicContact CD1-CD2 3.79Å; L1884-L1967 HydrophobicContact CD2-CD1 3.48Å; L1884-L1967 HydrophobicContact CD2-CD2 3.86Å; L1884-L1967 HydrophobicContact CD2-CG 4.32Å; L1884-L1967 HydrophobicContact CG-CD1 4.2Å
1885C93.8Very high88.9Confident9.25 Ų9.2525.6 Ų25.66%0.06311%0.114CC..Hα-helixtrans-57-46.5173.5-69.40000111.8Y1881 G1882 S1883 I1888 R1889 S1966 L1967 L1970Y1881-C1885 PolarHBondContact O-N 3.08Å; Y1881-C1885 PolarHBondContact O-SG 2.99Å; G1882-C1885 WeakPolarHBondContact O-CB 3.34Å; G1882-C1885 PolarHBondContact O-N 3.33Å; S1883-C1885 VanDerWaalsContact C-N 3.33Å; S1883-C1885 PolarHBondContact O-N 3.2Å; C1885-I1888 PolarHBondContact O-N 3.23Å; C1885-R1889 WeakPolarHBondContact O-CB 3.46Å; C1885-R1889 VanDerWaalsContact O-CG 3.23Å; C1885-R1889 WeakPolarHBondContact O-CG 3.3Å; C1885-R1889 PolarHBondContact O-N 3.24Å; C1885-S1966 PolarHBondContact SG-OG 3.07Å; C1885-S1966 VanDerWaalsContact SG-OG 3.36Å; C1885-L1967 VanDerWaalsContact SG-CA 3.52Å; C1885-L1967 WeakPolarHBondContact SG-CA 3.35Å; C1885-L1967 PolarHBondContact SG-N 3.15Å; C1885-L1970 HydrophobicContact CB-CD1 3.77Å
1886Y92.4Very high88Confident76.75 Ų76.7521.8 Ų21.830%0.30111%0.105SC..Hα-helixtrans-62.5-44.6177-76.5-55000112.6L1814 C1817 H1821 G1882 S1883 L1884 I1888 R1889 F1890L1814-Y1886 HydrophobicContact CD1-CD2 3.92Å; L1814-Y1886 HydrophobicContact CD1-CE2 3.67Å; L1814-Y1886 HydrophobicContact CG-CE2 4.41Å; C1817-Y1886 HydrophobicContact CB-CD2 4.18Å; C1817-Y1886 HydrophobicContact CB-CG 4.4Å; C1817-Y1886 WeakPolarHBondContact O-CB 3.23Å; H1821-Y1886 HydrophobicContact CB-CD1 3.88Å; H1821-Y1886 HydrophobicContact CB-CG 4.35Å; H1821-Y1886 AromaticContact CD2-CD1 3.61Å; H1821-Y1886 AromaticContact CD2-CE1 3.97Å; H1821-Y1886 AromaticContact CG-CD1 3.88Å; G1882-Y1886 WeakPolarHBondContact O-CD2 3.32Å; G1882-Y1886 PolarHBondContact O-N 3.24Å; S1883-Y1886 PolarHBondContact O-N 3.08Å; L1884-Y1886 VanDerWaalsContact C-N 3.32Å; L1884-Y1886 PolarHBondContact O-N 3.15Å; Y1886-I1888 VanDerWaalsContact C-N 3.35Å; Y1886-I1888 PolarHBondContact O-N 3.2Å; Y1886-R1889 PolarHBondContact O-N 3.16Å; Y1886-F1890 WeakPolarHBondContact O-CB 3.34Å; Y1886-F1890 PolarHBondContact O-N 3.1Å
1887V90.9Very high86.9Confident0 Ų023 Ų230%011%0.113CC..Hα-helixtrans-62.9-45178.5-176.60000110.8C1817 F1820 L1855 V1858 M1859 L1862 S1883 L1884 R1889 F1890 C1891C1817-V1887 HydrophobicContact CB-CG2 4.37Å; F1820-V1887 HydrophobicContact CE1-CG1 4.33Å; F1820-V1887 HydrophobicContact CE1-CG2 4.23Å; F1820-V1887 HydrophobicContact CZ-CB 3.99Å; F1820-V1887 HydrophobicContact CZ-CG1 4.18Å; F1820-V1887 HydrophobicContact CZ-CG2 3.59Å; L1855-V1887 HydrophobicContact CD1-CG1 3.62Å; L1855-V1887 HydrophobicContact CD2-CG1 4.11Å; L1855-V1887 HydrophobicContact CG-CG1 4.33Å; V1858-V1887 HydrophobicContact CG1-CG2 4.15Å; M1859-V1887 HydrophobicContact CE-CB 4.36Å; M1859-V1887 HydrophobicContact CE-CG1 3.72Å; M1859-V1887 VanDerWaalsContact CE-CG1 3.45Å; M1859-V1887 HydrophobicContact CG-CG1 3.75Å; M1859-V1887 HydrophobicContact SD-CG1 4.24Å; L1862-V1887 HydrophobicContact CD1-CG2 4.15Å; S1883-V1887 VanDerWaalsContact O-CG2 3.23Å; S1883-V1887 WeakPolarHBondContact O-CG2 3.31Å; S1883-V1887 PolarHBondContact O-N 3.34Å; S1883-V1887 VanDerWaalsContact O-N 3.09Å; L1884-V1887 PolarHBondContact O-N 3.11Å; V1887-R1889 PolarHBondContact O-N 3.39Å; V1887-F1890 WeakPolarHBondContact O-CB 3.48Å; V1887-F1890 PolarHBondContact O-N 3.18Å; V1887-C1891 PolarHBondContact O-N 3.25Å; V1887-C1891 PolarHBondContact O-SG 3.23Å; V1887-C1891 VanDerWaalsContact O-SG 3.38Å
1888I88.7Confident85.6Confident0 Ų023.4 Ų23.40%012%0.116CC..Hα-helixtrans-62.8-46.5178.3-73.8172.8000111.3M1859 L1884 C1885 Y1886 F1890 C1891 R1892 F1915 F1918 L1967 L1970 L1971 F1974M1859-I1888 HydrophobicContact CE-CB 4.46Å; M1859-I1888 HydrophobicContact CE-CD1 4.46Å; M1859-I1888 HydrophobicContact CE-CG1 3.83Å; M1859-I1888 VanDerWaalsContact CE-CG1 3.46Å; L1884-I1888 HydrophobicContact CB-CD1 4.49Å; L1884-I1888 HydrophobicContact CD2-CD1 3.38Å; L1884-I1888 HydrophobicContact CD2-CG1 4.04Å; L1884-I1888 HydrophobicContact CG-CD1 4.19Å; L1884-I1888 HydrophobicContact CG-CG1 4.45Å; L1884-I1888 VanDerWaalsContact O-CB 3.31Å; L1884-I1888 WeakPolarHBondContact O-CB 3.35Å; L1884-I1888 VanDerWaalsContact O-CG1 3.25Å; L1884-I1888 WeakPolarHBondContact O-CG1 3.25Å; L1884-I1888 PolarHBondContact O-N 3.14Å; C1885-I1888 PolarHBondContact O-N 3.23Å; Y1886-I1888 VanDerWaalsContact C-N 3.35Å; Y1886-I1888 PolarHBondContact O-N 3.2Å; I1888-F1890 VanDerWaalsContact C-N 3.34Å; I1888-F1890 PolarHBondContact O-N 3.16Å; I1888-C1891 WeakPolarHBondContact O-CB 3.36Å; I1888-C1891 PolarHBondContact O-N 3.15Å; I1888-R1892 WeakPolarHBondContact O-CB 3.22Å; I1888-R1892 PolarHBondContact O-N 3.06Å; I1888-F1915 HydrophobicContact CG2-CE1 4.27Å; I1888-F1918 HydrophobicContact CD1-CE2 4.24Å; I1888-F1918 HydrophobicContact CD1-CZ 4.3Å; I1888-F1918 HydrophobicContact CG1-CE2 4.4Å; I1888-L1967 HydrophobicContact CD1-CD1 3.69Å; I1888-L1970 HydrophobicContact CB-CD1 4.43Å; I1888-L1970 HydrophobicContact CG2-CB 4.1Å; I1888-L1970 HydrophobicContact CG2-CD1 4.15Å; I1888-L1970 HydrophobicContact CG2-CD2 4.4Å; I1888-L1970 HydrophobicContact CG2-CG 4.45Å; I1888-L1971 HydrophobicContact CD1-CD2 4.27Å; I1888-F1974 HydrophobicContact CG2-CD2 4.22Å; I1888-F1974 HydrophobicContact CG2-CE2 3.25Å; I1888-F1974 VanDerWaalsContact CG2-CE2 3.4Å; I1888-F1974 HydrophobicContact CG2-CZ 3.65Å
1889R88Confident84.1Confident82.75 Ų82.7529.3 Ų29.331%0.31214%0.139SC..Hα-helixtrans-61.9-44.2178.2-74.9175.3116.4159.6-0.5111H1821 C1885 Y1886 V1887 C1891 R1892 D1893 L1970 E2187H1821-R1889 VanDerWaalsContact CE1-CB 3.47Å; H1821-R1889 WeakPolarHBondContact CE1-CB 3.37Å; C1885-R1889 WeakPolarHBondContact O-CB 3.46Å; C1885-R1889 VanDerWaalsContact O-CG 3.23Å; C1885-R1889 WeakPolarHBondContact O-CG 3.3Å; C1885-R1889 PolarHBondContact O-N 3.24Å; Y1886-R1889 PolarHBondContact O-N 3.16Å; V1887-R1889 PolarHBondContact O-N 3.39Å; R1889-C1891 VanDerWaalsContact C-N 3.34Å; R1889-C1891 PolarHBondContact O-N 3.18Å; R1889-R1892 WeakPolarHBondContact O-CA 3.43Å; R1889-R1892 WeakPolarHBondContact O-CB 3.21Å; R1889-R1892 PolarHBondContact O-N 3.19Å; R1889-R1892 VanDerWaalsContact O-N 3.12Å; R1889-D1893 WeakPolarHBondContact O-CB 3.22Å; R1889-D1893 PolarHBondContact O-N 3.18Å; R1889-L1970 HydrophobicContact CG-CD1 4.11Å; R1889-L1970 HydrophobicContact CG-CD2 4.21Å; R1889-E2187 IonicContact CZ-OE1 3.85Å; R1889-E2187 IonicContact NE-OE1 2.74Å; R1889-E2187 PolarHBondContact NE-OE1 3.47Å; R1889-E2187 VanDerWaalsContact NE-OE1 3.1Å; R1889-E2187 IonicContact NH2-OE1 3.69Å; R1889-E2187 PolarHBondContact NH2-OE1 3.49Å
1890F85.7Confident82.4Confident0.75 Ų0.7534.4 Ų34.40%0.00317%0.166CC..Hα-helixtrans-56.3-48.2173.9177.1-94.5000112.5P1781 F1820 H1821 Y1847 W1851 L1855 Y1886 V1887 I1888 R1892 D1893 L1894P1781-F1890 HydrophobicContact CB-CZ 4.35Å; F1820-F1890 HydrophobicContact CD1-CB 4.13Å; F1820-F1890 HydrophobicContact CD1-CD1 4.35Å; F1820-F1890 HydrophobicContact CD1-CD2 4.17Å; F1820-F1890 AromaticContact CD1-CG 3.95Å; F1820-F1890 HydrophobicContact CD1-CG 3.98Å; F1820-F1890 HydrophobicContact CD2-CB 4.1Å; F1820-F1890 AromaticContact CD2-CD1 3.78Å; F1820-F1890 HydrophobicContact CD2-CD1 3.9Å; F1820-F1890 AromaticContact CD2-CD2 3.68Å; F1820-F1890 HydrophobicContact CD2-CD2 3.68Å; F1820-F1890 HydrophobicContact CD2-CE1 4.15Å; F1820-F1890 AromaticContact CD2-CE2 3.96Å; F1820-F1890 HydrophobicContact CD2-CE2 4.17Å; F1820-F1890 AromaticContact CD2-CG 3.63Å; F1820-F1890 HydrophobicContact CD2-CG 3.63Å; F1820-F1890 HydrophobicContact CD2-CZ 4.26Å; F1820-F1890 HydrophobicContact CE1-CB 3.58Å; F1820-F1890 AromaticContact CE1-CD1 3.27Å; F1820-F1890 HydrophobicContact CE1-CD1 3.27Å; F1820-F1890 AromaticContact CE1-CD2 3.83Å; F1820-F1890 HydrophobicContact CE1-CD2 3.83Å; F1820-F1890 AromaticContact CE1-CE1 3.75Å; F1820-F1890 HydrophobicContact CE1-CE1 3.75Å; F1820-F1890 HydrophobicContact CE1-CE2 4.27Å; F1820-F1890 AromaticContact CE1-CG 3.27Å; F1820-F1890 HydrophobicContact CE1-CG 3.27Å; F1820-F1890 HydrophobicContact CE1-CZ 4.21Å; F1820-F1890 HydrophobicContact CE2-CB 3.54Å; F1820-F1890 AromaticContact CE2-CD1 3.71Å; F1820-F1890 HydrophobicContact CE2-CD1 3.8Å; F1820-F1890 AromaticContact CE2-CD2 3.95Å; F1820-F1890 HydrophobicContact CE2-CD2 4.15Å; F1820-F1890 AromaticContact CE2-CE1 3.56Å; F1820-F1890 HydrophobicContact CE2-CE1 3.89Å; F1820-F1890 AromaticContact CE2-CE2 3.94Å; F1820-F1890 HydrophobicContact CE2-CE2 3.94Å; F1820-F1890 AromaticContact CE2-CG 3.44Å; F1820-F1890 HydrophobicContact CE2-CG 3.89Å; F1820-F1890 VanDerWaalsContact CE2-CG 3.44Å; F1820-F1890 AromaticContact CE2-CZ 3.51Å; F1820-F1890 HydrophobicContact CE2-CZ 3.51Å; F1820-F1890 VanDerWaalsContact CE2-CZ 3.42Å; F1820-F1890 HydrophobicContact CZ-CB 4.28Å; F1820-F1890 AromaticContact CZ-CD1 3.06Å; F1820-F1890 HydrophobicContact CZ-CD1 3.06Å; F1820-F1890 AromaticContact CZ-CD2 3.92Å; F1820-F1890 HydrophobicContact CZ-CD2 3.92Å; F1820-F1890 AromaticContact CZ-CE1 3.01Å; F1820-F1890 HydrophobicContact CZ-CE1 3.01Å; F1820-F1890 AromaticContact CZ-CE2 3.91Å; F1820-F1890 HydrophobicContact CZ-CE2 3.91Å; F1820-F1890 AromaticContact CZ-CG 3.5Å; F1820-F1890 HydrophobicContact CZ-CG 3.5Å; F1820-F1890 AromaticContact CZ-CZ 3.45Å; F1820-F1890 HydrophobicContact CZ-CZ 3.45Å; F1820-F1890 WeakPolarHBondContact O-CD2 3.45Å; F1820-F1890 WeakPolarHBondContact O-CE2 2.97Å; H1821-F1890 HydrophobicContact CB-CB 4.42Å; H1821-F1890 PolarHBondContact ND1-N 3.29Å; Y1847-F1890 HydrophobicContact CE1-CZ 4.37Å; Y1847-F1890 WeakPolarHBondContact OH-CE2 3.45Å; Y1847-F1890 WeakPolarHBondContact OH-CZ 3.11Å; W1851-F1890 HydrophobicContact CE3-CE1 4.13Å; W1851-F1890 AromaticContact CE3-CZ 3.96Å; W1851-F1890 HydrophobicContact CE3-CZ 3.96Å; W1851-F1890 HydrophobicContact CZ3-CE1 4.27Å; W1851-F1890 AromaticContact CZ3-CZ 3.65Å; W1851-F1890 HydrophobicContact CZ3-CZ 4.13Å; L1855-F1890 HydrophobicContact CD1-CE1 4.36Å; L1855-F1890 HydrophobicContact CD2-CD1 4.16Å; L1855-F1890 HydrophobicContact CD2-CE1 4.25Å; Y1886-F1890 WeakPolarHBondContact O-CB 3.34Å; Y1886-F1890 PolarHBondContact O-N 3.1Å; V1887-F1890 WeakPolarHBondContact O-CB 3.48Å; V1887-F1890 PolarHBondContact O-N 3.18Å; I1888-F1890 VanDerWaalsContact C-N 3.34Å; I1888-F1890 PolarHBondContact O-N 3.16Å; F1890-R1892 VanDerWaalsContact C-N 3.29Å; F1890-R1892 PolarHBondContact O-N 3.13Å; F1890-D1893 PolarHBondContact O-N 3.14Å; F1890-L1894 HydrophobicContact CD1-CD1 3.73Å; F1890-L1894 HydrophobicContact CD1-CG 4.3Å; F1890-L1894 HydrophobicContact CE1-CD1 3.23Å; F1890-L1894 HydrophobicContact CE1-CD2 4.43Å; F1890-L1894 HydrophobicContact CE1-CG 4.1Å; F1890-L1894 HydrophobicContact CE2-CD1 4.32Å; F1890-L1894 HydrophobicContact CE2-CD2 4.4Å; F1890-L1894 HydrophobicContact CE2-CG 4.37Å; F1890-L1894 HydrophobicContact CG-CD1 4.38Å; F1890-L1894 HydrophobicContact CZ-CD1 3.66Å; F1890-L1894 VanDerWaalsContact CZ-CD1 3.47Å; F1890-L1894 HydrophobicContact CZ-CD2 4.09Å; F1890-L1894 HydrophobicContact CZ-CG 4.23Å; F1890-L1894 WeakPolarHBondContact O-CB 3.09Å; F1890-L1894 VanDerWaalsContact O-CG 3.31Å; F1890-L1894 WeakPolarHBondContact O-CG 3.28Å; F1890-L1894 PolarHBondContact O-N 3.02Å; F1890-L1894 VanDerWaalsContact O-N 3.09Å
1891C83.6Confident80.2Confident0 Ų037.6 Ų37.60%018%0.183CC..Hα-helixtrans-61-39.8176.9-650000111.6L1855 M1859 V1887 I1888 R1889 G1895 L1911 F1915L1855-C1891 WeakPolarHBondContact CD2-SG 3.41Å; M1859-C1891 HydrophobicContact CE-CB 4.48Å; V1887-C1891 PolarHBondContact O-N 3.25Å; V1887-C1891 PolarHBondContact O-SG 3.23Å; V1887-C1891 VanDerWaalsContact O-SG 3.38Å; I1888-C1891 WeakPolarHBondContact O-CB 3.36Å; I1888-C1891 PolarHBondContact O-N 3.15Å; R1889-C1891 VanDerWaalsContact C-N 3.34Å; R1889-C1891 PolarHBondContact O-N 3.18Å; C1891-G1895 PolarHBondContact O-N 3.22Å; C1891-L1911 HydrophobicContact CB-CD2 4.27Å; C1891-L1911 HydrophobicContact CB-CG 4.46Å; C1891-L1911 WeakPolarHBondContact O-CD1 3.19Å; C1891-L1911 WeakPolarHBondContact O-CD2 3.38Å; C1891-F1915 HydrophobicContact CB-CE1 3.87Å; C1891-F1915 HydrophobicContact CB-CE2 3.93Å; C1891-F1915 HydrophobicContact CB-CZ 3.26Å
1892R81Confident78.4Confident63 Ų6347.9 Ų47.924%0.23823%0.228CC..Hα-helixtrans-63.1-47.5177.2-176.3-172.770.7176.14.2111.8I1888 R1889 F1890 L1894 G1895 Q1896 F1974 E2187I1888-R1892 WeakPolarHBondContact O-CB 3.22Å; I1888-R1892 PolarHBondContact O-N 3.06Å; R1889-R1892 WeakPolarHBondContact O-CA 3.43Å; R1889-R1892 WeakPolarHBondContact O-CB 3.21Å; R1889-R1892 PolarHBondContact O-N 3.19Å; R1889-R1892 VanDerWaalsContact O-N 3.12Å; F1890-R1892 VanDerWaalsContact C-N 3.29Å; F1890-R1892 PolarHBondContact O-N 3.13Å; R1892-L1894 VanDerWaalsContact C-N 3.34Å; R1892-L1894 PolarHBondContact O-N 2.99Å; R1892-G1895 CarbonylContact O-C 3.49Å; R1892-G1895 WeakPolarHBondContact O-CA 3.42Å; R1892-G1895 PolarHBondContact O-N 3.08Å; R1892-G1895 VanDerWaalsContact O-N 3.14Å; R1892-Q1896 WeakPolarHBondContact O-CG 3.31Å; R1892-Q1896 PolarHBondContact O-N 3.17Å; R1892-F1974 HydrophobicContact CB-CZ 4.38Å; R1892-E2187 IonicContact CZ-OE1 3.82Å; R1892-E2187 IonicContact NH1-OE1 3.72Å; R1892-E2187 IonicContact NH2-OE1 2.66Å; R1892-E2187 PolarHBondContact NH2-OE1 3.28Å
1893D77.7Confident76.4Confident30.5 Ų30.551.7 Ų51.716%0.16325%0.248CC..Hα-helixtrans-67.7-36.8-176.2-58-14000110.7H1821 N1828 R1889 F1890 Q1896 S1897H1821-D1893 IonicContact CE1-OD2 3.06Å; H1821-D1893 PolarHBondContact CE1-OD2 3.27Å; H1821-D1893 VanDerWaalsContact CE1-OD2 3.26Å; H1821-D1893 IonicContact ND1-OD2 3.07Å; N1828-D1893 PolarHBondContact ND2-O 2.81Å; N1828-D1893 VanDerWaalsContact ND2-O 3.09Å; R1889-D1893 WeakPolarHBondContact O-CB 3.22Å; R1889-D1893 PolarHBondContact O-N 3.18Å; F1890-D1893 PolarHBondContact O-N 3.14Å; D1893-Q1896 PolarHBondContact O-N 3.15Å; D1893-S1897 PolarHBondContact O-N 3.16Å; D1893-S1897 VanDerWaalsContact O-N 3.1Å
1894L75.1Confident74.6Confident3.75 Ų3.7553.4 Ų53.42%0.0226%0.26CS..Hα-helixtrans-61-47.6168.1-74.2178.7000111.8V1827 N1828 Y1847 W1851 F1890 R1892 Q1896 S1897 L1898 L1911V1827-L1894 HydrophobicContact CB-CD2 4.02Å; V1827-L1894 HydrophobicContact CG1-CD2 3.82Å; N1828-L1894 WeakPolarHBondContact ND2-CD2 3.18Å; Y1847-L1894 HydrophobicContact CD1-CD2 3.98Å; Y1847-L1894 HydrophobicContact CD2-CD1 3.55Å; Y1847-L1894 HydrophobicContact CE1-CD1 3.59Å; Y1847-L1894 HydrophobicContact CE1-CD2 3.21Å; Y1847-L1894 HydrophobicContact CE1-CG 4.03Å; Y1847-L1894 HydrophobicContact CE2-CD1 4.12Å; Y1847-L1894 HydrophobicContact CG-CD1 4.16Å; W1851-L1894 HydrophobicContact CE3-CD1 4.46Å; F1890-L1894 HydrophobicContact CD1-CD1 3.73Å; F1890-L1894 HydrophobicContact CD1-CG 4.3Å; F1890-L1894 HydrophobicContact CE1-CD1 3.23Å; F1890-L1894 HydrophobicContact CE1-CD2 4.43Å; F1890-L1894 HydrophobicContact CE1-CG 4.1Å; F1890-L1894 HydrophobicContact CE2-CD1 4.32Å; F1890-L1894 HydrophobicContact CE2-CD2 4.4Å; F1890-L1894 HydrophobicContact CE2-CG 4.37Å; F1890-L1894 HydrophobicContact CG-CD1 4.38Å; F1890-L1894 HydrophobicContact CZ-CD1 3.66Å; F1890-L1894 VanDerWaalsContact CZ-CD1 3.47Å; F1890-L1894 HydrophobicContact CZ-CD2 4.09Å; F1890-L1894 HydrophobicContact CZ-CG 4.23Å; F1890-L1894 WeakPolarHBondContact O-CB 3.09Å; F1890-L1894 VanDerWaalsContact O-CG 3.31Å; F1890-L1894 WeakPolarHBondContact O-CG 3.28Å; F1890-L1894 PolarHBondContact O-N 3.02Å; F1890-L1894 VanDerWaalsContact O-N 3.09Å; R1892-L1894 VanDerWaalsContact C-N 3.34Å; R1892-L1894 PolarHBondContact O-N 2.99Å; L1894-Q1896 VanDerWaalsContact C-N 3.3Å; L1894-Q1896 PolarHBondContact O-N 3.13Å; L1894-S1897 WeakPolarHBondContact O-CB 3.17Å; L1894-S1897 PolarHBondContact O-N 3.05Å; L1894-S1897 VanDerWaalsContact O-N 3.15Å; L1894-S1897 PolarHBondContact O-OG 3.19Å; L1894-L1898 WeakPolarHBondContact O-CG 3.31Å; L1894-L1898 PolarHBondContact O-N 3.07Å; L1894-L1898 VanDerWaalsContact O-N 3.14Å; L1894-L1911 HydrophobicContact CB-CD1 3.82Å; L1894-L1911 VanDerWaalsContact CB-CD1 3.47Å; L1894-L1911 HydrophobicContact CB-CD2 4.33Å; L1894-L1911 HydrophobicContact CD1-CD1 3.98Å; L1894-L1911 HydrophobicContact CD1-CD2 4.42Å; L1894-L1911 HydrophobicContact CG-CD1 4.41Å
1895G73.6Confident73.2Confident9.25 Ų9.2559.3 Ų59.310%0.09529%0.291CS..Hα-helixtrans-62.2-33.3179.300000113.4C1891 R1892 L1898 K1899 F1908 L1911C1891-G1895 PolarHBondContact O-N 3.22Å; R1892-G1895 CarbonylContact O-C 3.49Å; R1892-G1895 WeakPolarHBondContact O-CA 3.42Å; R1892-G1895 PolarHBondContact O-N 3.08Å; R1892-G1895 VanDerWaalsContact O-N 3.14Å; G1895-L1898 PolarHBondContact O-N 2.95Å; G1895-K1899 WeakPolarHBondContact O-CG 3.29Å; G1895-K1899 PolarHBondContact O-N 3.06Å; G1895-F1908 WeakPolarHBondContact O-CE2 3.14Å; G1895-L1911 VanDerWaalsContact CA-CD1 3.44Å
1896Q72.1Confident71.8Confident109 Ų10962.4 Ų62.451%0.50931%0.31SS..Hα-helixtrans-67.2-44173.9-74.3175.1-12.400111.5R1892 D1893 L1894 L1898 K1899R1892-Q1896 WeakPolarHBondContact O-CG 3.31Å; R1892-Q1896 PolarHBondContact O-N 3.17Å; D1893-Q1896 PolarHBondContact O-N 3.15Å; L1894-Q1896 VanDerWaalsContact C-N 3.3Å; L1894-Q1896 PolarHBondContact O-N 3.13Å; Q1896-L1898 VanDerWaalsContact C-N 3.34Å; Q1896-L1898 PolarHBondContact O-N 3.22Å; Q1896-L1898 VanDerWaalsContact O-N 3.14Å; Q1896-K1899 PolarHBondContact O-N 3.15Å; Q1896-K1899 VanDerWaalsContact O-N 3.15Å
1897S65.8Low70.5Confident28.75 Ų28.7559.8 Ų59.820%0.20130%0.301CS..Hα-helixtrans-64.9-27.7178.5170.40000114N1828 K1831 D1893 L1894N1828-S1897 VanDerWaalsContact CB-OG 3.29Å; N1828-S1897 WeakPolarHBondContact CB-OG 3.31Å; N1828-S1897 WeakPolarHBondContact ND2-CB 3.49Å; N1828-S1897 PolarHBondContact ND2-OG 3.15Å; N1828-S1897 VanDerWaalsContact OD1-CB 3.29Å; N1828-S1897 WeakPolarHBondContact OD1-CB 3.43Å; N1828-S1897 PolarHBondContact OD1-OG 3.25Å; K1831-S1897 WeakPolarHBondContact CE-OG 3.34Å; K1831-S1897 PolarHBondContact NZ-O 3.08Å; K1831-S1897 PolarHBondContact NZ-OG 3.43Å; K1831-S1897 VanDerWaalsContact NZ-OG 3.07Å; D1893-S1897 PolarHBondContact O-N 3.16Å; D1893-S1897 VanDerWaalsContact O-N 3.1Å; L1894-S1897 WeakPolarHBondContact O-CB 3.17Å; L1894-S1897 PolarHBondContact O-N 3.05Å; L1894-S1897 VanDerWaalsContact O-N 3.15Å; L1894-S1897 PolarHBondContact O-OG 3.19Å
1898L66.3Low69.4Low17.75 Ų17.7562.9 Ų62.99%0.09331%0.314CS..Hα-helixtrans-82-19-177.7-67.8173.8000113.8Y1847 L1894 G1895 Q1896 D1900 D1901 V1903 S1904 D1907 F1908 L1911Y1847-L1898 HydrophobicContact CD1-CD1 4.11Å; L1894-L1898 WeakPolarHBondContact O-CG 3.31Å; L1894-L1898 PolarHBondContact O-N 3.07Å; L1894-L1898 VanDerWaalsContact O-N 3.14Å; G1895-L1898 PolarHBondContact O-N 2.95Å; Q1896-L1898 VanDerWaalsContact C-N 3.34Å; Q1896-L1898 PolarHBondContact O-N 3.22Å; Q1896-L1898 VanDerWaalsContact O-N 3.14Å; L1898-D1900 VanDerWaalsContact C-N 3.3Å; L1898-D1900 PolarHBondContact O-N 3.4Å; L1898-D1901 PolarHBondContact O-N 3.27Å; L1898-V1903 HydrophobicContact CB-CG2 4.4Å; L1898-V1903 HydrophobicContact CD2-CB 4.26Å; L1898-V1903 HydrophobicContact CD2-CG1 4.02Å; L1898-V1903 HydrophobicContact CD2-CG2 4.21Å; L1898-S1904 PolarHBondContact O-OG 2.91Å; L1898-S1904 VanDerWaalsContact O-OG 3.11Å; L1898-D1907 HydrophobicContact CD1-CB 4.3Å; L1898-F1908 HydrophobicContact CB-CB 4.44Å; L1898-F1908 HydrophobicContact CB-CD2 4.3Å; L1898-L1911 HydrophobicContact CD1-CD1 3.95Å; L1898-L1911 VanDerWaalsContact CD1-CD1 3.41Å
1899K61.7Low68.6Low140 Ų14067.1 Ų67.161%0.60934%0.337SS*.THydrogen-bonded Turntrans-65.1-25.3-177.3-79.5179.1-179-177.90113.9G1895 Q1896 D1901 F1908G1895-K1899 WeakPolarHBondContact O-CG 3.29Å; G1895-K1899 PolarHBondContact O-N 3.06Å; Q1896-K1899 PolarHBondContact O-N 3.15Å; Q1896-K1899 VanDerWaalsContact O-N 3.15Å; K1899-D1901 VanDerWaalsContact C-N 3.32Å; K1899-D1901 PolarHBondContact O-N 3.41Å; K1899-F1908 HydrophobicContact CD-CE2 4.32Å; K1899-F1908 HydrophobicContact CD-CZ 4.46Å; K1899-F1908 HydrophobicContact CG-CD2 4.21Å; K1899-F1908 HydrophobicContact CG-CE2 3.62Å; K1899-F1908 VanDerWaalsContact CG-CE2 3.5Å; K1899-F1908 HydrophobicContact CG-CZ 4.12Å
1900D57.8Low67.8Low133.75 Ų133.7563.8 Ų63.872%0.71533%0.326SS*.THydrogen-bonded Turntrans-79.6-17.8-176.1-65.8-27.5000113L1898L1898-D1900 VanDerWaalsContact C-N 3.3Å; L1898-D1900 PolarHBondContact O-N 3.4Å
1901D50.9Low67.2Low69.5 Ų69.564.1 Ų64.137%0.37233%0.328SS..  trans-107.9133.4-173.7-76.3-22.9000112.2K1831 L1898 K1899 V1903 S1904K1831-D1901 WeakPolarHBondContact CE-OD2 3.36Å; K1831-D1901 IonicContact NZ-OD1 3.08Å; K1831-D1901 PolarHBondContact NZ-OD1 2.99Å; K1831-D1901 IonicContact NZ-OD2 3.29Å; K1831-D1901 PolarHBondContact NZ-OD2 3.18Å; L1898-D1901 PolarHBondContact O-N 3.27Å; K1899-D1901 VanDerWaalsContact C-N 3.32Å; K1899-D1901 PolarHBondContact O-N 3.41Å; D1901-V1903 HydrophobicContact CB-CB 4.09Å; D1901-V1903 HydrophobicContact CB-CG2 3.3Å; D1901-V1903 PolarHBondContact O-N 3.26Å; D1901-S1904 WeakPolarHBondContact CB-OG 3.2Å; D1901-S1904 PolarHBondContact O-N 2.97Å; D1901-S1904 PolarHBondContact O-OG 3.35Å
1902K55.9Low66.8Low216.5 Ų216.568.5 Ų68.594%0.94135%0.35SS*.SBendtrans-67.39.3169.3-66.7-177.4-179.8177.40112.2S1904K1902-S1904 VanDerWaalsContact C-N 3.31Å
1903V53.9Low66.5Low93.75 Ų93.7570.6 Ų70.657%0.56836%0.362SS*.  trans-71.360.7-179.3-179.90000110.3L1898 D1901 L1905 D1907L1898-V1903 HydrophobicContact CB-CG2 4.4Å; L1898-V1903 HydrophobicContact CD2-CB 4.26Å; L1898-V1903 HydrophobicContact CD2-CG1 4.02Å; L1898-V1903 HydrophobicContact CD2-CG2 4.21Å; D1901-V1903 HydrophobicContact CB-CB 4.09Å; D1901-V1903 HydrophobicContact CB-CG2 3.3Å; D1901-V1903 PolarHBondContact O-N 3.26Å; V1903-L1905 VanDerWaalsContact C-N 3.32Å; V1903-L1905 PolarHBondContact O-N 2.99Å; V1903-D1907 HydrophobicContact CG1-CB 3.92Å; V1903-D1907 VanDerWaalsContact CG1-OD2 3.31Å; V1903-D1907 WeakPolarHBondContact CG1-OD2 3.48Å
1904S58.7Low66.5Low36.5 Ų36.569.1 Ų69.126%0.25535%0.354SS..  trans-70.468-179.352.70000113L1898 D1901 K1902 T1906 D1907 F1908L1898-S1904 PolarHBondContact O-OG 2.91Å; L1898-S1904 VanDerWaalsContact O-OG 3.11Å; D1901-S1904 WeakPolarHBondContact CB-OG 3.2Å; D1901-S1904 PolarHBondContact O-N 2.97Å; D1901-S1904 PolarHBondContact O-OG 3.35Å; K1902-S1904 VanDerWaalsContact C-N 3.31Å; S1904-T1906 WeakPolarHBondContact CB-OG1 3.33Å; S1904-T1906 PolarHBondContact O-N 3.25Å; S1904-T1906 VanDerWaalsContact O-N 3.08Å; S1904-T1906 PolarHBondContact OG-OG1 3.19Å; S1904-T1906 VanDerWaalsContact OG-OG1 3.12Å; S1904-D1907 WeakPolarHBondContact O-CA 3.38Å; S1904-D1907 WeakPolarHBondContact O-CB 3.35Å; S1904-D1907 PolarHBondContact O-N 3.14Å; S1904-F1908 PolarHBondContact O-N 2.87Å
1905L63.5Low66.7Low123 Ų12369.8 Ų69.864%0.64436%0.357SS*.Hα-helixtrans-48.7-31.9179.3-164.581.8000113.1V1903 D1907 N1909V1903-L1905 VanDerWaalsContact C-N 3.32Å; V1903-L1905 PolarHBondContact O-N 2.99Å; L1905-D1907 PolarHBondContact O-N 3.43Å; L1905-N1909 WeakPolarHBondContact O-CB 3.39Å; L1905-N1909 PolarHBondContact O-N 3.22Å; L1905-N1909 PolarHBondContact O-ND2 3.14Å; L1905-N1909 PolarHBondContact O-OD1 3.34Å
1906T64.3Low66.7Low75 Ų7572 Ų7246%0.4637%0.371SS..Hα-helixtrans-64.1-38177.154.70000113.6K1849 S1904 N1909 S1910K1849-T1906 WeakPolarHBondContact CE-OG1 3.35Å; S1904-T1906 WeakPolarHBondContact CB-OG1 3.33Å; S1904-T1906 PolarHBondContact O-N 3.25Å; S1904-T1906 VanDerWaalsContact O-N 3.08Å; S1904-T1906 PolarHBondContact OG-OG1 3.19Å; S1904-T1906 VanDerWaalsContact OG-OG1 3.12Å; T1906-N1909 WeakPolarHBondContact O-CB 3.36Å; T1906-N1909 PolarHBondContact O-N 3.22Å; T1906-S1910 WeakPolarHBondContact O-CB 3.28Å; T1906-S1910 PolarHBondContact O-N 3.28Å; T1906-S1910 VanDerWaalsContact O-N 3.08Å; T1906-S1910 PolarHBondContact O-OG 2.64Å
1907D64.6Low66.9Low21.25 Ų21.2567.8 Ų67.811%0.11435%0.352CS..Hα-helixtrans-74.3-40.8-176.6-66.4-14.8000110.4Y1847 N1848 K1849 L1898 V1903 S1904 L1905 N1909 S1910 L1911Y1847-D1907 HydrophobicContact CD1-CB 3.87Å; Y1847-D1907 HydrophobicContact CE1-CB 3.9Å; N1848-D1907 HydrophobicContact CB-CB 3.63Å; N1848-D1907 WeakPolarHBondContact CB-OD2 3.3Å; N1848-D1907 WeakPolarHBondContact ND2-CB 3.08Å; N1848-D1907 VanDerWaalsContact ND2-CG 3.31Å; N1848-D1907 PolarHBondContact ND2-OD2 2.61Å; K1849-D1907 VanDerWaalsContact CB-OD1 3.32Å; K1849-D1907 WeakPolarHBondContact CB-OD1 3.42Å; K1849-D1907 WeakPolarHBondContact CE-OD1 3.35Å; K1849-D1907 PolarHBondContact N-OD1 2.83Å; K1849-D1907 VanDerWaalsContact N-OD1 3.1Å; L1898-D1907 HydrophobicContact CD1-CB 4.3Å; V1903-D1907 HydrophobicContact CG1-CB 3.92Å; V1903-D1907 VanDerWaalsContact CG1-OD2 3.31Å; V1903-D1907 WeakPolarHBondContact CG1-OD2 3.48Å; S1904-D1907 WeakPolarHBondContact O-CA 3.38Å; S1904-D1907 WeakPolarHBondContact O-CB 3.35Å; S1904-D1907 PolarHBondContact O-N 3.14Å; L1905-D1907 PolarHBondContact O-N 3.43Å; D1907-N1909 VanDerWaalsContact C-N 3.28Å; D1907-N1909 PolarHBondContact O-N 3.06Å; D1907-S1910 WeakPolarHBondContact CA-OG 3.3Å; D1907-S1910 PolarHBondContact O-N 3.03Å; D1907-S1910 PolarHBondContact O-OG 3.28Å; D1907-L1911 WeakPolarHBondContact O-CB 3.39Å; D1907-L1911 PolarHBondContact O-N 3.36Å
1908F68.8Low67.5Low65.25 Ų65.2567.4 Ų67.429%0.28635%0.347SS..Hα-helixtrans-59.1-43.6171.3-173.7-96.6000111.5G1895 L1898 K1899 S1904 S1910 L1911 M1912G1895-F1908 WeakPolarHBondContact O-CE2 3.14Å; L1898-F1908 HydrophobicContact CB-CB 4.44Å; L1898-F1908 HydrophobicContact CB-CD2 4.3Å; K1899-F1908 HydrophobicContact CD-CE2 4.32Å; K1899-F1908 HydrophobicContact CD-CZ 4.46Å; K1899-F1908 HydrophobicContact CG-CD2 4.21Å; K1899-F1908 HydrophobicContact CG-CE2 3.62Å; K1899-F1908 VanDerWaalsContact CG-CE2 3.5Å; K1899-F1908 HydrophobicContact CG-CZ 4.12Å; S1904-F1908 PolarHBondContact O-N 2.87Å; F1908-S1910 VanDerWaalsContact C-N 3.35Å; F1908-S1910 PolarHBondContact O-N 3.32Å; F1908-L1911 PolarHBondContact O-N 3.34Å; F1908-M1912 HydrophobicContact CD1-CE 4.4Å; F1908-M1912 HydrophobicContact CD1-CG 3.94Å; F1908-M1912 HydrophobicContact CD2-CE 4.21Å; F1908-M1912 HydrophobicContact CE1-CE 4.04Å; F1908-M1912 HydrophobicContact CE1-CG 3.63Å; F1908-M1912 VanDerWaalsContact CE1-CG 3.5Å; F1908-M1912 HydrophobicContact CE1-SD 4.25Å; F1908-M1912 HydrophobicContact CE2-CE 3.92Å; F1908-M1912 HydrophobicContact CE2-CG 4.31Å; F1908-M1912 HydrophobicContact CE2-SD 4.36Å; F1908-M1912 HydrophobicContact CZ-CE 3.42Å; F1908-M1912 VanDerWaalsContact CZ-CE 3.46Å; F1908-M1912 HydrophobicContact CZ-CG 4.04Å; F1908-M1912 HydrophobicContact CZ-SD 3.97Å; F1908-M1912 WeakPolarHBondContact O-CB 3.39Å; F1908-M1912 VanDerWaalsContact O-CG 3.26Å; F1908-M1912 WeakPolarHBondContact O-CG 3.29Å; F1908-M1912 PolarHBondContact O-N 3.07Å
1909N71.4Confident67.6Low89 Ų8970.1 Ų70.148%0.47636%0.361SS..Hα-helixtrans-62.4-41.5176.9-70.4-13.3000112.1L1905 T1906 D1907 L1911 M1912 E1913L1905-N1909 WeakPolarHBondContact O-CB 3.39Å; L1905-N1909 PolarHBondContact O-N 3.22Å; L1905-N1909 PolarHBondContact O-ND2 3.14Å; L1905-N1909 PolarHBondContact O-OD1 3.34Å; T1906-N1909 WeakPolarHBondContact O-CB 3.36Å; T1906-N1909 PolarHBondContact O-N 3.22Å; D1907-N1909 VanDerWaalsContact C-N 3.28Å; D1907-N1909 PolarHBondContact O-N 3.06Å; N1909-L1911 VanDerWaalsContact C-N 3.25Å; N1909-L1911 PolarHBondContact O-N 3.19Å; N1909-M1912 CarbonylContact O-C 3.48Å; N1909-M1912 PolarHBondContact O-N 2.99Å; N1909-E1913 WeakPolarHBondContact O-CB 3.42Å; N1909-E1913 PolarHBondContact O-N 3.13Å
1910S71.5Confident67.3Low13.25 Ų13.2568.9 Ų68.99%0.09335%0.354CS..Hα-helixtrans-65.1-33.4177.266.70000113.4Y1847 N1848 K1849 S1852 T1906 D1907 F1908 E1913 C1914Y1847-S1910 PolarHBondContact OH-OG 3.11Å; N1848-S1910 PolarHBondContact O-OG 2.66Å; K1849-S1910 WeakPolarHBondContact CB-OG 3.4Å; S1852-S1910 WeakPolarHBondContact CB-O 3.33Å; S1852-S1910 PolarHBondContact OG-O 3.16Å; T1906-S1910 WeakPolarHBondContact O-CB 3.28Å; T1906-S1910 PolarHBondContact O-N 3.28Å; T1906-S1910 VanDerWaalsContact O-N 3.08Å; T1906-S1910 PolarHBondContact O-OG 2.64Å; D1907-S1910 WeakPolarHBondContact CA-OG 3.3Å; D1907-S1910 PolarHBondContact O-N 3.03Å; D1907-S1910 PolarHBondContact O-OG 3.28Å; F1908-S1910 VanDerWaalsContact C-N 3.35Å; F1908-S1910 PolarHBondContact O-N 3.32Å; S1910-E1913 WeakPolarHBondContact O-CB 3.41Å; S1910-E1913 PolarHBondContact O-N 3.33Å; S1910-C1914 PolarHBondContact O-N 2.94Å; S1910-C1914 VanDerWaalsContact O-N 3.1Å; S1910-C1914 PolarHBondContact O-SG 3.21Å; S1910-C1914 VanDerWaalsContact O-SG 3.36Å
1911L73.7Confident66.6Low7.75 Ų7.7566.4 Ų66.44%0.04135%0.347CS..Hα-helixtrans-73.4-38.6173.8-126.5164000111.2Y1847 C1891 L1894 G1895 L1898 D1907 F1908 N1909 E1913 C1914 F1915Y1847-L1911 HydrophobicContact CE1-CB 4.46Å; Y1847-L1911 HydrophobicContact CE2-CD1 4.22Å; C1891-L1911 HydrophobicContact CB-CD2 4.27Å; C1891-L1911 HydrophobicContact CB-CG 4.46Å; C1891-L1911 WeakPolarHBondContact O-CD1 3.19Å; C1891-L1911 WeakPolarHBondContact O-CD2 3.38Å; L1894-L1911 HydrophobicContact CB-CD1 3.82Å; L1894-L1911 VanDerWaalsContact CB-CD1 3.47Å; L1894-L1911 HydrophobicContact CB-CD2 4.33Å; L1894-L1911 HydrophobicContact CD1-CD1 3.98Å; L1894-L1911 HydrophobicContact CD1-CD2 4.42Å; L1894-L1911 HydrophobicContact CG-CD1 4.41Å; G1895-L1911 VanDerWaalsContact CA-CD1 3.44Å; L1898-L1911 HydrophobicContact CD1-CD1 3.95Å; L1898-L1911 VanDerWaalsContact CD1-CD1 3.41Å; D1907-L1911 WeakPolarHBondContact O-CB 3.39Å; D1907-L1911 PolarHBondContact O-N 3.36Å; F1908-L1911 PolarHBondContact O-N 3.34Å; N1909-L1911 VanDerWaalsContact C-N 3.25Å; N1909-L1911 PolarHBondContact O-N 3.19Å; L1911-E1913 VanDerWaalsContact C-N 3.25Å; L1911-E1913 PolarHBondContact O-N 2.96Å; L1911-C1914 WeakPolarHBondContact O-CB 3.36Å; L1911-C1914 PolarHBondContact O-N 3.16Å; L1911-C1914 VanDerWaalsContact O-N 3.11Å; L1911-F1915 HydrophobicContact CD2-CD2 4.3Å; L1911-F1915 HydrophobicContact CD2-CE2 3.76Å; L1911-F1915 WeakPolarHBondContact O-CD2 3.39Å; L1911-F1915 PolarHBondContact O-N 3.13Å; L1911-F1915 VanDerWaalsContact O-N 3.13Å
1912M73.4Confident66.1Low92.5 Ų92.568.8 Ų68.846%0.45636%0.364SS..Hα-helixtrans-62.7-33.6172.8-71.8-63.3-12900111.8F1908 N1909 C1914 F1915 S1916F1908-M1912 HydrophobicContact CD1-CE 4.4Å; F1908-M1912 HydrophobicContact CD1-CG 3.94Å; F1908-M1912 HydrophobicContact CD2-CE 4.21Å; F1908-M1912 HydrophobicContact CE1-CE 4.04Å; F1908-M1912 HydrophobicContact CE1-CG 3.63Å; F1908-M1912 VanDerWaalsContact CE1-CG 3.5Å; F1908-M1912 HydrophobicContact CE1-SD 4.25Å; F1908-M1912 HydrophobicContact CE2-CE 3.92Å; F1908-M1912 HydrophobicContact CE2-CG 4.31Å; F1908-M1912 HydrophobicContact CE2-SD 4.36Å; F1908-M1912 HydrophobicContact CZ-CE 3.42Å; F1908-M1912 VanDerWaalsContact CZ-CE 3.46Å; F1908-M1912 HydrophobicContact CZ-CG 4.04Å; F1908-M1912 HydrophobicContact CZ-SD 3.97Å; F1908-M1912 WeakPolarHBondContact O-CB 3.39Å; F1908-M1912 VanDerWaalsContact O-CG 3.26Å; F1908-M1912 WeakPolarHBondContact O-CG 3.29Å; F1908-M1912 PolarHBondContact O-N 3.07Å; N1909-M1912 CarbonylContact O-C 3.48Å; N1909-M1912 PolarHBondContact O-N 2.99Å; M1912-C1914 VanDerWaalsContact C-N 3.28Å; M1912-C1914 PolarHBondContact O-N 3.17Å; M1912-F1915 HydrophobicContact CE-CE2 4.45Å; M1912-F1915 CarbonylContact O-C 3.59Å; M1912-F1915 PolarHBondContact O-N 3.11Å; M1912-F1915 VanDerWaalsContact O-N 3.08Å; M1912-F1915 HydrophobicContact SD-CD2 4.3Å; M1912-S1916 WeakPolarHBondContact O-CB 3.2Å; M1912-S1916 PolarHBondContact O-N 3.06Å
1913E76Confident65.1Low106.25 Ų106.2563.3 Ų63.350%0.49635%0.349SS..Hα-helixtrans-61.6-38.7172.2-167.7178.2-176.100111.8I1856 N1909 S1910 L1911 F1915 S1916I1856-E1913 HydrophobicContact CD1-CB 4.39Å; I1856-E1913 HydrophobicContact CD1-CG 4.16Å; N1909-E1913 WeakPolarHBondContact O-CB 3.42Å; N1909-E1913 PolarHBondContact O-N 3.13Å; S1910-E1913 WeakPolarHBondContact O-CB 3.41Å; S1910-E1913 PolarHBondContact O-N 3.33Å; L1911-E1913 VanDerWaalsContact C-N 3.25Å; L1911-E1913 PolarHBondContact O-N 2.96Å; E1913-F1915 VanDerWaalsContact C-N 3.26Å; E1913-F1915 PolarHBondContact O-N 3.24Å; E1913-F1915 VanDerWaalsContact O-N 3.15Å; E1913-S1916 VanDerWaalsContact O-CB 3.25Å; E1913-S1916 WeakPolarHBondContact O-CB 3.37Å; E1913-S1916 PolarHBondContact O-N 3.12Å; E1913-S1916 VanDerWaalsContact O-N 3.11Å; E1913-S1916 PolarHBondContact O-OG 3.25Å
1914C78.6Confident64.3Low0 Ų065.1 Ų65.10%036%0.355CS..Hα-helixtrans-57.6-34.8173.7-59.90000112.5S1852 L1855 I1856 S1910 L1911 M1912 I1917S1852-C1914 PolarHBondContact OG-SG 3.26Å; S1852-C1914 VanDerWaalsContact OG-SG 3.4Å; L1855-C1914 HydrophobicContact CD2-CB 4.11Å; L1855-C1914 VanDerWaalsContact CD2-SG 3.54Å; I1856-C1914 HydrophobicContact CG1-CB 4.31Å; S1910-C1914 PolarHBondContact O-N 2.94Å; S1910-C1914 VanDerWaalsContact O-N 3.1Å; S1910-C1914 PolarHBondContact O-SG 3.21Å; S1910-C1914 VanDerWaalsContact O-SG 3.36Å; L1911-C1914 WeakPolarHBondContact O-CB 3.36Å; L1911-C1914 PolarHBondContact O-N 3.16Å; L1911-C1914 VanDerWaalsContact O-N 3.11Å; M1912-C1914 VanDerWaalsContact C-N 3.28Å; M1912-C1914 PolarHBondContact O-N 3.17Å; C1914-I1917 VanDerWaalsContact O-CD1 3.23Å; C1914-I1917 WeakPolarHBondContact O-CD1 3.29Å; C1914-I1917 VanDerWaalsContact O-CG1 3.27Å; C1914-I1917 WeakPolarHBondContact O-CG1 3.35Å
1915F77.9Confident63.3Low17.75 Ų17.7569.2 Ų69.28%0.07838%0.379CS..Hα-helixtrans-82.7-16.9177.7-63.6-61.8000113.7M1859 I1888 C1891 L1911 M1912 E1913 I1917 F1918 F1974M1859-F1915 HydrophobicContact CE-CE1 4.45Å; I1888-F1915 HydrophobicContact CG2-CE1 4.27Å; C1891-F1915 HydrophobicContact CB-CE1 3.87Å; C1891-F1915 HydrophobicContact CB-CE2 3.93Å; C1891-F1915 HydrophobicContact CB-CZ 3.26Å; L1911-F1915 HydrophobicContact CD2-CD2 4.3Å; L1911-F1915 HydrophobicContact CD2-CE2 3.76Å; L1911-F1915 WeakPolarHBondContact O-CD2 3.39Å; L1911-F1915 PolarHBondContact O-N 3.13Å; L1911-F1915 VanDerWaalsContact O-N 3.13Å; M1912-F1915 HydrophobicContact CE-CE2 4.45Å; M1912-F1915 CarbonylContact O-C 3.59Å; M1912-F1915 PolarHBondContact O-N 3.11Å; M1912-F1915 VanDerWaalsContact O-N 3.08Å; M1912-F1915 HydrophobicContact SD-CD2 4.3Å; E1913-F1915 VanDerWaalsContact C-N 3.26Å; E1913-F1915 PolarHBondContact O-N 3.24Å; E1913-F1915 VanDerWaalsContact O-N 3.15Å; F1915-I1917 PolarHBondContact O-N 3.07Å; F1915-I1917 VanDerWaalsContact O-N 3.13Å; F1915-F1918 PolarHBondContact O-N 3.38Å; F1915-F1918 VanDerWaalsContact O-N 3.13Å; F1915-F1974 HydrophobicContact CB-CD1 4.43Å; F1915-F1974 AromaticContact CD1-CD1 3.77Å; F1915-F1974 HydrophobicContact CD1-CD1 3.77Å; F1915-F1974 HydrophobicContact CD1-CD2 4.4Å; F1915-F1974 AromaticContact CD1-CE1 3.58Å; F1915-F1974 HydrophobicContact CD1-CE1 3.58Å; F1915-F1974 VanDerWaalsContact CD1-CE1 3.48Å; F1915-F1974 HydrophobicContact CD1-CE2 4.32Å; F1915-F1974 HydrophobicContact CD1-CG 4.21Å; F1915-F1974 AromaticContact CD1-CZ 3.75Å; F1915-F1974 HydrophobicContact CD1-CZ 3.89Å; F1915-F1974 HydrophobicContact CD2-CD1 4.28Å; F1915-F1974 AromaticContact CD2-CE1 3.89Å; F1915-F1974 HydrophobicContact CD2-CE1 4.01Å; F1915-F1974 AromaticContact CE1-CD1 3.76Å; F1915-F1974 HydrophobicContact CE1-CD1 3.97Å; F1915-F1974 HydrophobicContact CE1-CD2 4.4Å; F1915-F1974 AromaticContact CE1-CE1 3.28Å; F1915-F1974 HydrophobicContact CE1-CE1 3.28Å; F1915-F1974 AromaticContact CE1-CE2 3.94Å; F1915-F1974 HydrophobicContact CE1-CE2 3.94Å; F1915-F1974 HydrophobicContact CE1-CG 4.32Å; F1915-F1974 AromaticContact CE1-CZ 3.27Å; F1915-F1974 HydrophobicContact CE1-CZ 3.27Å; F1915-F1974 HydrophobicContact CE2-CD1 4.36Å; F1915-F1974 AromaticContact CE2-CE1 3.73Å; F1915-F1974 HydrophobicContact CE2-CE1 3.73Å; F1915-F1974 HydrophobicContact CE2-CZ 4.32Å; F1915-F1974 AromaticContact CG-CD1 3.9Å; F1915-F1974 HydrophobicContact CG-CD1 3.93Å; F1915-F1974 AromaticContact CG-CE1 3.8Å; F1915-F1974 HydrophobicContact CG-CE1 3.93Å; F1915-F1974 HydrophobicContact CG-CG 4.45Å; F1915-F1974 HydrophobicContact CG-CZ 4.31Å; F1915-F1974 HydrophobicContact CZ-CD1 4.16Å; F1915-F1974 AromaticContact CZ-CE1 3.33Å; F1915-F1974 HydrophobicContact CZ-CE1 3.33Å; F1915-F1974 AromaticContact CZ-CZ 3.55Å; F1915-F1974 HydrophobicContact CZ-CZ 3.55Å
1916S74.6Confident61.9Low56 Ų5670.4 Ų70.439%0.39239%0.386SS..Hα-helixtrans-62.7-20.2177.974.10000113M1912 E1913 F1918 N1919M1912-S1916 WeakPolarHBondContact O-CB 3.2Å; M1912-S1916 PolarHBondContact O-N 3.06Å; E1913-S1916 VanDerWaalsContact O-CB 3.25Å; E1913-S1916 WeakPolarHBondContact O-CB 3.37Å; E1913-S1916 PolarHBondContact O-N 3.12Å; E1913-S1916 VanDerWaalsContact O-N 3.11Å; E1913-S1916 PolarHBondContact O-OG 3.25Å; S1916-F1918 PolarHBondContact O-N 3.04Å; S1916-F1918 VanDerWaalsContact O-N 3.13Å; S1916-N1919 PolarHBondContact O-N 2.97Å
1917I75.4Confident60.7Low20.25 Ų20.2571 Ų7110%0.10439%0.389CS..THydrogen-bonded Turntrans-53.8-32173.6-57.1173.6000111.9I1856 M1859 E1860 C1914 F1915 L1937 L1942I1856-I1917 HydrophobicContact CB-CD1 4.02Å; I1856-I1917 HydrophobicContact CG1-CD1 4.02Å; I1856-I1917 HydrophobicContact CG2-CD1 3.77Å; I1856-I1917 HydrophobicContact CG2-CG1 4.3Å; M1859-I1917 HydrophobicContact CB-CD1 3.81Å; M1859-I1917 HydrophobicContact CG-CD1 4.48Å; M1859-I1917 HydrophobicContact SD-CD1 4.1Å; E1860-I1917 HydrophobicContact CG-CD1 4.37Å; E1860-I1917 HydrophobicContact CG-CG2 4.36Å; C1914-I1917 VanDerWaalsContact O-CD1 3.23Å; C1914-I1917 WeakPolarHBondContact O-CD1 3.29Å; C1914-I1917 VanDerWaalsContact O-CG1 3.27Å; C1914-I1917 WeakPolarHBondContact O-CG1 3.35Å; F1915-I1917 PolarHBondContact O-N 3.07Å; F1915-I1917 VanDerWaalsContact O-N 3.13Å; I1917-L1937 HydrophobicContact CG2-CD1 3.41Å; I1917-L1937 VanDerWaalsContact CG2-CD1 3.48Å; I1917-L1937 HydrophobicContact CG2-CG 4.39Å; I1917-L1942 WeakPolarHBondContact O-CD1 3.38Å
1918F77.8Confident59.3Low20.25 Ų20.2577.5 Ų77.59%0.08942%0.424CS..THydrogen-bonded Turntrans-94.7-4.2-178.7-58.9-68.5000114M1859 V1863 L1884 I1888 F1915 S1916 L1942 L1971M1859-F1918 HydrophobicContact CE-CE2 3.73Å; M1859-F1918 HydrophobicContact CE-CZ 4.22Å; M1859-F1918 HydrophobicContact SD-CE2 4.13Å; M1859-F1918 HydrophobicContact SD-CZ 4.47Å; V1863-F1918 HydrophobicContact CG2-CE1 4.07Å; L1884-F1918 HydrophobicContact CD1-CZ 4.28Å; L1884-F1918 HydrophobicContact CD2-CE1 4.38Å; L1884-F1918 HydrophobicContact CD2-CZ 4.18Å; L1884-F1918 HydrophobicContact CG-CZ 4.43Å; I1888-F1918 HydrophobicContact CD1-CE2 4.24Å; I1888-F1918 HydrophobicContact CD1-CZ 4.3Å; I1888-F1918 HydrophobicContact CG1-CE2 4.4Å; F1915-F1918 PolarHBondContact O-N 3.38Å; F1915-F1918 VanDerWaalsContact O-N 3.13Å; S1916-F1918 PolarHBondContact O-N 3.04Å; S1916-F1918 VanDerWaalsContact O-N 3.13Å; F1918-L1942 HydrophobicContact CD1-CD1 4Å; F1918-L1942 HydrophobicContact CD1-CD2 4.19Å; F1918-L1971 HydrophobicContact CB-CD2 4.38Å; F1918-L1971 HydrophobicContact CD1-CD2 3.69Å; F1918-L1971 HydrophobicContact CD2-CD2 4.1Å; F1918-L1971 HydrophobicContact CE1-CD2 3.89Å; F1918-L1971 HydrophobicContact CE2-CD2 4.28Å; F1918-L1971 HydrophobicContact CG-CD2 3.8Å; F1918-L1971 HydrophobicContact CZ-CD2 4.19Å
1919N68.5Low57.8Low74.25 Ų74.2580.2 Ų80.240%0.39744%0.441SS..  trans-103.5117-176.5-74.4-20.7000111.3S1916 S1921S1916-N1919 PolarHBondContact O-N 2.97Å; N1919-S1921 PolarHBondContact O-N 3.14Å; N1919-S1921 VanDerWaalsContact O-N 3.09Å
1920Y55.2Low56Low115 Ų11583.3 Ų83.345%0.45146%0.458SS..  trans-77.746.6172.8-102-81.6000112.7T1922 L1942 N1943 H1946Y1920-T1922 PolarHBondContact O-N 3.22Å; Y1920-L1942 HydrophobicContact CD2-CD1 4.18Å; Y1920-N1943 WeakPolarHBondContact CE1-OD1 3.35Å; Y1920-N1943 PolarHBondContact OH-OD1 3Å; Y1920-H1946 PolarHBondContact OH-CD2 3.08Å; Y1920-H1946 VanDerWaalsContact OH-CD2 3.31Å
1921S44.4Very low54.3Low81.75 Ų81.7587.8 Ų87.857%0.57249%0.485SS*.  trans-80.798.8174.860.20000111N1919 T1923N1919-S1921 PolarHBondContact O-N 3.14Å; N1919-S1921 VanDerWaalsContact O-N 3.09Å; S1921-T1923 PolarHBondContact O-N 3.34Å
1922T39.4Very low52.7Low119 Ų11991.3 Ų91.373%0.7350%0.503SS*.SBendtrans-73.823.6179.939.30000114.1Y1920 N1924Y1920-T1922 PolarHBondContact O-N 3.22Å; T1922-N1924 VanDerWaalsContact C-N 3.32Å; T1922-N1924 PolarHBondContact O-N 3.3Å
1923T36.3Very low51.3Low101.75 Ų101.7591.6 Ų91.662%0.62450%0.503SS*.  trans-122.952.5179.756.90000112.4S1921S1921-T1923 PolarHBondContact O-N 3.34Å
1924N36.5Very low50Low132 Ų13291.6 Ų91.671%0.70651%0.514SS*.  trans-13151.2164.2-90-7.6000111.4T1922 N1926T1922-N1924 VanDerWaalsContact C-N 3.32Å; T1922-N1924 PolarHBondContact O-N 3.3Å; N1924-N1926 PolarHBondContact O-N 3.4Å
1925T36.8Very low48.9Very low121.5 Ų121.593.8 Ų93.875%0.74553%0.526SS*.  trans-86.454.9164.748.90000110.8T1927T1925-T1927 PolarHBondContact O-N 3.37Å
1926N34.6Very low48.3Very low149.5 Ų149.595.1 Ų95.180%0.79954%0.54SS*.  trans-124.127.7-179.7-70.8-10.9000116.8N1924N1924-N1926 PolarHBondContact O-N 3.4Å
1927T39.3Very low48.1Very low86.5 Ų86.593.5 Ų93.553%0.53153%0.527SS..  trans-95.5113.3159.950.80000108.6T1925 L1929T1925-T1927 PolarHBondContact O-N 3.37Å; T1927-L1929 PolarHBondContact O-N 3.18Å
1928N34.8Very low48.1Very low157.25 Ų157.2597.4 Ų97.484%0.84155%0.548SS*.SBendtrans-64.254.9174.3-76.7-26000112.6
1929L36.8Very low47.8Very low122.75 Ų122.75100.1 Ų100.164%0.64357%0.57SS**  trans-112.127.4168.8-79.7166.9000110.6T1927 T1931T1927-L1929 PolarHBondContact O-N 3.18Å; L1929-T1931 PolarHBondContact O-N 3.09Å; L1929-T1931 VanDerWaalsContact O-N 3.11Å
1930N35.1Very low48.4Very low153.75 Ų153.7599.2 Ų99.282%0.82257%0.569SS**THydrogen-bonded Turntrans-7117.5178.1-83.2-10.9000114.5
1931T35.8Very low49.8Very low108.5 Ų108.594.8 Ų94.867%0.66655%0.553SS**THydrogen-bonded Turntrans-128.660.1-179.627.40000113.4L1929L1929-T1931 PolarHBondContact O-N 3.09Å; L1929-T1931 VanDerWaalsContact O-N 3.11Å
1932I38.5Very low51.6Low80.5 Ų80.591.6 Ų91.641%0.41353%0.53SS..SBendtrans165.73.1170-44.6167.5000118.4L1527 N1528L1527-I1932 HydrophobicContact CD1-CB 3.92Å; L1527-I1932 HydrophobicContact CD1-CD1 4.35Å; L1527-I1932 HydrophobicContact CD1-CG2 3.03Å; L1527-I1932 HydrophobicContact CD2-CD1 4.07Å; L1527-I1932 WeakPolarHBondContact O-CG2 3.24Å; N1528-I1932 HydrophobicContact CB-CD1 3.95Å; N1528-I1932 WeakPolarHBondContact O-CD1 3.41Å; N1528-I1932 WeakPolarHBondContact O-CG2 3.37Å; N1528-I1932 WeakPolarHBondContact OD1-CD1 3.45Å; N1528-I1932 WeakPolarHBondContact OD1-CG1 3.41Å
1933H44.6Very low53.8Low99.75 Ų99.7589.8 Ų89.846%0.46252%0.516SS..  trans-106.287.5165.8-72.3-74000111.2F1530 N1935 A1936F1530-H1933 AromaticContact CE2-CE1 3.74Å; F1530-H1933 AromaticContact CE2-ND1 3.91Å; F1530-H1933 AromaticContact CZ-CE1 3.97Å; H1933-N1935 PolarHBondContact O-N 3.01Å; H1933-A1936 HydrophobicContact CB-CB 4.42Å; H1933-A1936 WeakPolarHBondContact O-CB 3.19Å; H1933-A1936 PolarHBondContact O-N 3.08Å; H1933-A1936 VanDerWaalsContact O-N 3.12Å
1934S49.4Very low56.3Low105 Ų10589.1 Ų89.173%0.73451%0.505SS*.THydrogen-bonded Turntrans-57.6-12.9169.458.10000113.2
1935N54.6Low58.9Low47.5 Ų47.582.8 Ų82.825%0.25447%0.472SS..THydrogen-bonded Turntrans-1012.8-177.9-67.6-7.1000114.8E1860 K1864 H1933 L1937E1860-N1935 VanDerWaalsContact OE2-C 3.26Å; K1864-N1935 VanDerWaalsContact CE-O 3.25Å; K1864-N1935 WeakPolarHBondContact CE-O 3.33Å; K1864-N1935 VanDerWaalsContact NZ-CA 3.3Å; K1864-N1935 PolarHBondContact NZ-O 3.25Å; H1933-N1935 PolarHBondContact O-N 3.01Å; N1935-L1937 PolarHBondContact O-N 2.97Å
1936A64.8Low61.4Low44.25 Ų44.2578 Ų7837%0.36644%0.441SS..PPolyproline II helixtrans-54.5142.3175.500000111.8E1860 K1864 H1933E1860-A1936 WeakPolarHBondContact OE1-CA 3.35Å; K1864-A1936 WeakPolarHBondContact CE-O 3.31Å; K1864-A1936 PolarHBondContact NZ-O 3Å; H1933-A1936 HydrophobicContact CB-CB 4.42Å; H1933-A1936 WeakPolarHBondContact O-CB 3.19Å; H1933-A1936 PolarHBondContact O-N 3.08Å; H1933-A1936 VanDerWaalsContact O-N 3.12Å
1937L71.4Confident64Low23.25 Ų23.2573 Ų7312%0.12242%0.418CS..PPolyproline II helixtrans-73.9136.3175.5-71.3175.8000110.9E1860 V1863 K1864 I1917 N1935 D1941 L1942E1860-L1937 HydrophobicContact CB-CG 4.33Å; E1860-L1937 HydrophobicContact CG-CD1 4.4Å; E1860-L1937 HydrophobicContact CG-CG 4.14Å; V1863-L1937 HydrophobicContact CB-CD1 3.95Å; V1863-L1937 HydrophobicContact CB-CD2 3.9Å; V1863-L1937 HydrophobicContact CG1-CD1 3.78Å; V1863-L1937 HydrophobicContact CG1-CD2 3.58Å; V1863-L1937 HydrophobicContact CG1-CG 4.37Å; V1863-L1937 HydrophobicContact CG2-CD1 4.18Å; K1864-L1937 HydrophobicContact CD-CD2 4.43Å; K1864-L1937 HydrophobicContact CG-CD2 3.77Å; I1917-L1937 HydrophobicContact CG2-CD1 3.41Å; I1917-L1937 VanDerWaalsContact CG2-CD1 3.48Å; I1917-L1937 HydrophobicContact CG2-CG 4.39Å; N1935-L1937 PolarHBondContact O-N 2.97Å; L1937-D1941 HydrophobicContact CD2-CB 3.97Å; L1937-L1942 HydrophobicContact CD1-CD2 4.13Å; L1937-L1942 HydrophobicContact CD1-CG 4.44Å
1938N74.5Confident66.5Low101.75 Ų101.7570.2 Ų70.254%0.54440%0.4SS..PPolyproline II helixtrans-83.2155.7169.3-67.5-14.6000109.9S1940 D1941 L1942N1938-S1940 VanDerWaalsContact CB-OG 3.31Å; N1938-S1940 WeakPolarHBondContact CB-OG 3.37Å; N1938-S1940 PolarHBondContact O-N 3.04Å; N1938-S1940 VanDerWaalsContact O-N 3.12Å; N1938-D1941 PolarHBondContact N-OD2 3.22Å; N1938-D1941 VanDerWaalsContact N-OD2 3.07Å; N1938-D1941 WeakPolarHBondContact O-CB 3.34Å; N1938-D1941 PolarHBondContact O-N 3.26Å; N1938-L1942 PolarHBondContact O-N 3.04Å
1939S73.1Confident69.2Low77 Ų7762.8 Ų62.854%0.53836%0.36SS..Hα-helixtrans-57.8-28.6173.659.30000112.7D1941 N1943S1939-D1941 VanDerWaalsContact C-N 3.3Å; S1939-D1941 PolarHBondContact O-N 3.03Å; S1939-N1943 PolarHBondContact O-N 3.26Å; S1939-N1943 PolarHBondContact O-ND2 3.12Å
1940S80.9Confident71.8Confident55.5 Ų55.557.6 Ų57.639%0.38833%0.333SS..Hα-helixtrans-60.4-36.917156.10000113N1938 N1943 Q1944N1938-S1940 VanDerWaalsContact CB-OG 3.31Å; N1938-S1940 WeakPolarHBondContact CB-OG 3.37Å; N1938-S1940 PolarHBondContact O-N 3.04Å; N1938-S1940 VanDerWaalsContact O-N 3.12Å; S1940-N1943 PolarHBondContact O-N 3.14Å; S1940-Q1944 VanDerWaalsContact O-CB 3.23Å; S1940-Q1944 WeakPolarHBondContact O-CB 3.38Å; S1940-Q1944 VanDerWaalsContact O-CG 3.29Å; S1940-Q1944 WeakPolarHBondContact O-CG 3.38Å; S1940-Q1944 PolarHBondContact O-N 3.15Å
1941D83.8Confident74.5Confident23 Ų2353.4 Ų53.412%0.12331%0.313CS..Hα-helixtrans-72.8-39.5-172.8-57.5-17.7000110.5V1867 L1937 N1938 S1939 Q1944 L1945V1867-D1941 HydrophobicContact CG2-CB 4.43Å; V1867-D1941 VanDerWaalsContact CG2-O 3.32Å; V1867-D1941 WeakPolarHBondContact CG2-O 3.32Å; L1937-D1941 HydrophobicContact CD2-CB 3.97Å; N1938-D1941 PolarHBondContact N-OD2 3.22Å; N1938-D1941 VanDerWaalsContact N-OD2 3.07Å; N1938-D1941 WeakPolarHBondContact O-CB 3.34Å; N1938-D1941 PolarHBondContact O-N 3.26Å; S1939-D1941 VanDerWaalsContact C-N 3.3Å; S1939-D1941 PolarHBondContact O-N 3.03Å; D1941-Q1944 PolarHBondContact O-N 3.2Å; D1941-L1945 WeakPolarHBondContact O-CB 3.24Å; D1941-L1945 PolarHBondContact O-N 3.21Å
1942L83.2Confident77.3Confident13.25 Ų13.2548.5 Ų48.57%0.06928%0.283CS..Hα-helixtrans-66.9-43.6174.8-89.2152.4000111.7I1917 F1918 Y1920 L1937 N1938 Q1944 L1945 H1946I1917-L1942 WeakPolarHBondContact O-CD1 3.38Å; F1918-L1942 HydrophobicContact CD1-CD1 4Å; F1918-L1942 HydrophobicContact CD1-CD2 4.19Å; Y1920-L1942 HydrophobicContact CD2-CD1 4.18Å; L1937-L1942 HydrophobicContact CD1-CD2 4.13Å; L1937-L1942 HydrophobicContact CD1-CG 4.44Å; N1938-L1942 PolarHBondContact O-N 3.04Å; L1942-Q1944 VanDerWaalsContact C-N 3.28Å; L1942-Q1944 PolarHBondContact O-N 3.03Å; L1942-L1945 WeakPolarHBondContact O-CB 3.39Å; L1942-L1945 PolarHBondContact O-N 3.06Å; L1942-L1945 VanDerWaalsContact O-N 3.17Å; L1942-H1946 PolarHBondContact O-CD2 3.14Å; L1942-H1946 PolarHBondContact O-N 3.35Å
1943N85.2Confident79.8Confident81.5 Ų81.544.9 Ų44.944%0.43627%0.265SS..Hα-helixtrans-60.8-41.2174.2-73.8-25.5000111.4Y1920 S1939 S1940 H1946 S1947Y1920-N1943 WeakPolarHBondContact CE1-OD1 3.35Å; Y1920-N1943 PolarHBondContact OH-OD1 3Å; S1939-N1943 PolarHBondContact O-N 3.26Å; S1939-N1943 PolarHBondContact O-ND2 3.12Å; S1940-N1943 PolarHBondContact O-N 3.14Å; N1943-H1946 PolarHBondContact O-N 3.14Å; N1943-S1947 WeakPolarHBondContact O-CB 3.39Å; N1943-S1947 PolarHBondContact O-N 2.96Å; N1943-S1947 PolarHBondContact O-OG 3.04Å
1944Q89Confident82Confident87.75 Ų87.7542.3 Ų42.341%0.4125%0.253SS..Hα-helixtrans-65.7-41.9175.4-121.8172.9-2.400111.2V1867 S1940 D1941 L1942 H1946 S1947 T1948V1867-Q1944 HydrophobicContact CG1-CB 4.03Å; V1867-Q1944 VanDerWaalsContact CG1-CD 3.47Å; V1867-Q1944 HydrophobicContact CG1-CG 4.26Å; V1867-Q1944 HydrophobicContact CG2-CB 4.13Å; V1867-Q1944 HydrophobicContact CG2-CG 4.4Å; V1867-Q1944 PolarHBondContact O-NE2 3.36Å; V1867-Q1944 VanDerWaalsContact O-NE2 3.15Å; S1940-Q1944 VanDerWaalsContact O-CB 3.23Å; S1940-Q1944 WeakPolarHBondContact O-CB 3.38Å; S1940-Q1944 VanDerWaalsContact O-CG 3.29Å; S1940-Q1944 WeakPolarHBondContact O-CG 3.38Å; S1940-Q1944 PolarHBondContact O-N 3.15Å; D1941-Q1944 PolarHBondContact O-N 3.2Å; L1942-Q1944 VanDerWaalsContact C-N 3.28Å; L1942-Q1944 PolarHBondContact O-N 3.03Å; Q1944-H1946 VanDerWaalsContact C-N 3.35Å; Q1944-H1946 PolarHBondContact O-N 3.22Å; Q1944-S1947 WeakPolarHBondContact CA-OG 3.38Å; Q1944-S1947 PolarHBondContact O-N 3.23Å; Q1944-S1947 PolarHBondContact O-OG 3.22Å; Q1944-T1948 HydrophobicContact CG-CG2 4.43Å; Q1944-T1948 WeakPolarHBondContact O-CB 3.5Å; Q1944-T1948 VanDerWaalsContact O-CG2 3.28Å; Q1944-T1948 WeakPolarHBondContact O-CG2 3.37Å; Q1944-T1948 PolarHBondContact O-N 3.38Å; Q1944-T1948 PolarHBondContact O-OG1 3.27Å; Q1944-T1948 VanDerWaalsContact O-OG1 3.08Å
1945L90.3Very high83.8Confident0 Ų044 Ų440%025%0.25CC..Hα-helixtrans-56.7-49.1173.7175.7142.7000111.5V1863 I1866 V1867 L1884 D1941 L1942 S1947 T1948 L1949 L1971V1863-L1945 HydrophobicContact CB-CD1 4.1Å; V1863-L1945 HydrophobicContact CG1-CB 4.37Å; V1863-L1945 HydrophobicContact CG1-CD1 3.66Å; V1863-L1945 HydrophobicContact CG2-CD1 3.67Å; I1866-L1945 HydrophobicContact CD1-CD1 4.38Å; V1867-L1945 HydrophobicContact CG2-CB 4.28Å; L1884-L1945 HydrophobicContact CD1-CD1 4.49Å; D1941-L1945 WeakPolarHBondContact O-CB 3.24Å; D1941-L1945 PolarHBondContact O-N 3.21Å; L1942-L1945 WeakPolarHBondContact O-CB 3.39Å; L1942-L1945 PolarHBondContact O-N 3.06Å; L1942-L1945 VanDerWaalsContact O-N 3.17Å; L1945-S1947 PolarHBondContact O-N 3.27Å; L1945-T1948 WeakPolarHBondContact CA-OG1 3.44Å; L1945-T1948 PolarHBondContact O-N 3.09Å; L1945-T1948 PolarHBondContact O-OG1 3.19Å; L1945-L1949 HydrophobicContact CD2-CD1 3.64Å; L1945-L1949 HydrophobicContact CD2-CG 4.46Å; L1945-L1949 HydrophobicContact CG-CD1 4.29Å; L1945-L1949 WeakPolarHBondContact O-CB 3.4Å; L1945-L1949 WeakPolarHBondContact O-CG 3.42Å; L1945-L1949 PolarHBondContact O-N 3.22Å; L1945-L1971 HydrophobicContact CD2-CD1 4.19Å
1946H88.8Confident85.4Confident19.5 Ų19.542.1 Ų42.19%0.0924%0.242CC..Hα-helixtrans-63-43.8177.7-67.3-65.3000111.7Y1920 L1942 N1943 Q1944 T1948 L1949 I1950 L1981 Y1984Y1920-H1946 PolarHBondContact OH-CD2 3.08Å; Y1920-H1946 VanDerWaalsContact OH-CD2 3.31Å; L1942-H1946 PolarHBondContact O-CD2 3.14Å; L1942-H1946 PolarHBondContact O-N 3.35Å; N1943-H1946 PolarHBondContact O-N 3.14Å; Q1944-H1946 VanDerWaalsContact C-N 3.35Å; Q1944-H1946 PolarHBondContact O-N 3.22Å; H1946-T1948 VanDerWaalsContact C-N 3.32Å; H1946-T1948 PolarHBondContact O-N 3.37Å; H1946-L1949 PolarHBondContact O-N 3.09Å; H1946-I1950 VanDerWaalsContact O-CG1 3.28Å; H1946-I1950 WeakPolarHBondContact O-CG1 3.35Å; H1946-I1950 PolarHBondContact O-N 2.94Å; H1946-L1981 VanDerWaalsContact CE1-CD1 3.47Å; H1946-L1981 WeakPolarHBondContact CE1-CD1 3.41Å; H1946-L1981 WeakPolarHBondContact ND1-CD1 3.3Å; H1946-Y1984 HydrophobicContact CB-CD1 4.41Å; H1946-Y1984 HydrophobicContact CB-CE1 3.94Å
1947S89.7Confident86.5Confident45.75 Ų45.7546.6 Ų46.632%0.3226%0.255SS..Hα-helixtrans-61.2-40176.574.70000112.4N1943 Q1944 L1945 I1950 T1951N1943-S1947 WeakPolarHBondContact O-CB 3.39Å; N1943-S1947 PolarHBondContact O-N 2.96Å; N1943-S1947 PolarHBondContact O-OG 3.04Å; Q1944-S1947 WeakPolarHBondContact CA-OG 3.38Å; Q1944-S1947 PolarHBondContact O-N 3.23Å; Q1944-S1947 PolarHBondContact O-OG 3.22Å; L1945-S1947 PolarHBondContact O-N 3.27Å; S1947-I1950 PolarHBondContact O-N 3.06Å; S1947-T1951 WeakPolarHBondContact O-CB 3.31Å; S1947-T1951 PolarHBondContact O-N 3.14Å; S1947-T1951 PolarHBondContact O-OG1 3.3Å
1948T91.8Very high87.3Confident25.75 Ų25.7547.9 Ų47.916%0.15826%0.264CS..Hα-helixtrans-68.9-41.3178.351.40000112Q1944 L1945 H1946 I1950 T1951 D1952Q1944-T1948 HydrophobicContact CG-CG2 4.43Å; Q1944-T1948 WeakPolarHBondContact O-CB 3.5Å; Q1944-T1948 VanDerWaalsContact O-CG2 3.28Å; Q1944-T1948 WeakPolarHBondContact O-CG2 3.37Å; Q1944-T1948 PolarHBondContact O-N 3.38Å; Q1944-T1948 PolarHBondContact O-OG1 3.27Å; Q1944-T1948 VanDerWaalsContact O-OG1 3.08Å; L1945-T1948 WeakPolarHBondContact CA-OG1 3.44Å; L1945-T1948 PolarHBondContact O-N 3.09Å; L1945-T1948 PolarHBondContact O-OG1 3.19Å; H1946-T1948 VanDerWaalsContact C-N 3.32Å; H1946-T1948 PolarHBondContact O-N 3.37Å; T1948-I1950 VanDerWaalsContact C-N 3.35Å; T1948-I1950 PolarHBondContact O-N 3.11Å; T1948-T1951 PolarHBondContact O-N 3.01Å; T1948-D1952 WeakPolarHBondContact O-CB 3.35Å; T1948-D1952 VanDerWaalsContact O-CG 3.31Å; T1948-D1952 PolarHBondContact O-N 3.05Å
1949L92.4Very high87.9Confident1.75 Ų1.7549.3 Ų49.31%0.00927%0.269CS..Hα-helixtrans-58.7-47.6174.1-80.2171.6000111.4Y1881 L1945 H1946 T1951 D1952 I1953 A1964 L1967 L1971Y1881-L1949 HydrophobicContact CD1-CD2 3.96Å; Y1881-L1949 HydrophobicContact CD2-CD2 4.43Å; Y1881-L1949 HydrophobicContact CE1-CD2 3.52Å; Y1881-L1949 VanDerWaalsContact CE1-CD2 3.48Å; Y1881-L1949 HydrophobicContact CE1-CG 4.15Å; Y1881-L1949 HydrophobicContact CE2-CD2 4.12Å; Y1881-L1949 HydrophobicContact CG-CD2 4.41Å; L1945-L1949 HydrophobicContact CD2-CD1 3.64Å; L1945-L1949 HydrophobicContact CD2-CG 4.46Å; L1945-L1949 HydrophobicContact CG-CD1 4.29Å; L1945-L1949 WeakPolarHBondContact O-CB 3.4Å; L1945-L1949 WeakPolarHBondContact O-CG 3.42Å; L1945-L1949 PolarHBondContact O-N 3.22Å; H1946-L1949 PolarHBondContact O-N 3.09Å; L1949-T1951 VanDerWaalsContact C-N 3.34Å; L1949-T1951 PolarHBondContact O-N 2.96Å; L1949-D1952 PolarHBondContact O-N 3.36Å; L1949-I1953 WeakPolarHBondContact O-CB 3.37Å; L1949-I1953 WeakPolarHBondContact O-CD1 3.31Å; L1949-I1953 VanDerWaalsContact O-CG1 3.22Å; L1949-I1953 WeakPolarHBondContact O-CG1 3.33Å; L1949-I1953 PolarHBondContact O-N 3Å; L1949-A1964 HydrophobicContact CD2-CB 3.73Å; L1949-L1967 HydrophobicContact CD1-CD2 4.4Å; L1949-L1967 HydrophobicContact CD2-CB 4.49Å; L1949-L1967 HydrophobicContact CD2-CD2 4.14Å; L1949-L1967 HydrophobicContact CD2-CG 4.48Å; L1949-L1971 HydrophobicContact CD1-CD1 3.93Å
1950I91.8Very high88.8Confident14.25 Ų14.2545.9 Ų45.97%0.07324%0.244CC..Hα-helixtrans-61.1-46.1177.9-68.8175.2000110.7H1946 S1947 T1948 D1952 I1953 I1954 Y1984 L1985 Q1988 T1990H1946-I1950 VanDerWaalsContact O-CG1 3.28Å; H1946-I1950 WeakPolarHBondContact O-CG1 3.35Å; H1946-I1950 PolarHBondContact O-N 2.94Å; S1947-I1950 PolarHBondContact O-N 3.06Å; T1948-I1950 VanDerWaalsContact C-N 3.35Å; T1948-I1950 PolarHBondContact O-N 3.11Å; I1950-D1952 VanDerWaalsContact C-N 3.3Å; I1950-D1952 PolarHBondContact O-N 3.2Å; I1950-I1953 PolarHBondContact O-N 3.15Å; I1950-I1954 HydrophobicContact CG2-CD1 3.76Å; I1950-I1954 WeakPolarHBondContact O-CG1 3.31Å; I1950-I1954 PolarHBondContact O-N 3Å; I1950-I1954 VanDerWaalsContact O-N 3.1Å; I1950-Y1984 HydrophobicContact CD1-CD1 4.04Å; I1950-Y1984 HydrophobicContact CD1-CE1 3.49Å; I1950-Y1984 VanDerWaalsContact CD1-CE1 3.47Å; I1950-L1985 HydrophobicContact CD1-CD2 3.99Å; I1950-L1985 HydrophobicContact CG1-CD2 3.94Å; I1950-Q1988 HydrophobicContact CD1-CB 4.04Å; I1950-Q1988 HydrophobicContact CD1-CG 3.94Å; I1950-T1990 HydrophobicContact CB-CG2 4.06Å; I1950-T1990 HydrophobicContact CD1-CG2 3.85Å; I1950-T1990 HydrophobicContact CG1-CG2 3.92Å; I1950-T1990 HydrophobicContact CG2-CG2 3.52Å; I1950-T1990 VanDerWaalsContact CG2-OG1 3.3Å; I1950-T1990 WeakPolarHBondContact CG2-OG1 2.96Å
1951T91.8Very high89.4Confident65.75 Ų65.7544.5 Ų44.540%0.40323%0.232SC..Hα-helixtrans-60.6-41.8179.7-480000111.3S1947 T1948 L1949 I1954 H1955S1947-T1951 WeakPolarHBondContact O-CB 3.31Å; S1947-T1951 PolarHBondContact O-N 3.14Å; S1947-T1951 PolarHBondContact O-OG1 3.3Å; T1948-T1951 PolarHBondContact O-N 3.01Å; L1949-T1951 VanDerWaalsContact C-N 3.34Å; L1949-T1951 PolarHBondContact O-N 2.96Å; T1951-I1954 PolarHBondContact O-N 3.24Å; T1951-H1955 WeakPolarHBondContact O-CB 3.42Å; T1951-H1955 PolarHBondContact O-N 3.01Å; T1951-H1955 PolarHBondContact O-ND1 3.31Å
1952D93.2Very high89.7Confident5 Ų544.8 Ų44.83%0.02723%0.233CC..Hα-helixtrans-73.5-32.3179.8-73.9-26.3000113.2R1877 Y1881 T1948 L1949 I1950 I1954 G1956 I1960 Q1961 A1964R1877-D1952 WeakPolarHBondContact CD-OD2 3.31Å; R1877-D1952 IonicContact CZ-OD1 3.27Å; R1877-D1952 VanDerWaalsContact CZ-OD1 3.32Å; R1877-D1952 IonicContact CZ-OD2 3.31Å; R1877-D1952 IonicContact NE-OD1 3.61Å; R1877-D1952 PolarHBondContact NE-OD1 3.01Å; R1877-D1952 VanDerWaalsContact NE-OD1 3.15Å; R1877-D1952 IonicContact NE-OD2 3.07Å; R1877-D1952 PolarHBondContact NE-OD2 2.9Å; R1877-D1952 IonicContact NH2-OD1 3.02Å; R1877-D1952 PolarHBondContact NH2-OD1 3.2Å; R1877-D1952 IonicContact NH2-OD2 3.36Å; Y1881-D1952 HydrophobicContact CE2-CB 4.41Å; Y1881-D1952 VanDerWaalsContact CE2-OD2 3.31Å; Y1881-D1952 WeakPolarHBondContact CE2-OD2 3.47Å; Y1881-D1952 PolarHBondContact OH-OD2 3.17Å; T1948-D1952 WeakPolarHBondContact O-CB 3.35Å; T1948-D1952 VanDerWaalsContact O-CG 3.31Å; T1948-D1952 PolarHBondContact O-N 3.05Å; L1949-D1952 PolarHBondContact O-N 3.36Å; I1950-D1952 VanDerWaalsContact C-N 3.3Å; I1950-D1952 PolarHBondContact O-N 3.2Å; D1952-I1954 VanDerWaalsContact C-N 3.32Å; D1952-G1956 WeakPolarHBondContact O-CA 3.29Å; D1952-G1956 PolarHBondContact O-N 3.16Å; D1952-I1960 HydrophobicContact CB-CD1 3.95Å; D1952-I1960 HydrophobicContact CB-CG1 4.06Å; D1952-I1960 VanDerWaalsContact CG-CD1 3.4Å; D1952-I1960 WeakPolarHBondContact OD1-CD1 3.32Å; D1952-I1960 VanDerWaalsContact OD2-CD1 3.25Å; D1952-I1960 WeakPolarHBondContact OD2-CD1 3.37Å; D1952-Q1961 VanDerWaalsContact O-CG 3.27Å; D1952-Q1961 WeakPolarHBondContact O-CG 3.28Å; D1952-A1964 HydrophobicContact CB-CB 4.34Å
1953I92Very high90.1Very high6.5 Ų6.544.9 Ų44.93%0.03324%0.236CC..Hα-helixtrans-65.2-39.9173-70.6165.1000110.4L1949 I1950 Q1961 A1964 M1965 L1968 I1994L1949-I1953 WeakPolarHBondContact O-CB 3.37Å; L1949-I1953 WeakPolarHBondContact O-CD1 3.31Å; L1949-I1953 VanDerWaalsContact O-CG1 3.22Å; L1949-I1953 WeakPolarHBondContact O-CG1 3.33Å; L1949-I1953 PolarHBondContact O-N 3Å; I1950-I1953 PolarHBondContact O-N 3.15Å; I1953-Q1961 PolarHBondContact O-NE2 3.11Å; I1953-A1964 HydrophobicContact CD1-CB 4.44Å; I1953-A1964 HydrophobicContact CG1-CB 3.81Å; I1953-M1965 HydrophobicContact CD1-CG 4.36Å; I1953-M1965 HydrophobicContact CG1-CG 4.06Å; I1953-M1965 HydrophobicContact CG2-CG 4.43Å; I1953-L1968 HydrophobicContact CD1-CB 4.44Å; I1953-L1968 HydrophobicContact CD1-CD2 3.6Å; I1953-I1994 HydrophobicContact CG2-CD1 4.33Å; I1953-I1994 HydrophobicContact CG2-CG1 4.24Å
1954I90.7Very high90.6Very high43.25 Ų43.2541.1 Ų41.122%0.22222%0.215CC..Hα-helixtrans-79.8-49.7-177.1-62.9170000111.7I1950 T1951 D1952 T1990 H1993I1950-I1954 HydrophobicContact CG2-CD1 3.76Å; I1950-I1954 WeakPolarHBondContact O-CG1 3.31Å; I1950-I1954 PolarHBondContact O-N 3Å; I1950-I1954 VanDerWaalsContact O-N 3.1Å; T1951-I1954 PolarHBondContact O-N 3.24Å; D1952-I1954 VanDerWaalsContact C-N 3.32Å; I1954-T1990 HydrophobicContact CD1-CG2 4.37Å; I1954-H1993 HydrophobicContact CG1-CB 4.47Å
1955H87.7Confident90.8Very high141.75 Ų141.7537 Ų3766%0.65620%0.196SC*.Hα-helixtrans-112.7-2.5-168.6-55.492.5000114.4T1951T1951-H1955 WeakPolarHBondContact O-CB 3.42Å; T1951-H1955 PolarHBondContact O-N 3.01Å; T1951-H1955 PolarHBondContact O-ND1 3.31Å
1956G87Confident90.9Very high8.5 Ų8.539.1 Ų39.19%0.08821%0.211CC..SBendtrans-75.4159.6-177.500000113D1952 Q1961D1952-G1956 WeakPolarHBondContact O-CA 3.29Å; D1952-G1956 PolarHBondContact O-N 3.16Å; G1956-Q1961 WeakPolarHBondContact O-CG 3.41Å; G1956-Q1961 PolarHBondContact O-NE2 3.25Å; G1956-Q1961 PolarHBondContact O-OE1 3.26Å
1957H89.3Confident91.1Very high138.5 Ų138.538.2 Ų38.264%0.64121%0.207SC*.  trans-66.5160.5165.8-66.3-61.3000111.6Q1874 M1959 I1960 Q1961Q1874-H1957 PolarHBondContact OE1-CD2 3.02Å; H1957-M1959 VanDerWaalsContact C-N 3.31Å; H1957-M1959 PolarHBondContact O-N 3.06Å; H1957-M1959 VanDerWaalsContact O-N 3.11Å; H1957-I1960 HydrophobicContact CB-CG2 4.45Å; H1957-I1960 WeakPolarHBondContact O-CG2 3.41Å; H1957-I1960 PolarHBondContact O-N 3.12Å; H1957-Q1961 WeakPolarHBondContact O-CG 3.41Å; H1957-Q1961 PolarHBondContact O-N 2.85Å
1958T87.1Confident91.2Very high50.25 Ų50.2536.2 Ų36.231%0.30819%0.192SC..Hα-helixtrans-45.8-49.2-17556.40000113.5I1960 Q1961 L1962 L2055T1958-I1960 PolarHBondContact O-N 3.26Å; T1958-Q1961 WeakPolarHBondContact O-CB 3.42Å; T1958-Q1961 PolarHBondContact O-N 3.18Å; T1958-L1962 VanDerWaalsContact O-CG 3.26Å; T1958-L1962 WeakPolarHBondContact O-CG 3.37Å; T1958-L1962 PolarHBondContact O-N 3.25Å; T1958-L2055 HydrophobicContact CG2-CD1 4Å
1959M86.2Confident91.1Very high131.5 Ų131.536.5 Ų36.565%0.64819%0.192SC*.Hα-helixtrans-64.2-39.3-178.9-70.4-62.2-128.600114.3H1957 L1962 A1963H1957-M1959 VanDerWaalsContact C-N 3.31Å; H1957-M1959 PolarHBondContact O-N 3.06Å; H1957-M1959 VanDerWaalsContact O-N 3.11Å; M1959-L1962 HydrophobicContact SD-CD1 4.38Å; M1959-A1963 WeakPolarHBondContact O-CB 3.3Å; M1959-A1963 PolarHBondContact O-N 3.12Å; M1959-A1963 VanDerWaalsContact O-N 3.13Å
1960I91.9Very high91Very high4 Ų437 Ų372%0.02119%0.194CC..Hα-helixtrans-75.7-34177.8-171.1173000110.9Q1874 R1877 A1878 Y1881 D1952 H1957 T1958 L1962 A1963 A1964Q1874-I1960 HydrophobicContact CB-CB 4.49Å; Q1874-I1960 HydrophobicContact CB-CD1 3.82Å; Q1874-I1960 HydrophobicContact CB-CG2 4.27Å; Q1874-I1960 HydrophobicContact CG-CD1 4.19Å; Q1874-I1960 HydrophobicContact CG-CG2 4.47Å; Q1874-I1960 WeakPolarHBondContact O-CD1 3.27Å; Q1874-I1960 VanDerWaalsContact OE1-CG2 3.32Å; R1877-I1960 HydrophobicContact CB-CD1 3.73Å; A1878-I1960 HydrophobicContact CB-CB 4.16Å; A1878-I1960 HydrophobicContact CB-CG1 4.24Å; Y1881-I1960 HydrophobicContact CD2-CG1 4.13Å; Y1881-I1960 HydrophobicContact CE2-CD1 4.09Å; Y1881-I1960 HydrophobicContact CE2-CG1 3.84Å; D1952-I1960 HydrophobicContact CB-CD1 3.95Å; D1952-I1960 HydrophobicContact CB-CG1 4.06Å; D1952-I1960 VanDerWaalsContact CG-CD1 3.4Å; D1952-I1960 WeakPolarHBondContact OD1-CD1 3.32Å; D1952-I1960 VanDerWaalsContact OD2-CD1 3.25Å; D1952-I1960 WeakPolarHBondContact OD2-CD1 3.37Å; H1957-I1960 HydrophobicContact CB-CG2 4.45Å; H1957-I1960 WeakPolarHBondContact O-CG2 3.41Å; H1957-I1960 PolarHBondContact O-N 3.12Å; T1958-I1960 PolarHBondContact O-N 3.26Å; I1960-L1962 VanDerWaalsContact C-N 3.35Å; I1960-L1962 PolarHBondContact O-N 3.23Å; I1960-A1963 PolarHBondContact O-N 3.24Å; I1960-A1964 WeakPolarHBondContact O-CB 3.3Å; I1960-A1964 PolarHBondContact O-N 3.27Å
1961Q93.5Very high90.8Very high27.75 Ų27.7536.7 Ų36.713%0.1319%0.193CC..Hα-helixtrans-59.3-48.3172.7-71.8175.3-44.600110.6D1952 I1953 G1956 H1957 T1958 A1963 A1964 M1965 L2055D1952-Q1961 VanDerWaalsContact O-CG 3.27Å; D1952-Q1961 WeakPolarHBondContact O-CG 3.28Å; I1953-Q1961 PolarHBondContact O-NE2 3.11Å; G1956-Q1961 WeakPolarHBondContact O-CG 3.41Å; G1956-Q1961 PolarHBondContact O-NE2 3.25Å; G1956-Q1961 PolarHBondContact O-OE1 3.26Å; H1957-Q1961 WeakPolarHBondContact O-CG 3.41Å; H1957-Q1961 PolarHBondContact O-N 2.85Å; T1958-Q1961 WeakPolarHBondContact O-CB 3.42Å; T1958-Q1961 PolarHBondContact O-N 3.18Å; Q1961-A1963 PolarHBondContact O-N 3.08Å; Q1961-A1964 PolarHBondContact O-N 3.25Å; Q1961-M1965 HydrophobicContact CB-CE 4.18Å; Q1961-M1965 WeakPolarHBondContact O-CB 3.14Å; Q1961-M1965 VanDerWaalsContact O-CG 3.22Å; Q1961-M1965 WeakPolarHBondContact O-CG 3.43Å; Q1961-M1965 PolarHBondContact O-N 3.2Å; Q1961-L2055 HydrophobicContact CB-CD2 3.84Å
1962L91.2Very high90.6Very high29.5 Ų29.533.5 Ų33.515%0.15417%0.174CC..Hα-helixtrans-59.1-47.4176.6-67.4171.6000111.9T1958 M1959 I1960 M1965 S1966 L2054 L2055 S2058T1958-L1962 VanDerWaalsContact O-CG 3.26Å; T1958-L1962 WeakPolarHBondContact O-CG 3.37Å; T1958-L1962 PolarHBondContact O-N 3.25Å; M1959-L1962 HydrophobicContact SD-CD1 4.38Å; I1960-L1962 VanDerWaalsContact C-N 3.35Å; I1960-L1962 PolarHBondContact O-N 3.23Å; L1962-M1965 HydrophobicContact CD2-CE 4.26Å; L1962-M1965 PolarHBondContact O-N 3.4Å; L1962-S1966 WeakPolarHBondContact O-CB 3.24Å; L1962-S1966 PolarHBondContact O-N 3.18Å; L1962-S1966 PolarHBondContact O-OG 3.1Å; L1962-L2054 HydrophobicContact CD1-CB 4.03Å; L1962-L2054 HydrophobicContact CD1-CD1 4.41Å; L1962-L2054 HydrophobicContact CD2-CB 4.07Å; L1962-L2054 WeakPolarHBondContact CD2-O 3.29Å; L1962-L2055 HydrophobicContact CD2-CD2 4.06Å; L1962-L2055 HydrophobicContact CD2-CG 4.4Å; L1962-L2055 HydrophobicContact CG-CD2 4.25Å; L1962-S2058 WeakPolarHBondContact CD2-OG 3.45Å
1963A91.9Very high90Very high15.25 Ų15.2533.8 Ų33.813%0.12618%0.176CC..Hα-helixtrans-65-44.4179.200000112.1A1878 Y1881 M1959 I1960 Q1961 M1965 S1966 L1967A1878-A1963 HydrophobicContact CB-CB 4.24Å; Y1881-A1963 HydrophobicContact CD2-CB 4.26Å; M1959-A1963 WeakPolarHBondContact O-CB 3.3Å; M1959-A1963 PolarHBondContact O-N 3.12Å; M1959-A1963 VanDerWaalsContact O-N 3.13Å; I1960-A1963 PolarHBondContact O-N 3.24Å; Q1961-A1963 PolarHBondContact O-N 3.08Å; A1963-M1965 VanDerWaalsContact C-N 3.34Å; A1963-M1965 PolarHBondContact O-N 3.03Å; A1963-S1966 PolarHBondContact O-N 3.38Å; A1963-S1966 PolarHBondContact O-OG 3.18Å; A1963-L1967 PolarHBondContact O-N 3.1Å; A1963-L1967 VanDerWaalsContact O-N 3.08Å
1964A94.2Very high89.2Confident0 Ų035.9 Ų35.90%019%0.185CC..Hα-helixtrans-64-41.417700000111.6Y1881 L1949 D1952 I1953 I1960 Q1961 L1967 L1968Y1881-A1964 HydrophobicContact CD2-CB 3.98Å; Y1881-A1964 HydrophobicContact CE2-CB 3.84Å; L1949-A1964 HydrophobicContact CD2-CB 3.73Å; D1952-A1964 HydrophobicContact CB-CB 4.34Å; I1953-A1964 HydrophobicContact CD1-CB 4.44Å; I1953-A1964 HydrophobicContact CG1-CB 3.81Å; I1960-A1964 WeakPolarHBondContact O-CB 3.3Å; I1960-A1964 PolarHBondContact O-N 3.27Å; Q1961-A1964 PolarHBondContact O-N 3.25Å; A1964-L1967 PolarHBondContact O-N 3.1Å; A1964-L1968 VanDerWaalsContact O-CB 3.31Å; A1964-L1968 WeakPolarHBondContact O-CB 3.39Å; A1964-L1968 PolarHBondContact O-N 3.07Å
1965M93.5Very high88.3Confident3.25 Ų3.2534.5 Ų34.52%0.01618%0.178CC..Hα-helixtrans-63-46.9176-81.7-164.2-80.300111.9I1953 Q1961 L1962 A1963 L1967 L1968 E1969 L2055 S2058 K2059 I2062I1953-M1965 HydrophobicContact CD1-CG 4.36Å; I1953-M1965 HydrophobicContact CG1-CG 4.06Å; I1953-M1965 HydrophobicContact CG2-CG 4.43Å; Q1961-M1965 HydrophobicContact CB-CE 4.18Å; Q1961-M1965 WeakPolarHBondContact O-CB 3.14Å; Q1961-M1965 VanDerWaalsContact O-CG 3.22Å; Q1961-M1965 WeakPolarHBondContact O-CG 3.43Å; Q1961-M1965 PolarHBondContact O-N 3.2Å; L1962-M1965 HydrophobicContact CD2-CE 4.26Å; L1962-M1965 PolarHBondContact O-N 3.4Å; A1963-M1965 VanDerWaalsContact C-N 3.34Å; A1963-M1965 PolarHBondContact O-N 3.03Å; M1965-L1967 VanDerWaalsContact C-N 3.31Å; M1965-L1967 PolarHBondContact O-N 3.22Å; M1965-L1968 PolarHBondContact O-N 3.24Å; M1965-E1969 WeakPolarHBondContact O-CB 3.47Å; M1965-E1969 PolarHBondContact O-N 3.12Å; M1965-L2055 HydrophobicContact CE-CD2 3.57Å; M1965-S2058 PolarHBondContact SD-OG 2.82Å; M1965-K2059 HydrophobicContact CE-CG 4.19Å; M1965-K2059 HydrophobicContact SD-CG 3.7Å; M1965-I2062 VanDerWaalsContact CA-CD1 3.48Å; M1965-I2062 HydrophobicContact CB-CD1 3.27Å; M1965-I2062 HydrophobicContact CB-CG1 4.44Å; M1965-I2062 HydrophobicContact CG-CD1 3.32Å; M1965-I2062 WeakPolarHBondContact O-CD1 3.36Å; M1965-I2062 HydrophobicContact SD-CD1 3.79Å
1966S92.4Very high87.2Confident43.75 Ų43.7535.5 Ų35.531%0.30618%0.176SC..Hα-helixtrans-60.8-40.617768.20000112.4C1885 L1962 A1963 E1969 L1970C1885-S1966 PolarHBondContact SG-OG 3.07Å; C1885-S1966 VanDerWaalsContact SG-OG 3.36Å; L1962-S1966 WeakPolarHBondContact O-CB 3.24Å; L1962-S1966 PolarHBondContact O-N 3.18Å; L1962-S1966 PolarHBondContact O-OG 3.1Å; A1963-S1966 PolarHBondContact O-N 3.38Å; A1963-S1966 PolarHBondContact O-OG 3.18Å; S1966-E1969 PolarHBondContact O-N 3.13Å; S1966-L1970 WeakPolarHBondContact O-CG 3.36Å; S1966-L1970 PolarHBondContact O-N 3.04Å; S1966-L1970 VanDerWaalsContact O-N 3.12Å
1967L93.5Very high85.7Confident0.5 Ų0.541.2 Ų41.20%0.00321%0.213CC..Hα-helixtrans-66.7-44.2175.6179.656.4000111.2Y1881 L1884 C1885 I1888 L1949 A1963 A1964 M1965 E1969 L1970 L1971Y1881-L1967 HydrophobicContact CD1-CD2 3.56Å; Y1881-L1967 HydrophobicContact CE1-CD2 4.29Å; Y1881-L1967 HydrophobicContact CG-CD2 4.23Å; L1884-L1967 HydrophobicContact CB-CD1 3.93Å; L1884-L1967 HydrophobicContact CB-CD2 4.28Å; L1884-L1967 HydrophobicContact CD1-CD1 4.49Å; L1884-L1967 HydrophobicContact CD1-CD2 3.79Å; L1884-L1967 HydrophobicContact CD2-CD1 3.48Å; L1884-L1967 HydrophobicContact CD2-CD2 3.86Å; L1884-L1967 HydrophobicContact CD2-CG 4.32Å; L1884-L1967 HydrophobicContact CG-CD1 4.2Å; C1885-L1967 VanDerWaalsContact SG-CA 3.52Å; C1885-L1967 WeakPolarHBondContact SG-CA 3.35Å; C1885-L1967 PolarHBondContact SG-N 3.15Å; I1888-L1967 HydrophobicContact CD1-CD1 3.69Å; L1949-L1967 HydrophobicContact CD1-CD2 4.4Å; L1949-L1967 HydrophobicContact CD2-CB 4.49Å; L1949-L1967 HydrophobicContact CD2-CD2 4.14Å; L1949-L1967 HydrophobicContact CD2-CG 4.48Å; A1963-L1967 PolarHBondContact O-N 3.1Å; A1963-L1967 VanDerWaalsContact O-N 3.08Å; A1964-L1967 PolarHBondContact O-N 3.1Å; M1965-L1967 VanDerWaalsContact C-N 3.31Å; M1965-L1967 PolarHBondContact O-N 3.22Å; L1967-E1969 VanDerWaalsContact C-N 3.33Å; L1967-E1969 PolarHBondContact O-N 3.15Å; L1967-L1970 WeakPolarHBondContact O-CB 3.34Å; L1967-L1970 PolarHBondContact O-N 3.16Å; L1967-L1971 HydrophobicContact CD1-CD1 4.37Å; L1967-L1971 HydrophobicContact CD1-CD2 4.44Å; L1967-L1971 HydrophobicContact CD1-CG 4.17Å; L1967-L1971 HydrophobicContact CG-CD1 4.09Å; L1967-L1971 HydrophobicContact CG-CG 4.36Å; L1967-L1971 WeakPolarHBondContact O-CG 3.29Å; L1967-L1971 PolarHBondContact O-N 3.18Å
1968L91.9Very high84.4Confident3.5 Ų3.537.2 Ų37.22%0.01820%0.201CC..Hα-helixtrans-60.9-42.8178.5-174.763.6000111.6I1953 A1964 M1965 L1970 L1971 I1972 L1981 L1985I1953-L1968 HydrophobicContact CD1-CB 4.44Å; I1953-L1968 HydrophobicContact CD1-CD2 3.6Å; A1964-L1968 VanDerWaalsContact O-CB 3.31Å; A1964-L1968 WeakPolarHBondContact O-CB 3.39Å; A1964-L1968 PolarHBondContact O-N 3.07Å; M1965-L1968 PolarHBondContact O-N 3.24Å; L1968-L1970 VanDerWaalsContact C-N 3.3Å; L1968-L1970 PolarHBondContact O-N 3.09Å; L1968-L1971 PolarHBondContact O-N 3.04Å; L1968-I1972 HydrophobicContact CD1-CD1 4.36Å; L1968-I1972 HydrophobicContact CD1-CG1 4.43Å; L1968-I1972 HydrophobicContact CD2-CD1 4.47Å; L1968-I1972 HydrophobicContact CG-CD1 3.9Å; L1968-I1972 HydrophobicContact CG-CG1 4.44Å; L1968-I1972 VanDerWaalsContact O-CG1 3.25Å; L1968-I1972 WeakPolarHBondContact O-CG1 3.33Å; L1968-I1972 PolarHBondContact O-N 3.13Å; L1968-L1981 HydrophobicContact CD1-CD1 4.49Å; L1968-L1981 HydrophobicContact CD1-CD2 4.14Å; L1968-L1981 HydrophobicContact CD1-CG 4.48Å; L1968-L1985 HydrophobicContact CD1-CD1 4.12Å; L1968-L1985 HydrophobicContact CD1-CD2 4.26Å; L1968-L1985 HydrophobicContact CD2-CD1 3.98Å; L1968-L1985 HydrophobicContact CD2-CD2 3.95Å; L1968-L1985 HydrophobicContact CG-CD1 4.34Å
1969E90.8Very high83.7Confident33 Ų3336.3 Ų36.315%0.15419%0.193CC..Hα-helixtrans-58.6-43.5176-163.3-160.3138.600111.6M1965 S1966 L1967 I1972 S1973 S2061 I2062 R2065M1965-E1969 WeakPolarHBondContact O-CB 3.47Å; M1965-E1969 PolarHBondContact O-N 3.12Å; S1966-E1969 PolarHBondContact O-N 3.13Å; L1967-E1969 VanDerWaalsContact C-N 3.33Å; L1967-E1969 PolarHBondContact O-N 3.15Å; E1969-I1972 PolarHBondContact O-N 2.83Å; E1969-S1973 PolarHBondContact O-N 3.41Å; E1969-S1973 VanDerWaalsContact O-N 3.12Å; E1969-S2061 VanDerWaalsContact CD-OG 3.26Å; E1969-S2061 PolarHBondContact OE1-OG 3.06Å; E1969-S2061 WeakPolarHBondContact OE2-CB 3.3Å; E1969-S2061 PolarHBondContact OE2-OG 3.35Å; E1969-I2062 HydrophobicContact CB-CG1 3.96Å; E1969-I2062 HydrophobicContact CG-CG1 4.34Å; E1969-R2065 HydrophobicContact CG-CB 3.67Å; E1969-R2065 HydrophobicContact CG-CG 3.74Å; E1969-R2065 IonicContact OE1-CZ 3.37Å; E1969-R2065 IonicContact OE1-NE 3.87Å; E1969-R2065 PolarHBondContact OE1-NE 3.18Å; E1969-R2065 IonicContact OE1-NH2 3.26Å; E1969-R2065 PolarHBondContact OE1-NH2 3.03Å
1970L89.5Confident83.3Confident10.5 Ų10.535.2 Ų35.26%0.05519%0.186CC..Hα-helixtrans-64.3-46.1175.6-71.8174.3000111.3C1885 I1888 R1889 S1966 L1967 L1968 I1972 S1973 F1974C1885-L1970 HydrophobicContact CB-CD1 3.77Å; I1888-L1970 HydrophobicContact CB-CD1 4.43Å; I1888-L1970 HydrophobicContact CG2-CB 4.1Å; I1888-L1970 HydrophobicContact CG2-CD1 4.15Å; I1888-L1970 HydrophobicContact CG2-CD2 4.4Å; I1888-L1970 HydrophobicContact CG2-CG 4.45Å; R1889-L1970 HydrophobicContact CG-CD1 4.11Å; R1889-L1970 HydrophobicContact CG-CD2 4.21Å; S1966-L1970 WeakPolarHBondContact O-CG 3.36Å; S1966-L1970 PolarHBondContact O-N 3.04Å; S1966-L1970 VanDerWaalsContact O-N 3.12Å; L1967-L1970 WeakPolarHBondContact O-CB 3.34Å; L1967-L1970 PolarHBondContact O-N 3.16Å; L1968-L1970 VanDerWaalsContact C-N 3.3Å; L1968-L1970 PolarHBondContact O-N 3.09Å; L1970-I1972 PolarHBondContact O-N 3.16Å; L1970-S1973 WeakPolarHBondContact O-CA 3.36Å; L1970-S1973 VanDerWaalsContact O-CB 3.28Å; L1970-S1973 WeakPolarHBondContact O-CB 3.34Å; L1970-S1973 PolarHBondContact O-N 3.06Å; L1970-S1973 VanDerWaalsContact O-N 3.08Å; L1970-S1973 PolarHBondContact O-OG 3.39Å; L1970-F1974 WeakPolarHBondContact O-CD2 3.32Å; L1970-F1974 WeakPolarHBondContact O-CE2 3.43Å; L1970-F1974 PolarHBondContact O-N 3.11Å
1971L88Confident82.9Confident8 Ų835.6 Ų35.64%0.04219%0.188CC..Hα-helixtrans-60.6-43.6178.3-69.1174.3000112.2I1888 F1918 L1945 L1949 L1967 L1968 S1973 F1974 D1975 L1981I1888-L1971 HydrophobicContact CD1-CD2 4.27Å; F1918-L1971 HydrophobicContact CB-CD2 4.38Å; F1918-L1971 HydrophobicContact CD1-CD2 3.69Å; F1918-L1971 HydrophobicContact CD2-CD2 4.1Å; F1918-L1971 HydrophobicContact CE1-CD2 3.89Å; F1918-L1971 HydrophobicContact CE2-CD2 4.28Å; F1918-L1971 HydrophobicContact CG-CD2 3.8Å; F1918-L1971 HydrophobicContact CZ-CD2 4.19Å; L1945-L1971 HydrophobicContact CD2-CD1 4.19Å; L1949-L1971 HydrophobicContact CD1-CD1 3.93Å; L1967-L1971 HydrophobicContact CD1-CD1 4.37Å; L1967-L1971 HydrophobicContact CD1-CD2 4.44Å; L1967-L1971 HydrophobicContact CD1-CG 4.17Å; L1967-L1971 HydrophobicContact CG-CD1 4.09Å; L1967-L1971 HydrophobicContact CG-CG 4.36Å; L1967-L1971 WeakPolarHBondContact O-CG 3.29Å; L1967-L1971 PolarHBondContact O-N 3.18Å; L1968-L1971 PolarHBondContact O-N 3.04Å; L1971-S1973 PolarHBondContact O-N 2.97Å; L1971-F1974 PolarHBondContact O-N 3.04Å; L1971-F1974 VanDerWaalsContact O-N 3.09Å; L1971-D1975 PolarHBondContact O-N 3.09Å; L1971-D1975 VanDerWaalsContact O-N 3.17Å; L1971-L1981 HydrophobicContact CB-CD2 3.96Å
1972I86.3Confident82.6Confident0 Ų034.3 Ų34.30%018%0.182CC..Hα-helixtrans-60.6-31175-66.3165.4000111.1L1968 E1969 L1970 F1974 D1975 L1981 I1982 L1985 R2065 I2066 Y2069L1968-I1972 HydrophobicContact CD1-CD1 4.36Å; L1968-I1972 HydrophobicContact CD1-CG1 4.43Å; L1968-I1972 HydrophobicContact CD2-CD1 4.47Å; L1968-I1972 HydrophobicContact CG-CD1 3.9Å; L1968-I1972 HydrophobicContact CG-CG1 4.44Å; L1968-I1972 VanDerWaalsContact O-CG1 3.25Å; L1968-I1972 WeakPolarHBondContact O-CG1 3.33Å; L1968-I1972 PolarHBondContact O-N 3.13Å; E1969-I1972 PolarHBondContact O-N 2.83Å; L1970-I1972 PolarHBondContact O-N 3.16Å; I1972-F1974 PolarHBondContact O-N 3.1Å; I1972-D1975 PolarHBondContact O-N 3.13Å; I1972-L1981 HydrophobicContact CG1-CD2 3.8Å; I1972-L1981 HydrophobicContact CG1-CG 4.37Å; I1972-I1982 HydrophobicContact CG2-CD1 4.1Å; I1972-I1982 HydrophobicContact CG2-CG1 4.13Å; I1972-L1985 HydrophobicContact CD1-CD1 3.93Å; I1972-L1985 HydrophobicContact CG1-CD1 4.49Å; I1972-R2065 HydrophobicContact CB-CG 4.12Å; I1972-R2065 HydrophobicContact CG2-CG 3.77Å; I1972-I2066 HydrophobicContact CD1-CD1 4.35Å; I1972-I2066 HydrophobicContact CD1-CG1 3.9Å; I1972-Y2069 HydrophobicContact CG2-CD2 4.27Å; I1972-Y2069 HydrophobicContact CG2-CE2 3.73Å; I1972-Y2069 PolarHBondContact O-OH 3.3Å
1973S81.7Confident82.4Confident10 Ų1035.4 Ų35.47%0.0719%0.19CC..Hα-helixtrans-66.9-23.4177.684.90000114.3E1969 L1970 L1971 R1976 Y2069E1969-S1973 PolarHBondContact O-N 3.41Å; E1969-S1973 VanDerWaalsContact O-N 3.12Å; L1970-S1973 WeakPolarHBondContact O-CA 3.36Å; L1970-S1973 VanDerWaalsContact O-CB 3.28Å; L1970-S1973 WeakPolarHBondContact O-CB 3.34Å; L1970-S1973 PolarHBondContact O-N 3.06Å; L1970-S1973 VanDerWaalsContact O-N 3.08Å; L1970-S1973 PolarHBondContact O-OG 3.39Å; L1971-S1973 PolarHBondContact O-N 2.97Å; S1973-R1976 WeakPolarHBondContact O-CG 3.37Å; S1973-R1976 PolarHBondContact O-NE 2.99Å; S1973-Y2069 WeakPolarHBondContact CA-OH 3.3Å; S1973-Y2069 PolarHBondContact O-OH 3.25Å
1974F74.7Confident82.1Confident51.25 Ų51.2537.9 Ų37.923%0.22520%0.197CC..Hα-helixtrans-91.7-28.5176.5-64.9-74.5000112.9I1888 R1892 F1915 L1970 L1971 I1972 R1976I1888-F1974 HydrophobicContact CG2-CD2 4.22Å; I1888-F1974 HydrophobicContact CG2-CE2 3.25Å; I1888-F1974 VanDerWaalsContact CG2-CE2 3.4Å; I1888-F1974 HydrophobicContact CG2-CZ 3.65Å; R1892-F1974 HydrophobicContact CB-CZ 4.38Å; F1915-F1974 HydrophobicContact CB-CD1 4.43Å; F1915-F1974 AromaticContact CD1-CD1 3.77Å; F1915-F1974 HydrophobicContact CD1-CD1 3.77Å; F1915-F1974 HydrophobicContact CD1-CD2 4.4Å; F1915-F1974 AromaticContact CD1-CE1 3.58Å; F1915-F1974 HydrophobicContact CD1-CE1 3.58Å; F1915-F1974 VanDerWaalsContact CD1-CE1 3.48Å; F1915-F1974 HydrophobicContact CD1-CE2 4.32Å; F1915-F1974 HydrophobicContact CD1-CG 4.21Å; F1915-F1974 AromaticContact CD1-CZ 3.75Å; F1915-F1974 HydrophobicContact CD1-CZ 3.89Å; F1915-F1974 HydrophobicContact CD2-CD1 4.28Å; F1915-F1974 AromaticContact CD2-CE1 3.89Å; F1915-F1974 HydrophobicContact CD2-CE1 4.01Å; F1915-F1974 AromaticContact CE1-CD1 3.76Å; F1915-F1974 HydrophobicContact CE1-CD1 3.97Å; F1915-F1974 HydrophobicContact CE1-CD2 4.4Å; F1915-F1974 AromaticContact CE1-CE1 3.28Å; F1915-F1974 HydrophobicContact CE1-CE1 3.28Å; F1915-F1974 AromaticContact CE1-CE2 3.94Å; F1915-F1974 HydrophobicContact CE1-CE2 3.94Å; F1915-F1974 HydrophobicContact CE1-CG 4.32Å; F1915-F1974 AromaticContact CE1-CZ 3.27Å; F1915-F1974 HydrophobicContact CE1-CZ 3.27Å; F1915-F1974 HydrophobicContact CE2-CD1 4.36Å; F1915-F1974 AromaticContact CE2-CE1 3.73Å; F1915-F1974 HydrophobicContact CE2-CE1 3.73Å; F1915-F1974 HydrophobicContact CE2-CZ 4.32Å; F1915-F1974 AromaticContact CG-CD1 3.9Å; F1915-F1974 HydrophobicContact CG-CD1 3.93Å; F1915-F1974 AromaticContact CG-CE1 3.8Å; F1915-F1974 HydrophobicContact CG-CE1 3.93Å; F1915-F1974 HydrophobicContact CG-CG 4.45Å; F1915-F1974 HydrophobicContact CG-CZ 4.31Å; F1915-F1974 HydrophobicContact CZ-CD1 4.16Å; F1915-F1974 AromaticContact CZ-CE1 3.33Å; F1915-F1974 HydrophobicContact CZ-CE1 3.33Å; F1915-F1974 AromaticContact CZ-CZ 3.55Å; F1915-F1974 HydrophobicContact CZ-CZ 3.55Å; L1970-F1974 WeakPolarHBondContact O-CD2 3.32Å; L1970-F1974 WeakPolarHBondContact O-CE2 3.43Å; L1970-F1974 PolarHBondContact O-N 3.11Å; L1971-F1974 PolarHBondContact O-N 3.04Å; L1971-F1974 VanDerWaalsContact O-N 3.09Å; I1972-F1974 PolarHBondContact O-N 3.1Å; F1974-R1976 PolarHBondContact O-N 3.11Å
1975D71.5Confident81.9Confident12.75 Ų12.7538 Ų387%0.06820%0.197CC..  trans-77.652.3177-170.615.5000113.2L1971 I1972 S1978 Q1979 Q1980 L1981L1971-D1975 PolarHBondContact O-N 3.09Å; L1971-D1975 VanDerWaalsContact O-N 3.17Å; I1972-D1975 PolarHBondContact O-N 3.13Å; D1975-S1978 VanDerWaalsContact CG-OG 3.26Å; D1975-S1978 WeakPolarHBondContact OD1-CA 3.23Å; D1975-S1978 VanDerWaalsContact OD1-CB 3.23Å; D1975-S1978 WeakPolarHBondContact OD1-CB 3.22Å; D1975-S1978 PolarHBondContact OD1-N 3.25Å; D1975-S1978 PolarHBondContact OD1-OG 3.21Å; D1975-S1978 PolarHBondContact OD2-OG 3.3Å; D1975-Q1979 PolarHBondContact OD1-N 3.18Å; D1975-Q1979 WeakPolarHBondContact OD2-CA 3.32Å; D1975-Q1979 PolarHBondContact OD2-N 3.25Å; D1975-Q1980 PolarHBondContact OD2-N 3.24Å; D1975-Q1980 VanDerWaalsContact OD2-N 3.09Å; D1975-L1981 HydrophobicContact CB-CB 4.43Å; D1975-L1981 VanDerWaalsContact OD2-CB 3.32Å; D1975-L1981 WeakPolarHBondContact OD2-CB 3.37Å; D1975-L1981 PolarHBondContact OD2-N 3.23Å
1976R65Low81.7Confident163.5 Ų163.539.9 Ų39.962%0.61721%0.208SC*.THydrogen-bonded Turntrans-69.4-37.6-177.3-61.5-173.3-179.1-169.4-3.7113S1973 F1974 Q1979 Y2069S1973-R1976 WeakPolarHBondContact O-CG 3.37Å; S1973-R1976 PolarHBondContact O-NE 2.99Å; F1974-R1976 PolarHBondContact O-N 3.11Å; R1976-Q1979 PolarHBondContact O-NE2 2.99Å; R1976-Y2069 HydrophobicContact CB-CE1 4.24Å; R1976-Y2069 HydrophobicContact CG-CE1 4.09Å
1977C55.7Low81.6Confident129 Ų12944.1 Ų44.187%0.87223%0.227SC*.THydrogen-bonded Turntrans-97.3-39.3-168.9-63.20000113.3
1978S61.2Low81.3Confident54.75 Ų54.7549 Ų4938%0.38325%0.25SC..THydrogen-bonded Turntrans-81.9-35.8-176.478.20000111.4D1975 Q1980D1975-S1978 VanDerWaalsContact CG-OG 3.26Å; D1975-S1978 WeakPolarHBondContact OD1-CA 3.23Å; D1975-S1978 VanDerWaalsContact OD1-CB 3.23Å; D1975-S1978 WeakPolarHBondContact OD1-CB 3.22Å; D1975-S1978 PolarHBondContact OD1-N 3.25Å; D1975-S1978 PolarHBondContact OD1-OG 3.21Å; D1975-S1978 PolarHBondContact OD2-OG 3.3Å; S1978-Q1980 PolarHBondContact O-N 3.26Å; S1978-Q1980 WeakPolarHBondContact OG-CB 3.31Å; S1978-Q1980 WeakPolarHBondContact OG-CG 3.4Å; S1978-Q1980 PolarHBondContact OG-N 3.27Å
1979Q73Confident81.3Confident30.5 Ų30.550.3 Ų50.314%0.14326%0.264CS..  trans5117.4-175.8-59.917630.100112.5D1975 R1976 L1981 I1982 T1983 I2071D1975-Q1979 PolarHBondContact OD1-N 3.18Å; D1975-Q1979 WeakPolarHBondContact OD2-CA 3.32Å; D1975-Q1979 PolarHBondContact OD2-N 3.25Å; R1976-Q1979 PolarHBondContact O-NE2 2.99Å; Q1979-L1981 VanDerWaalsContact C-N 3.32Å; Q1979-L1981 PolarHBondContact O-N 2.88Å; Q1979-I1982 PolarHBondContact O-N 3.02Å; Q1979-T1983 WeakPolarHBondContact O-CG2 3Å; Q1979-T1983 PolarHBondContact O-N 3.14Å; Q1979-T1983 PolarHBondContact O-OG1 3.48Å; Q1979-I2071 HydrophobicContact CB-CD1 4.21Å
1980Q78.3Confident81.2Confident108.25 Ų108.2548.9 Ų48.951%0.50626%0.258SS..Hα-helixtrans-69.5-36.5-176.6-72.2177.3-0.300109.7D1975 S1978 I1982 T1983 Y1984D1975-Q1980 PolarHBondContact OD2-N 3.24Å; D1975-Q1980 VanDerWaalsContact OD2-N 3.09Å; S1978-Q1980 PolarHBondContact O-N 3.26Å; S1978-Q1980 WeakPolarHBondContact OG-CB 3.31Å; S1978-Q1980 WeakPolarHBondContact OG-CG 3.4Å; S1978-Q1980 PolarHBondContact OG-N 3.27Å; Q1980-I1982 VanDerWaalsContact C-N 3.32Å; Q1980-I1982 PolarHBondContact O-N 3.4Å; Q1980-T1983 WeakPolarHBondContact CA-OG1 3.38Å; Q1980-T1983 PolarHBondContact O-N 3.25Å; Q1980-T1983 PolarHBondContact O-OG1 3.26Å; Q1980-Y1984 VanDerWaalsContact O-CB 3.28Å; Q1980-Y1984 WeakPolarHBondContact O-CB 3.37Å; Q1980-Y1984 PolarHBondContact O-N 3.15Å
1981L83.9Confident81.3Confident13 Ų1348.4 Ų48.47%0.06826%0.255CS..Hα-helixtrans-64.2-42.9178.7-175.260.9000111.3H1946 L1968 L1971 I1972 D1975 Q1979 Y1984 L1985H1946-L1981 VanDerWaalsContact CE1-CD1 3.47Å; H1946-L1981 WeakPolarHBondContact CE1-CD1 3.41Å; H1946-L1981 WeakPolarHBondContact ND1-CD1 3.3Å; L1968-L1981 HydrophobicContact CD1-CD1 4.49Å; L1968-L1981 HydrophobicContact CD1-CD2 4.14Å; L1968-L1981 HydrophobicContact CD1-CG 4.48Å; L1971-L1981 HydrophobicContact CB-CD2 3.96Å; I1972-L1981 HydrophobicContact CG1-CD2 3.8Å; I1972-L1981 HydrophobicContact CG1-CG 4.37Å; D1975-L1981 HydrophobicContact CB-CB 4.43Å; D1975-L1981 VanDerWaalsContact OD2-CB 3.32Å; D1975-L1981 WeakPolarHBondContact OD2-CB 3.37Å; D1975-L1981 PolarHBondContact OD2-N 3.23Å; Q1979-L1981 VanDerWaalsContact C-N 3.32Å; Q1979-L1981 PolarHBondContact O-N 2.88Å; L1981-Y1984 PolarHBondContact O-N 3.19Å; L1981-L1985 HydrophobicContact CG-CD1 4.42Å; L1981-L1985 VanDerWaalsContact O-CG 3.23Å; L1981-L1985 WeakPolarHBondContact O-CG 3.36Å; L1981-L1985 PolarHBondContact O-N 3.16Å
1982I86.9Confident81.4Confident0.25 Ų0.2550.7 Ų50.70%0.00127%0.266CS..Hα-helixtrans-62.5-46.8177.4-61.8176.1000110.3I1972 Q1979 Q1980 Y1984 L1985 D1986 I2066 Y2069 I2075I1972-I1982 HydrophobicContact CG2-CD1 4.1Å; I1972-I1982 HydrophobicContact CG2-CG1 4.13Å; Q1979-I1982 PolarHBondContact O-N 3.02Å; Q1980-I1982 VanDerWaalsContact C-N 3.32Å; Q1980-I1982 PolarHBondContact O-N 3.4Å; I1982-Y1984 VanDerWaalsContact C-N 3.3Å; I1982-Y1984 PolarHBondContact O-N 3.09Å; I1982-L1985 PolarHBondContact O-N 3.1Å; I1982-D1986 PolarHBondContact O-N 3.15Å; I1982-D1986 VanDerWaalsContact O-N 3.07Å; I1982-I2066 HydrophobicContact CG2-CG2 4.06Å; I1982-Y2069 HydrophobicContact CD1-CD2 3.68Å; I1982-Y2069 HydrophobicContact CD1-CE2 4.42Å; I1982-Y2069 HydrophobicContact CD1-CG 4.07Å; I1982-I2075 HydrophobicContact CG2-CD1 3.87Å
1983T86.3Confident81.7Confident53.25 Ų53.2553.3 Ų53.333%0.32728%0.278SS..Hα-helixtrans-65.4-34177.457.20000112.6Q1979 Q1980 D1986 N1987 I2071Q1979-T1983 WeakPolarHBondContact O-CG2 3Å; Q1979-T1983 PolarHBondContact O-N 3.14Å; Q1979-T1983 PolarHBondContact O-OG1 3.48Å; Q1980-T1983 WeakPolarHBondContact CA-OG1 3.38Å; Q1980-T1983 PolarHBondContact O-N 3.25Å; Q1980-T1983 PolarHBondContact O-OG1 3.26Å; T1983-D1986 WeakPolarHBondContact O-CB 3.41Å; T1983-D1986 PolarHBondContact O-N 3.27Å; T1983-N1987 WeakPolarHBondContact O-CB 3.42Å; T1983-N1987 PolarHBondContact O-N 3.14Å; T1983-N1987 PolarHBondContact O-ND2 3.29Å; T1983-N1987 VanDerWaalsContact O-ND2 3.13Å; T1983-I2071 HydrophobicContact CG2-CG2 4.17Å
1984Y86.5Confident82.2Confident66 Ų6653 Ų5326%0.25928%0.276SS..Hα-helixtrans-66.5-44.5175.3179-102.9000111.6H1946 I1950 Q1980 L1981 I1982 D1986 N1987 Q1988H1946-Y1984 HydrophobicContact CB-CD1 4.41Å; H1946-Y1984 HydrophobicContact CB-CE1 3.94Å; I1950-Y1984 HydrophobicContact CD1-CD1 4.04Å; I1950-Y1984 HydrophobicContact CD1-CE1 3.49Å; I1950-Y1984 VanDerWaalsContact CD1-CE1 3.47Å; Q1980-Y1984 VanDerWaalsContact O-CB 3.28Å; Q1980-Y1984 WeakPolarHBondContact O-CB 3.37Å; Q1980-Y1984 PolarHBondContact O-N 3.15Å; L1981-Y1984 PolarHBondContact O-N 3.19Å; I1982-Y1984 VanDerWaalsContact C-N 3.3Å; I1982-Y1984 PolarHBondContact O-N 3.09Å; Y1984-D1986 VanDerWaalsContact C-N 3.28Å; Y1984-D1986 PolarHBondContact O-N 3.21Å; Y1984-N1987 PolarHBondContact O-N 3.21Å; Y1984-Q1988 HydrophobicContact CD1-CG 4.36Å; Y1984-Q1988 HydrophobicContact CD2-CG 4.37Å; Y1984-Q1988 HydrophobicContact CE1-CG 3.99Å; Y1984-Q1988 HydrophobicContact CE2-CG 4.05Å; Y1984-Q1988 WeakPolarHBondContact O-CB 3.18Å; Y1984-Q1988 VanDerWaalsContact O-CG 3.27Å; Y1984-Q1988 WeakPolarHBondContact O-CG 3.3Å; Y1984-Q1988 PolarHBondContact O-N 3.05Å
1985L88.9Confident82.9Confident2.75 Ų2.7550.8 Ų50.81%0.01427%0.266CS..Hα-helixtrans-59.6-39.8174.9-70.7170.4000112.1I1950 L1968 I1972 L1981 I1982 Q1988 G1989 T1990 I1991I1950-L1985 HydrophobicContact CD1-CD2 3.99Å; I1950-L1985 HydrophobicContact CG1-CD2 3.94Å; L1968-L1985 HydrophobicContact CD1-CD1 4.12Å; L1968-L1985 HydrophobicContact CD1-CD2 4.26Å; L1968-L1985 HydrophobicContact CD2-CD1 3.98Å; L1968-L1985 HydrophobicContact CD2-CD2 3.95Å; L1968-L1985 HydrophobicContact CG-CD1 4.34Å; I1972-L1985 HydrophobicContact CD1-CD1 3.93Å; I1972-L1985 HydrophobicContact CG1-CD1 4.49Å; L1981-L1985 HydrophobicContact CG-CD1 4.42Å; L1981-L1985 VanDerWaalsContact O-CG 3.23Å; L1981-L1985 WeakPolarHBondContact O-CG 3.36Å; L1981-L1985 PolarHBondContact O-N 3.16Å; I1982-L1985 PolarHBondContact O-N 3.1Å; L1985-Q1988 PolarHBondContact O-N 3.3Å; L1985-G1989 PolarHBondContact O-N 2.95Å; L1985-T1990 VanDerWaalsContact C-OG1 3.3Å; L1985-T1990 WeakPolarHBondContact CA-OG1 3.43Å; L1985-T1990 VanDerWaalsContact CB-OG1 3.31Å; L1985-T1990 WeakPolarHBondContact CB-OG1 3.34Å; L1985-T1990 HydrophobicContact CD2-CG2 4.35Å; L1985-T1990 WeakPolarHBondContact CD2-OG1 3.26Å; L1985-T1990 PolarHBondContact O-N 3.19Å; L1985-T1990 PolarHBondContact O-OG1 3.15Å; L1985-I1991 HydrophobicContact CB-CD1 4.27Å; L1985-I1991 HydrophobicContact CB-CG1 4.17Å
1986D90.1Very high83.7Confident43.5 Ų43.553.4 Ų53.423%0.23328%0.28CS..Hα-helixtrans-64-50.2175.9-164.942.7000111.7I1982 T1983 Y1984 Q1988 G1989 I1991 I2075 H2079I1982-D1986 PolarHBondContact O-N 3.15Å; I1982-D1986 VanDerWaalsContact O-N 3.07Å; T1983-D1986 WeakPolarHBondContact O-CB 3.41Å; T1983-D1986 PolarHBondContact O-N 3.27Å; Y1984-D1986 VanDerWaalsContact C-N 3.28Å; Y1984-D1986 PolarHBondContact O-N 3.21Å; D1986-Q1988 PolarHBondContact O-N 3.03Å; D1986-G1989 PolarHBondContact O-N 3.15Å; D1986-I1991 HydrophobicContact CB-CD1 4.06Å; D1986-I2075 HydrophobicContact CB-CD1 4.1Å; D1986-I2075 HydrophobicContact CB-CG2 4.17Å; D1986-I2075 VanDerWaalsContact CG-CG2 3.46Å; D1986-I2075 VanDerWaalsContact OD1-CG2 3.24Å; D1986-I2075 WeakPolarHBondContact OD1-CG2 3.19Å; D1986-H2079 IonicContact OD1-CE1 3.01Å; D1986-H2079 PolarHBondContact OD1-CE1 3.18Å; D1986-H2079 IonicContact OD1-ND1 3.77Å; D1986-H2079 IonicContact OD1-NE2 3.5Å; D1986-H2079 PolarHBondContact OD1-NE2 2.91Å
1987N89.3Confident84.9Confident131.75 Ų131.7546.6 Ų46.671%0.70526%0.256SS*.Hα-helixtrans-61.7-30.2178.7-70.2-26.6000113.2T1983 Y1984 G1989T1983-N1987 WeakPolarHBondContact O-CB 3.42Å; T1983-N1987 PolarHBondContact O-N 3.14Å; T1983-N1987 PolarHBondContact O-ND2 3.29Å; T1983-N1987 VanDerWaalsContact O-ND2 3.13Å; Y1984-N1987 PolarHBondContact O-N 3.21Å; N1987-G1989 VanDerWaalsContact C-N 3.28Å
1988Q88.4Confident86.6Confident103 Ų10340.7 Ų40.748%0.48122%0.216SC..THydrogen-bonded Turntrans-82.3-2.7175.3-66.4-64.6-26.900113.1I1950 Y1984 L1985 D1986 T1990I1950-Q1988 HydrophobicContact CD1-CB 4.04Å; I1950-Q1988 HydrophobicContact CD1-CG 3.94Å; Y1984-Q1988 HydrophobicContact CD1-CG 4.36Å; Y1984-Q1988 HydrophobicContact CD2-CG 4.37Å; Y1984-Q1988 HydrophobicContact CE1-CG 3.99Å; Y1984-Q1988 HydrophobicContact CE2-CG 4.05Å; Y1984-Q1988 WeakPolarHBondContact O-CB 3.18Å; Y1984-Q1988 VanDerWaalsContact O-CG 3.27Å; Y1984-Q1988 WeakPolarHBondContact O-CG 3.3Å; Y1984-Q1988 PolarHBondContact O-N 3.05Å; L1985-Q1988 PolarHBondContact O-N 3.3Å; D1986-Q1988 PolarHBondContact O-N 3.03Å; Q1988-T1990 VanDerWaalsContact C-N 3.25Å; Q1988-T1990 HydrophobicContact CB-CG2 3.85Å; Q1988-T1990 PolarHBondContact O-N 3.41Å
1989G90.8Very high87.8Confident32.25 Ų32.2540.3 Ų40.333%0.33221%0.209SC..THydrogen-bonded Turntrans72.612.4-179.600000114.5L1985 D1986 N1987 I1991 Q1992 H1993L1985-G1989 PolarHBondContact O-N 2.95Å; D1986-G1989 PolarHBondContact O-N 3.15Å; N1987-G1989 VanDerWaalsContact C-N 3.28Å; G1989-I1991 VanDerWaalsContact C-N 3.34Å; G1989-I1991 PolarHBondContact O-N 3.48Å; G1989-Q1992 PolarHBondContact O-N 3.18Å; G1989-H1993 PolarHBondContact O-N 3.09Å; G1989-H1993 VanDerWaalsContact O-N 3.08Å
1990T89.9Confident88.4Confident2.25 Ų2.2544.6 Ų44.61%0.01423%0.229CC..Hα-helixtrans-70.2-36.8-174.546.70000112.2I1950 I1954 L1985 Q1988 Q1992 H1993 I1994I1950-T1990 HydrophobicContact CB-CG2 4.06Å; I1950-T1990 HydrophobicContact CD1-CG2 3.85Å; I1950-T1990 HydrophobicContact CG1-CG2 3.92Å; I1950-T1990 HydrophobicContact CG2-CG2 3.52Å; I1950-T1990 VanDerWaalsContact CG2-OG1 3.3Å; I1950-T1990 WeakPolarHBondContact CG2-OG1 2.96Å; I1954-T1990 HydrophobicContact CD1-CG2 4.37Å; L1985-T1990 VanDerWaalsContact C-OG1 3.3Å; L1985-T1990 WeakPolarHBondContact CA-OG1 3.43Å; L1985-T1990 VanDerWaalsContact CB-OG1 3.31Å; L1985-T1990 WeakPolarHBondContact CB-OG1 3.34Å; L1985-T1990 HydrophobicContact CD2-CG2 4.35Å; L1985-T1990 WeakPolarHBondContact CD2-OG1 3.26Å; L1985-T1990 PolarHBondContact O-N 3.19Å; L1985-T1990 PolarHBondContact O-OG1 3.15Å; Q1988-T1990 VanDerWaalsContact C-N 3.25Å; Q1988-T1990 HydrophobicContact CB-CG2 3.85Å; Q1988-T1990 PolarHBondContact O-N 3.41Å; T1990-Q1992 VanDerWaalsContact C-N 3.34Å; T1990-H1993 PolarHBondContact O-N 2.99Å; T1990-I1994 HydrophobicContact CG2-CD1 4.26Å; T1990-I1994 VanDerWaalsContact O-CG1 3.31Å; T1990-I1994 WeakPolarHBondContact O-CG1 3.32Å; T1990-I1994 PolarHBondContact O-N 3.22Å
1991I91.2Very high88.8Confident0.75 Ų0.7540.1 Ų40.10%0.00421%0.209CC..Hα-helixtrans-63.4-47.4177.4-62176000109.2L1985 D1986 G1989 H1993 I1994 L1995 L2063 I2066 I2075 L2076L1985-I1991 HydrophobicContact CB-CD1 4.27Å; L1985-I1991 HydrophobicContact CB-CG1 4.17Å; D1986-I1991 HydrophobicContact CB-CD1 4.06Å; G1989-I1991 VanDerWaalsContact C-N 3.34Å; G1989-I1991 PolarHBondContact O-N 3.48Å; I1991-H1993 VanDerWaalsContact C-N 3.34Å; I1991-H1993 PolarHBondContact O-N 2.97Å; I1991-I1994 PolarHBondContact O-N 3.31Å; I1991-L1995 HydrophobicContact CG2-CD1 4.24Å; I1991-L1995 VanDerWaalsContact O-CG 3.25Å; I1991-L1995 WeakPolarHBondContact O-CG 3.4Å; I1991-L1995 PolarHBondContact O-N 3.07Å; I1991-L2063 HydrophobicContact CG2-CD2 4.5Å; I1991-I2066 HydrophobicContact CD1-CD1 4.33Å; I1991-I2066 HydrophobicContact CG1-CD1 4.28Å; I1991-I2075 HydrophobicContact CD1-CG2 3.83Å; I1991-L2076 HydrophobicContact CG2-CD2 3.75Å
1992Q90.7Very high89Confident56 Ų5639.5 Ų39.526%0.26221%0.206SC..Hα-helixtrans-57.6-45.4175.4177.859.429.700111.9G1989 T1990 I1994 L1995 D1996 H2079 R2084G1989-Q1992 PolarHBondContact O-N 3.18Å; T1990-Q1992 VanDerWaalsContact C-N 3.34Å; Q1992-I1994 PolarHBondContact O-N 3.21Å; Q1992-L1995 WeakPolarHBondContact O-CB 3.3Å; Q1992-L1995 PolarHBondContact O-N 3.01Å; Q1992-L1995 VanDerWaalsContact O-N 3.13Å; Q1992-D1996 VanDerWaalsContact NE2-CG 3.27Å; Q1992-D1996 PolarHBondContact NE2-OD1 3.14Å; Q1992-D1996 VanDerWaalsContact NE2-OD1 3.09Å; Q1992-D1996 PolarHBondContact NE2-OD2 3.23Å; Q1992-D1996 VanDerWaalsContact O-CG 3.26Å; Q1992-D1996 PolarHBondContact O-N 3.42Å; Q1992-H2079 PolarHBondContact OE1-CD2 3.28Å; Q1992-H2079 VanDerWaalsContact OE1-CD2 3.29Å; Q1992-R2084 VanDerWaalsContact CD-NH2 3.29Å
1993H91.5Very high88.9Confident55 Ų5544.5 Ų44.526%0.25523%0.229SC..Hα-helixtrans-61-43.1176.2179.1-85.3000113.1I1954 G1989 T1990 I1991 L1995 D1996 T1997I1954-H1993 HydrophobicContact CG1-CB 4.47Å; G1989-H1993 PolarHBondContact O-N 3.09Å; G1989-H1993 VanDerWaalsContact O-N 3.08Å; T1990-H1993 PolarHBondContact O-N 2.99Å; I1991-H1993 VanDerWaalsContact C-N 3.34Å; I1991-H1993 PolarHBondContact O-N 2.97Å; H1993-L1995 VanDerWaalsContact C-N 3.28Å; H1993-L1995 PolarHBondContact O-N 3.25Å; H1993-D1996 PolarHBondContact O-N 3.15Å; H1993-T1997 WeakPolarHBondContact O-CG2 3.35Å; H1993-T1997 PolarHBondContact O-N 3.27Å; H1993-T1997 VanDerWaalsContact O-N 3.11Å; H1993-T1997 PolarHBondContact O-OG1 2.99Å
1994I91.4Very high88.9Confident4 Ų444.3 Ų44.32%0.02123%0.228CC..Hα-helixtrans-59.4-43.4175.4-71.1167.7000110I1953 T1990 I1991 Q1992 T1997 I1998 K2059 L2063I1953-I1994 HydrophobicContact CG2-CD1 4.33Å; I1953-I1994 HydrophobicContact CG2-CG1 4.24Å; T1990-I1994 HydrophobicContact CG2-CD1 4.26Å; T1990-I1994 VanDerWaalsContact O-CG1 3.31Å; T1990-I1994 WeakPolarHBondContact O-CG1 3.32Å; T1990-I1994 PolarHBondContact O-N 3.22Å; I1991-I1994 PolarHBondContact O-N 3.31Å; Q1992-I1994 PolarHBondContact O-N 3.21Å; I1994-T1997 PolarHBondContact O-N 2.88Å; I1994-T1997 PolarHBondContact O-OG1 3.1Å; I1994-I1998 HydrophobicContact CG2-CD1 4.06Å; I1994-I1998 WeakPolarHBondContact O-CD1 3.02Å; I1994-I1998 VanDerWaalsContact O-CG1 3.29Å; I1994-I1998 WeakPolarHBondContact O-CG1 3.26Å; I1994-I1998 PolarHBondContact O-N 3.08Å; I1994-I1998 VanDerWaalsContact O-N 3.13Å; I1994-K2059 HydrophobicContact CG2-CB 3.91Å; I1994-K2059 HydrophobicContact CG2-CD 4.25Å; I1994-K2059 HydrophobicContact CG2-CG 3.94Å; I1994-L2063 HydrophobicContact CG2-CD1 4.15Å; I1994-L2063 HydrophobicContact CG2-CD2 4.31Å; I1994-L2063 HydrophobicContact CG2-CG 4.26Å
1995L89.9Confident88.6Confident4.5 Ų4.541.2 Ų41.22%0.02422%0.216CC..Hα-helixtrans-64.8-40.2178.7-67.3173.2000113.2I1991 Q1992 H1993 T1997 I1998 L2063 H2079 I2081 R2084I1991-L1995 HydrophobicContact CG2-CD1 4.24Å; I1991-L1995 VanDerWaalsContact O-CG 3.25Å; I1991-L1995 WeakPolarHBondContact O-CG 3.4Å; I1991-L1995 PolarHBondContact O-N 3.07Å; Q1992-L1995 WeakPolarHBondContact O-CB 3.3Å; Q1992-L1995 PolarHBondContact O-N 3.01Å; Q1992-L1995 VanDerWaalsContact O-N 3.13Å; H1993-L1995 VanDerWaalsContact C-N 3.28Å; H1993-L1995 PolarHBondContact O-N 3.25Å; L1995-T1997 VanDerWaalsContact C-N 3.35Å; L1995-T1997 PolarHBondContact O-N 3.1Å; L1995-I1998 PolarHBondContact O-N 2.86Å; L1995-L2063 HydrophobicContact CD2-CD1 4.07Å; L1995-L2063 HydrophobicContact CD2-CD2 4.09Å; L1995-H2079 HydrophobicContact CD1-CB 3.46Å; L1995-H2079 VanDerWaalsContact CD1-CB 3.46Å; L1995-I2081 HydrophobicContact CD2-CB 3.9Å; L1995-I2081 HydrophobicContact CD2-CD1 3.42Å; L1995-I2081 VanDerWaalsContact CD2-CD1 3.49Å; L1995-I2081 HydrophobicContact CD2-CG1 3.51Å; L1995-I2081 VanDerWaalsContact CD2-CG1 3.49Å; L1995-R2084 VanDerWaalsContact CB-NH1 3.3Å
1996D89.1Confident88.2Confident67.25 Ų67.2541.2 Ų41.236%0.3622%0.216SC..Hα-helixtrans-66.6-41.2-179.8-68.6-27.6000111.2Q1992 H1993 I1998 I1999 R2084Q1992-D1996 VanDerWaalsContact NE2-CG 3.27Å; Q1992-D1996 PolarHBondContact NE2-OD1 3.14Å; Q1992-D1996 VanDerWaalsContact NE2-OD1 3.09Å; Q1992-D1996 PolarHBondContact NE2-OD2 3.23Å; Q1992-D1996 VanDerWaalsContact O-CG 3.26Å; Q1992-D1996 PolarHBondContact O-N 3.42Å; H1993-D1996 PolarHBondContact O-N 3.15Å; D1996-I1998 PolarHBondContact O-N 3.3Å; D1996-I1999 PolarHBondContact O-N 3.11Å; D1996-R2084 IonicContact OD1-CZ 3.28Å; D1996-R2084 IonicContact OD1-NH1 3.09Å; D1996-R2084 PolarHBondContact OD1-NH1 2.89Å; D1996-R2084 IonicContact OD1-NH2 2.76Å
1997T90.5Very high87.7Confident19.75 Ų19.7545.9 Ų45.912%0.12124%0.235CC..Hα-helixtrans-79.4-15.9-177.657.50000114.5H1993 I1994 L1995 I1999 E2000 D2001 K2059H1993-T1997 WeakPolarHBondContact O-CG2 3.35Å; H1993-T1997 PolarHBondContact O-N 3.27Å; H1993-T1997 VanDerWaalsContact O-N 3.11Å; H1993-T1997 PolarHBondContact O-OG1 2.99Å; I1994-T1997 PolarHBondContact O-N 2.88Å; I1994-T1997 PolarHBondContact O-OG1 3.1Å; L1995-T1997 VanDerWaalsContact C-N 3.35Å; L1995-T1997 PolarHBondContact O-N 3.1Å; T1997-I1999 VanDerWaalsContact C-N 3.27Å; T1997-I1999 PolarHBondContact O-N 3.1Å; T1997-E2000 PolarHBondContact O-N 2.95Å; T1997-D2001 PolarHBondContact O-N 3.11Å; T1997-D2001 VanDerWaalsContact O-N 3.11Å; T1997-K2059 VanDerWaalsContact CB-NZ 3.26Å; T1997-K2059 PolarHBondContact O-NZ 2.98Å; T1997-K2059 PolarHBondContact OG1-NZ 3.19Å
1998I89.8Confident87Confident5 Ų542.8 Ų42.83%0.02622%0.215CC..Hα-helixtrans-61.9-37.6174.5-79.4165.9000111.5I1994 L1995 D1996 E2000 D2001 L2002 Y2056 K2059 M2060 L2063 L2085I1994-I1998 HydrophobicContact CG2-CD1 4.06Å; I1994-I1998 WeakPolarHBondContact O-CD1 3.02Å; I1994-I1998 VanDerWaalsContact O-CG1 3.29Å; I1994-I1998 WeakPolarHBondContact O-CG1 3.26Å; I1994-I1998 PolarHBondContact O-N 3.08Å; I1994-I1998 VanDerWaalsContact O-N 3.13Å; L1995-I1998 PolarHBondContact O-N 2.86Å; D1996-I1998 PolarHBondContact O-N 3.3Å; I1998-E2000 VanDerWaalsContact C-N 3.3Å; I1998-E2000 PolarHBondContact O-N 2.92Å; I1998-D2001 PolarHBondContact O-N 3.03Å; I1998-L2002 HydrophobicContact CG2-CD1 3.9Å; I1998-L2002 HydrophobicContact CG2-CG 4.36Å; I1998-L2002 WeakPolarHBondContact O-CB 3.3Å; I1998-L2002 WeakPolarHBondContact O-CG 3.38Å; I1998-L2002 PolarHBondContact O-N 3.32Å; I1998-Y2056 HydrophobicContact CG2-CD2 4.19Å; I1998-Y2056 HydrophobicContact CG2-CE2 4.19Å; I1998-K2059 HydrophobicContact CD1-CB 3.94Å; I1998-K2059 HydrophobicContact CD1-CD 4.48Å; I1998-K2059 HydrophobicContact CG1-CB 3.83Å; I1998-K2059 HydrophobicContact CG1-CD 3.63Å; I1998-K2059 HydrophobicContact CG1-CG 4.35Å; I1998-M2060 HydrophobicContact CD1-SD 4.29Å; I1998-L2063 HydrophobicContact CD1-CD1 3.22Å; I1998-L2063 HydrophobicContact CD1-CG 4.5Å; I1998-L2085 HydrophobicContact CG2-CD2 4.26Å
1999I87Confident86Confident47.5 Ų47.538.8 Ų38.824%0.24420%0.197CC..Hα-helixtrans-65.9-39.8-179.4-60.7172000109.7D1996 T1997 L2002 Q2003 R2084D1996-I1999 PolarHBondContact O-N 3.11Å; T1997-I1999 VanDerWaalsContact C-N 3.27Å; T1997-I1999 PolarHBondContact O-N 3.1Å; I1999-L2002 PolarHBondContact O-N 3.02Å; I1999-Q2003 VanDerWaalsContact O-CG 3.27Å; I1999-Q2003 WeakPolarHBondContact O-CG 3.35Å; I1999-Q2003 PolarHBondContact O-N 3.37Å; I1999-R2084 HydrophobicContact CD1-CB 4.26Å; I1999-R2084 HydrophobicContact CD1-CG 4.48Å
2000E85.9Confident85Confident120.25 Ų120.2539.5 Ų39.556%0.56220%0.195SC*.Hα-helixtrans-63-46.9176.3-60.4179.8168.800111.4T1997 I1998 L2002 Q2003 V2004T1997-E2000 PolarHBondContact O-N 2.95Å; I1998-E2000 VanDerWaalsContact C-N 3.3Å; I1998-E2000 PolarHBondContact O-N 2.92Å; E2000-L2002 VanDerWaalsContact C-N 3.34Å; E2000-L2002 PolarHBondContact O-N 3.15Å; E2000-Q2003 WeakPolarHBondContact O-CB 3.38Å; E2000-Q2003 PolarHBondContact O-N 3.28Å; E2000-V2004 WeakPolarHBondContact O-CG2 3.39Å; E2000-V2004 PolarHBondContact O-N 3.15Å; E2000-V2004 VanDerWaalsContact O-N 3.13Å
2001D87.4Confident83.6Confident13.3333 Ų13.333342 Ų427%0.07121%0.212CC..Hα-helixtrans-59.2-46.4176.5-64.8-23.9000111.2T1997 I1998 Q2003 V2004 I2005 K2059T1997-D2001 PolarHBondContact O-N 3.11Å; T1997-D2001 VanDerWaalsContact O-N 3.11Å; I1998-D2001 PolarHBondContact O-N 3.03Å; D2001-Q2003 VanDerWaalsContact C-N 3.3Å; D2001-Q2003 PolarHBondContact O-N 3.06Å; D2001-V2004 PolarHBondContact O-N 3.07Å; D2001-I2005 WeakPolarHBondContact O-CD1 3.33Å; D2001-I2005 VanDerWaalsContact O-CG1 3.24Å; D2001-I2005 WeakPolarHBondContact O-CG1 3.28Å; D2001-I2005 PolarHBondContact O-N 3.29Å; D2001-K2059 VanDerWaalsContact CG-NZ 3.32Å; D2001-K2059 IonicContact OD1-NZ 3.53Å; D2001-K2059 PolarHBondContact OD1-NZ 3.45Å; D2001-K2059 WeakPolarHBondContact OD2-CD 3.39Å; D2001-K2059 VanDerWaalsContact OD2-CE 3.29Å; D2001-K2059 WeakPolarHBondContact OD2-CE 3.42Å; D2001-K2059 IonicContact OD2-NZ 3.15Å; D2001-K2059 PolarHBondContact OD2-NZ 2.82Å
2002L87.8Confident81.6Confident1.66667 Ų1.6666744.6 Ų44.61%0.00923%0.228CC..Hα-helixtrans-62.4-35.3178.1-77.6174.4000112.4I1998 I1999 E2000 G2006 Y2056 L2085 C2088 L2201I1998-L2002 HydrophobicContact CG2-CD1 3.9Å; I1998-L2002 HydrophobicContact CG2-CG 4.36Å; I1998-L2002 WeakPolarHBondContact O-CB 3.3Å; I1998-L2002 WeakPolarHBondContact O-CG 3.38Å; I1998-L2002 PolarHBondContact O-N 3.32Å; I1999-L2002 PolarHBondContact O-N 3.02Å; E2000-L2002 VanDerWaalsContact C-N 3.34Å; E2000-L2002 PolarHBondContact O-N 3.15Å; L2002-G2006 WeakPolarHBondContact O-CA 3.26Å; L2002-G2006 PolarHBondContact O-N 3.18Å; L2002-Y2056 HydrophobicContact CD1-CD2 4.45Å; L2002-Y2056 HydrophobicContact CD1-CE2 4.02Å; L2002-Y2056 HydrophobicContact CD2-CD2 3.73Å; L2002-Y2056 HydrophobicContact CD2-CE1 4.49Å; L2002-Y2056 HydrophobicContact CD2-CE2 3.54Å; L2002-Y2056 HydrophobicContact CD2-CG 4.34Å; L2002-Y2056 HydrophobicContact CG-CD2 3.84Å; L2002-Y2056 HydrophobicContact CG-CE2 3.82Å; L2002-L2085 HydrophobicContact CD1-CD2 4.23Å; L2002-C2088 HydrophobicContact CD1-CB 4.24Å; L2002-L2201 HydrophobicContact CD2-CD1 4.48Å; L2002-L2201 HydrophobicContact CD2-CD2 3.82Å
2003Q85.4Confident79.2Confident105 Ų10546.5 Ų46.549%0.49124%0.24SC..Hα-helixtrans-66.9-40.3175.3-75.2174.27.600112I1999 E2000 D2001 G2006 K2007I1999-Q2003 VanDerWaalsContact O-CG 3.27Å; I1999-Q2003 WeakPolarHBondContact O-CG 3.35Å; I1999-Q2003 PolarHBondContact O-N 3.37Å; E2000-Q2003 WeakPolarHBondContact O-CB 3.38Å; E2000-Q2003 PolarHBondContact O-N 3.28Å; D2001-Q2003 VanDerWaalsContact C-N 3.3Å; D2001-Q2003 PolarHBondContact O-N 3.06Å; Q2003-G2006 PolarHBondContact O-N 2.62Å; Q2003-K2007 WeakPolarHBondContact O-CB 3.42Å; Q2003-K2007 VanDerWaalsContact O-CG 3.26Å; Q2003-K2007 WeakPolarHBondContact O-CG 3.3Å; Q2003-K2007 PolarHBondContact O-N 3.15Å
2004V84.7Confident76.6Confident49.6667 Ų49.666749.2 Ų49.230%0.30126%0.26SS..Hα-helixtrans-64.5-47.8176.3175.80000110.5E2000 D2001 G2006 K2007 F2008 I2049E2000-V2004 WeakPolarHBondContact O-CG2 3.39Å; E2000-V2004 PolarHBondContact O-N 3.15Å; E2000-V2004 VanDerWaalsContact O-N 3.13Å; D2001-V2004 PolarHBondContact O-N 3.07Å; V2004-G2006 VanDerWaalsContact C-N 3.34Å; V2004-G2006 PolarHBondContact O-N 3.13Å; V2004-K2007 PolarHBondContact O-N 3.27Å; V2004-F2008 PolarHBondContact O-N 3.35Å; V2004-F2008 VanDerWaalsContact O-N 3.13Å; V2004-I2049 HydrophobicContact CG1-CG1 4.38Å
2005I81.2Confident73.8Confident0 Ų055.6 Ų55.60%029%0.291CS..Hα-helixtrans-65.4-40.8178.8-56.3156.3000110.5D2001 K2007 F2008 L2009 Y2053 Y2056 I2196 L2201D2001-I2005 WeakPolarHBondContact O-CD1 3.33Å; D2001-I2005 VanDerWaalsContact O-CG1 3.24Å; D2001-I2005 WeakPolarHBondContact O-CG1 3.28Å; D2001-I2005 PolarHBondContact O-N 3.29Å; I2005-K2007 PolarHBondContact O-N 3.48Å; I2005-F2008 WeakPolarHBondContact O-CB 3.4Å; I2005-F2008 PolarHBondContact O-N 2.9Å; I2005-L2009 HydrophobicContact CG2-CD1 3.98Å; I2005-L2009 HydrophobicContact CG2-CG 4.35Å; I2005-L2009 WeakPolarHBondContact O-CG 3.36Å; I2005-L2009 PolarHBondContact O-N 3.25Å; I2005-Y2053 HydrophobicContact CD1-CD2 4.25Å; I2005-Y2053 HydrophobicContact CG2-CD2 4.47Å; I2005-Y2056 HydrophobicContact CD1-CG 4.31Å; I2005-I2196 HydrophobicContact CG2-CG2 4.01Å; I2005-L2201 HydrophobicContact CD1-CD2 4.03Å; I2005-L2201 HydrophobicContact CG2-CD1 4Å; I2005-L2201 HydrophobicContact CG2-CD2 4.05Å; I2005-L2201 HydrophobicContact CG2-CG 4.45Å
2006G80.2Confident71Confident3 Ų359.1 Ų59.13%0.03131%0.309CS..Hα-helixtrans-62.7-40.5177.500000112.8L2002 Q2003 V2004 F2008 L2009 T2010L2002-G2006 WeakPolarHBondContact O-CA 3.26Å; L2002-G2006 PolarHBondContact O-N 3.18Å; Q2003-G2006 PolarHBondContact O-N 2.62Å; V2004-G2006 VanDerWaalsContact C-N 3.34Å; V2004-G2006 PolarHBondContact O-N 3.13Å; G2006-F2008 VanDerWaalsContact C-N 3.34Å; G2006-F2008 PolarHBondContact O-N 3.46Å; G2006-L2009 PolarHBondContact O-N 3.11Å; G2006-T2010 WeakPolarHBondContact O-CB 3.08Å; G2006-T2010 VanDerWaalsContact O-CG2 3.29Å; G2006-T2010 WeakPolarHBondContact O-CG2 3.31Å; G2006-T2010 PolarHBondContact O-N 3.04Å; G2006-T2010 VanDerWaalsContact O-N 3.15Å; G2006-T2010 PolarHBondContact O-OG1 3.23Å
2007K79Confident68.4Low142.667 Ų142.66760.9 Ų60.962%0.6232%0.324SS*.Hα-helixtrans-60.3-42.9172.8-77172.9-175.9176.50111.6Q2003 V2004 I2005 T2010 S2011Q2003-K2007 WeakPolarHBondContact O-CB 3.42Å; Q2003-K2007 VanDerWaalsContact O-CG 3.26Å; Q2003-K2007 WeakPolarHBondContact O-CG 3.3Å; Q2003-K2007 PolarHBondContact O-N 3.15Å; V2004-K2007 PolarHBondContact O-N 3.27Å; I2005-K2007 PolarHBondContact O-N 3.48Å; K2007-T2010 WeakPolarHBondContact CA-OG1 3.37Å; K2007-T2010 PolarHBondContact O-N 3.14Å; K2007-T2010 PolarHBondContact O-OG1 3.14Å; K2007-T2010 VanDerWaalsContact O-OG1 3.11Å; K2007-S2011 WeakPolarHBondContact O-CA 3.25Å; K2007-S2011 VanDerWaalsContact O-CB 3.3Å; K2007-S2011 WeakPolarHBondContact O-CB 3.23Å; K2007-S2011 PolarHBondContact O-N 3.11Å; K2007-S2011 PolarHBondContact O-OG 3.09Å; K2007-S2011 VanDerWaalsContact O-OG 3.08Å
2008F75Confident65.6Low65 Ų6566.6 Ų66.629%0.28535%0.354SS..Hα-helixtrans-62.6-47.9175.9171.1-108.2000112.1V2004 I2005 G2006 T2010 S2011 V2012 I2049 I2196V2004-F2008 PolarHBondContact O-N 3.35Å; V2004-F2008 VanDerWaalsContact O-N 3.13Å; I2005-F2008 WeakPolarHBondContact O-CB 3.4Å; I2005-F2008 PolarHBondContact O-N 2.9Å; G2006-F2008 VanDerWaalsContact C-N 3.34Å; G2006-F2008 PolarHBondContact O-N 3.46Å; F2008-T2010 VanDerWaalsContact C-N 3.26Å; F2008-T2010 PolarHBondContact O-N 3.2Å; F2008-S2011 PolarHBondContact O-OG 3.12Å; F2008-S2011 VanDerWaalsContact O-OG 3.11Å; F2008-V2012 VanDerWaalsContact O-CG2 3.29Å; F2008-V2012 WeakPolarHBondContact O-CG2 3.25Å; F2008-I2049 HydrophobicContact CB-CD1 3.83Å; F2008-I2049 HydrophobicContact CB-CG1 4.05Å; F2008-I2049 HydrophobicContact CB-CG2 3.9Å; F2008-I2049 HydrophobicContact CD1-CG2 3.86Å; F2008-I2049 HydrophobicContact CD2-CD1 3.4Å; F2008-I2049 VanDerWaalsContact CD2-CD1 3.48Å; F2008-I2049 HydrophobicContact CD2-CG1 4.4Å; F2008-I2049 HydrophobicContact CD2-CG2 4.29Å; F2008-I2049 HydrophobicContact CE1-CG2 4.41Å; F2008-I2049 HydrophobicContact CE2-CD1 4.13Å; F2008-I2049 HydrophobicContact CG-CD1 3.8Å; F2008-I2049 HydrophobicContact CG-CG1 4.34Å; F2008-I2049 HydrophobicContact CG-CG2 3.74Å; F2008-I2196 HydrophobicContact CD1-CG2 4.25Å; F2008-I2196 HydrophobicContact CE1-CB 4.26Å; F2008-I2196 HydrophobicContact CE1-CD1 4.42Å; F2008-I2196 HydrophobicContact CE1-CG2 4.23Å
2009L68.6Low62.7Low19 Ų1974 Ų7410%0.09938%0.382CS..Hα-helixtrans-68.2-20-179.4-66.5173.3000113.2I2005 G2006 I2196 W2198 L2201I2005-L2009 HydrophobicContact CG2-CD1 3.98Å; I2005-L2009 HydrophobicContact CG2-CG 4.35Å; I2005-L2009 WeakPolarHBondContact O-CG 3.36Å; I2005-L2009 PolarHBondContact O-N 3.25Å; G2006-L2009 PolarHBondContact O-N 3.11Å; L2009-I2196 HydrophobicContact CD2-CG2 4.31Å; L2009-I2196 HydrophobicContact CG-CG2 4.44Å; L2009-W2198 HydrophobicContact CB-CH2 3.68Å; L2009-W2198 HydrophobicContact CB-CZ2 3.41Å; L2009-W2198 VanDerWaalsContact CB-CZ2 3.42Å; L2009-W2198 HydrophobicContact CB-CZ3 4.34Å; L2009-W2198 HydrophobicContact CD1-CD2 3.78Å; L2009-W2198 HydrophobicContact CD1-CE3 3.75Å; L2009-W2198 HydrophobicContact CD1-CG 4.45Å; L2009-W2198 HydrophobicContact CD1-CH2 3.92Å; L2009-W2198 HydrophobicContact CD1-CZ2 4.02Å; L2009-W2198 HydrophobicContact CD1-CZ3 3.79Å; L2009-W2198 HydrophobicContact CG-CH2 4.42Å; L2009-W2198 HydrophobicContact CG-CZ2 4.29Å; L2009-L2201 HydrophobicContact CD1-CD1 3.64Å
2010T69.1Low60.2Low47.6667 Ų47.666777.2 Ų77.229%0.29241%0.409SS..Hα-helixtrans-101.7-25179.851.60000114.7G2006 K2007 F2008 V2012 N2013 L2093 W2198G2006-T2010 WeakPolarHBondContact O-CB 3.08Å; G2006-T2010 VanDerWaalsContact O-CG2 3.29Å; G2006-T2010 WeakPolarHBondContact O-CG2 3.31Å; G2006-T2010 PolarHBondContact O-N 3.04Å; G2006-T2010 VanDerWaalsContact O-N 3.15Å; G2006-T2010 PolarHBondContact O-OG1 3.23Å; K2007-T2010 WeakPolarHBondContact CA-OG1 3.37Å; K2007-T2010 PolarHBondContact O-N 3.14Å; K2007-T2010 PolarHBondContact O-OG1 3.14Å; K2007-T2010 VanDerWaalsContact O-OG1 3.11Å; F2008-T2010 VanDerWaalsContact C-N 3.26Å; F2008-T2010 PolarHBondContact O-N 3.2Å; T2010-V2012 PolarHBondContact O-N 3.14Å; T2010-N2013 WeakPolarHBondContact O-CA 2.94Å; T2010-N2013 WeakPolarHBondContact O-CB 3.41Å; T2010-N2013 PolarHBondContact O-N 2.97Å; T2010-L2093 HydrophobicContact CG2-CD1 3.55Å; T2010-L2093 VanDerWaalsContact CG2-CD1 3.43Å; T2010-W2198 HydrophobicContact CG2-CH2 4.3Å; T2010-W2198 HydrophobicContact CG2-CZ2 4.42Å
2011S60.8Low57.7Low54.3333 Ų54.333376.2 Ų76.238%0.3842%0.415SS..G310 helixtrans-61.7-16.8-177.5600000113.6K2007 F2008 N2013 T2014K2007-S2011 WeakPolarHBondContact O-CA 3.25Å; K2007-S2011 VanDerWaalsContact O-CB 3.3Å; K2007-S2011 WeakPolarHBondContact O-CB 3.23Å; K2007-S2011 PolarHBondContact O-N 3.11Å; K2007-S2011 PolarHBondContact O-OG 3.09Å; K2007-S2011 VanDerWaalsContact O-OG 3.08Å; F2008-S2011 PolarHBondContact O-OG 3.12Å; F2008-S2011 VanDerWaalsContact O-OG 3.11Å; S2011-N2013 VanDerWaalsContact C-N 3.27Å; S2011-N2013 PolarHBondContact O-N 3.1Å; S2011-N2013 VanDerWaalsContact O-N 3.16Å; S2011-T2014 PolarHBondContact O-N 2.96Å; S2011-T2014 PolarHBondContact O-OG1 3.42Å
2012V48.7Very low55.1Low55 Ų5580.9 Ų80.933%0.33344%0.444SS..G310 helixtrans-62.3-21.5172.2-1780000112.2F2008 T2010 L2134 L2137 I2138F2008-V2012 VanDerWaalsContact O-CG2 3.29Å; F2008-V2012 WeakPolarHBondContact O-CG2 3.25Å; T2010-V2012 PolarHBondContact O-N 3.14Å; V2012-L2134 HydrophobicContact CB-CD2 4.48Å; V2012-L2134 HydrophobicContact CG1-CD2 3.94Å; V2012-L2134 HydrophobicContact CG1-CG 4.22Å; V2012-L2137 HydrophobicContact CG1-CB 4.13Å; V2012-I2138 HydrophobicContact CB-CD1 4.04Å; V2012-I2138 HydrophobicContact CB-CG1 3.59Å; V2012-I2138 HydrophobicContact CG1-CD1 4.32Å; V2012-I2138 HydrophobicContact CG1-CG1 3.8Å; V2012-I2138 HydrophobicContact CG1-CG2 4.38Å; V2012-I2138 WeakPolarHBondContact CG1-O 2.92Å; V2012-I2138 HydrophobicContact CG2-CB 4.44Å; V2012-I2138 HydrophobicContact CG2-CD1 4.3Å; V2012-I2138 HydrophobicContact CG2-CG1 3.38Å
2013N39.4Very low52.3Low97 Ų9788.3 Ų88.352%0.51948%0.483SS..G310 helixtrans-86.6-21.6-178.4-74-15.6000115.6T2010 S2011 L2134 I2138T2010-N2013 WeakPolarHBondContact O-CA 2.94Å; T2010-N2013 WeakPolarHBondContact O-CB 3.41Å; T2010-N2013 PolarHBondContact O-N 2.97Å; S2011-N2013 VanDerWaalsContact C-N 3.27Å; S2011-N2013 PolarHBondContact O-N 3.1Å; S2011-N2013 VanDerWaalsContact O-N 3.16Å; N2013-L2134 WeakPolarHBondContact OD1-CD2 3.23Å; N2013-I2138 HydrophobicContact CB-CD1 4.22Å; N2013-I2138 HydrophobicContact CB-CG1 4.33Å; N2013-I2138 WeakPolarHBondContact OD1-CG2 3.16Å
2014T37.8Very low49.6Very low111 Ų11190.7 Ų90.768%0.68150%0.499SS*.THydrogen-bonded Turntrans-96.3-12.9-165.546.20000116.3S2011 L2016S2011-T2014 PolarHBondContact O-N 2.96Å; S2011-T2014 PolarHBondContact O-OG1 3.42Å; T2014-L2016 PolarHBondContact O-N 3.48Å
2015E31.8Very low46.9Very low140 Ų14099.4 Ų99.465%0.65453%0.527SS*.  trans-101.446.5-178.9-67.6-170.117300113.5R2141E2015-R2141 VanDerWaalsContact CB-NH1 3.35Å; E2015-R2141 IonicContact OE2-CZ 2.65Å; E2015-R2141 IonicContact OE2-NH1 3.69Å; E2015-R2141 PolarHBondContact OE2-NH1 3.12Å; E2015-R2141 IonicContact OE2-NH2 3.78Å; E2015-R2141 PolarHBondContact OE2-NH2 3.46Å
2016L31.9Very low44.3Very low76.6667 Ų76.6667104.4 Ų104.440%0.40156%0.562SS.*  trans-125.344.3-179.3-82.7165.3000115.5T2014 D2018 Y2019 L2134 L2137T2014-L2016 PolarHBondContact O-N 3.48Å; L2016-D2018 PolarHBondContact O-N 3.4Å; L2016-Y2019 HydrophobicContact CB-CE2 4.35Å; L2016-Y2019 HydrophobicContact CD1-CE2 4Å; L2016-Y2019 HydrophobicContact CD2-CD2 3.77Å; L2016-Y2019 HydrophobicContact CD2-CE2 3.32Å; L2016-Y2019 VanDerWaalsContact CD2-CE2 3.49Å; L2016-Y2019 HydrophobicContact CD2-CG 4.14Å; L2016-Y2019 HydrophobicContact CG-CE2 4.05Å; L2016-L2134 HydrophobicContact CD1-CD1 3.98Å; L2016-L2134 HydrophobicContact CD1-CG 4.17Å; L2016-L2137 HydrophobicContact CD1-CB 4.29Å; L2016-L2137 HydrophobicContact CD1-CD1 4.42Å; L2016-L2137 HydrophobicContact CD2-CD1 4.33Å
2017P33.7Very low41.8Very low106 Ų106111.3 Ų111.369%0.68860%0.598SS**  trans-82.1130.816532.2-26.7000110.3Y2019P2017-Y2019 PolarHBondContact O-N 3.32Å
2018D32.1Very low39.2Very low138.333 Ų138.333114.2 Ų114.274%0.7461%0.606SS**  trans77.949.8167.1-56.1-18.9000117.7L2016 S2020L2016-D2018 PolarHBondContact O-N 3.4Å; D2018-S2020 VanDerWaalsContact C-N 3.29Å; D2018-S2020 PolarHBondContact O-N 2.75Å
2019Y30.2Very low36.9Very low160.667 Ų160.667118.3 Ų118.363%0.6363%0.631SS**G310 helixtrans-650.6175.7-112.9-90.5000117L2016 P2017 S2021 L2137L2016-Y2019 HydrophobicContact CB-CE2 4.35Å; L2016-Y2019 HydrophobicContact CD1-CE2 4Å; L2016-Y2019 HydrophobicContact CD2-CD2 3.77Å; L2016-Y2019 HydrophobicContact CD2-CE2 3.32Å; L2016-Y2019 VanDerWaalsContact CD2-CE2 3.49Å; L2016-Y2019 HydrophobicContact CD2-CG 4.14Å; L2016-Y2019 HydrophobicContact CG-CE2 4.05Å; P2017-Y2019 PolarHBondContact O-N 3.32Å; Y2019-S2021 VanDerWaalsContact C-N 3.29Å; Y2019-S2021 PolarHBondContact O-N 2.97Å; Y2019-L2137 HydrophobicContact CE1-CD1 4.32Å; Y2019-L2137 HydrophobicContact CE2-CD1 4.01Å; Y2019-L2137 WeakPolarHBondContact OH-CD2 3.44Å
2020S33.1Very low35.1Very low115.333 Ų115.333123.2 Ų123.281%0.80766%0.663SS**G310 helixtrans-82.9-11.7-173.961.50000115.3D2018D2018-S2020 VanDerWaalsContact C-N 3.29Å; D2018-S2020 PolarHBondContact O-N 2.75Å
2021S33.9Very low33.1Very low98.3333 Ų98.3333128.9 Ų128.969%0.68869%0.691SS**G310 helixtrans-106.7-7.8-173.468.90000116.6Y2019Y2019-S2021 VanDerWaalsContact C-N 3.29Å; Y2019-S2021 PolarHBondContact O-N 2.97Å
2022V32.8Very low31.4Very low112 Ų112134.7 Ų134.768%0.67971%0.712SS**THydrogen-bonded Turntrans-104.99.7-172.9-171.80000113.1N2024V2022-N2024 VanDerWaalsContact C-N 3.26Å; V2022-N2024 PolarHBondContact O-N 3.01Å
2023L29Very low30.4Very low158.667 Ų158.667137.3 Ų137.383%0.83173%0.733SS**THydrogen-bonded Turntrans-73-1.6177.4-90.9165.1000115
2024N28.7Very low29.8Very low154.667 Ų154.667140.1 Ų140.183%0.82775%0.748SS**THydrogen-bonded Turntrans-117.338.2-175-87.4-15.5000114.7V2022V2022-N2024 VanDerWaalsContact C-N 3.26Å; V2022-N2024 PolarHBondContact O-N 3.01Å
2025R27.8Very low29.4Very low233 Ų233141.8 Ų141.888%0.87975%0.753SS**  trans-139.980.3159.4-83.5-172.7-154.6-161.75.7111N2027R2025-N2027 PolarHBondContact O-N 3.06Å; R2025-N2027 VanDerWaalsContact O-N 3.09Å
2026S26.3Very low29.3Very low105 Ų105142.1 Ų142.173%0.73476%0.759SS**  trans-59.8100150.444.50000108.5
2027N27.1Very low29.3Very low147 Ų147145.1 Ų145.179%0.78678%0.775SS**  trans-168.9102.6149.8-90.9-18.9000108R2025 L2029R2025-N2027 PolarHBondContact O-N 3.06Å; R2025-N2027 VanDerWaalsContact O-N 3.09Å; N2027-L2029 HydrophobicContact CB-CD1 4.49Å; N2027-L2029 PolarHBondContact O-N 3.26Å
2028Y26.1Very low29.2Very low203.333 Ų203.333146.9 Ų146.980%0.79778%0.779SS**  trans-48.7122.7165.9-71.5-93.3000110.8P2030 D2112Y2028-P2030 WeakPolarHBondContact O-CD 3.22Å; Y2028-P2030 VanDerWaalsContact O-N 3.14Å; Y2028-D2112 HydrophobicContact CE1-CB 4.44Å; Y2028-D2112 WeakPolarHBondContact OH-CB 3.31Å; Y2028-D2112 PolarHBondContact OH-OD1 2.96Å; Y2028-D2112 PolarHBondContact OH-OD2 2.97Å
2029L26.2Very low29.2Very low152 Ų152148.7 Ų148.780%0.79678%0.783SS**  trans-105.7123.5161.7-95.3102.9000109.9N2027 L2031N2027-L2029 HydrophobicContact CB-CD1 4.49Å; N2027-L2029 PolarHBondContact O-N 3.26Å; L2029-L2031 PolarHBondContact O-N 2.88Å
2030P31.1Very low29.2Very low121.667 Ų121.667149.1 Ų149.179%0.7980%0.796SS**  trans-73.3125.1-178.13.67000110.1Y2028 E2032Y2028-P2030 WeakPolarHBondContact O-CD 3.22Å; Y2028-P2030 VanDerWaalsContact O-N 3.14Å; P2030-E2032 PolarHBondContact O-N 2.82Å
2031L27.1Very low29Very low166.333 Ų166.333152.3 Ų152.387%0.87179%0.791SS**  trans-74.4104.9165.4-98.381.2000109.4L2029L2029-L2031 PolarHBondContact O-N 2.88Å
2032E24.9Very low29Very low177.333 Ų177.333151.7 Ų151.783%0.82979%0.785SS**  trans-36.2137.9150.1-69.7-174.1155.600113.6P2030 N2034P2030-E2032 PolarHBondContact O-N 2.82Å; E2032-N2034 PolarHBondContact O-N 2.79Å
2033S26.6Very low29.3Very low109.333 Ų109.333153.4 Ų153.477%0.76579%0.79SS**  trans19.795.3165.666.90000114.8
2034N26.4Very low29.8Very low155.333 Ų155.333153.4 Ų153.483%0.83179%0.786SS**  trans-142.5116.4138.5-105.1-28.6000110.8E2032 N2036E2032-N2034 PolarHBondContact O-N 2.79Å; N2034-N2036 PolarHBondContact O-N 3.06Å
2035N30.2Very low30.9Very low146.667 Ų146.667150.7 Ų150.778%0.78477%0.772SS**  trans-41.2117.9165.2-72.2-36.7000110.7
2036N29.7Very low32.5Very low146.333 Ų146.333142.9 Ų142.978%0.78375%0.753SS**  trans-173.5113.3136.1-84.1-26.2000109.9N2034N2034-N2036 PolarHBondContact O-N 3.06Å
2037N32.1Very low34.4Very low140.333 Ų140.333141.8 Ų141.875%0.7575%0.745SS**  trans29.9117.5156-57.9-26.1000116.9
2038N32.5Very low36.6Very low142.333 Ų142.333137 Ų13776%0.76172%0.723SS**  trans97.253.1142.1-67-8.6000118
2039H31.9Very low39.1Very low177 Ų177128.3 Ų128.382%0.81969%0.69SS**  trans-134.897.8148.1-80-54.8000110.3Y2041H2039-Y2041 VanDerWaalsContact C-N 3.31Å; H2039-Y2041 HydrophobicContact CB-CD2 4.47Å; H2039-Y2041 PolarHBondContact O-N 3.08Å; H2039-Y2041 VanDerWaalsContact O-N 3.1Å
2040N29.3Very low41.5Very low168.333 Ų168.333123.3 Ų123.390%0.966%0.663SS**  trans-6690.7167.2-73.9-15.1000108.8
2041Y29.2Very low43.9Very low183.333 Ų183.333118.8 Ų118.872%0.71964%0.635SS**  trans-81.4126158.8-96.3-85.9000108.1H2039 N2043H2039-Y2041 VanDerWaalsContact C-N 3.31Å; H2039-Y2041 HydrophobicContact CB-CD2 4.47Å; H2039-Y2041 PolarHBondContact O-N 3.08Å; H2039-Y2041 VanDerWaalsContact O-N 3.1Å; Y2041-N2043 PolarHBondContact O-N 3.21Å
2042P34.2Very low46.7Very low86.6667 Ų86.6667111.6 Ų111.656%0.56360%0.598SS**  trans-77.4105.1-176.430.8-31000109.5E2044P2042-E2044 PolarHBondContact O-N 3.19Å; P2042-E2044 VanDerWaalsContact O-N 3.14Å
2043N38Very low49.5Very low146 Ų146103.7 Ų103.778%0.78156%0.561SS**THydrogen-bonded Turntrans-71.71.8174.7-74.6-19.3000113.7Y2041 S2046Y2041-N2043 PolarHBondContact O-N 3.21Å; N2043-S2046 PolarHBondContact O-OG 2.87Å
2044E39.8Very low52.2Low159 Ų159100.7 Ų100.774%0.74354%0.536SS*.THydrogen-bonded Turntrans-78.2-26.3-174.3-69.6-166.4157.700114.1P2042 S2046 S2047P2042-E2044 PolarHBondContact O-N 3.19Å; P2042-E2044 VanDerWaalsContact O-N 3.14Å; E2044-S2046 VanDerWaalsContact C-N 3.32Å; E2044-S2046 PolarHBondContact O-N 3.22Å; E2044-S2047 PolarHBondContact O-N 3.31Å; E2044-S2047 PolarHBondContact O-OG 3.1Å
2045D52.8Low55.2Low99 Ų9993.7 Ų93.753%0.52950%0.499SS..Hα-helixtrans-67.2-34.4-170.3-68.5-21.4000113.5S2047 S2048 I2049D2045-S2047 VanDerWaalsContact C-N 3.35Å; D2045-S2047 PolarHBondContact O-N 3.1Å; D2045-S2048 PolarHBondContact O-N 3.34Å; D2045-S2048 PolarHBondContact O-OG 3.02Å; D2045-I2049 VanDerWaalsContact O-CD1 3.23Å; D2045-I2049 WeakPolarHBondContact O-CD1 3.39Å; D2045-I2049 VanDerWaalsContact O-CG1 3.26Å; D2045-I2049 WeakPolarHBondContact O-CG1 3.33Å; D2045-I2049 PolarHBondContact O-N 3.26Å; D2045-I2049 VanDerWaalsContact O-N 3.13Å
2046S60Low58.1Low68.6667 Ų68.666786.8 Ų86.848%0.4846%0.462SS..Hα-helixtrans-62.9-39.2-176.162.20000113.3N2043 E2044 S2048 I2049 M2050N2043-S2046 PolarHBondContact O-OG 2.87Å; E2044-S2046 VanDerWaalsContact C-N 3.32Å; E2044-S2046 PolarHBondContact O-N 3.22Å; S2046-S2048 VanDerWaalsContact C-N 3.35Å; S2046-I2049 PolarHBondContact O-N 3.13Å; S2046-M2050 PolarHBondContact O-N 3.05Å; S2046-M2050 VanDerWaalsContact O-N 3.17Å
2047S66.4Low60.8Low81.3333 Ų81.333381.7 Ų81.757%0.56943%0.433SS*.Hα-helixtrans-69.3-37.1179.8710000112.2E2044 D2045 S2051E2044-S2047 PolarHBondContact O-N 3.31Å; E2044-S2047 PolarHBondContact O-OG 3.1Å; D2045-S2047 VanDerWaalsContact C-N 3.35Å; D2045-S2047 PolarHBondContact O-N 3.1Å; S2047-S2051 WeakPolarHBondContact O-CB 3.36Å; S2047-S2051 PolarHBondContact O-N 2.92Å; S2047-S2051 VanDerWaalsContact O-N 3.13Å; S2047-S2051 PolarHBondContact O-OG 2.85Å
2048S74.3Confident63.5Low47 Ų4776.4 Ų76.433%0.32941%0.407SS..Hα-helixtrans-67.8-42.3180730000111.3D2045 S2046 M2050 S2051 S2052D2045-S2048 PolarHBondContact O-N 3.34Å; D2045-S2048 PolarHBondContact O-OG 3.02Å; S2046-S2048 VanDerWaalsContact C-N 3.35Å; S2048-M2050 PolarHBondContact O-N 2.95Å; S2048-S2051 PolarHBondContact O-N 3.03Å; S2048-S2051 PolarHBondContact O-OG 2.98Å; S2048-S2052 PolarHBondContact O-N 3.2Å; S2048-S2052 PolarHBondContact O-OG 3.15Å
2049I77.9Confident66.4Low19.3333 Ų19.333370.1 Ų70.110%0.09937%0.373CS..Hα-helixtrans-62.6-48.2179.4-65.1156.5000111.1V2004 F2008 D2045 S2046 S2051 S2052 Y2053 I2196V2004-I2049 HydrophobicContact CG1-CG1 4.38Å; F2008-I2049 HydrophobicContact CB-CD1 3.83Å; F2008-I2049 HydrophobicContact CB-CG1 4.05Å; F2008-I2049 HydrophobicContact CB-CG2 3.9Å; F2008-I2049 HydrophobicContact CD1-CG2 3.86Å; F2008-I2049 HydrophobicContact CD2-CD1 3.4Å; F2008-I2049 VanDerWaalsContact CD2-CD1 3.48Å; F2008-I2049 HydrophobicContact CD2-CG1 4.4Å; F2008-I2049 HydrophobicContact CD2-CG2 4.29Å; F2008-I2049 HydrophobicContact CE1-CG2 4.41Å; F2008-I2049 HydrophobicContact CE2-CD1 4.13Å; F2008-I2049 HydrophobicContact CG-CD1 3.8Å; F2008-I2049 HydrophobicContact CG-CG1 4.34Å; F2008-I2049 HydrophobicContact CG-CG2 3.74Å; D2045-I2049 VanDerWaalsContact O-CD1 3.23Å; D2045-I2049 WeakPolarHBondContact O-CD1 3.39Å; D2045-I2049 VanDerWaalsContact O-CG1 3.26Å; D2045-I2049 WeakPolarHBondContact O-CG1 3.33Å; D2045-I2049 PolarHBondContact O-N 3.26Å; D2045-I2049 VanDerWaalsContact O-N 3.13Å; S2046-I2049 PolarHBondContact O-N 3.13Å; I2049-S2051 VanDerWaalsContact C-N 3.28Å; I2049-S2051 PolarHBondContact O-N 3.2Å; I2049-S2052 PolarHBondContact O-N 3.02Å; I2049-Y2053 WeakPolarHBondContact O-CB 3.33Å; I2049-Y2053 PolarHBondContact O-N 3.37Å; I2049-I2196 HydrophobicContact CG2-CD1 3.93Å
2050M76.2Confident69.2Low48.3333 Ų48.333361.7 Ų61.724%0.23833%0.334CS..Hα-helixtrans-59.8-42.3177.6-178.358.274.600111.1S2046 S2048 S2052 Y2053 L2054 E2192 L2193 I2196S2046-M2050 PolarHBondContact O-N 3.05Å; S2046-M2050 VanDerWaalsContact O-N 3.17Å; S2048-M2050 PolarHBondContact O-N 2.95Å; M2050-S2052 PolarHBondContact O-N 3.09Å; M2050-Y2053 PolarHBondContact O-N 2.88Å; M2050-L2054 HydrophobicContact CG-CD1 4.14Å; M2050-L2054 WeakPolarHBondContact O-CG 3.36Å; M2050-L2054 PolarHBondContact O-N 3.31Å; M2050-L2054 HydrophobicContact SD-CD1 4.3Å; M2050-L2054 HydrophobicContact SD-CG 4.28Å; M2050-E2192 VanDerWaalsContact CE-C 3.44Å; M2050-E2192 HydrophobicContact CE-CB 3.57Å; M2050-E2192 HydrophobicContact SD-CB 4.17Å; M2050-L2193 HydrophobicContact CE-CB 4.28Å; M2050-L2193 HydrophobicContact CE-CD1 3.67Å; M2050-L2193 HydrophobicContact CE-CG 3.81Å; M2050-L2193 VanDerWaalsContact CE-N 3.33Å; M2050-I2196 HydrophobicContact CE-CD1 4.11Å; M2050-I2196 HydrophobicContact CE-CG1 4.32Å; M2050-I2196 HydrophobicContact SD-CD1 4.36Å
2051S82.8Confident72.1Confident27.6667 Ų27.666755.6 Ų55.619%0.19330%0.304CS..Hα-helixtrans-64-41.5178.877.80000112.7S2047 S2048 I2049 L2054 L2055S2047-S2051 WeakPolarHBondContact O-CB 3.36Å; S2047-S2051 PolarHBondContact O-N 2.92Å; S2047-S2051 VanDerWaalsContact O-N 3.13Å; S2047-S2051 PolarHBondContact O-OG 2.85Å; S2048-S2051 PolarHBondContact O-N 3.03Å; S2048-S2051 PolarHBondContact O-OG 2.98Å; I2049-S2051 VanDerWaalsContact C-N 3.28Å; I2049-S2051 PolarHBondContact O-N 3.2Å; S2051-L2054 PolarHBondContact O-N 3.17Å; S2051-L2055 WeakPolarHBondContact O-CB 3.36Å; S2051-L2055 VanDerWaalsContact O-CG 3.27Å; S2051-L2055 WeakPolarHBondContact O-CG 3.32Å; S2051-L2055 PolarHBondContact O-N 3.18Å
2052S85.6Confident75Confident14 Ų1446.9 Ų46.910%0.09827%0.27CS..Hα-helixtrans-66.2-38.3176-62.90000111.8S2048 I2049 M2050 L2055 Y2056S2048-S2052 PolarHBondContact O-N 3.2Å; S2048-S2052 PolarHBondContact O-OG 3.15Å; I2049-S2052 PolarHBondContact O-N 3.02Å; M2050-S2052 PolarHBondContact O-N 3.09Å; S2052-L2055 PolarHBondContact O-N 3.12Å; S2052-Y2056 WeakPolarHBondContact O-CB 3.37Å; S2052-Y2056 PolarHBondContact O-N 3.23Å
2053Y82.9Confident77.7Confident11 Ų1142.7 Ų42.74%0.04324%0.243CC..Hα-helixtrans-63.9-47.1175.9-179.6-102.9000112.6I2005 I2049 M2050 L2055 Y2056 Q2057 L2193 K2195 I2196 L2201I2005-Y2053 HydrophobicContact CD1-CD2 4.25Å; I2005-Y2053 HydrophobicContact CG2-CD2 4.47Å; I2049-Y2053 WeakPolarHBondContact O-CB 3.33Å; I2049-Y2053 PolarHBondContact O-N 3.37Å; M2050-Y2053 PolarHBondContact O-N 2.88Å; Y2053-L2055 VanDerWaalsContact C-N 3.33Å; Y2053-L2055 PolarHBondContact O-N 3.41Å; Y2053-Y2056 WeakPolarHBondContact O-CB 2.98Å; Y2053-Y2056 PolarHBondContact O-N 3.19Å; Y2053-Q2057 HydrophobicContact CD1-CG 4.47Å; Y2053-Q2057 HydrophobicContact CE1-CG 4.08Å; Y2053-Q2057 HydrophobicContact CE2-CG 4.35Å; Y2053-Q2057 WeakPolarHBondContact O-CG 3.35Å; Y2053-Q2057 PolarHBondContact O-N 3.17Å; Y2053-Q2057 PolarHBondContact OH-NE2 3.21Å; Y2053-Q2057 VanDerWaalsContact OH-NE2 3.15Å; Y2053-L2193 WeakPolarHBondContact CE1-O 3.32Å; Y2053-L2193 PolarHBondContact OH-O 3.03Å; Y2053-K2195 HydrophobicContact CE1-CB 4.42Å; Y2053-K2195 PolarHBondContact OH-O 3.34Å; Y2053-I2196 HydrophobicContact CD1-CD1 4.41Å; Y2053-I2196 HydrophobicContact CD1-CG1 3.91Å; Y2053-I2196 HydrophobicContact CD2-CB 4.41Å; Y2053-I2196 HydrophobicContact CD2-CG1 4.23Å; Y2053-I2196 HydrophobicContact CD2-CG2 4.06Å; Y2053-I2196 HydrophobicContact CE1-CG1 4.31Å; Y2053-I2196 HydrophobicContact CE2-CG2 4.42Å; Y2053-I2196 HydrophobicContact CG-CD1 4.34Å; Y2053-I2196 HydrophobicContact CG-CG1 3.86Å; Y2053-I2196 HydrophobicContact CG-CG2 4.4Å; Y2053-L2201 HydrophobicContact CD2-CD2 4.44Å; Y2053-L2201 HydrophobicContact CE2-CD2 4.44Å
2054L84Confident80.3Confident46.3333 Ų46.333336.3 Ų36.324%0.24321%0.21CC..Hα-helixtrans-64.2-38.5176.8-69.7170.7000112L1962 M2050 S2051 Q2057 S2058 M2194L1962-L2054 HydrophobicContact CD1-CB 4.03Å; L1962-L2054 HydrophobicContact CD1-CD1 4.41Å; L1962-L2054 HydrophobicContact CD2-CB 4.07Å; L1962-L2054 WeakPolarHBondContact CD2-O 3.29Å; M2050-L2054 HydrophobicContact CG-CD1 4.14Å; M2050-L2054 WeakPolarHBondContact O-CG 3.36Å; M2050-L2054 PolarHBondContact O-N 3.31Å; M2050-L2054 HydrophobicContact SD-CD1 4.3Å; M2050-L2054 HydrophobicContact SD-CG 4.28Å; S2051-L2054 PolarHBondContact O-N 3.17Å; L2054-Q2057 PolarHBondContact O-N 3.19Å; L2054-S2058 WeakPolarHBondContact O-CB 3.32Å; L2054-S2058 PolarHBondContact O-N 3.31Å; L2054-S2058 PolarHBondContact O-OG 3.25Å; L2054-M2194 HydrophobicContact CD2-CE 4.11Å; L2054-M2194 HydrophobicContact CD2-SD 4.05Å
2055L89.3Confident82.7Confident10 Ų1031.5 Ų31.55%0.05219%0.185CC..Hα-helixtrans-62.3-47.5173.9-78.2174000111.1T1958 Q1961 L1962 M1965 S2051 S2052 Y2053 Q2057 S2058 K2059T1958-L2055 HydrophobicContact CG2-CD1 4Å; Q1961-L2055 HydrophobicContact CB-CD2 3.84Å; L1962-L2055 HydrophobicContact CD2-CD2 4.06Å; L1962-L2055 HydrophobicContact CD2-CG 4.4Å; L1962-L2055 HydrophobicContact CG-CD2 4.25Å; M1965-L2055 HydrophobicContact CE-CD2 3.57Å; S2051-L2055 WeakPolarHBondContact O-CB 3.36Å; S2051-L2055 VanDerWaalsContact O-CG 3.27Å; S2051-L2055 WeakPolarHBondContact O-CG 3.32Å; S2051-L2055 PolarHBondContact O-N 3.18Å; S2052-L2055 PolarHBondContact O-N 3.12Å; Y2053-L2055 VanDerWaalsContact C-N 3.33Å; Y2053-L2055 PolarHBondContact O-N 3.41Å; L2055-Q2057 PolarHBondContact O-N 3.35Å; L2055-S2058 WeakPolarHBondContact CA-OG 3.5Å; L2055-S2058 PolarHBondContact O-N 2.98Å; L2055-S2058 PolarHBondContact O-OG 3.27Å; L2055-K2059 WeakPolarHBondContact O-CB 3.42Å; L2055-K2059 VanDerWaalsContact O-CG 3.24Å; L2055-K2059 WeakPolarHBondContact O-CG 3.32Å; L2055-K2059 PolarHBondContact O-N 3.1Å
2056Y90.7Very high84.4Confident0 Ų026.9 Ų26.90%016%0.16CC..Hα-helixtrans-54.9-50.2175.4169.9-99.4000111.8I1998 L2002 I2005 S2052 Y2053 S2058 K2059 M2060 L2201 P2204 T2205I1998-Y2056 HydrophobicContact CG2-CD2 4.19Å; I1998-Y2056 HydrophobicContact CG2-CE2 4.19Å; L2002-Y2056 HydrophobicContact CD1-CD2 4.45Å; L2002-Y2056 HydrophobicContact CD1-CE2 4.02Å; L2002-Y2056 HydrophobicContact CD2-CD2 3.73Å; L2002-Y2056 HydrophobicContact CD2-CE1 4.49Å; L2002-Y2056 HydrophobicContact CD2-CE2 3.54Å; L2002-Y2056 HydrophobicContact CD2-CG 4.34Å; L2002-Y2056 HydrophobicContact CG-CD2 3.84Å; L2002-Y2056 HydrophobicContact CG-CE2 3.82Å; I2005-Y2056 HydrophobicContact CD1-CG 4.31Å; S2052-Y2056 WeakPolarHBondContact O-CB 3.37Å; S2052-Y2056 PolarHBondContact O-N 3.23Å; Y2053-Y2056 WeakPolarHBondContact O-CB 2.98Å; Y2053-Y2056 PolarHBondContact O-N 3.19Å; Y2056-S2058 VanDerWaalsContact C-N 3.33Å; Y2056-S2058 PolarHBondContact O-N 3.18Å; Y2056-K2059 PolarHBondContact O-N 3.31Å; Y2056-M2060 HydrophobicContact CD2-CG 4.13Å; Y2056-M2060 HydrophobicContact CE1-CG 4.13Å; Y2056-M2060 HydrophobicContact CE2-CG 3.57Å; Y2056-M2060 HydrophobicContact CE2-SD 4.18Å; Y2056-M2060 WeakPolarHBondContact O-CB 3.32Å; Y2056-M2060 WeakPolarHBondContact O-CG 3.43Å; Y2056-M2060 PolarHBondContact O-N 3.02Å; Y2056-L2201 HydrophobicContact CD1-CD2 3.82Å; Y2056-L2201 HydrophobicContact CE1-CD2 3.76Å; Y2056-L2201 HydrophobicContact CG-CD2 4.4Å; Y2056-L2201 PolarHBondContact OH-O 3.33Å; Y2056-P2204 HydrophobicContact CE1-CG 4.22Å; Y2056-T2205 PolarHBondContact OH-OG1 3.12Å
2057Q87.1Confident85.9Confident40.6667 Ų40.666723.6 Ų23.619%0.1914%0.137CC..Hα-helixtrans-58.8-45.7178-70.4-62-18.500111.9Y2053 L2054 L2055 K2059 M2060 S2061 L2193 G2200 P2204Y2053-Q2057 HydrophobicContact CD1-CG 4.47Å; Y2053-Q2057 HydrophobicContact CE1-CG 4.08Å; Y2053-Q2057 HydrophobicContact CE2-CG 4.35Å; Y2053-Q2057 WeakPolarHBondContact O-CG 3.35Å; Y2053-Q2057 PolarHBondContact O-N 3.17Å; Y2053-Q2057 PolarHBondContact OH-NE2 3.21Å; Y2053-Q2057 VanDerWaalsContact OH-NE2 3.15Å; L2054-Q2057 PolarHBondContact O-N 3.19Å; L2055-Q2057 PolarHBondContact O-N 3.35Å; Q2057-K2059 PolarHBondContact O-N 3.49Å; Q2057-M2060 PolarHBondContact O-N 3.27Å; Q2057-S2061 WeakPolarHBondContact O-CB 3.34Å; Q2057-S2061 PolarHBondContact O-N 2.87Å; Q2057-L2193 HydrophobicContact CG-CD2 4.24Å; Q2057-G2200 PolarHBondContact NE2-O 3.13Å; Q2057-P2204 VanDerWaalsContact OE1-CG 3.28Å
2058S88.5Confident86.9Confident27.6667 Ų27.666722.3 Ų22.319%0.19313%0.128CC..Hα-helixtrans-66.5-41.3-179-30.20000112.5L1962 M1965 L2054 L2055 Y2056 S2061 I2062L1962-S2058 WeakPolarHBondContact CD2-OG 3.45Å; M1965-S2058 PolarHBondContact SD-OG 2.82Å; L2054-S2058 WeakPolarHBondContact O-CB 3.32Å; L2054-S2058 PolarHBondContact O-N 3.31Å; L2054-S2058 PolarHBondContact O-OG 3.25Å; L2055-S2058 WeakPolarHBondContact CA-OG 3.5Å; L2055-S2058 PolarHBondContact O-N 2.98Å; L2055-S2058 PolarHBondContact O-OG 3.27Å; Y2056-S2058 VanDerWaalsContact C-N 3.33Å; Y2056-S2058 PolarHBondContact O-N 3.18Å; S2058-S2061 WeakPolarHBondContact O-CB 3.41Å; S2058-S2061 PolarHBondContact O-N 3.11Å; S2058-I2062 PolarHBondContact O-N 3.1Å
2059K93Very high87.5Confident10.6667 Ų10.666721.4 Ų21.45%0.04612%0.118CC..Hα-helixtrans-63.1-46.2175.6-70.2176.5-168.1176.30110.5M1965 I1994 T1997 I1998 D2001 L2055 Y2056 Q2057 S2061 I2062 L2063M1965-K2059 HydrophobicContact CE-CG 4.19Å; M1965-K2059 HydrophobicContact SD-CG 3.7Å; I1994-K2059 HydrophobicContact CG2-CB 3.91Å; I1994-K2059 HydrophobicContact CG2-CD 4.25Å; I1994-K2059 HydrophobicContact CG2-CG 3.94Å; T1997-K2059 VanDerWaalsContact CB-NZ 3.26Å; T1997-K2059 PolarHBondContact O-NZ 2.98Å; T1997-K2059 PolarHBondContact OG1-NZ 3.19Å; I1998-K2059 HydrophobicContact CD1-CB 3.94Å; I1998-K2059 HydrophobicContact CD1-CD 4.48Å; I1998-K2059 HydrophobicContact CG1-CB 3.83Å; I1998-K2059 HydrophobicContact CG1-CD 3.63Å; I1998-K2059 HydrophobicContact CG1-CG 4.35Å; D2001-K2059 VanDerWaalsContact CG-NZ 3.32Å; D2001-K2059 IonicContact OD1-NZ 3.53Å; D2001-K2059 PolarHBondContact OD1-NZ 3.45Å; D2001-K2059 WeakPolarHBondContact OD2-CD 3.39Å; D2001-K2059 VanDerWaalsContact OD2-CE 3.29Å; D2001-K2059 WeakPolarHBondContact OD2-CE 3.42Å; D2001-K2059 IonicContact OD2-NZ 3.15Å; D2001-K2059 PolarHBondContact OD2-NZ 2.82Å; L2055-K2059 WeakPolarHBondContact O-CB 3.42Å; L2055-K2059 VanDerWaalsContact O-CG 3.24Å; L2055-K2059 WeakPolarHBondContact O-CG 3.32Å; L2055-K2059 PolarHBondContact O-N 3.1Å; Y2056-K2059 PolarHBondContact O-N 3.31Å; Q2057-K2059 PolarHBondContact O-N 3.49Å; K2059-S2061 VanDerWaalsContact C-N 3.32Å; K2059-S2061 PolarHBondContact O-N 3.04Å; K2059-I2062 PolarHBondContact O-N 3.14Å; K2059-L2063 WeakPolarHBondContact O-CB 3.29Å; K2059-L2063 WeakPolarHBondContact O-CD1 3.47Å; K2059-L2063 WeakPolarHBondContact O-CG 3.29Å; K2059-L2063 PolarHBondContact O-N 3.04Å
2060M91.8Very high88Confident1.33333 Ų1.3333323.6 Ų23.61%0.00713%0.133CC..Hα-helixtrans-63.5-36.6176.2-71.9-57.9-66.500112.6I1998 Y2056 Q2057 L2063 C2064 L2085 P2204 L2208I1998-M2060 HydrophobicContact CD1-SD 4.29Å; Y2056-M2060 HydrophobicContact CD2-CG 4.13Å; Y2056-M2060 HydrophobicContact CE1-CG 4.13Å; Y2056-M2060 HydrophobicContact CE2-CG 3.57Å; Y2056-M2060 HydrophobicContact CE2-SD 4.18Å; Y2056-M2060 WeakPolarHBondContact O-CB 3.32Å; Y2056-M2060 WeakPolarHBondContact O-CG 3.43Å; Y2056-M2060 PolarHBondContact O-N 3.02Å; Q2057-M2060 PolarHBondContact O-N 3.27Å; M2060-L2063 PolarHBondContact O-N 3.1Å; M2060-L2063 HydrophobicContact SD-CD1 4.25Å; M2060-C2064 WeakPolarHBondContact O-CB 3.34Å; M2060-C2064 PolarHBondContact O-N 3.26Å; M2060-C2064 PolarHBondContact O-SG 3.22Å; M2060-L2085 HydrophobicContact CE-CD1 4.37Å; M2060-P2204 HydrophobicContact CB-CB 3.68Å; M2060-P2204 VanDerWaalsContact CE-C 3.46Å; M2060-P2204 HydrophobicContact CE-CB 4.04Å; M2060-P2204 VanDerWaalsContact CE-O 3.31Å; M2060-P2204 WeakPolarHBondContact CE-O 3.38Å; M2060-P2204 HydrophobicContact CG-CB 3.96Å; M2060-L2208 HydrophobicContact CE-CB 3.97Å; M2060-L2208 HydrophobicContact CE-CD2 3.93Å
2061S88.5Confident88.5Confident38.6667 Ų38.666724.9 Ų24.927%0.2714%0.14SC..Hα-helixtrans-61.6-48.1175.1-166.90000111.8E1969 Q2057 S2058 K2059 L2063 C2064 R2065E1969-S2061 VanDerWaalsContact CD-OG 3.26Å; E1969-S2061 PolarHBondContact OE1-OG 3.06Å; E1969-S2061 WeakPolarHBondContact OE2-CB 3.3Å; E1969-S2061 PolarHBondContact OE2-OG 3.35Å; Q2057-S2061 WeakPolarHBondContact O-CB 3.34Å; Q2057-S2061 PolarHBondContact O-N 2.87Å; S2058-S2061 WeakPolarHBondContact O-CB 3.41Å; S2058-S2061 PolarHBondContact O-N 3.11Å; K2059-S2061 VanDerWaalsContact C-N 3.32Å; K2059-S2061 PolarHBondContact O-N 3.04Å; S2061-L2063 PolarHBondContact O-N 3.15Å; S2061-C2064 WeakPolarHBondContact O-CB 3.3Å; S2061-C2064 PolarHBondContact O-N 2.98Å; S2061-R2065 WeakPolarHBondContact O-CB 3.32Å; S2061-R2065 PolarHBondContact O-N 2.89Å
2062I90.4Very high88.8Confident1 Ų123.6 Ų23.61%0.00513%0.131CC..Hα-helixtrans-62.4-43.5175.4-72.9164.5000111.7M1965 E1969 S2058 K2059 C2064 R2065 I2066M1965-I2062 VanDerWaalsContact CA-CD1 3.48Å; M1965-I2062 HydrophobicContact CB-CD1 3.27Å; M1965-I2062 HydrophobicContact CB-CG1 4.44Å; M1965-I2062 HydrophobicContact CG-CD1 3.32Å; M1965-I2062 WeakPolarHBondContact O-CD1 3.36Å; M1965-I2062 HydrophobicContact SD-CD1 3.79Å; E1969-I2062 HydrophobicContact CB-CG1 3.96Å; E1969-I2062 HydrophobicContact CG-CG1 4.34Å; S2058-I2062 PolarHBondContact O-N 3.1Å; K2059-I2062 PolarHBondContact O-N 3.14Å; I2062-C2064 VanDerWaalsContact C-N 3.32Å; I2062-C2064 PolarHBondContact O-N 2.96Å; I2062-R2065 CarbonylContact O-C 3.53Å; I2062-R2065 WeakPolarHBondContact O-CA 3.27Å; I2062-R2065 VanDerWaalsContact O-CB 3.3Å; I2062-R2065 WeakPolarHBondContact O-CB 3.43Å; I2062-R2065 PolarHBondContact O-N 3.19Å; I2062-R2065 VanDerWaalsContact O-N 3.08Å; I2062-I2066 HydrophobicContact CG2-CD1 3.59Å; I2062-I2066 HydrophobicContact CG2-CG1 4.12Å; I2062-I2066 WeakPolarHBondContact O-CG1 3.2Å; I2062-I2066 PolarHBondContact O-N 3.24Å
2063L92.4Very high89Confident0 Ų022.9 Ų22.90%013%0.127CC..Hα-helixtrans-64.8-39.5179.8-68.2167.5000111.3I1991 I1994 L1995 I1998 K2059 M2060 S2061 R2065 I2066 G2067 L2076 I2081 L2208I1991-L2063 HydrophobicContact CG2-CD2 4.5Å; I1994-L2063 HydrophobicContact CG2-CD1 4.15Å; I1994-L2063 HydrophobicContact CG2-CD2 4.31Å; I1994-L2063 HydrophobicContact CG2-CG 4.26Å; L1995-L2063 HydrophobicContact CD2-CD1 4.07Å; L1995-L2063 HydrophobicContact CD2-CD2 4.09Å; I1998-L2063 HydrophobicContact CD1-CD1 3.22Å; I1998-L2063 HydrophobicContact CD1-CG 4.5Å; K2059-L2063 WeakPolarHBondContact O-CB 3.29Å; K2059-L2063 WeakPolarHBondContact O-CD1 3.47Å; K2059-L2063 WeakPolarHBondContact O-CG 3.29Å; K2059-L2063 PolarHBondContact O-N 3.04Å; M2060-L2063 PolarHBondContact O-N 3.1Å; M2060-L2063 HydrophobicContact SD-CD1 4.25Å; S2061-L2063 PolarHBondContact O-N 3.15Å; L2063-R2065 VanDerWaalsContact C-N 3.3Å; L2063-R2065 PolarHBondContact O-N 3.27Å; L2063-I2066 PolarHBondContact O-N 3.14Å; L2063-G2067 PolarHBondContact O-N 3.05Å; L2063-L2076 HydrophobicContact CD2-CD1 4.49Å; L2063-L2076 HydrophobicContact CD2-CD2 3.52Å; L2063-L2076 WeakPolarHBondContact O-CD1 3.46Å; L2063-I2081 HydrophobicContact CB-CD1 4.24Å; L2063-I2081 HydrophobicContact CD1-CD1 3.67Å; L2063-I2081 VanDerWaalsContact CD1-CD1 3.5Å; L2063-I2081 HydrophobicContact CD2-CD1 4.12Å; L2063-I2081 HydrophobicContact CG-CD1 4.23Å; L2063-L2208 HydrophobicContact CB-CD1 4.09Å
2064C91Very high89.3Confident11 Ų1128.1 Ų28.17%0.07415%0.149CC..Hα-helixtrans-59.8-42.4170.1-730000111.2M2060 S2061 I2062 G2067 S2068 I2211M2060-C2064 WeakPolarHBondContact O-CB 3.34Å; M2060-C2064 PolarHBondContact O-N 3.26Å; M2060-C2064 PolarHBondContact O-SG 3.22Å; S2061-C2064 WeakPolarHBondContact O-CB 3.3Å; S2061-C2064 PolarHBondContact O-N 2.98Å; I2062-C2064 VanDerWaalsContact C-N 3.32Å; I2062-C2064 PolarHBondContact O-N 2.96Å; C2064-G2067 PolarHBondContact O-N 3.09Å; C2064-S2068 PolarHBondContact O-N 3.06Å; C2064-S2068 VanDerWaalsContact O-N 3.08Å; C2064-I2211 HydrophobicContact CB-CD1 3.56Å
2065R90.1Very high89.6Confident58.3333 Ų58.333326.6 Ų26.622%0.2214%0.141CC..Hα-helixtrans-62.9-48.1176.6-176.465.861.31527.8112.1E1969 I1972 S2061 I2062 L2063 G2067 S2068 Y2069E1969-R2065 HydrophobicContact CG-CB 3.67Å; E1969-R2065 HydrophobicContact CG-CG 3.74Å; E1969-R2065 IonicContact OE1-CZ 3.37Å; E1969-R2065 IonicContact OE1-NE 3.87Å; E1969-R2065 PolarHBondContact OE1-NE 3.18Å; E1969-R2065 IonicContact OE1-NH2 3.26Å; E1969-R2065 PolarHBondContact OE1-NH2 3.03Å; I1972-R2065 HydrophobicContact CB-CG 4.12Å; I1972-R2065 HydrophobicContact CG2-CG 3.77Å; S2061-R2065 WeakPolarHBondContact O-CB 3.32Å; S2061-R2065 PolarHBondContact O-N 2.89Å; I2062-R2065 CarbonylContact O-C 3.53Å; I2062-R2065 WeakPolarHBondContact O-CA 3.27Å; I2062-R2065 VanDerWaalsContact O-CB 3.3Å; I2062-R2065 WeakPolarHBondContact O-CB 3.43Å; I2062-R2065 PolarHBondContact O-N 3.19Å; I2062-R2065 VanDerWaalsContact O-N 3.08Å; L2063-R2065 VanDerWaalsContact C-N 3.3Å; L2063-R2065 PolarHBondContact O-N 3.27Å; R2065-G2067 VanDerWaalsContact C-N 3.34Å; R2065-S2068 WeakPolarHBondContact O-CB 3.41Å; R2065-S2068 PolarHBondContact O-N 3.18Å; R2065-S2068 PolarHBondContact O-OG 3.17Å; R2065-Y2069 WeakPolarHBondContact O-CD2 3.38Å
2066I90.3Very high89.7Confident1 Ų126.1 Ų26.11%0.00514%0.139CC..Hα-helixtrans-61.6-45.8177.4-69.3170.7000110.1I1972 I1982 I1991 I2062 L2063 S2068 Y2069 G2072 L2076I1972-I2066 HydrophobicContact CD1-CD1 4.35Å; I1972-I2066 HydrophobicContact CD1-CG1 3.9Å; I1982-I2066 HydrophobicContact CG2-CG2 4.06Å; I1991-I2066 HydrophobicContact CD1-CD1 4.33Å; I1991-I2066 HydrophobicContact CG1-CD1 4.28Å; I2062-I2066 HydrophobicContact CG2-CD1 3.59Å; I2062-I2066 HydrophobicContact CG2-CG1 4.12Å; I2062-I2066 WeakPolarHBondContact O-CG1 3.2Å; I2062-I2066 PolarHBondContact O-N 3.24Å; L2063-I2066 PolarHBondContact O-N 3.14Å; I2066-S2068 PolarHBondContact O-N 2.87Å; I2066-Y2069 PolarHBondContact O-N 3.22Å; I2066-G2072 WeakPolarHBondContact O-CA 3.38Å; I2066-L2076 HydrophobicContact CB-CD1 4.29Å; I2066-L2076 HydrophobicContact CG2-CD1 4Å; I2066-L2076 HydrophobicContact CG2-CD2 4.35Å; I2066-L2076 HydrophobicContact CG2-CG 4.07Å
2067G90.1Very high89.6Confident0 Ų026.5 Ų26.50%014%0.142CC..Hα-helixtrans-66.3-17.3179.700000114.4L2063 C2064 R2065 Y2069 A2073 I2211 S2215L2063-G2067 PolarHBondContact O-N 3.05Å; C2064-G2067 PolarHBondContact O-N 3.09Å; R2065-G2067 VanDerWaalsContact C-N 3.34Å; G2067-Y2069 PolarHBondContact O-N 3.25Å; G2067-A2073 WeakPolarHBondContact O-CB 3.37Å; G2067-I2211 VanDerWaalsContact O-CG2 3.23Å; G2067-I2211 WeakPolarHBondContact O-CG2 3.47Å; G2067-S2215 VanDerWaalsContact O-CB 3.26Å; G2067-S2215 WeakPolarHBondContact O-CB 3.28Å; G2067-S2215 PolarHBondContact O-OG 3.32Å
2068S88Confident89.6Confident55.3333 Ų55.333330.5 Ų30.539%0.38717%0.165SC..THydrogen-bonded Turntrans-70.3-15.2176.474.80000113.4C2064 R2065 I2066 I2211C2064-S2068 PolarHBondContact O-N 3.06Å; C2064-S2068 VanDerWaalsContact O-N 3.08Å; R2065-S2068 WeakPolarHBondContact O-CB 3.41Å; R2065-S2068 PolarHBondContact O-N 3.18Å; R2065-S2068 PolarHBondContact O-OG 3.17Å; I2066-S2068 PolarHBondContact O-N 2.87Å; S2068-I2211 VanDerWaalsContact N-CG2 3.3Å
2069Y87.7Confident89.6Confident26.3333 Ų26.333331.4 Ų31.410%0.10317%0.166CC..SBendtrans-103.5141.6174.5-59-79.2000110.9I1972 S1973 R1976 I1982 R2065 I2066 G2067 I2071 G2072 A2073I1972-Y2069 HydrophobicContact CG2-CD2 4.27Å; I1972-Y2069 HydrophobicContact CG2-CE2 3.73Å; I1972-Y2069 PolarHBondContact O-OH 3.3Å; S1973-Y2069 WeakPolarHBondContact CA-OH 3.3Å; S1973-Y2069 PolarHBondContact O-OH 3.25Å; R1976-Y2069 HydrophobicContact CB-CE1 4.24Å; R1976-Y2069 HydrophobicContact CG-CE1 4.09Å; I1982-Y2069 HydrophobicContact CD1-CD2 3.68Å; I1982-Y2069 HydrophobicContact CD1-CE2 4.42Å; I1982-Y2069 HydrophobicContact CD1-CG 4.07Å; R2065-Y2069 WeakPolarHBondContact O-CD2 3.38Å; I2066-Y2069 PolarHBondContact O-N 3.22Å; G2067-Y2069 PolarHBondContact O-N 3.25Å; Y2069-I2071 VanDerWaalsContact C-N 3.34Å; Y2069-I2071 PolarHBondContact O-N 3.26Å; Y2069-G2072 PolarHBondContact O-N 3.17Å; Y2069-G2072 VanDerWaalsContact O-N 3.14Å; Y2069-A2073 WeakPolarHBondContact O-CB 3.4Å; Y2069-A2073 PolarHBondContact O-N 3.23Å
2070P86.7Confident89.4Confident66.6667 Ų66.666731.5 Ų31.543%0.43317%0.17SC..Hα-helixtrans-61.6-37.5-174.223.5-33.9000113.5K2074P2070-K2074 WeakPolarHBondContact O-CB 3.32Å; P2070-K2074 WeakPolarHBondContact O-CG 3.45Å; P2070-K2074 PolarHBondContact O-N 2.96Å; P2070-K2074 VanDerWaalsContact O-N 3.11Å
2071I87.7Confident89.3Confident75.3333 Ų75.333331.5 Ų31.539%0.38617%0.17SC..Hα-helixtrans-68-46.5176.1-62.3179.5000110.4Q1979 T1983 Y2069 A2073 K2074 I2075Q1979-I2071 HydrophobicContact CB-CD1 4.21Å; T1983-I2071 HydrophobicContact CG2-CG2 4.17Å; Y2069-I2071 VanDerWaalsContact C-N 3.34Å; Y2069-I2071 PolarHBondContact O-N 3.26Å; I2071-A2073 VanDerWaalsContact C-N 3.33Å; I2071-A2073 PolarHBondContact O-N 3.21Å; I2071-K2074 WeakPolarHBondContact O-CB 3.34Å; I2071-K2074 PolarHBondContact O-N 3.06Å; I2071-I2075 HydrophobicContact CG2-CD1 3.91Å; I2071-I2075 WeakPolarHBondContact O-CG1 3.33Å; I2071-I2075 PolarHBondContact O-N 3.07Å
2072G89.1Confident89.2Confident0 Ų029.7 Ų29.70%016%0.157CC..Hα-helixtrans-62-40.1177.400000112.6I2066 Y2069 K2074 I2075 L2076I2066-G2072 WeakPolarHBondContact O-CA 3.38Å; Y2069-G2072 PolarHBondContact O-N 3.17Å; Y2069-G2072 VanDerWaalsContact O-N 3.14Å; G2072-K2074 VanDerWaalsContact C-N 3.35Å; G2072-K2074 PolarHBondContact O-N 3.13Å; G2072-I2075 WeakPolarHBondContact O-CB 3.39Å; G2072-I2075 PolarHBondContact O-N 3.34Å; G2072-L2076 VanDerWaalsContact O-CG 3.32Å; G2072-L2076 WeakPolarHBondContact O-CG 3.3Å; G2072-L2076 PolarHBondContact O-N 3.16Å
2073A89.6Confident89.1Confident0 Ų032.7 Ų32.70%017%0.173CC..Hα-helixtrans-61.5-42.6174.600000112.5G2067 Y2069 I2071 I2075 L2076 A2077 L2212 S2215 L2216G2067-A2073 WeakPolarHBondContact O-CB 3.37Å; Y2069-A2073 WeakPolarHBondContact O-CB 3.4Å; Y2069-A2073 PolarHBondContact O-N 3.23Å; I2071-A2073 VanDerWaalsContact C-N 3.33Å; I2071-A2073 PolarHBondContact O-N 3.21Å; A2073-I2075 VanDerWaalsContact C-N 3.35Å; A2073-L2076 PolarHBondContact O-N 3.04Å; A2073-A2077 VanDerWaalsContact O-CB 3.32Å; A2073-A2077 WeakPolarHBondContact O-CB 3.28Å; A2073-A2077 PolarHBondContact O-N 3.09Å; A2073-L2212 HydrophobicContact CB-CD2 3.86Å; A2073-S2215 WeakPolarHBondContact CB-OG 3.34Å; A2073-L2216 HydrophobicContact CB-CD1 3.73Å; A2073-L2216 HydrophobicContact CB-CD2 3.95Å; A2073-L2216 HydrophobicContact CB-CG 3.59Å
2074K89.7Confident88.9Confident120 Ų12035.2 Ų35.252%0.52218%0.183SC..Hα-helixtrans-62.8-42.7175.4-144178.9-178.8179.70111.4P2070 I2071 G2072 A2077 N2078 L2216P2070-K2074 WeakPolarHBondContact O-CB 3.32Å; P2070-K2074 WeakPolarHBondContact O-CG 3.45Å; P2070-K2074 PolarHBondContact O-N 2.96Å; P2070-K2074 VanDerWaalsContact O-N 3.11Å; I2071-K2074 WeakPolarHBondContact O-CB 3.34Å; I2071-K2074 PolarHBondContact O-N 3.06Å; G2072-K2074 VanDerWaalsContact C-N 3.35Å; G2072-K2074 PolarHBondContact O-N 3.13Å; K2074-A2077 WeakPolarHBondContact O-CB 3.43Å; K2074-A2077 PolarHBondContact O-N 3.34Å; K2074-N2078 WeakPolarHBondContact O-CB 3.26Å; K2074-N2078 PolarHBondContact O-N 3.3Å; K2074-N2078 PolarHBondContact O-ND2 2.95Å; K2074-N2078 PolarHBondContact O-OD1 3.05Å; K2074-L2216 HydrophobicContact CB-CD2 4.24Å; K2074-L2216 HydrophobicContact CD-CD2 4.5Å; K2074-L2216 HydrophobicContact CG-CD2 3.41Å; K2074-L2216 VanDerWaalsContact CG-CD2 3.41Å
2075I89.6Confident88.7Confident14.6667 Ų14.666734.9 Ų34.98%0.07518%0.18CC..Hα-helixtrans-59.9-50.1176.2-70164.4000110.4I1982 D1986 I1991 I2071 G2072 A2073 A2077 N2078 H2079I1982-I2075 HydrophobicContact CG2-CD1 3.87Å; D1986-I2075 HydrophobicContact CB-CD1 4.1Å; D1986-I2075 HydrophobicContact CB-CG2 4.17Å; D1986-I2075 VanDerWaalsContact CG-CG2 3.46Å; D1986-I2075 VanDerWaalsContact OD1-CG2 3.24Å; D1986-I2075 WeakPolarHBondContact OD1-CG2 3.19Å; I1991-I2075 HydrophobicContact CD1-CG2 3.83Å; I2071-I2075 HydrophobicContact CG2-CD1 3.91Å; I2071-I2075 WeakPolarHBondContact O-CG1 3.33Å; I2071-I2075 PolarHBondContact O-N 3.07Å; G2072-I2075 WeakPolarHBondContact O-CB 3.39Å; G2072-I2075 PolarHBondContact O-N 3.34Å; A2073-I2075 VanDerWaalsContact C-N 3.35Å; I2075-A2077 VanDerWaalsContact C-N 3.31Å; I2075-A2077 PolarHBondContact O-N 3.01Å; I2075-N2078 PolarHBondContact O-N 3.21Å; I2075-H2079 PolarHBondContact O-N 3.41Å; I2075-H2079 PolarHBondContact O-ND1 3.25Å
2076L91.9Very high88.5Confident0 Ų032.5 Ų32.50%017%0.172CC..Hα-helixtrans-61.7-38.6179.2-70179.3000112.9I1991 L2063 I2066 G2072 A2073 H2079 G2080 I2081 L2208 L2212I1991-L2076 HydrophobicContact CG2-CD2 3.75Å; L2063-L2076 HydrophobicContact CD2-CD1 4.49Å; L2063-L2076 HydrophobicContact CD2-CD2 3.52Å; L2063-L2076 WeakPolarHBondContact O-CD1 3.46Å; I2066-L2076 HydrophobicContact CB-CD1 4.29Å; I2066-L2076 HydrophobicContact CG2-CD1 4Å; I2066-L2076 HydrophobicContact CG2-CD2 4.35Å; I2066-L2076 HydrophobicContact CG2-CG 4.07Å; G2072-L2076 VanDerWaalsContact O-CG 3.32Å; G2072-L2076 WeakPolarHBondContact O-CG 3.3Å; G2072-L2076 PolarHBondContact O-N 3.16Å; A2073-L2076 PolarHBondContact O-N 3.04Å; L2076-H2079 PolarHBondContact O-N 2.85Å; L2076-G2080 PolarHBondContact O-N 3.39Å; L2076-I2081 HydrophobicContact CB-CG2 4.12Å; L2076-I2081 HydrophobicContact CD2-CD1 4.38Å; L2076-I2081 WeakPolarHBondContact O-CG2 3.37Å; L2076-I2081 PolarHBondContact O-N 3.39Å; L2076-L2208 HydrophobicContact CD1-CD1 4.39Å; L2076-L2212 HydrophobicContact CB-CD2 4.14Å; L2076-L2212 HydrophobicContact CD1-CD2 4.22Å
2077A87.3Confident88.2Confident8 Ų838.2 Ų38.27%0.06620%0.203CC..Hα-helixtrans-64.6-41.8175.100000112.6A2073 K2074 I2075 H2079 G2080 L2216 I2223 Q2226A2073-A2077 VanDerWaalsContact O-CB 3.32Å; A2073-A2077 WeakPolarHBondContact O-CB 3.28Å; A2073-A2077 PolarHBondContact O-N 3.09Å; K2074-A2077 WeakPolarHBondContact O-CB 3.43Å; K2074-A2077 PolarHBondContact O-N 3.34Å; I2075-A2077 VanDerWaalsContact C-N 3.31Å; I2075-A2077 PolarHBondContact O-N 3.01Å; A2077-H2079 VanDerWaalsContact C-N 3.32Å; A2077-H2079 PolarHBondContact O-N 3.12Å; A2077-G2080 PolarHBondContact O-N 3.19Å; A2077-G2080 VanDerWaalsContact O-N 3.13Å; A2077-L2216 HydrophobicContact CB-CD1 4.41Å; A2077-I2223 HydrophobicContact CB-CD1 3.28Å; A2077-I2223 HydrophobicContact CB-CG1 3.6Å; A2077-I2223 VanDerWaalsContact CB-CG1 3.45Å; A2077-Q2226 PolarHBondContact O-NE2 3.28Å
2078N88.8Confident87.9Confident124 Ų12438.7 Ų38.766%0.66321%0.206SC*.Hα-helixtrans-65.4-35.9177-70.7-13.7000112K2074 I2075 G2080K2074-N2078 WeakPolarHBondContact O-CB 3.26Å; K2074-N2078 PolarHBondContact O-N 3.3Å; K2074-N2078 PolarHBondContact O-ND2 2.95Å; K2074-N2078 PolarHBondContact O-OD1 3.05Å; I2075-N2078 PolarHBondContact O-N 3.21Å; N2078-G2080 PolarHBondContact O-N 3.17Å
2079H88.5Confident87.5Confident46.6667 Ų46.666741.7 Ų41.722%0.21622%0.218CC..THydrogen-bonded Turntrans-73.8-5.8174-72.380.7000113.6D1986 Q1992 L1995 I2075 L2076 A2077 I2081 R2084D1986-H2079 IonicContact OD1-CE1 3.01Å; D1986-H2079 PolarHBondContact OD1-CE1 3.18Å; D1986-H2079 IonicContact OD1-ND1 3.77Å; D1986-H2079 IonicContact OD1-NE2 3.5Å; D1986-H2079 PolarHBondContact OD1-NE2 2.91Å; Q1992-H2079 PolarHBondContact OE1-CD2 3.28Å; Q1992-H2079 VanDerWaalsContact OE1-CD2 3.29Å; L1995-H2079 HydrophobicContact CD1-CB 3.46Å; L1995-H2079 VanDerWaalsContact CD1-CB 3.46Å; I2075-H2079 PolarHBondContact O-N 3.41Å; I2075-H2079 PolarHBondContact O-ND1 3.25Å; L2076-H2079 PolarHBondContact O-N 2.85Å; A2077-H2079 VanDerWaalsContact C-N 3.32Å; A2077-H2079 PolarHBondContact O-N 3.12Å; H2079-I2081 PolarHBondContact O-N 3.28Å; H2079-R2084 PolarHBondContact O-NE 2.94Å; H2079-R2084 VanDerWaalsContact O-NE 3.17Å; H2079-R2084 PolarHBondContact O-NH2 2.82Å
2080G87.7Confident87.1Confident12.6667 Ų12.666741.4 Ų41.413%0.13122%0.218CC..THydrogen-bonded Turntrans67.535.1175.800000113.7L2076 A2077 N2078 I2082 N2083 R2084L2076-G2080 PolarHBondContact O-N 3.39Å; A2077-G2080 PolarHBondContact O-N 3.19Å; A2077-G2080 VanDerWaalsContact O-N 3.13Å; N2078-G2080 PolarHBondContact O-N 3.17Å; G2080-I2082 VanDerWaalsContact C-N 3.28Å; G2080-I2082 PolarHBondContact O-N 2.93Å; G2080-N2083 WeakPolarHBondContact O-CB 3.25Å; G2080-N2083 PolarHBondContact O-N 3.07Å; G2080-N2083 VanDerWaalsContact O-N 3.1Å; G2080-R2084 WeakPolarHBondContact O-CG 3.42Å; G2080-R2084 PolarHBondContact O-N 3.29Å
2081I89.3Confident86.5Confident2 Ų238.5 Ų38.51%0.0120%0.199CC..Hα-helixtrans-51.7-43.4-177.4-174.5166.3000113L1995 L2063 L2076 H2079 R2084 L2085 L2208 L2212L1995-I2081 HydrophobicContact CD2-CB 3.9Å; L1995-I2081 HydrophobicContact CD2-CD1 3.42Å; L1995-I2081 VanDerWaalsContact CD2-CD1 3.49Å; L1995-I2081 HydrophobicContact CD2-CG1 3.51Å; L1995-I2081 VanDerWaalsContact CD2-CG1 3.49Å; L2063-I2081 HydrophobicContact CB-CD1 4.24Å; L2063-I2081 HydrophobicContact CD1-CD1 3.67Å; L2063-I2081 VanDerWaalsContact CD1-CD1 3.5Å; L2063-I2081 HydrophobicContact CD2-CD1 4.12Å; L2063-I2081 HydrophobicContact CG-CD1 4.23Å; L2076-I2081 HydrophobicContact CB-CG2 4.12Å; L2076-I2081 HydrophobicContact CD2-CD1 4.38Å; L2076-I2081 WeakPolarHBondContact O-CG2 3.37Å; L2076-I2081 PolarHBondContact O-N 3.39Å; H2079-I2081 PolarHBondContact O-N 3.28Å; I2081-R2084 WeakPolarHBondContact O-CB 3.35Å; I2081-R2084 PolarHBondContact O-N 3.25Å; I2081-L2085 HydrophobicContact CG1-CD1 4.13Å; I2081-L2085 WeakPolarHBondContact O-CG 3.34Å; I2081-L2085 PolarHBondContact O-N 3.06Å; I2081-L2208 HydrophobicContact CD1-CD1 4.26Å; I2081-L2208 HydrophobicContact CD1-CD2 3.44Å; I2081-L2208 HydrophobicContact CD1-CG 4.35Å; I2081-L2208 HydrophobicContact CG1-CD2 3.9Å; I2081-L2208 HydrophobicContact CG2-CD2 4.32Å; I2081-L2212 HydrophobicContact CG2-CD1 4.02Å
2082I87.7Confident85.9Confident1.33333 Ų1.3333336.9 Ų36.91%0.00720%0.195CC..Hα-helixtrans-66.2-43.2-179.3-61.3-60.2000110.4G2080 R2084 L2085 T2086 L2208 L2212 Q2226 I2227 F2230G2080-I2082 VanDerWaalsContact C-N 3.28Å; G2080-I2082 PolarHBondContact O-N 2.93Å; I2082-R2084 VanDerWaalsContact C-N 3.26Å; I2082-R2084 PolarHBondContact O-N 3.28Å; I2082-L2085 CarbonylContact O-C 3.56Å; I2082-L2085 PolarHBondContact O-N 3.09Å; I2082-L2085 VanDerWaalsContact O-N 3.16Å; I2082-T2086 HydrophobicContact CG2-CG2 4.22Å; I2082-T2086 WeakPolarHBondContact O-CG2 3.42Å; I2082-T2086 PolarHBondContact O-N 3.32Å; I2082-L2208 HydrophobicContact CD1-CD2 4.38Å; I2082-L2212 HydrophobicContact CD1-CD1 3.99Å; I2082-L2212 HydrophobicContact CG1-CD1 3.95Å; I2082-Q2226 HydrophobicContact CB-CB 3.96Å; I2082-Q2226 VanDerWaalsContact CG2-C 3.5Å; I2082-Q2226 HydrophobicContact CG2-CB 3.79Å; I2082-Q2226 WeakPolarHBondContact CG2-O 3.3Å; I2082-I2227 HydrophobicContact CD1-CG1 4.3Å; I2082-I2227 HydrophobicContact CG1-CG1 4.03Å; I2082-I2227 HydrophobicContact CG2-CG1 4.06Å; I2082-F2230 HydrophobicContact CG2-CB 3.88Å; I2082-F2230 HydrophobicContact CG2-CG 4.46Å
2083N87.8Confident85Confident62.6667 Ų62.666741 Ų4134%0.33522%0.216SC..Hα-helixtrans-63.6-28.1175.5-74.8-12.3000113.3G2080 T2086 N2087 Q2226G2080-N2083 WeakPolarHBondContact O-CB 3.25Å; G2080-N2083 PolarHBondContact O-N 3.07Å; G2080-N2083 VanDerWaalsContact O-N 3.1Å; N2083-T2086 VanDerWaalsContact C-OG1 3.3Å; N2083-T2086 WeakPolarHBondContact CA-OG1 3.3Å; N2083-T2086 PolarHBondContact O-OG1 3.08Å; N2083-N2087 VanDerWaalsContact O-CG 3.24Å; N2083-N2087 PolarHBondContact O-N 3.01Å; N2083-N2087 PolarHBondContact O-ND2 2.96Å; N2083-N2087 VanDerWaalsContact O-ND2 3.12Å; N2083-N2087 PolarHBondContact O-OD1 3.14Å; N2083-Q2226 VanDerWaalsContact OD1-CG 3.24Å; N2083-Q2226 WeakPolarHBondContact OD1-CG 3.31Å
2084R87.5Confident83.8Confident53 Ų5341.6 Ų41.620%0.222%0.22CC..Hα-helixtrans-72.2-44.5173.3-67.6173.3-175.7-1342.2110.7Q1992 L1995 D1996 I1999 H2079 G2080 I2081 I2082 T2086 N2087 C2088Q1992-R2084 VanDerWaalsContact CD-NH2 3.29Å; L1995-R2084 VanDerWaalsContact CB-NH1 3.3Å; D1996-R2084 IonicContact OD1-CZ 3.28Å; D1996-R2084 IonicContact OD1-NH1 3.09Å; D1996-R2084 PolarHBondContact OD1-NH1 2.89Å; D1996-R2084 IonicContact OD1-NH2 2.76Å; I1999-R2084 HydrophobicContact CD1-CB 4.26Å; I1999-R2084 HydrophobicContact CD1-CG 4.48Å; H2079-R2084 PolarHBondContact O-NE 2.94Å; H2079-R2084 VanDerWaalsContact O-NE 3.17Å; H2079-R2084 PolarHBondContact O-NH2 2.82Å; G2080-R2084 WeakPolarHBondContact O-CG 3.42Å; G2080-R2084 PolarHBondContact O-N 3.29Å; I2081-R2084 WeakPolarHBondContact O-CB 3.35Å; I2081-R2084 PolarHBondContact O-N 3.25Å; I2082-R2084 VanDerWaalsContact C-N 3.26Å; I2082-R2084 PolarHBondContact O-N 3.28Å; R2084-T2086 VanDerWaalsContact C-N 3.3Å; R2084-T2086 PolarHBondContact O-N 3.38Å; R2084-N2087 PolarHBondContact O-N 3.24Å; R2084-N2087 VanDerWaalsContact O-N 3.16Å; R2084-C2088 PolarHBondContact O-SG 3.16Å; R2084-C2088 VanDerWaalsContact O-SG 3.38Å
2085L87.6Confident82.5Confident5 Ų537.7 Ų37.73%0.02621%0.205CC..Hα-helixtrans-67.5-33.3176.9-65.8171.7000112.2I1998 L2002 M2060 I2081 I2082 N2087 C2088 T2205 L2208 F2230 H2234I1998-L2085 HydrophobicContact CG2-CD2 4.26Å; L2002-L2085 HydrophobicContact CD1-CD2 4.23Å; M2060-L2085 HydrophobicContact CE-CD1 4.37Å; I2081-L2085 HydrophobicContact CG1-CD1 4.13Å; I2081-L2085 WeakPolarHBondContact O-CG 3.34Å; I2081-L2085 PolarHBondContact O-N 3.06Å; I2082-L2085 CarbonylContact O-C 3.56Å; I2082-L2085 PolarHBondContact O-N 3.09Å; I2082-L2085 VanDerWaalsContact O-N 3.16Å; L2085-N2087 PolarHBondContact O-N 3.33Å; L2085-C2088 WeakPolarHBondContact O-CB 3.27Å; L2085-C2088 PolarHBondContact O-N 3.2Å; L2085-C2088 VanDerWaalsContact O-N 3.12Å; L2085-T2205 HydrophobicContact CB-CG2 4.35Å; L2085-T2205 HydrophobicContact CD1-CG2 3.82Å; L2085-T2205 HydrophobicContact CG-CG2 4.49Å; L2085-L2208 HydrophobicContact CD1-CD2 3.96Å; L2085-F2230 HydrophobicContact CB-CD2 4.39Å; L2085-F2230 HydrophobicContact CB-CE2 4.35Å; L2085-H2234 PolarHBondContact O-NE2 3.39Å
2086T85.4Confident80.9Confident7 Ų738.4 Ų38.44%0.04321%0.209CC..Hα-helixtrans-60.7-28.6173.961.30000112.8I2082 N2083 R2084 C2088 F2230 H2234I2082-T2086 HydrophobicContact CG2-CG2 4.22Å; I2082-T2086 WeakPolarHBondContact O-CG2 3.42Å; I2082-T2086 PolarHBondContact O-N 3.32Å; N2083-T2086 VanDerWaalsContact C-OG1 3.3Å; N2083-T2086 WeakPolarHBondContact CA-OG1 3.3Å; N2083-T2086 PolarHBondContact O-OG1 3.08Å; R2084-T2086 VanDerWaalsContact C-N 3.3Å; R2084-T2086 PolarHBondContact O-N 3.38Å; T2086-C2088 VanDerWaalsContact C-N 3.29Å; T2086-F2230 HydrophobicContact CG2-CB 3.48Å; T2086-F2230 VanDerWaalsContact CG2-CB 3.48Å; T2086-F2230 HydrophobicContact CG2-CD2 3.95Å; T2086-F2230 HydrophobicContact CG2-CG 4.21Å; T2086-H2234 PolarHBondContact O-NE2 3.24Å
2087N85Confident79Confident121.667 Ų121.66739.7 Ų39.765%0.65122%0.219SC*.THydrogen-bonded Turntrans-88-1-178.4-61.7-12.8000112.1N2083 R2084 L2085 D2089N2083-N2087 VanDerWaalsContact O-CG 3.24Å; N2083-N2087 PolarHBondContact O-N 3.01Å; N2083-N2087 PolarHBondContact O-ND2 2.96Å; N2083-N2087 VanDerWaalsContact O-ND2 3.12Å; N2083-N2087 PolarHBondContact O-OD1 3.14Å; R2084-N2087 PolarHBondContact O-N 3.24Å; R2084-N2087 VanDerWaalsContact O-N 3.16Å; L2085-N2087 PolarHBondContact O-N 3.33Å; N2087-D2089 PolarHBondContact O-N 3.38Å
2088C84.2Confident77.5Confident10 Ų1041.7 Ų41.77%0.06823%0.229CC..  trans-85.492177.6-660000109.7L2002 R2084 L2085 T2086 V2090 L2091 H2234L2002-C2088 HydrophobicContact CD1-CB 4.24Å; R2084-C2088 PolarHBondContact O-SG 3.16Å; R2084-C2088 VanDerWaalsContact O-SG 3.38Å; L2085-C2088 WeakPolarHBondContact O-CB 3.27Å; L2085-C2088 PolarHBondContact O-N 3.2Å; L2085-C2088 VanDerWaalsContact O-N 3.12Å; T2086-C2088 VanDerWaalsContact C-N 3.29Å; C2088-V2090 PolarHBondContact O-N 3.29Å; C2088-L2091 HydrophobicContact CB-CD1 4.22Å; C2088-L2091 HydrophobicContact CB-CG 4.32Å; C2088-L2091 PolarHBondContact O-N 3.04Å; C2088-H2234 PolarHBondContact O-CE1 2.9Å
2089D79.3Confident75.9Confident119.333 Ų119.33337.5 Ų37.564%0.63821%0.209SC*.G310 helixtrans-52.7-28.3178.6-64.9-26.9000113N2087 L2091 S2092 L2093N2087-D2089 PolarHBondContact O-N 3.38Å; D2089-L2091 PolarHBondContact O-N 2.9Å; D2089-L2091 VanDerWaalsContact O-N 3.14Å; D2089-S2092 WeakPolarHBondContact O-CA 3.44Å; D2089-S2092 WeakPolarHBondContact O-CB 3.43Å; D2089-S2092 PolarHBondContact O-N 3.16Å; D2089-S2092 PolarHBondContact O-OG 3.27Å; D2089-L2093 WeakPolarHBondContact O-CG 3.37Å; D2089-L2093 PolarHBondContact O-N 3.06Å
2090V77.9Confident74.2Confident19.3333 Ų19.333338.1 Ų38.112%0.11721%0.21CC..G310 helixtrans-51-38176.1-179.80000111.7C2088 S2092 L2093 W2198 L2201C2088-V2090 PolarHBondContact O-N 3.29Å; V2090-S2092 VanDerWaalsContact C-N 3.28Å; V2090-S2092 PolarHBondContact O-N 2.9Å; V2090-L2093 HydrophobicContact CB-CD1 4.5Å; V2090-L2093 HydrophobicContact CG2-CD1 4.46Å; V2090-L2093 PolarHBondContact O-N 3.22Å; V2090-L2093 VanDerWaalsContact O-N 3.15Å; V2090-W2198 HydrophobicContact CB-CZ3 4.49Å; V2090-W2198 HydrophobicContact CG1-CE3 4.42Å; V2090-W2198 HydrophobicContact CG1-CH2 4.22Å; V2090-W2198 HydrophobicContact CG1-CZ3 3.68Å; V2090-W2198 WeakPolarHBondContact O-CZ3 3.47Å; V2090-L2201 HydrophobicContact CG1-CD1 4.06Å
2091L75.8Confident72.5Confident5.33333 Ų5.3333339 Ų393%0.02821%0.214CC..G310 helixtrans-70.7-14.3179.9-61.7174.6000113.8C2088 D2089 L2201 L2202 T2205 F2230 S2237C2088-L2091 HydrophobicContact CB-CD1 4.22Å; C2088-L2091 HydrophobicContact CB-CG 4.32Å; C2088-L2091 PolarHBondContact O-N 3.04Å; D2089-L2091 PolarHBondContact O-N 2.9Å; D2089-L2091 VanDerWaalsContact O-N 3.14Å; L2091-L2201 HydrophobicContact CD2-CB 4.2Å; L2091-L2202 HydrophobicContact CB-CD2 4.18Å; L2091-L2202 HydrophobicContact CD2-CD2 4.26Å; L2091-T2205 HydrophobicContact CD1-CG2 4.23Å; L2091-F2230 HydrophobicContact CD1-CE2 3.8Å; L2091-F2230 HydrophobicContact CD1-CZ 4.23Å; L2091-S2237 WeakPolarHBondContact O-CB 3.41Å; L2091-S2237 PolarHBondContact O-OG 2.97Å
2092S74.9Confident70.7Confident41.3333 Ų41.333342.7 Ų42.729%0.28923%0.228SC..G310 helixtrans-101.1-5.4176.254.60000114.4D2089 V2090 S2094 H2234D2089-S2092 WeakPolarHBondContact O-CA 3.44Å; D2089-S2092 WeakPolarHBondContact O-CB 3.43Å; D2089-S2092 PolarHBondContact O-N 3.16Å; D2089-S2092 PolarHBondContact O-OG 3.27Å; V2090-S2092 VanDerWaalsContact C-N 3.28Å; V2090-S2092 PolarHBondContact O-N 2.9Å; S2092-S2094 VanDerWaalsContact C-N 3.33Å; S2092-S2094 PolarHBondContact O-N 2.94Å; S2092-H2234 PolarHBondContact N-ND1 3.33Å
2093L68.8Low68.9Low86.6667 Ų86.666743.5 Ų43.545%0.45424%0.237SC..SBendtrans-73.8-20.2-172.7-71176000114.5T2010 D2089 V2090 N2095 W2198T2010-L2093 HydrophobicContact CG2-CD1 3.55Å; T2010-L2093 VanDerWaalsContact CG2-CD1 3.43Å; D2089-L2093 WeakPolarHBondContact O-CG 3.37Å; D2089-L2093 PolarHBondContact O-N 3.06Å; V2090-L2093 HydrophobicContact CB-CD1 4.5Å; V2090-L2093 HydrophobicContact CG2-CD1 4.46Å; V2090-L2093 PolarHBondContact O-N 3.22Å; V2090-L2093 VanDerWaalsContact O-N 3.15Å; L2093-N2095 PolarHBondContact O-N 3.3Å; L2093-N2095 VanDerWaalsContact O-N 3.1Å; L2093-W2198 HydrophobicContact CB-CH2 3.55Å; L2093-W2198 VanDerWaalsContact CB-CH2 3.48Å; L2093-W2198 HydrophobicContact CB-CZ2 4.08Å; L2093-W2198 HydrophobicContact CB-CZ3 4.01Å; L2093-W2198 HydrophobicContact CD1-CH2 3.91Å; L2093-W2198 HydrophobicContact CD1-CZ2 4.47Å; L2093-W2198 HydrophobicContact CD1-CZ3 4.12Å; L2093-W2198 HydrophobicContact CG-CH2 4.25Å
2094S64.8Low67Low12.3333 Ų12.333341.2 Ų41.29%0.08623%0.225CC..SBendtrans-116.3140.1174.269.90000109.8S2092 W2198 S2237 N2241S2092-S2094 VanDerWaalsContact C-N 3.33Å; S2092-S2094 PolarHBondContact O-N 2.94Å; S2094-W2198 VanDerWaalsContact CB-CG 3.42Å; S2094-W2198 VanDerWaalsContact OG-CB 3.29Å; S2094-W2198 WeakPolarHBondContact OG-CB 3.43Å; S2094-S2237 WeakPolarHBondContact O-CB 3.41Å; S2094-S2237 PolarHBondContact O-OG 3.36Å; S2094-S2237 VanDerWaalsContact OG-CA 3.31Å; S2094-S2237 WeakPolarHBondContact OG-CA 3.48Å; S2094-S2237 WeakPolarHBondContact OG-CB 3.3Å; S2094-N2241 WeakPolarHBondContact CB-ND2 3.43Å; S2094-N2241 PolarHBondContact OG-ND2 3.2Å
2095N61.8Low65.2Low39 Ų3942.3 Ų42.321%0.20924%0.235CC..  trans-99.8160.9171.964.317.7000110.1L2093 A2097 N2098 C2099 S2237 C2240L2093-N2095 PolarHBondContact O-N 3.3Å; L2093-N2095 VanDerWaalsContact O-N 3.1Å; N2095-A2097 VanDerWaalsContact C-N 3.28Å; N2095-A2097 PolarHBondContact O-N 3.43Å; N2095-A2097 WeakPolarHBondContact OD1-CB 3.36Å; N2095-A2097 PolarHBondContact OD1-N 3.4Å; N2095-N2098 PolarHBondContact ND2-OD1 3.24Å; N2095-N2098 PolarHBondContact O-N 2.78Å; N2095-N2098 WeakPolarHBondContact OD1-CA 3.32Å; N2095-N2098 WeakPolarHBondContact OD1-CB 3.39Å; N2095-N2098 PolarHBondContact OD1-N 3.12Å; N2095-N2098 PolarHBondContact OD1-ND2 3.04Å; N2095-N2098 PolarHBondContact OD1-OD1 3.14Å; N2095-N2098 VanDerWaalsContact OD1-OD1 3.08Å; N2095-C2099 PolarHBondContact O-N 3.28Å; N2095-C2099 PolarHBondContact O-SG 3.17Å; N2095-C2099 VanDerWaalsContact O-SG 3.4Å; N2095-S2237 WeakPolarHBondContact CA-O 3.34Å; N2095-S2237 WeakPolarHBondContact CB-O 3.19Å; N2095-C2240 HydrophobicContact CB-CB 4.05Å; N2095-C2240 PolarHBondContact ND2-SG 3.02Å
2096L56.2Low63.2Low29.6667 Ų29.666744.2 Ų44.216%0.15525%0.248CC..Hα-helixtrans-59.1-37.4178.5-169.295.6000111.2N2098 C2099 Y2100 L2202 S2287 E2288 L2358L2096-N2098 PolarHBondContact O-N 3.17Å; L2096-C2099 VanDerWaalsContact O-CB 3.23Å; L2096-C2099 WeakPolarHBondContact O-CB 3.41Å; L2096-C2099 PolarHBondContact O-N 3.25Å; L2096-C2099 VanDerWaalsContact O-N 3.09Å; L2096-Y2100 HydrophobicContact CD1-CE2 4.35Å; L2096-Y2100 HydrophobicContact CD2-CD2 3.92Å; L2096-Y2100 HydrophobicContact CD2-CE2 3.53Å; L2096-Y2100 HydrophobicContact CG-CD2 4.29Å; L2096-Y2100 HydrophobicContact CG-CE2 3.87Å; L2096-Y2100 VanDerWaalsContact O-CB 3.32Å; L2096-Y2100 WeakPolarHBondContact O-CB 3.46Å; L2096-Y2100 VanDerWaalsContact O-CD2 3.25Å; L2096-Y2100 WeakPolarHBondContact O-CD2 3.33Å; L2096-Y2100 PolarHBondContact O-N 3.1Å; L2096-L2202 HydrophobicContact CD1-CD2 4.17Å; L2096-S2287 WeakPolarHBondContact CD1-OG 3.29Å; L2096-S2287 WeakPolarHBondContact CD2-OG 3.2Å; L2096-E2288 HydrophobicContact CD2-CB 3.99Å; L2096-E2288 WeakPolarHBondContact CD2-OE2 3.43Å; L2096-L2358 HydrophobicContact CD1-CD1 4.21Å; L2096-L2358 HydrophobicContact CD2-CG 4.38Å
2097A52.6Low61.2Low25.6667 Ų25.666747 Ų4721%0.21226%0.262CS..Hα-helixtrans-60.5-44.3178.400000113.4N2095 C2099 Y2100 S2101 E2242 L2245N2095-A2097 VanDerWaalsContact C-N 3.28Å; N2095-A2097 PolarHBondContact O-N 3.43Å; N2095-A2097 WeakPolarHBondContact OD1-CB 3.36Å; N2095-A2097 PolarHBondContact OD1-N 3.4Å; A2097-C2099 VanDerWaalsContact C-N 3.27Å; A2097-C2099 PolarHBondContact O-N 3.16Å; A2097-Y2100 CarbonylContact O-C 3.34Å; A2097-Y2100 PolarHBondContact O-N 3.13Å; A2097-Y2100 VanDerWaalsContact O-N 3.1Å; A2097-S2101 WeakPolarHBondContact O-CB 3.49Å; A2097-S2101 PolarHBondContact O-N 3.08Å; A2097-S2101 PolarHBondContact O-OG 3.03Å; A2097-E2242 HydrophobicContact CB-CG 4.21Å; A2097-L2245 VanDerWaalsContact CA-CD1 3.43Å; A2097-L2245 HydrophobicContact CB-CD1 3.63Å
2098N56.6Low59.3Low50.6667 Ų50.666745.2 Ų45.227%0.27125%0.247SC..Hα-helixtrans-66-32.5178.7-68.2-2.9000111.4N2095 L2096 Y2100 S2101 Y2102N2095-N2098 PolarHBondContact ND2-OD1 3.24Å; N2095-N2098 PolarHBondContact O-N 2.78Å; N2095-N2098 WeakPolarHBondContact OD1-CA 3.32Å; N2095-N2098 WeakPolarHBondContact OD1-CB 3.39Å; N2095-N2098 PolarHBondContact OD1-N 3.12Å; N2095-N2098 PolarHBondContact OD1-ND2 3.04Å; N2095-N2098 PolarHBondContact OD1-OD1 3.14Å; N2095-N2098 VanDerWaalsContact OD1-OD1 3.08Å; L2096-N2098 PolarHBondContact O-N 3.17Å; N2098-Y2100 VanDerWaalsContact C-N 3.34Å; N2098-Y2100 PolarHBondContact O-N 3.08Å; N2098-S2101 WeakPolarHBondContact CA-OG 3.44Å; N2098-S2101 PolarHBondContact O-OG 3.14Å; N2098-Y2102 VanDerWaalsContact O-CB 3.3Å; N2098-Y2102 WeakPolarHBondContact O-CB 3.18Å; N2098-Y2102 PolarHBondContact O-N 3.08Å
2099C53.9Low57.3Low37 Ų3749.6 Ų49.625%0.2527%0.269CS..Hα-helixtrans-64.9-33.2175.8-60.10000111.5N2095 L2096 A2097 G2103 N2241N2095-C2099 PolarHBondContact O-N 3.28Å; N2095-C2099 PolarHBondContact O-SG 3.17Å; N2095-C2099 VanDerWaalsContact O-SG 3.4Å; L2096-C2099 VanDerWaalsContact O-CB 3.23Å; L2096-C2099 WeakPolarHBondContact O-CB 3.41Å; L2096-C2099 PolarHBondContact O-N 3.25Å; L2096-C2099 VanDerWaalsContact O-N 3.09Å; A2097-C2099 VanDerWaalsContact C-N 3.27Å; A2097-C2099 PolarHBondContact O-N 3.16Å; C2099-G2103 PolarHBondContact O-N 3.2Å; C2099-N2241 PolarHBondContact SG-OD1 3.37Å
2100Y53.9Low55.4Low59.3333 Ų59.333347.3 Ų47.323%0.23326%0.261CS..Hα-helixtrans-92-29.5-178.8-93.4-77.6000113.1L2096 A2097 N2098 Y2102 G2103 L2104 W2280 Q2283 W2284L2096-Y2100 HydrophobicContact CD1-CE2 4.35Å; L2096-Y2100 HydrophobicContact CD2-CD2 3.92Å; L2096-Y2100 HydrophobicContact CD2-CE2 3.53Å; L2096-Y2100 HydrophobicContact CG-CD2 4.29Å; L2096-Y2100 HydrophobicContact CG-CE2 3.87Å; L2096-Y2100 VanDerWaalsContact O-CB 3.32Å; L2096-Y2100 WeakPolarHBondContact O-CB 3.46Å; L2096-Y2100 VanDerWaalsContact O-CD2 3.25Å; L2096-Y2100 WeakPolarHBondContact O-CD2 3.33Å; L2096-Y2100 PolarHBondContact O-N 3.1Å; A2097-Y2100 CarbonylContact O-C 3.34Å; A2097-Y2100 PolarHBondContact O-N 3.13Å; A2097-Y2100 VanDerWaalsContact O-N 3.1Å; N2098-Y2100 VanDerWaalsContact C-N 3.34Å; N2098-Y2100 PolarHBondContact O-N 3.08Å; Y2100-Y2102 PolarHBondContact O-N 2.92Å; Y2100-Y2102 VanDerWaalsContact O-N 3.15Å; Y2100-G2103 WeakPolarHBondContact O-CA 3.49Å; Y2100-G2103 PolarHBondContact O-N 3.27Å; Y2100-G2103 VanDerWaalsContact O-N 3.1Å; Y2100-L2104 HydrophobicContact CD1-CD1 3.7Å; Y2100-L2104 HydrophobicContact CD1-CG 4.17Å; Y2100-L2104 HydrophobicContact CE1-CD1 3.21Å; Y2100-L2104 HydrophobicContact CE1-CD2 4.46Å; Y2100-L2104 HydrophobicContact CE1-CG 3.83Å; Y2100-L2104 WeakPolarHBondContact O-CB 3.44Å; Y2100-L2104 WeakPolarHBondContact O-CG 3.43Å; Y2100-L2104 PolarHBondContact O-N 3.13Å; Y2100-W2280 HydrophobicContact CD1-CB 4.26Å; Y2100-W2280 WeakPolarHBondContact CD1-O 3.31Å; Y2100-Q2283 HydrophobicContact CD1-CB 4.36Å; Y2100-Q2283 HydrophobicContact CE1-CB 3.45Å; Y2100-Q2283 VanDerWaalsContact CE1-CB 3.45Å; Y2100-W2284 HydrophobicContact CD1-CB 4.41Å; Y2100-W2284 HydrophobicContact CD2-CB 3.68Å; Y2100-W2284 AromaticContact CD2-CD1 3.66Å; Y2100-W2284 HydrophobicContact CD2-CG 4.06Å; Y2100-W2284 HydrophobicContact CE2-CB 4.08Å; Y2100-W2284 HydrophobicContact CG-CB 3.84Å
2101S51.6Low53.5Low30.3333 Ų30.333350.3 Ų50.321%0.21227%0.274CS..Hα-helixtrans-59.9-37.5176.669.20000111.7A2097 N2098 G2103 L2104 D2105A2097-S2101 WeakPolarHBondContact O-CB 3.49Å; A2097-S2101 PolarHBondContact O-N 3.08Å; A2097-S2101 PolarHBondContact O-OG 3.03Å; N2098-S2101 WeakPolarHBondContact CA-OG 3.44Å; N2098-S2101 PolarHBondContact O-OG 3.14Å; S2101-G2103 VanDerWaalsContact C-N 3.28Å; S2101-G2103 PolarHBondContact O-N 3.07Å; S2101-L2104 CarbonylContact O-C 3.36Å; S2101-L2104 VanDerWaalsContact O-CA 3.31Å; S2101-L2104 WeakPolarHBondContact O-CA 3.43Å; S2101-L2104 WeakPolarHBondContact O-CB 3.36Å; S2101-L2104 PolarHBondContact O-N 3.13Å; S2101-D2105 VanDerWaalsContact O-CG 3.28Å; S2101-D2105 PolarHBondContact O-N 3.22Å
2102Y50.8Low51.7Low79.3333 Ų79.333354.4 Ų54.431%0.31130%0.296SS..Hα-helixtrans-62.5-38.9175.3-179.2-95000112.7N2098 Y2100 L2104 D2105 C2106 M2135 D2136 W2139N2098-Y2102 VanDerWaalsContact O-CB 3.3Å; N2098-Y2102 WeakPolarHBondContact O-CB 3.18Å; N2098-Y2102 PolarHBondContact O-N 3.08Å; Y2100-Y2102 PolarHBondContact O-N 2.92Å; Y2100-Y2102 VanDerWaalsContact O-N 3.15Å; Y2102-L2104 VanDerWaalsContact C-N 3.27Å; Y2102-L2104 PolarHBondContact O-N 3.31Å; Y2102-D2105 PolarHBondContact O-N 3.07Å; Y2102-C2106 WeakPolarHBondContact CE1-SG 3.31Å; Y2102-C2106 VanDerWaalsContact CE2-SG 3.57Å; Y2102-C2106 WeakPolarHBondContact O-CB 3.2Å; Y2102-C2106 PolarHBondContact O-N 3.32Å; Y2102-C2106 VanDerWaalsContact O-N 3.13Å; Y2102-C2106 PolarHBondContact O-SG 3.19Å; Y2102-C2106 VanDerWaalsContact O-SG 3.39Å; Y2102-C2106 PolarHBondContact OH-SG 2.99Å; Y2102-M2135 HydrophobicContact CD2-CB 4.42Å; Y2102-M2135 HydrophobicContact CE2-CB 4.39Å; Y2102-D2136 WeakPolarHBondContact CE2-OD1 3.05Å; Y2102-D2136 VanDerWaalsContact OH-CA 3.27Å; Y2102-D2136 WeakPolarHBondContact OH-CA 3.05Å; Y2102-D2136 PolarHBondContact OH-OD1 3.26Å; Y2102-W2139 HydrophobicContact CD1-CB 3.82Å; Y2102-W2139 HydrophobicContact CD1-CD2 4.43Å; Y2102-W2139 AromaticContact CD1-CG 3.95Å; Y2102-W2139 HydrophobicContact CD1-CG 3.95Å; Y2102-W2139 HydrophobicContact CE1-CB 3.05Å; Y2102-W2139 AromaticContact CE1-CD1 3.55Å; Y2102-W2139 HydrophobicContact CE1-CD2 4.25Å; Y2102-W2139 AromaticContact CE1-CG 3.34Å; Y2102-W2139 HydrophobicContact CE1-CG 3.34Å
2103G49.9Very low50Low19 Ų1958.5 Ų58.520%0.19631%0.314CS..Hα-helixtrans-62.4-35.7173.600000112.6C2099 Y2100 S2101 L2107 W2280C2099-G2103 PolarHBondContact O-N 3.2Å; Y2100-G2103 WeakPolarHBondContact O-CA 3.49Å; Y2100-G2103 PolarHBondContact O-N 3.27Å; Y2100-G2103 VanDerWaalsContact O-N 3.1Å; S2101-G2103 VanDerWaalsContact C-N 3.28Å; S2101-G2103 PolarHBondContact O-N 3.07Å; G2103-L2107 WeakPolarHBondContact O-CG 3.31Å; G2103-L2107 PolarHBondContact O-N 3.17Å; G2103-W2280 VanDerWaalsContact C-CE2 3.41Å; G2103-W2280 VanDerWaalsContact C-CZ2 3.43Å; G2103-W2280 VanDerWaalsContact CA-CE2 3.47Å; G2103-W2280 WeakPolarHBondContact O-CZ2 3.25Å
2104L49.5Very low48.5Very low15 Ų1560 Ų608%0.07932%0.323CS..Hα-helixtrans-70.7-43.4173.5-94.6172.2000112.2Y2100 S2101 Y2102 C2106 L2107 Y2108 Q2244 L2245 W2280Y2100-L2104 HydrophobicContact CD1-CD1 3.7Å; Y2100-L2104 HydrophobicContact CD1-CG 4.17Å; Y2100-L2104 HydrophobicContact CE1-CD1 3.21Å; Y2100-L2104 HydrophobicContact CE1-CD2 4.46Å; Y2100-L2104 HydrophobicContact CE1-CG 3.83Å; Y2100-L2104 WeakPolarHBondContact O-CB 3.44Å; Y2100-L2104 WeakPolarHBondContact O-CG 3.43Å; Y2100-L2104 PolarHBondContact O-N 3.13Å; S2101-L2104 CarbonylContact O-C 3.36Å; S2101-L2104 VanDerWaalsContact O-CA 3.31Å; S2101-L2104 WeakPolarHBondContact O-CA 3.43Å; S2101-L2104 WeakPolarHBondContact O-CB 3.36Å; S2101-L2104 PolarHBondContact O-N 3.13Å; Y2102-L2104 VanDerWaalsContact C-N 3.27Å; Y2102-L2104 PolarHBondContact O-N 3.31Å; L2104-C2106 VanDerWaalsContact C-N 3.28Å; L2104-C2106 PolarHBondContact O-N 3.34Å; L2104-L2107 HydrophobicContact CD2-CD1 4.42Å; L2104-L2107 CarbonylContact O-C 3.46Å; L2104-L2107 WeakPolarHBondContact O-CA 3.26Å; L2104-L2107 VanDerWaalsContact O-CB 3.31Å; L2104-L2107 WeakPolarHBondContact O-CB 3.32Å; L2104-L2107 PolarHBondContact O-N 3.11Å; L2104-L2107 VanDerWaalsContact O-N 3.07Å; L2104-Y2108 HydrophobicContact CB-CD2 3.98Å; L2104-Y2108 HydrophobicContact CB-CE2 4.03Å; L2104-Y2108 HydrophobicContact CD1-CE2 4.26Å; L2104-Y2108 HydrophobicContact CD2-CD2 3.97Å; L2104-Y2108 HydrophobicContact CD2-CE2 3.43Å; L2104-Y2108 HydrophobicContact CG-CE2 4.25Å; L2104-Y2108 WeakPolarHBondContact O-CB 3.48Å; L2104-Y2108 VanDerWaalsContact O-CD2 3.23Å; L2104-Y2108 WeakPolarHBondContact O-CD2 3.46Å; L2104-Y2108 PolarHBondContact O-N 3.05Å; L2104-Y2108 VanDerWaalsContact O-N 3.14Å; L2104-Q2244 HydrophobicContact CD1-CB 3.73Å; L2104-L2245 HydrophobicContact CD1-CB 4.41Å; L2104-L2245 HydrophobicContact CD1-CD2 3.42Å; L2104-L2245 VanDerWaalsContact CD1-CD2 3.42Å; L2104-L2245 HydrophobicContact CD1-CG 3.64Å; L2104-L2245 HydrophobicContact CG-CD2 4.14Å; L2104-W2280 HydrophobicContact CB-CH2 4.41Å; L2104-W2280 HydrophobicContact CG-CH2 4.16Å
2105D47.9Very low47.2Very low76.3333 Ų76.333364.8 Ų64.841%0.40835%0.348SS..Hα-helixtrans-61-39.4176.6-69.1-25.1000111.1S2101 Y2102 L2107 Y2108 I2109S2101-D2105 VanDerWaalsContact O-CG 3.28Å; S2101-D2105 PolarHBondContact O-N 3.22Å; Y2102-D2105 PolarHBondContact O-N 3.07Å; D2105-L2107 VanDerWaalsContact C-N 3.3Å; D2105-L2107 PolarHBondContact O-N 3.23Å; D2105-Y2108 WeakPolarHBondContact O-CB 3.23Å; D2105-Y2108 PolarHBondContact O-N 3.28Å; D2105-Y2108 VanDerWaalsContact O-N 3.16Å; D2105-I2109 HydrophobicContact CB-CD1 4.44Å; D2105-I2109 WeakPolarHBondContact O-CB 3.37Å; D2105-I2109 WeakPolarHBondContact O-CD1 3.33Å; D2105-I2109 WeakPolarHBondContact O-CG1 3.36Å; D2105-I2109 PolarHBondContact O-N 3.19Å
2106C47Very low45.9Very low43.6667 Ų43.666768.8 Ų68.830%0.29537%0.369SS..Hα-helixtrans-62.1-33.9173.3-69.30000113Y2102 L2104 C2110Y2102-C2106 WeakPolarHBondContact CE1-SG 3.31Å; Y2102-C2106 VanDerWaalsContact CE2-SG 3.57Å; Y2102-C2106 WeakPolarHBondContact O-CB 3.2Å; Y2102-C2106 PolarHBondContact O-N 3.32Å; Y2102-C2106 VanDerWaalsContact O-N 3.13Å; Y2102-C2106 PolarHBondContact O-SG 3.19Å; Y2102-C2106 VanDerWaalsContact O-SG 3.39Å; Y2102-C2106 PolarHBondContact OH-SG 2.99Å; L2104-C2106 VanDerWaalsContact C-N 3.28Å; L2104-C2106 PolarHBondContact O-N 3.34Å; C2106-C2110 PolarHBondContact O-N 3.18Å; C2106-C2110 VanDerWaalsContact O-N 3.08Å; C2106-C2110 PolarHBondContact O-SG 3.1Å
2107L42.6Very low45Very low66.6667 Ų66.666774.2 Ų74.235%0.34940%0.398SS..Hα-helixtrans-69.8-44.6174.7-75.7170.6000111.3G2103 L2104 D2105 I2109 C2110 E2111 I2276 W2280G2103-L2107 WeakPolarHBondContact O-CG 3.31Å; G2103-L2107 PolarHBondContact O-N 3.17Å; L2104-L2107 HydrophobicContact CD2-CD1 4.42Å; L2104-L2107 CarbonylContact O-C 3.46Å; L2104-L2107 WeakPolarHBondContact O-CA 3.26Å; L2104-L2107 VanDerWaalsContact O-CB 3.31Å; L2104-L2107 WeakPolarHBondContact O-CB 3.32Å; L2104-L2107 PolarHBondContact O-N 3.11Å; L2104-L2107 VanDerWaalsContact O-N 3.07Å; D2105-L2107 VanDerWaalsContact C-N 3.3Å; D2105-L2107 PolarHBondContact O-N 3.23Å; L2107-I2109 PolarHBondContact O-N 3.25Å; L2107-C2110 WeakPolarHBondContact O-CB 3.45Å; L2107-C2110 PolarHBondContact O-N 3.01Å; L2107-E2111 PolarHBondContact O-N 3.32Å; L2107-E2111 VanDerWaalsContact O-N 3.09Å; L2107-I2276 HydrophobicContact CD2-CD1 4.34Å; L2107-I2276 HydrophobicContact CD2-CG2 3.68Å; L2107-I2276 HydrophobicContact CG-CG2 4.36Å; L2107-W2280 HydrophobicContact CD1-CH2 3.99Å; L2107-W2280 HydrophobicContact CD1-CZ2 3.48Å; L2107-W2280 VanDerWaalsContact CD1-CZ2 3.48Å; L2107-W2280 HydrophobicContact CG-CZ2 4.12Å
2108Y44.8Very low44.2Very low83 Ų8379.6 Ų79.633%0.32542%0.423SS..Hα-helixtrans-73.2-35.2-177.3-72.4-56.2000113.5L2104 D2105 C2110 E2111 D2112L2104-Y2108 HydrophobicContact CB-CD2 3.98Å; L2104-Y2108 HydrophobicContact CB-CE2 4.03Å; L2104-Y2108 HydrophobicContact CD1-CE2 4.26Å; L2104-Y2108 HydrophobicContact CD2-CD2 3.97Å; L2104-Y2108 HydrophobicContact CD2-CE2 3.43Å; L2104-Y2108 HydrophobicContact CG-CE2 4.25Å; L2104-Y2108 WeakPolarHBondContact O-CB 3.48Å; L2104-Y2108 VanDerWaalsContact O-CD2 3.23Å; L2104-Y2108 WeakPolarHBondContact O-CD2 3.46Å; L2104-Y2108 PolarHBondContact O-N 3.05Å; L2104-Y2108 VanDerWaalsContact O-N 3.14Å; D2105-Y2108 WeakPolarHBondContact O-CB 3.23Å; D2105-Y2108 PolarHBondContact O-N 3.28Å; D2105-Y2108 VanDerWaalsContact O-N 3.16Å; Y2108-C2110 VanDerWaalsContact C-N 3.35Å; Y2108-C2110 PolarHBondContact O-N 3.39Å; Y2108-E2111 WeakPolarHBondContact CD1-OE2 3.35Å; Y2108-E2111 WeakPolarHBondContact O-CA 3.49Å; Y2108-E2111 WeakPolarHBondContact O-CB 3.43Å; Y2108-E2111 PolarHBondContact O-N 3.25Å; Y2108-E2111 VanDerWaalsContact O-N 3.15Å; Y2108-D2112 PolarHBondContact O-N 3.12Å; Y2108-D2112 VanDerWaalsContact O-N 3.14Å
2109I42.9Very low42.9Very low101.667 Ų101.66785.6 Ų85.652%0.52145%0.45SS..Hα-helixtrans-60.1-31.3174.2-67.4165000110.9D2105 L2107 E2111 D2112 D2113D2105-I2109 HydrophobicContact CB-CD1 4.44Å; D2105-I2109 WeakPolarHBondContact O-CB 3.37Å; D2105-I2109 WeakPolarHBondContact O-CD1 3.33Å; D2105-I2109 WeakPolarHBondContact O-CG1 3.36Å; D2105-I2109 PolarHBondContact O-N 3.19Å; L2107-I2109 PolarHBondContact O-N 3.25Å; I2109-E2111 VanDerWaalsContact C-N 3.26Å; I2109-E2111 PolarHBondContact O-N 2.93Å; I2109-D2112 PolarHBondContact O-N 3.23Å; I2109-D2113 PolarHBondContact O-N 3.1Å
2110C39.9Very low41.8Very low71.6667 Ų71.666792.6 Ų92.648%0.48448%0.479SS..Hα-helixtrans-75.3-21.8176.2-65.30000114.1C2106 L2107 Y2108 N2114C2106-C2110 PolarHBondContact O-N 3.18Å; C2106-C2110 VanDerWaalsContact O-N 3.08Å; C2106-C2110 PolarHBondContact O-SG 3.1Å; L2107-C2110 WeakPolarHBondContact O-CB 3.45Å; L2107-C2110 PolarHBondContact O-N 3.01Å; Y2108-C2110 VanDerWaalsContact C-N 3.35Å; Y2108-C2110 PolarHBondContact O-N 3.39Å; C2110-N2114 PolarHBondContact O-ND2 3.3Å
2111E36.7Very low40.7Very low81.6667 Ų81.6667100.6 Ų100.638%0.38251%0.51SS..Hα-helixtrans-79.4-36.8176.8-74.9-173.4160.600112.4L2107 Y2108 I2109 D2113 N2114 N2115 R2255L2107-E2111 PolarHBondContact O-N 3.32Å; L2107-E2111 VanDerWaalsContact O-N 3.09Å; Y2108-E2111 WeakPolarHBondContact CD1-OE2 3.35Å; Y2108-E2111 WeakPolarHBondContact O-CA 3.49Å; Y2108-E2111 WeakPolarHBondContact O-CB 3.43Å; Y2108-E2111 PolarHBondContact O-N 3.25Å; Y2108-E2111 VanDerWaalsContact O-N 3.15Å; I2109-E2111 VanDerWaalsContact C-N 3.26Å; I2109-E2111 PolarHBondContact O-N 2.93Å; E2111-D2113 VanDerWaalsContact C-N 3.32Å; E2111-D2113 PolarHBondContact O-N 3.46Å; E2111-N2114 PolarHBondContact O-N 2.97Å; E2111-N2115 PolarHBondContact O-N 2.81Å; E2111-R2255 IonicContact OE1-CZ 3.97Å; E2111-R2255 IonicContact OE1-NH1 2.75Å; E2111-R2255 IonicContact OE1-NH2 2.71Å; E2111-R2255 PolarHBondContact OE1-NH2 2.82Å
2112D39.1Very low39.6Very low93.3333 Ų93.3333107.4 Ų107.450%0.49954%0.539SS..Hα-helixtrans-71.9-29.2-175.4-84.1-17.5000113.5Y2028 Y2108 I2109 N2114 N2115 N2116Y2028-D2112 HydrophobicContact CE1-CB 4.44Å; Y2028-D2112 WeakPolarHBondContact OH-CB 3.31Å; Y2028-D2112 PolarHBondContact OH-OD1 2.96Å; Y2028-D2112 PolarHBondContact OH-OD2 2.97Å; Y2108-D2112 PolarHBondContact O-N 3.12Å; Y2108-D2112 VanDerWaalsContact O-N 3.14Å; I2109-D2112 PolarHBondContact O-N 3.23Å; D2112-N2114 VanDerWaalsContact C-N 3.26Å; D2112-N2114 PolarHBondContact O-N 3.18Å; D2112-N2115 PolarHBondContact O-N 2.96Å; D2112-N2116 VanDerWaalsContact O-CB 3.29Å; D2112-N2116 WeakPolarHBondContact O-CB 3.47Å; D2112-N2116 PolarHBondContact O-N 3.32Å; D2112-N2116 VanDerWaalsContact O-N 3.11Å; D2112-N2116 PolarHBondContact O-ND2 3.3Å
2113D38.8Very low38.5Very low125.667 Ų125.667110.2 Ų110.267%0.67256%0.559SS**Hα-helixtrans-68.2-22.6174.9-84.4-17.5000112.8I2109 E2111I2109-D2113 PolarHBondContact O-N 3.1Å; E2111-D2113 VanDerWaalsContact C-N 3.32Å; E2111-D2113 PolarHBondContact O-N 3.46Å
2114N38.2Very low37.6Very low120 Ų120116.9 Ų116.964%0.64259%0.589SS**Hα-helixtrans-89-23.4-179.9-80.3-33.8000113.9C2110 E2111 D2112C2110-N2114 PolarHBondContact O-ND2 3.3Å; E2111-N2114 PolarHBondContact O-N 2.97Å; D2112-N2114 VanDerWaalsContact C-N 3.26Å; D2112-N2114 PolarHBondContact O-N 3.18Å
2115N36.9Very low36.6Very low112.333 Ų112.333121 Ų12160%0.60162%0.619SS**Hα-helixtrans-88.1-19.1-178.3-80.8-24.7000114.3E2111 D2112 N2117 N2118E2111-N2115 PolarHBondContact O-N 2.81Å; D2112-N2115 PolarHBondContact O-N 2.96Å; N2115-N2117 VanDerWaalsContact C-N 3.3Å; N2115-N2117 PolarHBondContact O-N 3.25Å; N2115-N2118 PolarHBondContact O-N 2.96Å
2116N34Very low35.7Very low123.333 Ų123.333125.9 Ų125.966%0.6664%0.639SS**THydrogen-bonded Turntrans-84.330.1179.1-76.9-27.9000113.7D2112 N2118D2112-N2116 VanDerWaalsContact O-CB 3.29Å; D2112-N2116 WeakPolarHBondContact O-CB 3.47Å; D2112-N2116 PolarHBondContact O-N 3.32Å; D2112-N2116 VanDerWaalsContact O-N 3.11Å; D2112-N2116 PolarHBondContact O-ND2 3.3Å; N2116-N2118 PolarHBondContact O-N 3.09Å
2117N37.6Very low34.8Very low142.333 Ų142.333135.4 Ų135.476%0.76167%0.669SS**THydrogen-bonded Turntrans-81.514.9167.2-70.4-31.8000114.5N2115 Q2119N2115-N2117 VanDerWaalsContact C-N 3.3Å; N2115-N2117 PolarHBondContact O-N 3.25Å; N2117-Q2119 PolarHBondContact O-N 2.74Å; N2117-Q2119 VanDerWaalsContact O-N 3.12Å
2118N34.6Very low34.3Very low138.667 Ų138.667137 Ų13774%0.74269%0.686SS**SBendtrans-109.380167.9-75.2-31.8000111.4N2115 N2116N2115-N2118 PolarHBondContact O-N 2.96Å; N2116-N2118 PolarHBondContact O-N 3.09Å
2119Q31.2Very low33.8Very low177.333 Ų177.333138.3 Ų138.383%0.82970%0.698SS**  trans159.4122.2145.5-88.3167.130.100114.7N2117N2117-Q2119 PolarHBondContact O-N 2.74Å; N2117-Q2119 VanDerWaalsContact O-N 3.12Å
2120Q30.3Very low33.3Very low184.667 Ų184.667142 Ų14286%0.86371%0.713SS**  trans25.3101.3161.9-64.9179.1-2300116Q2122Q2120-Q2122 PolarHBondContact O-N 2.97Å
2121Y30.2Very low33Very low225.667 Ų225.667142.8 Ų142.889%0.88572%0.72SS**  trans-41.9110.1146.4-80.3-90.3000113.9
2122Q28.2Very low33Very low174 Ų174142.9 Ų142.981%0.81372%0.722SS**  trans-154.8126.7133.1-91.3171-11.400110.1Q2120Q2120-Q2122 PolarHBondContact O-N 2.97Å
2123D29.2Very low32.9Very low137.667 Ų137.667144.4 Ų144.474%0.73673%0.727SS**  trans65.7100.7151-55.6-23.1000119.1
2124I30.2Very low32.6Very low160 Ų160142.6 Ų142.682%0.82172%0.717SS**  146.7101124.7-72.6152.4000110.3H2126I2124-H2126 PolarHBondContact O-N 2.73Å
2125S28.5Very low32.4Very low101.667 Ų101.667141.3 Ų141.371%0.71171%0.708SS**  trans-128.198.5148.652.20000112.3
2126H29.3Very low32.4Very low178.333 Ų178.333139.3 Ų139.383%0.82670%0.697SS**  trans154.797.3148.1-75.5-56.5000115I2124I2124-H2126 PolarHBondContact O-N 2.73Å
2127R28.2Very low32.4Very low244 Ų244137 Ų13792%0.92168%0.684SS**  trans145.473.4148.9-95.6177.3-166.1-134.91.8115.5
2128S31.1Very low32.3Very low101 Ų101132.7 Ų132.771%0.70666%0.661SS**  trans-165.890.7143.750.60000110.5
2129N34Very low32.5Very low108.667 Ų108.667131.8 Ų131.858%0.58165%0.647SS**  trans-163.925.6169.9-83.6-6.7000114.1S2131 N2132 Q2133N2129-S2131 PolarHBondContact O-N 2.91Å; N2129-N2132 HydrophobicContact CB-CB 4.37Å; N2129-Q2133 WeakPolarHBondContact O-CG 3.34Å
2130E32.5Very low32.5Very low180 Ų180127.5 Ų127.584%0.84163%0.626SS**THydrogen-bonded Turntrans-80.7-26.9176.1-71.8177.9171.600112.9N2132 Q2133E2130-N2132 PolarHBondContact O-N 3.2Å; E2130-Q2133 PolarHBondContact O-N 3.27Å
2131S34.3Very low32.7Very low88.6667 Ų88.6667125.5 Ų125.562%0.6261%0.61SS**THydrogen-bonded Turntrans-77.2-25178.356.20000114.3N2129N2129-S2131 PolarHBondContact O-N 2.91Å
2132N37.5Very low33Very low83 Ų83116.5 Ų116.544%0.44458%0.581SS.*Hα-helixtrans-79.6-25.7-177.2-72.3-0.2000112.6N2129 E2130 L2134 M2135 D2136N2129-N2132 HydrophobicContact CB-CB 4.37Å; E2130-N2132 PolarHBondContact O-N 3.2Å; N2132-L2134 VanDerWaalsContact C-N 3.29Å; N2132-L2134 PolarHBondContact O-N 3.28Å; N2132-M2135 PolarHBondContact O-N 3.4Å; N2132-D2136 WeakPolarHBondContact O-CA 3.25Å; N2132-D2136 WeakPolarHBondContact O-CB 3.44Å; N2132-D2136 PolarHBondContact O-N 3.14Å; N2132-D2136 VanDerWaalsContact O-N 3.13Å; N2132-D2136 VanDerWaalsContact O-OD2 3.12Å
2133Q37Very low33.3Very low126.333 Ų126.333109.1 Ų109.159%0.5955%0.548SS*.Hα-helixtrans-68.4-26.9-176.3-67.8-178.8-0.100113.8N2129 E2130 L2137N2129-Q2133 WeakPolarHBondContact O-CG 3.34Å; E2130-Q2133 PolarHBondContact O-N 3.27Å; Q2133-L2137 WeakPolarHBondContact O-CB 3.37Å; Q2133-L2137 PolarHBondContact O-N 2.99Å; Q2133-L2137 VanDerWaalsContact O-N 3.08Å
2134L32.2Very low33.4Very low87.3333 Ų87.3333109.6 Ų109.646%0.45754%0.544SS..Hα-helixtrans-81.1-35.5-179.2-152.5142.5000111.8V2012 N2013 L2016 N2132 D2136 L2137 I2138V2012-L2134 HydrophobicContact CB-CD2 4.48Å; V2012-L2134 HydrophobicContact CG1-CD2 3.94Å; V2012-L2134 HydrophobicContact CG1-CG 4.22Å; N2013-L2134 WeakPolarHBondContact OD1-CD2 3.23Å; L2016-L2134 HydrophobicContact CD1-CD1 3.98Å; L2016-L2134 HydrophobicContact CD1-CG 4.17Å; N2132-L2134 VanDerWaalsContact C-N 3.29Å; N2132-L2134 PolarHBondContact O-N 3.28Å; L2134-D2136 PolarHBondContact O-N 3.33Å; L2134-L2137 PolarHBondContact O-N 2.86Å; L2134-L2137 VanDerWaalsContact O-N 3.08Å; L2134-I2138 HydrophobicContact CD2-CD1 3.96Å; L2134-I2138 HydrophobicContact CD2-CG1 4.17Å; L2134-I2138 WeakPolarHBondContact O-CD1 3.36Å; L2134-I2138 VanDerWaalsContact O-CG1 3.27Å; L2134-I2138 WeakPolarHBondContact O-CG1 3.45Å; L2134-I2138 PolarHBondContact O-N 3.23Å
2135M33.6Very low33.5Very low92.3333 Ų92.3333107.7 Ų107.746%0.45553%0.53SS..Hα-helixtrans-70.6-33.3169-78.2-65.5-79.500111.5Y2102 N2132 L2137 I2138 W2139Y2102-M2135 HydrophobicContact CD2-CB 4.42Å; Y2102-M2135 HydrophobicContact CE2-CB 4.39Å; N2132-M2135 PolarHBondContact O-N 3.4Å; M2135-L2137 VanDerWaalsContact C-N 3.3Å; M2135-L2137 PolarHBondContact O-N 3.27Å; M2135-I2138 PolarHBondContact O-N 2.82Å; M2135-I2138 VanDerWaalsContact O-N 3.12Å; M2135-I2138 HydrophobicContact SD-CD1 3.41Å; M2135-I2138 WeakPolarHBondContact SD-CD1 3.46Å; M2135-W2139 VanDerWaalsContact O-CA 3.3Å; M2135-W2139 WeakPolarHBondContact O-CA 3.34Å; M2135-W2139 WeakPolarHBondContact O-CB 3.27Å; M2135-W2139 PolarHBondContact O-N 3.33Å
2136D36.8Very low33.7Very low71 Ų71107.6 Ų107.638%0.3852%0.518SS..Hα-helixtrans-61-37.3172.2-73.7-27.2000111.5Y2102 N2132 L2134 W2139 F2140Y2102-D2136 WeakPolarHBondContact CE2-OD1 3.05Å; Y2102-D2136 VanDerWaalsContact OH-CA 3.27Å; Y2102-D2136 WeakPolarHBondContact OH-CA 3.05Å; Y2102-D2136 PolarHBondContact OH-OD1 3.26Å; N2132-D2136 WeakPolarHBondContact O-CA 3.25Å; N2132-D2136 WeakPolarHBondContact O-CB 3.44Å; N2132-D2136 PolarHBondContact O-N 3.14Å; N2132-D2136 VanDerWaalsContact O-N 3.13Å; N2132-D2136 VanDerWaalsContact O-OD2 3.12Å; L2134-D2136 PolarHBondContact O-N 3.33Å; D2136-W2139 CarbonylContact O-C 3.43Å; D2136-F2140 VanDerWaalsContact O-CA 3.26Å; D2136-F2140 WeakPolarHBondContact O-CA 3.39Å; D2136-F2140 VanDerWaalsContact O-CB 3.28Å; D2136-F2140 WeakPolarHBondContact O-CB 3.4Å; D2136-F2140 VanDerWaalsContact O-CD2 3.3Å; D2136-F2140 WeakPolarHBondContact O-CD2 3.33Å; D2136-F2140 PolarHBondContact O-N 3.26Å
2137L34.8Very low33.8Very low73.6667 Ų73.6667106.7 Ų106.739%0.38651%0.507SS..Hα-helixtrans-73.2-39.2178.1-85.8161.8000113.7V2012 L2016 Y2019 Q2133 L2134 M2135 W2139 F2140 R2141V2012-L2137 HydrophobicContact CG1-CB 4.13Å; L2016-L2137 HydrophobicContact CD1-CB 4.29Å; L2016-L2137 HydrophobicContact CD1-CD1 4.42Å; L2016-L2137 HydrophobicContact CD2-CD1 4.33Å; Y2019-L2137 HydrophobicContact CE1-CD1 4.32Å; Y2019-L2137 HydrophobicContact CE2-CD1 4.01Å; Y2019-L2137 WeakPolarHBondContact OH-CD2 3.44Å; Q2133-L2137 WeakPolarHBondContact O-CB 3.37Å; Q2133-L2137 PolarHBondContact O-N 2.99Å; Q2133-L2137 VanDerWaalsContact O-N 3.08Å; L2134-L2137 PolarHBondContact O-N 2.86Å; L2134-L2137 VanDerWaalsContact O-N 3.08Å; M2135-L2137 VanDerWaalsContact C-N 3.3Å; M2135-L2137 PolarHBondContact O-N 3.27Å; L2137-W2139 VanDerWaalsContact C-N 3.29Å; L2137-W2139 PolarHBondContact O-N 2.88Å; L2137-F2140 HydrophobicContact CD2-CB 4.41Å; L2137-F2140 PolarHBondContact O-N 3.34Å; L2137-F2140 VanDerWaalsContact O-N 3.09Å; L2137-R2141 WeakPolarHBondContact O-CB 3.41Å; L2137-R2141 WeakPolarHBondContact O-CG 3.22Å; L2137-R2141 PolarHBondContact O-N 3.12Å
2138I35.5Very low33.8Very low53.6667 Ų53.6667103.6 Ų103.628%0.27550%0.497SS..Hα-helixtrans-62.1-45177.4-70.7167.1000109.8V2012 N2013 L2134 M2135 R2141 S2142V2012-I2138 HydrophobicContact CB-CD1 4.04Å; V2012-I2138 HydrophobicContact CB-CG1 3.59Å; V2012-I2138 HydrophobicContact CG1-CD1 4.32Å; V2012-I2138 HydrophobicContact CG1-CG1 3.8Å; V2012-I2138 HydrophobicContact CG1-CG2 4.38Å; V2012-I2138 WeakPolarHBondContact CG1-O 2.92Å; V2012-I2138 HydrophobicContact CG2-CB 4.44Å; V2012-I2138 HydrophobicContact CG2-CD1 4.3Å; V2012-I2138 HydrophobicContact CG2-CG1 3.38Å; N2013-I2138 HydrophobicContact CB-CD1 4.22Å; N2013-I2138 HydrophobicContact CB-CG1 4.33Å; N2013-I2138 WeakPolarHBondContact OD1-CG2 3.16Å; L2134-I2138 HydrophobicContact CD2-CD1 3.96Å; L2134-I2138 HydrophobicContact CD2-CG1 4.17Å; L2134-I2138 WeakPolarHBondContact O-CD1 3.36Å; L2134-I2138 VanDerWaalsContact O-CG1 3.27Å; L2134-I2138 WeakPolarHBondContact O-CG1 3.45Å; L2134-I2138 PolarHBondContact O-N 3.23Å; M2135-I2138 PolarHBondContact O-N 2.82Å; M2135-I2138 VanDerWaalsContact O-N 3.12Å; M2135-I2138 HydrophobicContact SD-CD1 3.41Å; M2135-I2138 WeakPolarHBondContact SD-CD1 3.46Å; I2138-R2141 PolarHBondContact O-N 3.38Å; I2138-S2142 WeakPolarHBondContact O-CB 3.19Å; I2138-S2142 PolarHBondContact O-N 2.85Å; I2138-S2142 VanDerWaalsContact O-N 3.1Å; I2138-S2142 PolarHBondContact O-OG 2.96Å
2139W37.6Very low33.8Very low119 Ų119103.4 Ų103.445%0.45149%0.488SS..Hα-helixtrans-77.2-28175-166.9-104.2000112.6Y2102 M2135 D2136 L2137 R2141 S2142 S2143Y2102-W2139 HydrophobicContact CD1-CB 3.82Å; Y2102-W2139 HydrophobicContact CD1-CD2 4.43Å; Y2102-W2139 AromaticContact CD1-CG 3.95Å; Y2102-W2139 HydrophobicContact CD1-CG 3.95Å; Y2102-W2139 HydrophobicContact CE1-CB 3.05Å; Y2102-W2139 AromaticContact CE1-CD1 3.55Å; Y2102-W2139 HydrophobicContact CE1-CD2 4.25Å; Y2102-W2139 AromaticContact CE1-CG 3.34Å; Y2102-W2139 HydrophobicContact CE1-CG 3.34Å; M2135-W2139 VanDerWaalsContact O-CA 3.3Å; M2135-W2139 WeakPolarHBondContact O-CA 3.34Å; M2135-W2139 WeakPolarHBondContact O-CB 3.27Å; M2135-W2139 PolarHBondContact O-N 3.33Å; D2136-W2139 CarbonylContact O-C 3.43Å; L2137-W2139 VanDerWaalsContact C-N 3.29Å; L2137-W2139 PolarHBondContact O-N 2.88Å; W2139-R2141 PolarHBondContact O-N 3.08Å; W2139-R2141 VanDerWaalsContact O-N 3.13Å; W2139-S2142 WeakPolarHBondContact CA-OG 3.45Å; W2139-S2142 VanDerWaalsContact CZ3-OG 3.31Å; W2139-S2142 WeakPolarHBondContact CZ3-OG 3.28Å; W2139-S2142 CarbonylContact O-C 3.52Å; W2139-S2142 PolarHBondContact O-N 3.07Å; W2139-S2142 PolarHBondContact O-OG 3.29Å; W2139-S2143 WeakPolarHBondContact O-CA 3.08Å; W2139-S2143 VanDerWaalsContact O-CB 3.27Å; W2139-S2143 WeakPolarHBondContact O-CB 3.35Å; W2139-S2143 PolarHBondContact O-N 3.2Å; W2139-S2143 PolarHBondContact O-OG 2.97Å
2140F32.5Very low33.7Very low86.6667 Ų86.6667101.3 Ų101.338%0.3848%0.481SS..Hα-helixtrans-62.8-33.9174.3-117.9-86.9000111.8N1728 D2136 L2137 S2143 K2144N1728-F2140 HydrophobicContact CB-CE1 4.36Å; N1728-F2140 HydrophobicContact CB-CE2 3.96Å; N1728-F2140 HydrophobicContact CB-CZ 3.62Å; N1728-F2140 WeakPolarHBondContact ND2-CE2 3.44Å; N1728-F2140 WeakPolarHBondContact OD1-CE1 3.2Å; N1728-F2140 WeakPolarHBondContact OD1-CZ 3.48Å; D2136-F2140 VanDerWaalsContact O-CA 3.26Å; D2136-F2140 WeakPolarHBondContact O-CA 3.39Å; D2136-F2140 VanDerWaalsContact O-CB 3.28Å; D2136-F2140 WeakPolarHBondContact O-CB 3.4Å; D2136-F2140 VanDerWaalsContact O-CD2 3.3Å; D2136-F2140 WeakPolarHBondContact O-CD2 3.33Å; D2136-F2140 PolarHBondContact O-N 3.26Å; L2137-F2140 HydrophobicContact CD2-CB 4.41Å; L2137-F2140 PolarHBondContact O-N 3.34Å; L2137-F2140 VanDerWaalsContact O-N 3.09Å; F2140-S2143 VanDerWaalsContact CA-OG 3.25Å; F2140-S2143 WeakPolarHBondContact CA-OG 3.33Å; F2140-S2143 PolarHBondContact O-OG 3.02Å; F2140-K2144 VanDerWaalsContact O-CB 3.25Å; F2140-K2144 WeakPolarHBondContact O-CB 3.33Å; F2140-K2144 PolarHBondContact O-N 3.22Å; F2140-K2144 VanDerWaalsContact O-N 3.1Å
2141R33.2Very low33.6Very low142 Ų142102.2 Ų102.254%0.53648%0.478SS..Hα-helixtrans-71.8-43.7174-90-174.6173.4178.5-1.8112.1E2015 L2137 I2138 W2139 S2143 K2144 F2145E2015-R2141 VanDerWaalsContact CB-NH1 3.35Å; E2015-R2141 IonicContact OE2-CZ 2.65Å; E2015-R2141 IonicContact OE2-NH1 3.69Å; E2015-R2141 PolarHBondContact OE2-NH1 3.12Å; E2015-R2141 IonicContact OE2-NH2 3.78Å; E2015-R2141 PolarHBondContact OE2-NH2 3.46Å; L2137-R2141 WeakPolarHBondContact O-CB 3.41Å; L2137-R2141 WeakPolarHBondContact O-CG 3.22Å; L2137-R2141 PolarHBondContact O-N 3.12Å; I2138-R2141 PolarHBondContact O-N 3.38Å; W2139-R2141 PolarHBondContact O-N 3.08Å; W2139-R2141 VanDerWaalsContact O-N 3.13Å; R2141-S2143 VanDerWaalsContact C-N 3.29Å; R2141-S2143 PolarHBondContact O-N 2.69Å; R2141-K2144 PolarHBondContact O-N 3.13Å; R2141-F2145 VanDerWaalsContact O-CB 3.29Å; R2141-F2145 WeakPolarHBondContact O-CB 3.5Å; R2141-F2145 PolarHBondContact O-N 3.49Å
2142S36.3Very low33.3Very low38 Ų38102.4 Ų102.427%0.26648%0.48SS..Hα-helixtrans-67.1-36.8174.965.60000112.5I2138 W2139 F2145 Q2146I2138-S2142 WeakPolarHBondContact O-CB 3.19Å; I2138-S2142 PolarHBondContact O-N 2.85Å; I2138-S2142 VanDerWaalsContact O-N 3.1Å; I2138-S2142 PolarHBondContact O-OG 2.96Å; W2139-S2142 WeakPolarHBondContact CA-OG 3.45Å; W2139-S2142 VanDerWaalsContact CZ3-OG 3.31Å; W2139-S2142 WeakPolarHBondContact CZ3-OG 3.28Å; W2139-S2142 CarbonylContact O-C 3.52Å; W2139-S2142 PolarHBondContact O-N 3.07Å; W2139-S2142 PolarHBondContact O-OG 3.29Å; S2142-F2145 CarbonylContact O-C 3.58Å; S2142-F2145 WeakPolarHBondContact O-CA 3.42Å; S2142-F2145 VanDerWaalsContact O-CB 3.31Å; S2142-F2145 WeakPolarHBondContact O-CB 3.41Å; S2142-F2145 PolarHBondContact O-N 2.98Å; S2142-F2145 VanDerWaalsContact O-N 3.14Å; S2142-Q2146 PolarHBondContact O-N 2.85Å
2143S35.1Very low32.9Very low19 Ų19102.8 Ų102.813%0.13349%0.489CS..Hα-helixtrans-78.9-26.8179.371.50000113.6W2139 F2140 R2141 F2145 Q2146 R2147W2139-S2143 WeakPolarHBondContact O-CA 3.08Å; W2139-S2143 VanDerWaalsContact O-CB 3.27Å; W2139-S2143 WeakPolarHBondContact O-CB 3.35Å; W2139-S2143 PolarHBondContact O-N 3.2Å; W2139-S2143 PolarHBondContact O-OG 2.97Å; F2140-S2143 VanDerWaalsContact CA-OG 3.25Å; F2140-S2143 WeakPolarHBondContact CA-OG 3.33Å; F2140-S2143 PolarHBondContact O-OG 3.02Å; R2141-S2143 VanDerWaalsContact C-N 3.29Å; R2141-S2143 PolarHBondContact O-N 2.69Å; S2143-F2145 VanDerWaalsContact C-N 3.34Å; S2143-F2145 PolarHBondContact O-N 3.31Å; S2143-Q2146 CarbonylContact O-C 3.47Å; S2143-Q2146 WeakPolarHBondContact O-CA 3.27Å; S2143-Q2146 WeakPolarHBondContact O-CB 3.01Å; S2143-Q2146 PolarHBondContact O-N 3.12Å; S2143-R2147 VanDerWaalsContact O-CB 3.3Å; S2143-R2147 WeakPolarHBondContact O-CB 3.29Å; S2143-R2147 PolarHBondContact O-N 3.2Å
2144K31.2Very low32.4Very low148 Ų148101 Ų10164%0.64349%0.49SS*.Hα-helixtrans-61.1-35.2165.9-111.4-177.2178.6176.10110.9F2140 R2141 Q2146 R2147 Y2148F2140-K2144 VanDerWaalsContact O-CB 3.25Å; F2140-K2144 WeakPolarHBondContact O-CB 3.33Å; F2140-K2144 PolarHBondContact O-N 3.22Å; F2140-K2144 VanDerWaalsContact O-N 3.1Å; R2141-K2144 PolarHBondContact O-N 3.13Å; K2144-Q2146 PolarHBondContact O-N 3.2Å; K2144-R2147 PolarHBondContact O-N 3.49Å; K2144-Y2148 PolarHBondContact O-N 3.34Å
2145F32.4Very low32.1Very low120.333 Ų120.333102.3 Ų102.353%0.52851%0.507SS..Hα-helixtrans-68.5-38.2173.2-146.5-92.5000111.7R2141 S2142 S2143 Y2148 L2149R2141-F2145 VanDerWaalsContact O-CB 3.29Å; R2141-F2145 WeakPolarHBondContact O-CB 3.5Å; R2141-F2145 PolarHBondContact O-N 3.49Å; S2142-F2145 CarbonylContact O-C 3.58Å; S2142-F2145 WeakPolarHBondContact O-CA 3.42Å; S2142-F2145 VanDerWaalsContact O-CB 3.31Å; S2142-F2145 WeakPolarHBondContact O-CB 3.41Å; S2142-F2145 PolarHBondContact O-N 2.98Å; S2142-F2145 VanDerWaalsContact O-N 3.14Å; S2143-F2145 VanDerWaalsContact C-N 3.34Å; S2143-F2145 PolarHBondContact O-N 3.31Å; F2145-Y2148 WeakPolarHBondContact O-CB 3.33Å; F2145-Y2148 PolarHBondContact O-N 3.22Å; F2145-L2149 HydrophobicContact CD1-CD1 4.2Å; F2145-L2149 HydrophobicContact CE1-CD1 4.14Å; F2145-L2149 PolarHBondContact O-N 3.43Å
2146Q33.4Very low31.8Very low99.3333 Ų99.3333102.9 Ų102.946%0.46452%0.52SS..Hα-helixtrans-74.1-36.1177.9-164.6173.2-1.200113.8S2142 S2143 K2144 Y2148 L2149 S2150 M2194S2142-Q2146 PolarHBondContact O-N 2.85Å; S2143-Q2146 CarbonylContact O-C 3.47Å; S2143-Q2146 WeakPolarHBondContact O-CA 3.27Å; S2143-Q2146 WeakPolarHBondContact O-CB 3.01Å; S2143-Q2146 PolarHBondContact O-N 3.12Å; K2144-Q2146 PolarHBondContact O-N 3.2Å; Q2146-Y2148 PolarHBondContact O-N 3.29Å; Q2146-L2149 WeakPolarHBondContact O-CB 3.15Å; Q2146-L2149 PolarHBondContact O-N 3Å; Q2146-S2150 PolarHBondContact O-N 3.07Å; Q2146-S2150 PolarHBondContact O-OG 3.36Å; Q2146-M2194 HydrophobicContact CB-CE 3.83Å; Q2146-M2194 HydrophobicContact CG-CE 3.89Å; Q2146-M2194 HydrophobicContact CG-SD 4.4Å
2147R30Very low31.2Very low158 Ų158105.3 Ų105.360%0.59654%0.543SS*.Hα-helixtrans-70.2-27.6176.6-84.4-174.3167.2162.8-1.1113N1730 S2143 K2144 L2149 S2150 Y2151N1730-R2147 VanDerWaalsContact ND2-CZ 3.26Å; N1730-R2147 PolarHBondContact ND2-NH1 3.28Å; N1730-R2147 PolarHBondContact ND2-NH2 3.34Å; N1730-R2147 PolarHBondContact OD1-NH1 3.1Å; N1730-R2147 PolarHBondContact OD1-NH2 3.28Å; S2143-R2147 VanDerWaalsContact O-CB 3.3Å; S2143-R2147 WeakPolarHBondContact O-CB 3.29Å; S2143-R2147 PolarHBondContact O-N 3.2Å; K2144-R2147 PolarHBondContact O-N 3.49Å; R2147-L2149 VanDerWaalsContact C-N 3.3Å; R2147-L2149 PolarHBondContact O-N 2.77Å; R2147-S2150 PolarHBondContact O-N 3.27Å; R2147-S2150 PolarHBondContact O-OG 2.88Å; R2147-Y2151 PolarHBondContact O-N 2.83Å
2148Y29.6Very low30.8Very low180.333 Ų180.333106.9 Ų106.971%0.70756%0.559SS**Hα-helixtrans-69.5-28.7173.3-120.3-86.2000112.4K2144 F2145 Q2146 S2152K2144-Y2148 PolarHBondContact O-N 3.34Å; F2145-Y2148 WeakPolarHBondContact O-CB 3.33Å; F2145-Y2148 PolarHBondContact O-N 3.22Å; Q2146-Y2148 PolarHBondContact O-N 3.29Å; Y2148-S2152 PolarHBondContact O-N 3.26Å; Y2148-S2152 PolarHBondContact O-OG 3.02Å
2149L31Very low30.4Very low96.6667 Ų96.6667109.9 Ų109.951%0.50659%0.585SS.*Hα-helixtrans-75.9-32.2177.4-78.3162.7000113.2F2145 Q2146 R2147 Y2151 S2152 S2153 M2194F2145-L2149 HydrophobicContact CD1-CD1 4.2Å; F2145-L2149 HydrophobicContact CE1-CD1 4.14Å; F2145-L2149 PolarHBondContact O-N 3.43Å; Q2146-L2149 WeakPolarHBondContact O-CB 3.15Å; Q2146-L2149 PolarHBondContact O-N 3Å; R2147-L2149 VanDerWaalsContact C-N 3.3Å; R2147-L2149 PolarHBondContact O-N 2.77Å; L2149-Y2151 PolarHBondContact O-N 2.98Å; L2149-S2152 VanDerWaalsContact O-CB 3.25Å; L2149-S2152 WeakPolarHBondContact O-CB 3.49Å; L2149-S2152 PolarHBondContact O-N 3.18Å; L2149-S2152 PolarHBondContact O-OG 3.36Å; L2149-S2153 PolarHBondContact O-OG 3.2Å; L2149-M2194 HydrophobicContact CD1-CE 4.41Å
2150S31.7Very low30Very low63.6667 Ų63.6667112.2 Ų112.245%0.44561%0.605SS.*Hα-helixtrans-78.2-23.2-18065.50000113.9Q2146 R2147 S2152 S2153 S2154Q2146-S2150 PolarHBondContact O-N 3.07Å; Q2146-S2150 PolarHBondContact O-OG 3.36Å; R2147-S2150 PolarHBondContact O-N 3.27Å; R2147-S2150 PolarHBondContact O-OG 2.88Å; S2150-S2152 PolarHBondContact O-N 2.9Å; S2150-S2153 PolarHBondContact O-N 3.11Å; S2150-S2153 PolarHBondContact O-OG 3.49Å; S2150-S2154 PolarHBondContact O-N 3.32Å; S2150-S2154 PolarHBondContact O-OG 3.15Å
2151Y29.6Very low29.8Very low198.667 Ų198.667114.6 Ų114.678%0.77963%0.626SS**Hα-helixtrans-79.8-19174.7-106.8-80.7000113.6R2147 L2149 S2153R2147-Y2151 PolarHBondContact O-N 2.83Å; L2149-Y2151 PolarHBondContact O-N 2.98Å; Y2151-S2153 VanDerWaalsContact C-N 3.31Å; Y2151-S2153 PolarHBondContact O-N 3.31Å
2152S28.8Very low29.5Very low93.3333 Ų93.3333111.3 Ų111.365%0.65364%0.636SS**THydrogen-bonded Turntrans-78.3-5.3178.232.90000114.3Y2148 L2149 S2150Y2148-S2152 PolarHBondContact O-N 3.26Å; Y2148-S2152 PolarHBondContact O-OG 3.02Å; L2149-S2152 VanDerWaalsContact O-CB 3.25Å; L2149-S2152 WeakPolarHBondContact O-CB 3.49Å; L2149-S2152 PolarHBondContact O-N 3.18Å; L2149-S2152 PolarHBondContact O-OG 3.36Å; S2150-S2152 PolarHBondContact O-N 2.9Å
2153S28Very low29.2Very low91.3333 Ų91.3333118.1 Ų118.164%0.63966%0.661SS**THydrogen-bonded Turntrans-138.242.5-17752.60000114L2149 S2150 Y2151L2149-S2153 PolarHBondContact O-OG 3.2Å; S2150-S2153 PolarHBondContact O-N 3.11Å; S2150-S2153 PolarHBondContact O-OG 3.49Å; Y2151-S2153 VanDerWaalsContact C-N 3.31Å; Y2151-S2153 PolarHBondContact O-N 3.31Å
2154S27.8Very low29Very low88 Ų88121.9 Ų121.962%0.61569%0.687SS**  trans-149.575.1162.353.70000112.5S2150 S2156S2150-S2154 PolarHBondContact O-N 3.32Å; S2150-S2154 PolarHBondContact O-OG 3.15Å; S2154-S2156 VanDerWaalsContact C-N 3.32Å; S2154-S2156 PolarHBondContact O-N 3.2Å
2155S25.3Very low29.1Very low116 Ų116120.7 Ų120.781%0.81169%0.688SS**  trans-127.371162.3-59.40000108.4S2157S2155-S2157 PolarHBondContact O-N 3.35Å
2156S27Very low29Very low104.333 Ų104.333121.7 Ų121.773%0.7369%0.694SS**  trans-141114.1157.843.20000109.3S2154 S2158S2154-S2156 VanDerWaalsContact C-N 3.32Å; S2154-S2156 PolarHBondContact O-N 3.2Å; S2156-S2158 PolarHBondContact O-N 3.32Å
2157S25.1Very low29.2Very low122 Ų122119.9 Ų119.985%0.85369%0.692SS**  trans-42.3102.1169.655.60000112.7S2155S2155-S2157 PolarHBondContact O-N 3.35Å
2158S26.3Very low29.5Very low105.667 Ų105.667116.9 Ų116.974%0.73969%0.687SS**  trans-149.8124.214954.90000110.4S2156 I2160S2156-S2158 PolarHBondContact O-N 3.32Å; S2158-I2160 PolarHBondContact O-N 3.49Å
2159S26.9Very low29.6Very low116.667 Ų116.667113.8 Ų113.882%0.81668%0.675SS**  trans-66.9125.9-175.348.80000112.7V2161S2159-V2161 PolarHBondContact O-N 2.74Å
2160I28.4Very low29.8Very low167.667 Ų167.667116.4 Ų116.486%0.8668%0.678SS**  trans-103.5123.1168.7-61.2169.9000110S2158S2158-I2160 PolarHBondContact O-N 3.49Å
2161V28.3Very low30Very low137 Ų137116.7 Ų116.783%0.8368%0.675SS**  trans-93131.7178.4173.30000109.7S2159 K2163S2159-V2161 PolarHBondContact O-N 2.74Å; V2161-K2163 PolarHBondContact O-N 3.04Å
2162G28.2Very low30.3Very low72.6667 Ų72.6667110.9 Ų110.975%0.74965%0.654SS**  trans-33112.7176.100000117
2163K28.9Very low30.5Very low182 Ų182108.8 Ų108.879%0.79164%0.635SS**  trans-113.4115.5160.6-77.9-179.6-179.8-179.30109.1N1729 V2161N1729-K2163 HydrophobicContact CB-CD 4.19Å; V2161-K2163 PolarHBondContact O-N 3.04Å
2164S30.8Very low30.9Very low97.3333 Ų97.3333110.2 Ų110.268%0.68163%0.632SS**  trans-31.8121.2169.754.10000116H2166S2164-H2166 PolarHBondContact O-N 3.11Å
2165D32.7Very low31.2Very low122.667 Ų122.667108.3 Ų108.366%0.65662%0.618SS**THydrogen-bonded Turntrans-24.94.1160.1-60.8-27.1000120Y2169D2165-Y2169 WeakPolarHBondContact O-CD2 3.46Å; D2165-Y2169 VanDerWaalsContact O-CE2 3.24Å; D2165-Y2169 WeakPolarHBondContact O-CE2 3.43Å
2166H32Very low31.5Very low143.333 Ų143.333104.7 Ų104.766%0.66459%0.589SS**THydrogen-bonded Turntrans-93.5-12.7179.8-76.3-25.5000115.9S2164 I2168 W2170S2164-H2166 PolarHBondContact O-N 3.11Å; H2166-I2168 VanDerWaalsContact C-N 3.31Å; H2166-I2168 PolarHBondContact O-N 2.89Å; H2166-W2170 PolarHBondContact O-N 3.06Å
2167S36.4Very low31.8Very low60.3333 Ų60.3333104.3 Ų104.342%0.42258%0.578SS.*SBendtrans-76.5-28.4177760000113.2Y2169 W2170 D2171S2167-Y2169 VanDerWaalsContact C-N 3.29Å; S2167-Y2169 PolarHBondContact O-N 3.04Å; S2167-W2170 PolarHBondContact O-N 3.27Å; S2167-D2171 PolarHBondContact O-N 2.97Å
2168I36.2Very low32.1Very low95 Ų95102.2 Ų102.249%0.48756%0.563SS.*Hα-helixtrans-63.6-33.3-175.2-59.1171.4000111.8H2166 F2172 Y2386H2166-I2168 VanDerWaalsContact C-N 3.31Å; H2166-I2168 PolarHBondContact O-N 2.89Å; I2168-F2172 VanDerWaalsContact O-CB 3.24Å; I2168-F2172 WeakPolarHBondContact O-CB 3.23Å; I2168-F2172 PolarHBondContact O-N 3.1Å; I2168-F2172 VanDerWaalsContact O-N 3.16Å; I2168-Y2386 HydrophobicContact CG2-CD2 3.43Å; I2168-Y2386 VanDerWaalsContact CG2-CD2 3.43Å; I2168-Y2386 HydrophobicContact CG2-CE2 4.18Å; I2168-Y2386 HydrophobicContact CG2-CG 3.8Å
2169Y33Very low32.4Very low115.667 Ų115.66799.5 Ų99.545%0.45454%0.544SS..Hα-helixtrans-72.2-33.9178.8-83.8-84.9000113.3D2165 S2167 F2172 I2173 N2385 M2577D2165-Y2169 WeakPolarHBondContact O-CD2 3.46Å; D2165-Y2169 VanDerWaalsContact O-CE2 3.24Å; D2165-Y2169 WeakPolarHBondContact O-CE2 3.43Å; S2167-Y2169 VanDerWaalsContact C-N 3.29Å; S2167-Y2169 PolarHBondContact O-N 3.04Å; Y2169-F2172 WeakPolarHBondContact O-CB 3.32Å; Y2169-I2173 VanDerWaalsContact O-CB 3.3Å; Y2169-I2173 WeakPolarHBondContact O-CB 3.14Å; Y2169-I2173 WeakPolarHBondContact O-CD1 3.43Å; Y2169-I2173 VanDerWaalsContact O-CG1 3.32Å; Y2169-I2173 WeakPolarHBondContact O-CG1 3.28Å; Y2169-I2173 PolarHBondContact O-N 3.07Å; Y2169-I2173 VanDerWaalsContact O-N 3.16Å; Y2169-N2385 HydrophobicContact CE1-CB 3.66Å; Y2169-N2385 VanDerWaalsContact OH-CB 3.27Å; Y2169-N2385 WeakPolarHBondContact OH-CB 3.45Å; Y2169-N2385 PolarHBondContact OH-ND2 3.47Å; Y2169-M2577 VanDerWaalsContact CB-CE 3.45Å; Y2169-M2577 HydrophobicContact CG-CE 4.1Å
2170W34.8Very low32.6Very low150.667 Ų150.66798.5 Ų98.557%0.57153%0.529SS*.Hα-helixtrans-75.7-41.3179-83.7109.2000111.9H2166 S2167 F2172 I2173 E2174H2166-W2170 PolarHBondContact O-N 3.06Å; S2167-W2170 PolarHBondContact O-N 3.27Å; W2170-F2172 VanDerWaalsContact C-N 3.33Å; W2170-F2172 PolarHBondContact O-N 3.4Å; W2170-F2172 VanDerWaalsContact O-N 3.16Å; W2170-I2173 HydrophobicContact CE3-CG2 4.49Å; W2170-I2173 CarbonylContact O-C 3.6Å; W2170-I2173 PolarHBondContact O-N 3Å; W2170-E2174 WeakPolarHBondContact O-CB 3.24Å; W2170-E2174 PolarHBondContact O-N 3.16Å
2171D36Very low32.4Very low70.3333 Ų70.333396.7 Ų96.738%0.37652%0.518SS..Hα-helixtrans-61.1-36.1174.7-63-18.9000110.9S2167 S2175S2167-D2171 PolarHBondContact O-N 2.97Å; D2171-S2175 VanDerWaalsContact O-CB 3.27Å; D2171-S2175 WeakPolarHBondContact O-CB 3.33Å; D2171-S2175 PolarHBondContact O-N 3.28Å
2172F35Very low32.3Very low76.6667 Ų76.666795 Ų9534%0.33650%0.503SS..Hα-helixtrans-66-45.5173.5-174.3-110.5000113I2168 Y2169 W2170 E2174 S2175 I2176 Y2386 F2389 E2390I2168-F2172 VanDerWaalsContact O-CB 3.24Å; I2168-F2172 WeakPolarHBondContact O-CB 3.23Å; I2168-F2172 PolarHBondContact O-N 3.1Å; I2168-F2172 VanDerWaalsContact O-N 3.16Å; Y2169-F2172 WeakPolarHBondContact O-CB 3.32Å; W2170-F2172 VanDerWaalsContact C-N 3.33Å; W2170-F2172 PolarHBondContact O-N 3.4Å; W2170-F2172 VanDerWaalsContact O-N 3.16Å; F2172-E2174 PolarHBondContact O-N 3.45Å; F2172-S2175 PolarHBondContact O-N 3.4Å; F2172-I2176 HydrophobicContact CD1-CD1 3.68Å; F2172-I2176 HydrophobicContact CD1-CG1 4.41Å; F2172-I2176 HydrophobicContact CD2-CD1 4.29Å; F2172-I2176 HydrophobicContact CD2-CG1 4.22Å; F2172-I2176 HydrophobicContact CE1-CD1 3.24Å; F2172-I2176 VanDerWaalsContact CE1-CD1 3.45Å; F2172-I2176 HydrophobicContact CE1-CG1 4.19Å; F2172-I2176 HydrophobicContact CE2-CD1 4.04Å; F2172-I2176 HydrophobicContact CE2-CG1 3.71Å; F2172-I2176 HydrophobicContact CG-CD1 4.27Å; F2172-I2176 HydrophobicContact CZ-CD1 3.45Å; F2172-I2176 HydrophobicContact CZ-CG1 3.62Å; F2172-I2176 WeakPolarHBondContact O-CB 3.43Å; F2172-I2176 WeakPolarHBondContact O-CD1 2.93Å; F2172-I2176 VanDerWaalsContact O-CG1 3.26Å; F2172-I2176 WeakPolarHBondContact O-CG1 3.38Å; F2172-I2176 PolarHBondContact O-N 3.29Å; F2172-I2176 VanDerWaalsContact O-N 3.17Å; F2172-Y2386 HydrophobicContact CB-CD2 3.69Å; F2172-Y2386 HydrophobicContact CB-CE2 3.41Å; F2172-Y2386 VanDerWaalsContact CB-CE2 3.41Å; F2172-Y2386 AromaticContact CD2-CD2 3.96Å; F2172-Y2386 HydrophobicContact CD2-CD2 3.96Å; F2172-Y2386 AromaticContact CD2-CE2 3.34Å; F2172-Y2386 HydrophobicContact CD2-CE2 3.34Å; F2172-Y2386 AromaticContact CD2-CZ 3.61Å; F2172-Y2386 HydrophobicContact CE2-CE2 4.36Å; F2172-Y2386 AromaticContact CG-CD2 3.81Å; F2172-Y2386 HydrophobicContact CG-CD2 3.81Å; F2172-Y2386 AromaticContact CG-CE2 3.56Å; F2172-Y2386 HydrophobicContact CG-CE2 3.56Å; F2172-F2389 HydrophobicContact CD1-CB 4.25Å; F2172-F2389 HydrophobicContact CE1-CB 3.44Å; F2172-F2389 VanDerWaalsContact CE1-CB 3.44Å; F2172-F2389 HydrophobicContact CE1-CG 4.34Å; F2172-F2389 HydrophobicContact CZ-CB 4.05Å; F2172-E2390 HydrophobicContact CD2-CG 4.15Å; F2172-E2390 HydrophobicContact CE2-CB 4.3Å; F2172-E2390 HydrophobicContact CE2-CG 3.42Å; F2172-E2390 VanDerWaalsContact CE2-CG 3.42Å; F2172-E2390 WeakPolarHBondContact CE2-OE1 3.38Å; F2172-E2390 HydrophobicContact CZ-CB 4.31Å; F2172-E2390 HydrophobicContact CZ-CG 3.78Å
2173I33.6Very low32.1Very low49.3333 Ų49.333398 Ų9825%0.25350%0.498SS..Hα-helixtrans-67.8-40.4179.1-70.6170000110.7Y2169 W2170 S2175 I2176 I2177 L2581Y2169-I2173 VanDerWaalsContact O-CB 3.3Å; Y2169-I2173 WeakPolarHBondContact O-CB 3.14Å; Y2169-I2173 WeakPolarHBondContact O-CD1 3.43Å; Y2169-I2173 VanDerWaalsContact O-CG1 3.32Å; Y2169-I2173 WeakPolarHBondContact O-CG1 3.28Å; Y2169-I2173 PolarHBondContact O-N 3.07Å; Y2169-I2173 VanDerWaalsContact O-N 3.16Å; W2170-I2173 HydrophobicContact CE3-CG2 4.49Å; W2170-I2173 CarbonylContact O-C 3.6Å; W2170-I2173 PolarHBondContact O-N 3Å; I2173-S2175 VanDerWaalsContact C-N 3.34Å; I2173-S2175 PolarHBondContact O-N 3.48Å; I2173-I2176 PolarHBondContact O-N 3.04Å; I2173-I2177 HydrophobicContact CG2-CD1 3.57Å; I2173-I2177 HydrophobicContact CG2-CG1 4.24Å; I2173-I2177 VanDerWaalsContact O-CB 3.3Å; I2173-I2177 WeakPolarHBondContact O-CB 3.12Å; I2173-I2177 WeakPolarHBondContact O-CD1 3.49Å; I2173-I2177 VanDerWaalsContact O-CG1 3.26Å; I2173-I2177 WeakPolarHBondContact O-CG1 3.11Å; I2173-I2177 PolarHBondContact O-N 3.13Å; I2173-L2581 HydrophobicContact CD1-CD2 4.19Å
2174E35.7Very low31.9Very low121.667 Ų121.66794.6 Ų94.657%0.56950%0.495SS*.Hα-helixtrans-68.9-37178.4-162.6169.1-162.200111.6N1727 W2170 F2172 I2176 I2177 S2178N1727-E2174 PolarHBondContact ND2-OE2 3.29Å; W2170-E2174 WeakPolarHBondContact O-CB 3.24Å; W2170-E2174 PolarHBondContact O-N 3.16Å; F2172-E2174 PolarHBondContact O-N 3.45Å; E2174-I2176 PolarHBondContact O-N 3.25Å; E2174-I2177 PolarHBondContact O-N 3.31Å; E2174-S2178 VanDerWaalsContact O-CB 3.27Å; E2174-S2178 WeakPolarHBondContact O-CB 3.4Å; E2174-S2178 PolarHBondContact O-N 3.35Å; E2174-S2178 PolarHBondContact O-OG 2.94Å; E2174-S2178 VanDerWaalsContact O-OG 3.13Å
2175S35.3Very low31.8Very low47.3333 Ų47.333392.4 Ų92.433%0.33149%0.487SS..Hα-helixtrans-64.6-42.8171.6-1750000112.3D2171 F2172 I2173 I2177 S2178 S2179 N2279D2171-S2175 VanDerWaalsContact O-CB 3.27Å; D2171-S2175 WeakPolarHBondContact O-CB 3.33Å; D2171-S2175 PolarHBondContact O-N 3.28Å; F2172-S2175 PolarHBondContact O-N 3.4Å; I2173-S2175 VanDerWaalsContact C-N 3.34Å; I2173-S2175 PolarHBondContact O-N 3.48Å; S2175-I2177 VanDerWaalsContact C-N 3.32Å; S2175-I2177 PolarHBondContact O-N 3.34Å; S2175-S2178 WeakPolarHBondContact CA-OG 3.47Å; S2175-S2178 PolarHBondContact O-N 3.11Å; S2175-S2178 PolarHBondContact O-OG 3.11Å; S2175-S2178 VanDerWaalsContact O-OG 3.05Å; S2175-S2179 VanDerWaalsContact O-CB 3.24Å; S2175-S2179 WeakPolarHBondContact O-CB 3.26Å; S2175-S2179 PolarHBondContact O-N 3.01Å; S2175-S2179 VanDerWaalsContact O-N 3.09Å; S2175-S2179 PolarHBondContact O-OG 3.05Å; S2175-N2279 PolarHBondContact OG-ND2 3.15Å; S2175-N2279 PolarHBondContact OG-OD1 2.79Å
2176I32.1Very low31.4Very low39.6667 Ų39.666791 Ų9120%0.20349%0.486CS..Hα-helixtrans-64.5-44.8174.3-70.5170.4000111F2172 I2173 E2174 S2178 S2179 I2180 F2393F2172-I2176 HydrophobicContact CD1-CD1 3.68Å; F2172-I2176 HydrophobicContact CD1-CG1 4.41Å; F2172-I2176 HydrophobicContact CD2-CD1 4.29Å; F2172-I2176 HydrophobicContact CD2-CG1 4.22Å; F2172-I2176 HydrophobicContact CE1-CD1 3.24Å; F2172-I2176 VanDerWaalsContact CE1-CD1 3.45Å; F2172-I2176 HydrophobicContact CE1-CG1 4.19Å; F2172-I2176 HydrophobicContact CE2-CD1 4.04Å; F2172-I2176 HydrophobicContact CE2-CG1 3.71Å; F2172-I2176 HydrophobicContact CG-CD1 4.27Å; F2172-I2176 HydrophobicContact CZ-CD1 3.45Å; F2172-I2176 HydrophobicContact CZ-CG1 3.62Å; F2172-I2176 WeakPolarHBondContact O-CB 3.43Å; F2172-I2176 WeakPolarHBondContact O-CD1 2.93Å; F2172-I2176 VanDerWaalsContact O-CG1 3.26Å; F2172-I2176 WeakPolarHBondContact O-CG1 3.38Å; F2172-I2176 PolarHBondContact O-N 3.29Å; F2172-I2176 VanDerWaalsContact O-N 3.17Å; I2173-I2176 PolarHBondContact O-N 3.04Å; E2174-I2176 PolarHBondContact O-N 3.25Å; I2176-S2178 VanDerWaalsContact C-N 3.33Å; I2176-S2178 PolarHBondContact O-N 3.45Å; I2176-S2179 WeakPolarHBondContact CA-OG 3.27Å; I2176-S2179 PolarHBondContact O-N 3.29Å; I2176-S2179 PolarHBondContact O-OG 2.99Å; I2176-I2180 HydrophobicContact CG2-CD1 3.46Å; I2176-I2180 VanDerWaalsContact CG2-CD1 3.47Å; I2176-I2180 HydrophobicContact CG2-CG1 4.06Å; I2176-I2180 VanDerWaalsContact O-CB 3.27Å; I2176-I2180 WeakPolarHBondContact O-CB 3.13Å; I2176-I2180 WeakPolarHBondContact O-CD1 2.96Å; I2176-I2180 VanDerWaalsContact O-CG1 3.26Å; I2176-I2180 WeakPolarHBondContact O-CG1 3.31Å; I2176-I2180 PolarHBondContact O-N 3.12Å; I2176-F2393 HydrophobicContact CG2-CE2 4.24Å; I2176-F2393 HydrophobicContact CG2-CZ 4.22Å
2177I31.6Very low31.2Very low95.6667 Ų95.666790.6 Ų90.649%0.49149%0.485SS..Hα-helixtrans-63.7-43.6178.6-70.5169.2000110.1I2173 E2174 S2175 S2179 I2180 M2181I2173-I2177 HydrophobicContact CG2-CD1 3.57Å; I2173-I2177 HydrophobicContact CG2-CG1 4.24Å; I2173-I2177 VanDerWaalsContact O-CB 3.3Å; I2173-I2177 WeakPolarHBondContact O-CB 3.12Å; I2173-I2177 WeakPolarHBondContact O-CD1 3.49Å; I2173-I2177 VanDerWaalsContact O-CG1 3.26Å; I2173-I2177 WeakPolarHBondContact O-CG1 3.11Å; I2173-I2177 PolarHBondContact O-N 3.13Å; E2174-I2177 PolarHBondContact O-N 3.31Å; S2175-I2177 VanDerWaalsContact C-N 3.32Å; S2175-I2177 PolarHBondContact O-N 3.34Å; I2177-S2179 VanDerWaalsContact C-N 3.32Å; I2177-S2179 PolarHBondContact O-N 3.28Å; I2177-I2180 PolarHBondContact O-N 3.25Å; I2177-M2181 HydrophobicContact CG2-CG 4.08Å; I2177-M2181 WeakPolarHBondContact O-CA 3.47Å; I2177-M2181 WeakPolarHBondContact O-CB 3.21Å; I2177-M2181 WeakPolarHBondContact O-CG 3.49Å; I2177-M2181 PolarHBondContact O-N 3.25Å
2178S32.9Very low30.8Very low78.3333 Ų78.333393.2 Ų93.255%0.54849%0.492SS..Hα-helixtrans-66.8-31.5178.169.10000113.1E2174 S2175 I2176 I2182E2174-S2178 VanDerWaalsContact O-CB 3.27Å; E2174-S2178 WeakPolarHBondContact O-CB 3.4Å; E2174-S2178 PolarHBondContact O-N 3.35Å; E2174-S2178 PolarHBondContact O-OG 2.94Å; E2174-S2178 VanDerWaalsContact O-OG 3.13Å; S2175-S2178 WeakPolarHBondContact CA-OG 3.47Å; S2175-S2178 PolarHBondContact O-N 3.11Å; S2175-S2178 PolarHBondContact O-OG 3.11Å; S2175-S2178 VanDerWaalsContact O-OG 3.05Å; I2176-S2178 VanDerWaalsContact C-N 3.33Å; I2176-S2178 PolarHBondContact O-N 3.45Å; S2178-I2182 WeakPolarHBondContact O-CG1 3.49Å
2179S32.6Very low30.6Very low48.6667 Ų48.666794.8 Ų94.834%0.3450%0.502SS..Hα-helixtrans-77-32.6175.9142.50000113.5S2175 I2176 I2177 M2181 I2182S2175-S2179 VanDerWaalsContact O-CB 3.24Å; S2175-S2179 WeakPolarHBondContact O-CB 3.26Å; S2175-S2179 PolarHBondContact O-N 3.01Å; S2175-S2179 VanDerWaalsContact O-N 3.09Å; S2175-S2179 PolarHBondContact O-OG 3.05Å; I2176-S2179 WeakPolarHBondContact CA-OG 3.27Å; I2176-S2179 PolarHBondContact O-N 3.29Å; I2176-S2179 PolarHBondContact O-OG 2.99Å; I2177-S2179 VanDerWaalsContact C-N 3.32Å; I2177-S2179 PolarHBondContact O-N 3.28Å; S2179-M2181 PolarHBondContact O-N 2.99Å; S2179-I2182 WeakPolarHBondContact O-CD1 3.29Å; S2179-I2182 WeakPolarHBondContact O-CG1 3.26Å
2180I30Very low30.7Very low97 Ų9796.8 Ų96.850%0.49752%0.515SS..Hα-helixtrans-85.4-28.8-178.3-66.4173.6000111.8I2176 I2177 I2182 F2393I2176-I2180 HydrophobicContact CG2-CD1 3.46Å; I2176-I2180 VanDerWaalsContact CG2-CD1 3.47Å; I2176-I2180 HydrophobicContact CG2-CG1 4.06Å; I2176-I2180 VanDerWaalsContact O-CB 3.27Å; I2176-I2180 WeakPolarHBondContact O-CB 3.13Å; I2176-I2180 WeakPolarHBondContact O-CD1 2.96Å; I2176-I2180 VanDerWaalsContact O-CG1 3.26Å; I2176-I2180 WeakPolarHBondContact O-CG1 3.31Å; I2176-I2180 PolarHBondContact O-N 3.12Å; I2177-I2180 PolarHBondContact O-N 3.25Å; I2180-I2182 PolarHBondContact O-N 3.19Å; I2180-F2393 HydrophobicContact CD1-CE2 3.47Å; I2180-F2393 VanDerWaalsContact CD1-CE2 3.47Å; I2180-F2393 HydrophobicContact CD1-CZ 3.49Å; I2180-F2393 VanDerWaalsContact CD1-CZ 3.49Å; I2180-F2393 HydrophobicContact CG1-CE2 4.1Å; I2180-F2393 HydrophobicContact CG1-CZ 3.57Å
2181M23.9Very low30.8Very low129 Ų12995.5 Ų95.564%0.63552%0.52SS*.  trans-89.256.2178.3-67.6-88.5112.800110.6I2177 S2179 E2183I2177-M2181 HydrophobicContact CG2-CG 4.08Å; I2177-M2181 WeakPolarHBondContact O-CA 3.47Å; I2177-M2181 WeakPolarHBondContact O-CB 3.21Å; I2177-M2181 WeakPolarHBondContact O-CG 3.49Å; I2177-M2181 PolarHBondContact O-N 3.25Å; S2179-M2181 PolarHBondContact O-N 2.99Å; M2181-E2183 HydrophobicContact CB-CB 4.39Å; M2181-E2183 PolarHBondContact O-N 3.32Å
2182I26.7Very low31Very low100.667 Ų100.66795.7 Ų95.752%0.51652%0.518SS..  trans-65.285.8161.4-57.9172.9000107.2S2178 S2179 I2180 C2186S2178-I2182 WeakPolarHBondContact O-CG1 3.49Å; S2179-I2182 WeakPolarHBondContact O-CD1 3.29Å; S2179-I2182 WeakPolarHBondContact O-CG1 3.26Å; I2180-I2182 PolarHBondContact O-N 3.19Å; I2182-C2186 HydrophobicContact CB-CB 4.39Å; I2182-C2186 HydrophobicContact CG2-CB 4.05Å
2183E23.8Very low31.3Very low136.333 Ų136.33396 Ų9664%0.63752%0.523SS*.  trans-62.9133.9159.1-92.9-166.7149.600107.9M2181 G2185 C2186M2181-E2183 HydrophobicContact CB-CB 4.39Å; M2181-E2183 PolarHBondContact O-N 3.32Å; E2183-G2185 PolarHBondContact O-N 3.3Å; E2183-G2185 VanDerWaalsContact O-N 3.11Å; E2183-C2186 PolarHBondContact O-N 3.15Å
2184P25.2Very low31.9Very low110.667 Ų110.66798.4 Ų98.472%0.71954%0.535SS*.THydrogen-bonded Turntrans-62.5103.1173.526.1-31.5000108.9
2185G27.8Very low32.7Very low50.6667 Ų50.666797.3 Ų97.352%0.52253%0.528SS..THydrogen-bonded Turntrans139.50.7178.400000116.2E2183 E2187E2183-G2185 PolarHBondContact O-N 3.3Å; E2183-G2185 VanDerWaalsContact O-N 3.11Å; G2185-E2187 PolarHBondContact O-N 3.41Å; G2185-E2187 VanDerWaalsContact O-N 3.12Å
2186C25Very low34.1Very low94.3333 Ų94.333396.1 Ų96.164%0.63752%0.518SS*.  trans-83.5124.1169.3-105.30000110.9I2182 E2183 I2188I2182-C2186 HydrophobicContact CB-CB 4.39Å; I2182-C2186 HydrophobicContact CG2-CB 4.05Å; E2183-C2186 PolarHBondContact O-N 3.15Å; C2186-I2188 PolarHBondContact O-N 2.77Å
2187E28.4Very low35.7Very low135 Ų13596.2 Ų96.263%0.63152%0.519SS*.  trans-47.2122.2-178.6-63.8176.7168.700113.1R1889 R1892 G2185 D2189R1889-E2187 IonicContact CZ-OE1 3.85Å; R1889-E2187 IonicContact NE-OE1 2.74Å; R1889-E2187 PolarHBondContact NE-OE1 3.47Å; R1889-E2187 VanDerWaalsContact NE-OE1 3.1Å; R1889-E2187 IonicContact NH2-OE1 3.69Å; R1889-E2187 PolarHBondContact NH2-OE1 3.49Å; R1892-E2187 IonicContact CZ-OE1 3.82Å; R1892-E2187 IonicContact NH1-OE1 3.72Å; R1892-E2187 IonicContact NH2-OE1 2.66Å; R1892-E2187 PolarHBondContact NH2-OE1 3.28Å; G2185-E2187 PolarHBondContact O-N 3.41Å; G2185-E2187 VanDerWaalsContact O-N 3.12Å; E2187-D2189 PolarHBondContact O-N 3.36Å
2188I27Very low37.4Very low113.667 Ų113.66793.3 Ų93.358%0.58350%0.501SS*.  trans-72.8121.1174.9-60.6162.9000107.3C2186 E2190 L2193C2186-I2188 PolarHBondContact O-N 2.77Å; I2188-E2190 PolarHBondContact O-N 2.76Å; I2188-L2193 HydrophobicContact CB-CD1 4.09Å; I2188-L2193 HydrophobicContact CG2-CD1 4.15Å
2189D31.5Very low38.9Very low128.667 Ų128.66790 Ų9069%0.68848%0.479SS*.  trans-56.5119.7172.1-82.8-24.6000110.4E2187 N2191 E2192E2187-D2189 PolarHBondContact O-N 3.36Å; D2189-N2191 PolarHBondContact O-N 3.27Å; D2189-E2192 WeakPolarHBondContact O-CG 3.38Å; D2189-E2192 PolarHBondContact O-N 3.19Å; D2189-E2192 VanDerWaalsContact O-N 3.07Å
2190E34.9Very low40.6Very low157.667 Ų157.66788.2 Ų88.274%0.73747%0.468SS*.THydrogen-bonded Turntrans-57.3-13.8-172.1-68.1-166.6148.800113.9I2188 E2192 L2193 M2194I2188-E2190 PolarHBondContact O-N 2.76Å; E2190-E2192 VanDerWaalsContact C-N 3.31Å; E2190-E2192 PolarHBondContact O-N 3.05Å; E2190-L2193 PolarHBondContact O-N 3.35Å; E2190-M2194 PolarHBondContact O-N 3.29Å
2191N38.8Very low43Very low125 Ų12583.6 Ų83.667%0.66844%0.444SS*.THydrogen-bonded Turntrans-77-8.9178.7-68.6-21.2000113.7D2189 L2193 M2194D2189-N2191 PolarHBondContact O-N 3.27Å; N2191-L2193 PolarHBondContact O-N 3.09Å; N2191-L2193 VanDerWaalsContact O-N 3.14Å; N2191-M2194 VanDerWaalsContact O-CB 3.31Å; N2191-M2194 WeakPolarHBondContact O-CB 3.47Å; N2191-M2194 WeakPolarHBondContact O-CG 3.39Å; N2191-M2194 PolarHBondContact O-N 3.49Å; N2191-M2194 VanDerWaalsContact O-N 3.08Å
2192E40.3Very low45.5Very low73.3333 Ų73.333378 Ų7834%0.34342%0.417SS..G310 helixtrans-75.8-29.8-179.3-67.9-146.1138.300113.7M2050 D2189 E2190 M2194 K2195M2050-E2192 VanDerWaalsContact CE-C 3.44Å; M2050-E2192 HydrophobicContact CE-CB 3.57Å; M2050-E2192 HydrophobicContact SD-CB 4.17Å; D2189-E2192 WeakPolarHBondContact O-CG 3.38Å; D2189-E2192 PolarHBondContact O-N 3.19Å; D2189-E2192 VanDerWaalsContact O-N 3.07Å; E2190-E2192 VanDerWaalsContact C-N 3.31Å; E2190-E2192 PolarHBondContact O-N 3.05Å; E2192-M2194 PolarHBondContact O-N 3.24Å; E2192-M2194 VanDerWaalsContact O-N 3.1Å; E2192-K2195 WeakPolarHBondContact O-CB 3.48Å; E2192-K2195 PolarHBondContact O-N 2.97Å; E2192-K2195 VanDerWaalsContact O-N 3.16Å; E2192-K2195 IonicContact OE1-NZ 3.33Å; E2192-K2195 PolarHBondContact OE1-NZ 3.25Å
2193L39.7Very low47.8Very low83.3333 Ų83.333375.5 Ų75.544%0.43640%0.404SS..Hα-helixtrans-61.7-22.6177-92.5130.3000112.8M2050 Y2053 Q2057 I2188 E2190 N2191 K2195 I2196M2050-L2193 HydrophobicContact CE-CB 4.28Å; M2050-L2193 HydrophobicContact CE-CD1 3.67Å; M2050-L2193 HydrophobicContact CE-CG 3.81Å; M2050-L2193 VanDerWaalsContact CE-N 3.33Å; Y2053-L2193 WeakPolarHBondContact CE1-O 3.32Å; Y2053-L2193 PolarHBondContact OH-O 3.03Å; Q2057-L2193 HydrophobicContact CG-CD2 4.24Å; I2188-L2193 HydrophobicContact CB-CD1 4.09Å; I2188-L2193 HydrophobicContact CG2-CD1 4.15Å; E2190-L2193 PolarHBondContact O-N 3.35Å; N2191-L2193 PolarHBondContact O-N 3.09Å; N2191-L2193 VanDerWaalsContact O-N 3.14Å; L2193-K2195 PolarHBondContact O-N 3.01Å; L2193-I2196 PolarHBondContact O-N 3.04Å
2194M45.9Very low50.6Low100.333 Ų100.33369.7 Ų69.749%0.49438%0.378SS..THydrogen-bonded Turntrans-77.9-11.7178.1-67.9-70.1177.600113.7L2054 Q2146 L2149 E2190 N2191 E2192 I2196L2054-M2194 HydrophobicContact CD2-CE 4.11Å; L2054-M2194 HydrophobicContact CD2-SD 4.05Å; Q2146-M2194 HydrophobicContact CB-CE 3.83Å; Q2146-M2194 HydrophobicContact CG-CE 3.89Å; Q2146-M2194 HydrophobicContact CG-SD 4.4Å; L2149-M2194 HydrophobicContact CD1-CE 4.41Å; E2190-M2194 PolarHBondContact O-N 3.29Å; N2191-M2194 VanDerWaalsContact O-CB 3.31Å; N2191-M2194 WeakPolarHBondContact O-CB 3.47Å; N2191-M2194 WeakPolarHBondContact O-CG 3.39Å; N2191-M2194 PolarHBondContact O-N 3.49Å; N2191-M2194 VanDerWaalsContact O-N 3.08Å; E2192-M2194 PolarHBondContact O-N 3.24Å; E2192-M2194 VanDerWaalsContact O-N 3.1Å; M2194-I2196 PolarHBondContact O-N 3.42Å
2195K54.3Low53.4Low98 Ų9864.4 Ų64.443%0.42634%0.344SS..SBendtrans-83.382.4179.6-66.7179.4-175.4171.50111.3Y2053 E2192 L2193 N2197Y2053-K2195 HydrophobicContact CE1-CB 4.42Å; Y2053-K2195 PolarHBondContact OH-O 3.34Å; E2192-K2195 WeakPolarHBondContact O-CB 3.48Å; E2192-K2195 PolarHBondContact O-N 2.97Å; E2192-K2195 VanDerWaalsContact O-N 3.16Å; E2192-K2195 IonicContact OE1-NZ 3.33Å; E2192-K2195 PolarHBondContact OE1-NZ 3.25Å; L2193-K2195 PolarHBondContact O-N 3.01Å; K2195-N2197 PolarHBondContact O-N 3.3Å; K2195-N2197 PolarHBondContact O-OD1 2.77Å
2196I63.2Low55.9Low22.6667 Ų22.666762.2 Ų62.212%0.11632%0.32CS..  trans-73.695.1176.3-52179.8000108.5I2005 F2008 L2009 I2049 M2050 Y2053 L2193 M2194I2005-I2196 HydrophobicContact CG2-CG2 4.01Å; F2008-I2196 HydrophobicContact CD1-CG2 4.25Å; F2008-I2196 HydrophobicContact CE1-CB 4.26Å; F2008-I2196 HydrophobicContact CE1-CD1 4.42Å; F2008-I2196 HydrophobicContact CE1-CG2 4.23Å; L2009-I2196 HydrophobicContact CD2-CG2 4.31Å; L2009-I2196 HydrophobicContact CG-CG2 4.44Å; I2049-I2196 HydrophobicContact CG2-CD1 3.93Å; M2050-I2196 HydrophobicContact CE-CD1 4.11Å; M2050-I2196 HydrophobicContact CE-CG1 4.32Å; M2050-I2196 HydrophobicContact SD-CD1 4.36Å; Y2053-I2196 HydrophobicContact CD1-CD1 4.41Å; Y2053-I2196 HydrophobicContact CD1-CG1 3.91Å; Y2053-I2196 HydrophobicContact CD2-CB 4.41Å; Y2053-I2196 HydrophobicContact CD2-CG1 4.23Å; Y2053-I2196 HydrophobicContact CD2-CG2 4.06Å; Y2053-I2196 HydrophobicContact CE1-CG1 4.31Å; Y2053-I2196 HydrophobicContact CE2-CG2 4.42Å; Y2053-I2196 HydrophobicContact CG-CD1 4.34Å; Y2053-I2196 HydrophobicContact CG-CG1 3.86Å; Y2053-I2196 HydrophobicContact CG-CG2 4.4Å; L2193-I2196 PolarHBondContact O-N 3.04Å; M2194-I2196 PolarHBondContact O-N 3.42Å
2197N65.3Low58.6Low42 Ų4264.6 Ų64.623%0.22532%0.316CS..  trans-133.5167.2176.264.614.5000111K2195 A2199 G2200 L2201K2195-N2197 PolarHBondContact O-N 3.3Å; K2195-N2197 PolarHBondContact O-OD1 2.77Å; N2197-A2199 VanDerWaalsContact C-N 3.29Å; N2197-A2199 PolarHBondContact O-N 3.28Å; N2197-A2199 PolarHBondContact OD1-N 3.38Å; N2197-G2200 PolarHBondContact O-N 3.14Å; N2197-G2200 VanDerWaalsContact O-N 3.1Å; N2197-G2200 WeakPolarHBondContact OD1-CA 3.36Å; N2197-G2200 PolarHBondContact OD1-N 3.12Å; N2197-L2201 PolarHBondContact O-N 3.15Å
2198W67.7Low61.5Low34 Ų3458.1 Ų58.113%0.12929%0.285CS..Hα-helixtrans-62-35.4178.7-67.1110.7000112.8L2009 T2010 V2090 L2093 S2094 G2200 L2201 L2202L2009-W2198 HydrophobicContact CB-CH2 3.68Å; L2009-W2198 HydrophobicContact CB-CZ2 3.41Å; L2009-W2198 VanDerWaalsContact CB-CZ2 3.42Å; L2009-W2198 HydrophobicContact CB-CZ3 4.34Å; L2009-W2198 HydrophobicContact CD1-CD2 3.78Å; L2009-W2198 HydrophobicContact CD1-CE3 3.75Å; L2009-W2198 HydrophobicContact CD1-CG 4.45Å; L2009-W2198 HydrophobicContact CD1-CH2 3.92Å; L2009-W2198 HydrophobicContact CD1-CZ2 4.02Å; L2009-W2198 HydrophobicContact CD1-CZ3 3.79Å; L2009-W2198 HydrophobicContact CG-CH2 4.42Å; L2009-W2198 HydrophobicContact CG-CZ2 4.29Å; T2010-W2198 HydrophobicContact CG2-CH2 4.3Å; T2010-W2198 HydrophobicContact CG2-CZ2 4.42Å; V2090-W2198 HydrophobicContact CB-CZ3 4.49Å; V2090-W2198 HydrophobicContact CG1-CE3 4.42Å; V2090-W2198 HydrophobicContact CG1-CH2 4.22Å; V2090-W2198 HydrophobicContact CG1-CZ3 3.68Å; V2090-W2198 WeakPolarHBondContact O-CZ3 3.47Å; L2093-W2198 HydrophobicContact CB-CH2 3.55Å; L2093-W2198 VanDerWaalsContact CB-CH2 3.48Å; L2093-W2198 HydrophobicContact CB-CZ2 4.08Å; L2093-W2198 HydrophobicContact CB-CZ3 4.01Å; L2093-W2198 HydrophobicContact CD1-CH2 3.91Å; L2093-W2198 HydrophobicContact CD1-CZ2 4.47Å; L2093-W2198 HydrophobicContact CD1-CZ3 4.12Å; L2093-W2198 HydrophobicContact CG-CH2 4.25Å; S2094-W2198 VanDerWaalsContact CB-CG 3.42Å; S2094-W2198 VanDerWaalsContact OG-CB 3.29Å; S2094-W2198 WeakPolarHBondContact OG-CB 3.43Å; W2198-G2200 VanDerWaalsContact C-N 3.29Å; W2198-G2200 PolarHBondContact O-N 3.21Å; W2198-L2201 HydrophobicContact CE3-CD1 4.13Å; W2198-L2201 HydrophobicContact CZ3-CD1 4.31Å; W2198-L2201 WeakPolarHBondContact O-CB 3.45Å; W2198-L2201 PolarHBondContact O-N 3.13Å; W2198-L2202 PolarHBondContact O-N 2.81Å
2199A64.7Low64.2Low9.66667 Ų9.6666752.7 Ų52.78%0.0826%0.258CS..Hα-helixtrans-61.3-39.6175.800000112.1N2197 L2201 L2202 I2203N2197-A2199 VanDerWaalsContact C-N 3.29Å; N2197-A2199 PolarHBondContact O-N 3.28Å; N2197-A2199 PolarHBondContact OD1-N 3.38Å; A2199-L2201 PolarHBondContact O-N 3.22Å; A2199-L2202 PolarHBondContact O-N 3.29Å; A2199-I2203 HydrophobicContact CB-CD1 4.17Å; A2199-I2203 WeakPolarHBondContact O-CB 3.3Å; A2199-I2203 VanDerWaalsContact O-CG1 3.26Å; A2199-I2203 WeakPolarHBondContact O-CG1 3.34Å; A2199-I2203 PolarHBondContact O-N 3.2Å
2200G68.9Low66.5Low10 Ų1048 Ų4810%0.10323%0.231CC..Hα-helixtrans-62.4-26.7175.400000113.3Q2057 N2197 W2198 P2204Q2057-G2200 PolarHBondContact NE2-O 3.13Å; N2197-G2200 PolarHBondContact O-N 3.14Å; N2197-G2200 VanDerWaalsContact O-N 3.1Å; N2197-G2200 WeakPolarHBondContact OD1-CA 3.36Å; N2197-G2200 PolarHBondContact OD1-N 3.12Å; W2198-G2200 VanDerWaalsContact C-N 3.29Å; W2198-G2200 PolarHBondContact O-N 3.21Å; G2200-P2204 WeakPolarHBondContact O-CD 3.34Å; G2200-P2204 VanDerWaalsContact O-CG 3.29Å; G2200-P2204 WeakPolarHBondContact O-CG 3.37Å
2201L79.4Confident68.8Low1 Ų141.9 Ų41.91%0.00520%0.203CC..Hα-helixtrans-82.5-35.3172.7-61.6-178.8000112.9L2002 I2005 L2009 Y2053 Y2056 V2090 L2091 N2197 W2198 A2199 T2205L2002-L2201 HydrophobicContact CD2-CD1 4.48Å; L2002-L2201 HydrophobicContact CD2-CD2 3.82Å; I2005-L2201 HydrophobicContact CD1-CD2 4.03Å; I2005-L2201 HydrophobicContact CG2-CD1 4Å; I2005-L2201 HydrophobicContact CG2-CD2 4.05Å; I2005-L2201 HydrophobicContact CG2-CG 4.45Å; L2009-L2201 HydrophobicContact CD1-CD1 3.64Å; Y2053-L2201 HydrophobicContact CD2-CD2 4.44Å; Y2053-L2201 HydrophobicContact CE2-CD2 4.44Å; Y2056-L2201 HydrophobicContact CD1-CD2 3.82Å; Y2056-L2201 HydrophobicContact CE1-CD2 3.76Å; Y2056-L2201 HydrophobicContact CG-CD2 4.4Å; Y2056-L2201 PolarHBondContact OH-O 3.33Å; V2090-L2201 HydrophobicContact CG1-CD1 4.06Å; L2091-L2201 HydrophobicContact CD2-CB 4.2Å; N2197-L2201 PolarHBondContact O-N 3.15Å; W2198-L2201 HydrophobicContact CE3-CD1 4.13Å; W2198-L2201 HydrophobicContact CZ3-CD1 4.31Å; W2198-L2201 WeakPolarHBondContact O-CB 3.45Å; W2198-L2201 PolarHBondContact O-N 3.13Å; A2199-L2201 PolarHBondContact O-N 3.22Å; L2201-T2205 PolarHBondContact O-OG1 3.03Å
2202L76.4Confident71.1Confident10 Ų1036 Ų365%0.05217%0.172CC..Hα-helixtrans-81.7-43.5-174.7-124.7114.3000112.9L2091 L2096 W2198 A2199 T2205 L2206 L2238 N2241L2091-L2202 HydrophobicContact CB-CD2 4.18Å; L2091-L2202 HydrophobicContact CD2-CD2 4.26Å; L2096-L2202 HydrophobicContact CD1-CD2 4.17Å; W2198-L2202 PolarHBondContact O-N 2.81Å; A2199-L2202 PolarHBondContact O-N 3.29Å; L2202-T2205 WeakPolarHBondContact O-CB 3.29Å; L2202-T2205 PolarHBondContact O-N 3.26Å; L2202-T2205 VanDerWaalsContact O-N 3.09Å; L2202-L2206 HydrophobicContact CD1-CG 4.36Å; L2202-L2206 HydrophobicContact CD2-CD1 4.26Å; L2202-L2206 HydrophobicContact CG-CD1 3.93Å; L2202-L2206 HydrophobicContact CG-CG 4.16Å; L2202-L2206 WeakPolarHBondContact O-CG 3.41Å; L2202-L2206 PolarHBondContact O-N 3.29Å; L2202-L2238 HydrophobicContact CD1-CD2 3.69Å; L2202-L2238 HydrophobicContact CD2-CD2 3.97Å; L2202-L2238 HydrophobicContact CG-CD2 4.19Å; L2202-N2241 WeakPolarHBondContact CD1-ND2 3.29Å
2203I75.5Confident73Confident49 Ų4932.5 Ų32.525%0.25116%0.156SC..Hα-helixtrans-58.2-45.6-173.2-68.7166000112.7A2199 T2205 L2206 R2207 E2242A2199-I2203 HydrophobicContact CB-CD1 4.17Å; A2199-I2203 WeakPolarHBondContact O-CB 3.3Å; A2199-I2203 VanDerWaalsContact O-CG1 3.26Å; A2199-I2203 WeakPolarHBondContact O-CG1 3.34Å; A2199-I2203 PolarHBondContact O-N 3.2Å; I2203-T2205 VanDerWaalsContact C-N 3.27Å; I2203-T2205 PolarHBondContact O-N 2.98Å; I2203-L2206 PolarHBondContact O-N 2.94Å; I2203-R2207 WeakPolarHBondContact O-CB 3.41Å; I2203-R2207 PolarHBondContact O-N 3.04Å; I2203-E2242 WeakPolarHBondContact CD1-OE1 3.37Å
2204P82.2Confident75.1Confident14 Ų1433.2 Ų33.29%0.09116%0.16CC..Hα-helixtrans-61.6-35.9177.5-23.535.1000112.6Y2056 Q2057 M2060 G2200 R2207 L2208Y2056-P2204 HydrophobicContact CE1-CG 4.22Å; Q2057-P2204 VanDerWaalsContact OE1-CG 3.28Å; M2060-P2204 HydrophobicContact CB-CB 3.68Å; M2060-P2204 VanDerWaalsContact CE-C 3.46Å; M2060-P2204 HydrophobicContact CE-CB 4.04Å; M2060-P2204 VanDerWaalsContact CE-O 3.31Å; M2060-P2204 WeakPolarHBondContact CE-O 3.38Å; M2060-P2204 HydrophobicContact CG-CB 3.96Å; G2200-P2204 WeakPolarHBondContact O-CD 3.34Å; G2200-P2204 VanDerWaalsContact O-CG 3.29Å; G2200-P2204 WeakPolarHBondContact O-CG 3.37Å; P2204-R2207 PolarHBondContact O-N 3Å; P2204-L2208 WeakPolarHBondContact O-CB 3.32Å; P2204-L2208 PolarHBondContact O-N 3.26Å
2205T85.1Confident76.9Confident0 Ų029.8 Ų29.80%015%0.145CC..Hα-helixtrans-67.5-42178-54.80000111.8Y2056 L2085 L2091 L2201 L2202 I2203 L2208 S2209 F2230Y2056-T2205 PolarHBondContact OH-OG1 3.12Å; L2085-T2205 HydrophobicContact CB-CG2 4.35Å; L2085-T2205 HydrophobicContact CD1-CG2 3.82Å; L2085-T2205 HydrophobicContact CG-CG2 4.49Å; L2091-T2205 HydrophobicContact CD1-CG2 4.23Å; L2201-T2205 PolarHBondContact O-OG1 3.03Å; L2202-T2205 WeakPolarHBondContact O-CB 3.29Å; L2202-T2205 PolarHBondContact O-N 3.26Å; L2202-T2205 VanDerWaalsContact O-N 3.09Å; I2203-T2205 VanDerWaalsContact C-N 3.27Å; I2203-T2205 PolarHBondContact O-N 2.98Å; T2205-L2208 PolarHBondContact O-N 3.37Å; T2205-S2209 PolarHBondContact O-N 2.92Å; T2205-S2209 VanDerWaalsContact O-N 3.08Å; T2205-S2209 PolarHBondContact O-OG 3.28Å; T2205-F2230 HydrophobicContact CG2-CD2 4.35Å; T2205-F2230 HydrophobicContact CG2-CE1 4.13Å; T2205-F2230 HydrophobicContact CG2-CE2 3.63Å; T2205-F2230 HydrophobicContact CG2-CZ 3.4Å
2206L80Confident78.3Confident4.5 Ų4.526.6 Ų26.62%0.02413%0.133CC..Hα-helixtrans-65.6-41.4173.7-65.2176.9000111.6L2202 I2203 L2208 S2209 K2210 F2230 L2231 L2238 L2245 L2291 L2294L2202-L2206 HydrophobicContact CD1-CG 4.36Å; L2202-L2206 HydrophobicContact CD2-CD1 4.26Å; L2202-L2206 HydrophobicContact CG-CD1 3.93Å; L2202-L2206 HydrophobicContact CG-CG 4.16Å; L2202-L2206 WeakPolarHBondContact O-CG 3.41Å; L2202-L2206 PolarHBondContact O-N 3.29Å; I2203-L2206 PolarHBondContact O-N 2.94Å; L2206-L2208 VanDerWaalsContact C-N 3.33Å; L2206-L2208 PolarHBondContact O-N 2.84Å; L2206-S2209 WeakPolarHBondContact CA-OG 3.34Å; L2206-S2209 PolarHBondContact O-N 3.3Å; L2206-S2209 PolarHBondContact O-OG 2.63Å; L2206-K2210 WeakPolarHBondContact O-CG 3.48Å; L2206-K2210 PolarHBondContact O-N 3.38Å; L2206-F2230 HydrophobicContact CD2-CE1 4.26Å; L2206-L2231 HydrophobicContact CD2-CD2 3.95Å; L2206-L2238 HydrophobicContact CD1-CD2 3.78Å; L2206-L2238 HydrophobicContact CD2-CD2 4.01Å; L2206-L2238 HydrophobicContact CG-CD2 4.27Å; L2206-L2245 HydrophobicContact CD1-CD1 4.15Å; L2206-L2291 HydrophobicContact CD1-CB 4.18Å; L2206-L2291 HydrophobicContact CD1-CD1 3.8Å; L2206-L2291 HydrophobicContact CD2-CD1 3.96Å; L2206-L2291 HydrophobicContact CD2-CD2 4.08Å; L2206-L2291 HydrophobicContact CD2-CG 4.23Å; L2206-L2291 HydrophobicContact CG-CD1 4.47Å; L2206-L2294 HydrophobicContact CD2-CD2 4.02Å
2207R81.2Confident78.9Confident144 Ų14426.8 Ų26.854%0.54314%0.141SC..Hα-helixtrans-60.9-45.3176.6-174.8176.3-178.5160.8-0.1111.5I2203 P2204 S2209 K2210 I2211I2203-R2207 WeakPolarHBondContact O-CB 3.41Å; I2203-R2207 PolarHBondContact O-N 3.04Å; P2204-R2207 PolarHBondContact O-N 3Å; R2207-S2209 VanDerWaalsContact C-N 3.34Å; R2207-S2209 PolarHBondContact O-N 3Å; R2207-K2210 PolarHBondContact O-N 3.42Å; R2207-I2211 HydrophobicContact CG-CD1 3.94Å; R2207-I2211 WeakPolarHBondContact O-CB 3.28Å; R2207-I2211 WeakPolarHBondContact O-CD1 3.37Å; R2207-I2211 VanDerWaalsContact O-CG1 3.25Å; R2207-I2211 WeakPolarHBondContact O-CG1 3.34Å; R2207-I2211 PolarHBondContact O-N 3.23Å
2208L88.3Confident79.1Confident0 Ų027.1 Ų27.10%014%0.144CC..Hα-helixtrans-59.4-48.7175.9177.874.6000111.7M2060 L2063 L2076 I2081 I2082 L2085 P2204 T2205 L2206 K2210 I2211 L2212M2060-L2208 HydrophobicContact CE-CB 3.97Å; M2060-L2208 HydrophobicContact CE-CD2 3.93Å; L2063-L2208 HydrophobicContact CB-CD1 4.09Å; L2076-L2208 HydrophobicContact CD1-CD1 4.39Å; I2081-L2208 HydrophobicContact CD1-CD1 4.26Å; I2081-L2208 HydrophobicContact CD1-CD2 3.44Å; I2081-L2208 HydrophobicContact CD1-CG 4.35Å; I2081-L2208 HydrophobicContact CG1-CD2 3.9Å; I2081-L2208 HydrophobicContact CG2-CD2 4.32Å; I2082-L2208 HydrophobicContact CD1-CD2 4.38Å; L2085-L2208 HydrophobicContact CD1-CD2 3.96Å; P2204-L2208 WeakPolarHBondContact O-CB 3.32Å; P2204-L2208 PolarHBondContact O-N 3.26Å; T2205-L2208 PolarHBondContact O-N 3.37Å; L2206-L2208 VanDerWaalsContact C-N 3.33Å; L2206-L2208 PolarHBondContact O-N 2.84Å; L2208-K2210 VanDerWaalsContact C-N 3.32Å; L2208-K2210 PolarHBondContact O-N 3.03Å; L2208-I2211 WeakPolarHBondContact O-CB 3.26Å; L2208-I2211 PolarHBondContact O-N 3.06Å; L2208-I2211 VanDerWaalsContact O-N 3.1Å; L2208-L2212 HydrophobicContact CG-CD1 4.3Å; L2208-L2212 WeakPolarHBondContact O-CG 3.46Å; L2208-L2212 PolarHBondContact O-N 3.25Å
2209S84.8Confident79.2Confident0.5 Ų0.530.8 Ų30.80%0.00317%0.171CC..Hα-helixtrans-59.5-42.6-179.4-2.40000111.9T2205 L2206 R2207 L2212 I2213 L2294T2205-S2209 PolarHBondContact O-N 2.92Å; T2205-S2209 VanDerWaalsContact O-N 3.08Å; T2205-S2209 PolarHBondContact O-OG 3.28Å; L2206-S2209 WeakPolarHBondContact CA-OG 3.34Å; L2206-S2209 PolarHBondContact O-N 3.3Å; L2206-S2209 PolarHBondContact O-OG 2.63Å; R2207-S2209 VanDerWaalsContact C-N 3.34Å; R2207-S2209 PolarHBondContact O-N 3Å; S2209-L2212 PolarHBondContact O-N 3.28Å; S2209-I2213 WeakPolarHBondContact O-CG1 3.45Å; S2209-I2213 PolarHBondContact O-N 2.91Å; S2209-L2294 VanDerWaalsContact OG-CD1 3.31Å; S2209-L2294 WeakPolarHBondContact OG-CD1 3.34Å
2210K79.2Confident79.7Confident28.5 Ų28.533 Ų3312%0.12418%0.179CC..Hα-helixtrans-61-45.1172.9-123.9-167.4-126.1-1740112.2L2206 R2207 L2208 L2212 I2213 N2214 T2289 N2290 N2293 L2294 L2297L2206-K2210 WeakPolarHBondContact O-CG 3.48Å; L2206-K2210 PolarHBondContact O-N 3.38Å; R2207-K2210 PolarHBondContact O-N 3.42Å; L2208-K2210 VanDerWaalsContact C-N 3.32Å; L2208-K2210 PolarHBondContact O-N 3.03Å; K2210-L2212 VanDerWaalsContact C-N 3.32Å; K2210-L2212 PolarHBondContact O-N 3.22Å; K2210-I2213 PolarHBondContact O-N 3.39Å; K2210-N2214 WeakPolarHBondContact O-CB 3.31Å; K2210-N2214 VanDerWaalsContact O-CG 3.27Å; K2210-N2214 PolarHBondContact O-N 2.98Å; K2210-N2214 PolarHBondContact O-ND2 2.93Å; K2210-T2289 WeakPolarHBondContact CD-O 3.37Å; K2210-T2289 WeakPolarHBondContact CE-O 3.41Å; K2210-T2289 VanDerWaalsContact NZ-CG2 3.27Å; K2210-T2289 PolarHBondContact NZ-O 2.97Å; K2210-N2290 PolarHBondContact NZ-O 3.09Å; K2210-N2290 VanDerWaalsContact NZ-O 3.07Å; K2210-N2290 PolarHBondContact NZ-OD1 2.94Å; K2210-N2293 HydrophobicContact CD-CB 4.16Å; K2210-L2294 HydrophobicContact CB-CD1 4.28Å; K2210-L2294 HydrophobicContact CD-CB 4.36Å; K2210-L2294 HydrophobicContact CG-CB 4.03Å; K2210-L2294 HydrophobicContact CG-CD1 3.66Å; K2210-L2294 HydrophobicContact CG-CG 4.48Å; K2210-L2297 HydrophobicContact CB-CD1 4.16Å; K2210-L2297 HydrophobicContact CG-CD1 4.06Å
2211I83.7Confident80.1Confident30 Ų3037.6 Ų37.615%0.15420%0.199CC..Hα-helixtrans-59.6-45.9179.7-75.4168000110.7C2064 G2067 S2068 R2207 L2208 I2213 N2214 S2215C2064-I2211 HydrophobicContact CB-CD1 3.56Å; G2067-I2211 VanDerWaalsContact O-CG2 3.23Å; G2067-I2211 WeakPolarHBondContact O-CG2 3.47Å; S2068-I2211 VanDerWaalsContact N-CG2 3.3Å; R2207-I2211 HydrophobicContact CG-CD1 3.94Å; R2207-I2211 WeakPolarHBondContact O-CB 3.28Å; R2207-I2211 WeakPolarHBondContact O-CD1 3.37Å; R2207-I2211 VanDerWaalsContact O-CG1 3.25Å; R2207-I2211 WeakPolarHBondContact O-CG1 3.34Å; R2207-I2211 PolarHBondContact O-N 3.23Å; L2208-I2211 WeakPolarHBondContact O-CB 3.26Å; L2208-I2211 PolarHBondContact O-N 3.06Å; L2208-I2211 VanDerWaalsContact O-N 3.1Å; I2211-I2213 VanDerWaalsContact C-N 3.34Å; I2211-I2213 PolarHBondContact O-N 2.86Å; I2211-N2214 PolarHBondContact O-N 2.94Å; I2211-S2215 WeakPolarHBondContact O-CB 3.21Å; I2211-S2215 PolarHBondContact O-N 3.1Å; I2211-S2215 PolarHBondContact O-OG 2.89Å
2212L86.2Confident80.1Confident0.5 Ų0.540.1 Ų40.10%0.00322%0.216CC..Hα-helixtrans-62.3-40.8179.4-69.1175.8000112.7A2073 L2076 I2081 I2082 L2208 S2209 K2210 S2215 L2216 I2223A2073-L2212 HydrophobicContact CB-CD2 3.86Å; L2076-L2212 HydrophobicContact CB-CD2 4.14Å; L2076-L2212 HydrophobicContact CD1-CD2 4.22Å; I2081-L2212 HydrophobicContact CG2-CD1 4.02Å; I2082-L2212 HydrophobicContact CD1-CD1 3.99Å; I2082-L2212 HydrophobicContact CG1-CD1 3.95Å; L2208-L2212 HydrophobicContact CG-CD1 4.3Å; L2208-L2212 WeakPolarHBondContact O-CG 3.46Å; L2208-L2212 PolarHBondContact O-N 3.25Å; S2209-L2212 PolarHBondContact O-N 3.28Å; K2210-L2212 VanDerWaalsContact C-N 3.32Å; K2210-L2212 PolarHBondContact O-N 3.22Å; L2212-S2215 PolarHBondContact O-OG 3.39Å; L2212-L2216 WeakPolarHBondContact O-CB 3.5Å; L2212-L2216 WeakPolarHBondContact O-CG 3.45Å; L2212-L2216 PolarHBondContact O-N 3.27Å; L2212-I2223 HydrophobicContact CB-CG2 4.33Å
2213I81.6Confident80.4Confident1.5 Ų1.539.7 Ų39.71%0.00821%0.214CC..Hα-helixtrans-66.2-43176.6-66.4163.2000110.5S2209 K2210 I2211 S2215 G2217 T2218 I2227 L2294 L2297 I2298S2209-I2213 WeakPolarHBondContact O-CG1 3.45Å; S2209-I2213 PolarHBondContact O-N 2.91Å; K2210-I2213 PolarHBondContact O-N 3.39Å; I2211-I2213 VanDerWaalsContact C-N 3.34Å; I2211-I2213 PolarHBondContact O-N 2.86Å; I2213-S2215 PolarHBondContact O-N 3.35Å; I2213-G2217 CarbonylContact O-C 3.53Å; I2213-G2217 VanDerWaalsContact O-CA 3.28Å; I2213-G2217 WeakPolarHBondContact O-CA 3.42Å; I2213-G2217 PolarHBondContact O-N 3.39Å; I2213-T2218 HydrophobicContact CG2-CG2 4.01Å; I2213-I2227 HydrophobicContact CD1-CD1 3.49Å; I2213-I2227 VanDerWaalsContact CD1-CD1 3.43Å; I2213-I2227 HydrophobicContact CD1-CG2 4.24Å; I2213-I2227 HydrophobicContact CG1-CD1 3.48Å; I2213-I2227 VanDerWaalsContact CG1-CD1 3.45Å; I2213-L2294 HydrophobicContact CD1-CD1 4.03Å; I2213-L2294 HydrophobicContact CD1-CD2 3.66Å; I2213-L2294 HydrophobicContact CD1-CG 3.44Å; I2213-L2294 VanDerWaalsContact CD1-CG 3.44Å; I2213-L2297 HydrophobicContact CD1-CB 4.33Å; I2213-L2297 HydrophobicContact CG2-CB 3.79Å; I2213-L2297 HydrophobicContact CG2-CD1 3.77Å; I2213-L2297 HydrophobicContact CG2-CD2 4.46Å; I2213-L2297 HydrophobicContact CG2-CG 4.1Å; I2213-I2298 HydrophobicContact CD1-CD1 4Å; I2213-I2298 HydrophobicContact CD1-CG1 3.78Å
2214N82.8Confident80.5Confident98 Ų9837.7 Ų37.752%0.52420%0.204SC..Hα-helixtrans-66.5-37-179.7-76.6-10.2000112.8K2210 I2211 L2297K2210-N2214 WeakPolarHBondContact O-CB 3.31Å; K2210-N2214 VanDerWaalsContact O-CG 3.27Å; K2210-N2214 PolarHBondContact O-N 2.98Å; K2210-N2214 PolarHBondContact O-ND2 2.93Å; I2211-N2214 PolarHBondContact O-N 2.94Å; N2214-L2297 WeakPolarHBondContact OD1-CD1 3.43Å; N2214-L2297 WeakPolarHBondContact OD1-CD2 3.46Å
2215S84.9Confident80.4Confident27.5 Ų27.541.5 Ų41.519%0.19222%0.221CC..Hα-helixtrans-82.6-31.2-176.356.10000113.9G2067 A2073 I2211 L2212 I2213G2067-S2215 VanDerWaalsContact O-CB 3.26Å; G2067-S2215 WeakPolarHBondContact O-CB 3.28Å; G2067-S2215 PolarHBondContact O-OG 3.32Å; A2073-S2215 WeakPolarHBondContact CB-OG 3.34Å; I2211-S2215 WeakPolarHBondContact O-CB 3.21Å; I2211-S2215 PolarHBondContact O-N 3.1Å; I2211-S2215 PolarHBondContact O-OG 2.89Å; L2212-S2215 PolarHBondContact O-OG 3.39Å; I2213-S2215 PolarHBondContact O-N 3.35Å
2216L83.4Confident80.3Confident32 Ų3242.8 Ų42.817%0.16823%0.227CC..Hα-helixtrans-97.3-14.1178.9-66.2169.4000113.8A2073 K2074 A2077 L2212 H2220 I2223A2073-L2216 HydrophobicContact CB-CD1 3.73Å; A2073-L2216 HydrophobicContact CB-CD2 3.95Å; A2073-L2216 HydrophobicContact CB-CG 3.59Å; K2074-L2216 HydrophobicContact CB-CD2 4.24Å; K2074-L2216 HydrophobicContact CD-CD2 4.5Å; K2074-L2216 HydrophobicContact CG-CD2 3.41Å; K2074-L2216 VanDerWaalsContact CG-CD2 3.41Å; A2077-L2216 HydrophobicContact CB-CD1 4.41Å; L2212-L2216 WeakPolarHBondContact O-CB 3.5Å; L2212-L2216 WeakPolarHBondContact O-CG 3.45Å; L2212-L2216 PolarHBondContact O-N 3.27Å; L2216-H2220 HydrophobicContact CB-CB 4.11Å; L2216-I2223 HydrophobicContact CB-CD1 4.38Å; L2216-I2223 HydrophobicContact CD1-CD1 2.95Å; L2216-I2223 HydrophobicContact CD1-CG1 4.42Å; L2216-I2223 HydrophobicContact CG-CD1 4.29Å
2217G76.4Confident80.3Confident26.5 Ų26.542.6 Ų42.627%0.27323%0.226SC..  trans84.9158-177.500000112.9I2213 T2219 H2220I2213-G2217 CarbonylContact O-C 3.53Å; I2213-G2217 VanDerWaalsContact O-CA 3.28Å; I2213-G2217 WeakPolarHBondContact O-CA 3.42Å; I2213-G2217 PolarHBondContact O-N 3.39Å; G2217-T2219 PolarHBondContact O-N 3.04Å; G2217-T2219 VanDerWaalsContact O-N 3.15Å; G2217-H2220 PolarHBondContact O-N 3.25Å
2218T69.6Low80.1Confident48 Ų4836.2 Ų36.229%0.29420%0.203SC..THydrogen-bonded Turntrans-65.4-14-177.457.40000113.5I2213 H2220 N2224 L2297 S2301I2213-T2218 HydrophobicContact CG2-CG2 4.01Å; T2218-H2220 VanDerWaalsContact C-N 3.28Å; T2218-H2220 PolarHBondContact O-N 3.27Å; T2218-N2224 PolarHBondContact O-ND2 3.25Å; T2218-L2297 WeakPolarHBondContact CB-O 3.49Å; T2218-L2297 HydrophobicContact CG2-CB 3.78Å; T2218-L2297 HydrophobicContact CG2-CD2 3.4Å; T2218-L2297 HydrophobicContact CG2-CG 4.21Å; T2218-L2297 WeakPolarHBondContact CG2-O 3.36Å; T2218-S2301 WeakPolarHBondContact O-CB 3.43Å
2219T68.8Low79.7Confident112.5 Ų112.538.6 Ų38.669%0.6922%0.216SC*.THydrogen-bonded Turntrans-84.7-7.7-17954.10000113.8G2217 M2221G2217-T2219 PolarHBondContact O-N 3.04Å; G2217-T2219 VanDerWaalsContact O-N 3.15Å; T2219-M2221 VanDerWaalsContact C-N 3.32Å; T2219-M2221 PolarHBondContact O-N 3.19Å
2220H75.7Confident79.7Confident54 Ų5438.6 Ų38.625%0.2522%0.216CC..  trans-75.688.6-176.6-162.6-77.9000111.9L2216 G2217 T2218 S2222 I2223 N2224L2216-H2220 HydrophobicContact CB-CB 4.11Å; G2217-H2220 PolarHBondContact O-N 3.25Å; T2218-H2220 VanDerWaalsContact C-N 3.28Å; T2218-H2220 PolarHBondContact O-N 3.27Å; H2220-S2222 VanDerWaalsContact C-N 3.3Å; H2220-S2222 PolarHBondContact CE1-OG 3.07Å; H2220-S2222 PolarHBondContact ND1-OG 3.09Å; H2220-S2222 VanDerWaalsContact ND1-OG 3.14Å; H2220-S2222 PolarHBondContact O-N 3.21Å; H2220-S2222 VanDerWaalsContact O-N 3.12Å; H2220-I2223 VanDerWaalsContact CE1-CD1 3.41Å; H2220-I2223 WeakPolarHBondContact CE1-CD1 3.43Å; H2220-I2223 VanDerWaalsContact ND1-CD1 3.32Å; H2220-I2223 WeakPolarHBondContact ND1-CD1 3.07Å; H2220-I2223 WeakPolarHBondContact ND1-CG1 3.28Å; H2220-I2223 PolarHBondContact O-N 2.85Å; H2220-I2223 VanDerWaalsContact O-N 3.13Å; H2220-N2224 PolarHBondContact O-N 3.37Å; H2220-N2224 PolarHBondContact O-ND2 3.3Å
2221M76.5Confident79.6Confident108.5 Ų108.537.5 Ų37.553%0.53421%0.211SC..Hα-helixtrans-52.4-46.1-170.5-69.3-173.1171.600114.7T2219 I2223 N2224 Q2225 V2306T2219-M2221 VanDerWaalsContact C-N 3.32Å; T2219-M2221 PolarHBondContact O-N 3.19Å; M2221-I2223 PolarHBondContact O-N 3.33Å; M2221-N2224 PolarHBondContact O-N 2.91Å; M2221-Q2225 WeakPolarHBondContact O-CB 3.4Å; M2221-Q2225 VanDerWaalsContact O-CG 3.28Å; M2221-Q2225 WeakPolarHBondContact O-CG 3.36Å; M2221-Q2225 PolarHBondContact O-N 3.07Å; M2221-V2306 HydrophobicContact CE-CB 3.17Å; M2221-V2306 HydrophobicContact CE-CG1 3.19Å; M2221-V2306 HydrophobicContact CE-CG2 4.4Å
2222S80.7Confident79.2Confident52 Ų5238 Ų3836%0.36421%0.212SC..Hα-helixtrans-64.4-41-173.2590000112.1H2220 Q2225 Q2226H2220-S2222 VanDerWaalsContact C-N 3.3Å; H2220-S2222 PolarHBondContact CE1-OG 3.07Å; H2220-S2222 PolarHBondContact ND1-OG 3.09Å; H2220-S2222 VanDerWaalsContact ND1-OG 3.14Å; H2220-S2222 PolarHBondContact O-N 3.21Å; H2220-S2222 VanDerWaalsContact O-N 3.12Å; S2222-Q2225 PolarHBondContact O-N 3.15Å; S2222-Q2226 VanDerWaalsContact O-CG 3.25Å; S2222-Q2226 WeakPolarHBondContact O-CG 3.32Å; S2222-Q2226 PolarHBondContact O-N 3.04Å
2223I82.2Confident78.9Confident2 Ų240.6 Ų40.61%0.0123%0.228CC..Hα-helixtrans-73.5-42-179.4-70.4169.1000110.8A2077 L2212 L2216 H2220 M2221 Q2225 Q2226 I2227A2077-I2223 HydrophobicContact CB-CD1 3.28Å; A2077-I2223 HydrophobicContact CB-CG1 3.6Å; A2077-I2223 VanDerWaalsContact CB-CG1 3.45Å; L2212-I2223 HydrophobicContact CB-CG2 4.33Å; L2216-I2223 HydrophobicContact CB-CD1 4.38Å; L2216-I2223 HydrophobicContact CD1-CD1 2.95Å; L2216-I2223 HydrophobicContact CD1-CG1 4.42Å; L2216-I2223 HydrophobicContact CG-CD1 4.29Å; H2220-I2223 VanDerWaalsContact CE1-CD1 3.41Å; H2220-I2223 WeakPolarHBondContact CE1-CD1 3.43Å; H2220-I2223 VanDerWaalsContact ND1-CD1 3.32Å; H2220-I2223 WeakPolarHBondContact ND1-CD1 3.07Å; H2220-I2223 WeakPolarHBondContact ND1-CG1 3.28Å; H2220-I2223 PolarHBondContact O-N 2.85Å; H2220-I2223 VanDerWaalsContact O-N 3.13Å; M2221-I2223 PolarHBondContact O-N 3.33Å; I2223-Q2225 PolarHBondContact O-N 3.42Å; I2223-Q2226 PolarHBondContact O-N 3.23Å; I2223-Q2226 VanDerWaalsContact O-N 3.13Å; I2223-I2227 HydrophobicContact CG2-CD1 3.47Å; I2223-I2227 VanDerWaalsContact CG2-CD1 3.47Å; I2223-I2227 HydrophobicContact CG2-CG1 4.1Å; I2223-I2227 WeakPolarHBondContact O-CB 3.5Å; I2223-I2227 VanDerWaalsContact O-CG1 3.3Å; I2223-I2227 WeakPolarHBondContact O-CG1 3.41Å; I2223-I2227 PolarHBondContact O-N 3.33Å
2224N77.8Confident78.8Confident7 Ų740.6 Ų40.64%0.03723%0.229CC..Hα-helixtrans-57.2-42.8174-69.8-15.8000110.5T2218 H2220 M2221 I2227 V2228 I2298 S2301T2218-N2224 PolarHBondContact O-ND2 3.25Å; H2220-N2224 PolarHBondContact O-N 3.37Å; H2220-N2224 PolarHBondContact O-ND2 3.3Å; M2221-N2224 PolarHBondContact O-N 2.91Å; N2224-I2227 PolarHBondContact O-N 3.38Å; N2224-V2228 VanDerWaalsContact O-CB 3.23Å; N2224-V2228 WeakPolarHBondContact O-CB 3.41Å; N2224-V2228 VanDerWaalsContact O-CG2 3.24Å; N2224-V2228 WeakPolarHBondContact O-CG2 3.22Å; N2224-V2228 PolarHBondContact O-N 2.92Å; N2224-I2298 HydrophobicContact CB-CG1 4.18Å; N2224-S2301 VanDerWaalsContact ND2-CB 3.34Å; N2224-S2301 WeakPolarHBondContact ND2-CB 3.29Å; N2224-S2301 PolarHBondContact ND2-OG 2.99Å; N2224-S2301 VanDerWaalsContact ND2-OG 3.11Å
2225Q79.5Confident78.4Confident94 Ų9436.3 Ų36.344%0.43921%0.206SC..Hα-helixtrans-63-43.5175.3-124.5175.2-7.600112.5M2221 S2222 I2223 I2227 V2228 N2229M2221-Q2225 WeakPolarHBondContact O-CB 3.4Å; M2221-Q2225 VanDerWaalsContact O-CG 3.28Å; M2221-Q2225 WeakPolarHBondContact O-CG 3.36Å; M2221-Q2225 PolarHBondContact O-N 3.07Å; S2222-Q2225 PolarHBondContact O-N 3.15Å; I2223-Q2225 PolarHBondContact O-N 3.42Å; Q2225-I2227 PolarHBondContact O-N 3.47Å; Q2225-V2228 PolarHBondContact O-N 3.09Å; Q2225-N2229 WeakPolarHBondContact O-CB 3.36Å; Q2225-N2229 PolarHBondContact O-N 3.21Å
2226Q83.4Confident77.8Confident28 Ų2838 Ų3813%0.13122%0.218CC..Hα-helixtrans-63.5-41.8177-67.3177.614.200111.9A2077 I2082 N2083 S2222 I2223 N2229 F2230A2077-Q2226 PolarHBondContact O-NE2 3.28Å; I2082-Q2226 HydrophobicContact CB-CB 3.96Å; I2082-Q2226 VanDerWaalsContact CG2-C 3.5Å; I2082-Q2226 HydrophobicContact CG2-CB 3.79Å; I2082-Q2226 WeakPolarHBondContact CG2-O 3.3Å; N2083-Q2226 VanDerWaalsContact OD1-CG 3.24Å; N2083-Q2226 WeakPolarHBondContact OD1-CG 3.31Å; S2222-Q2226 VanDerWaalsContact O-CG 3.25Å; S2222-Q2226 WeakPolarHBondContact O-CG 3.32Å; S2222-Q2226 PolarHBondContact O-N 3.04Å; I2223-Q2226 PolarHBondContact O-N 3.23Å; I2223-Q2226 VanDerWaalsContact O-N 3.13Å; Q2226-N2229 WeakPolarHBondContact O-CB 3.4Å; Q2226-N2229 PolarHBondContact O-N 3.05Å; Q2226-F2230 PolarHBondContact O-N 3.21Å
2227I80.4Confident77.2Confident0 Ų036.6 Ų36.60%021%0.211CC..Hα-helixtrans-72.1-38.3179.6-63170.2000111I2082 I2213 I2223 N2224 Q2225 N2229 F2230 L2231 L2294 I2298I2082-I2227 HydrophobicContact CD1-CG1 4.3Å; I2082-I2227 HydrophobicContact CG1-CG1 4.03Å; I2082-I2227 HydrophobicContact CG2-CG1 4.06Å; I2213-I2227 HydrophobicContact CD1-CD1 3.49Å; I2213-I2227 VanDerWaalsContact CD1-CD1 3.43Å; I2213-I2227 HydrophobicContact CD1-CG2 4.24Å; I2213-I2227 HydrophobicContact CG1-CD1 3.48Å; I2213-I2227 VanDerWaalsContact CG1-CD1 3.45Å; I2223-I2227 HydrophobicContact CG2-CD1 3.47Å; I2223-I2227 VanDerWaalsContact CG2-CD1 3.47Å; I2223-I2227 HydrophobicContact CG2-CG1 4.1Å; I2223-I2227 WeakPolarHBondContact O-CB 3.5Å; I2223-I2227 VanDerWaalsContact O-CG1 3.3Å; I2223-I2227 WeakPolarHBondContact O-CG1 3.41Å; I2223-I2227 PolarHBondContact O-N 3.33Å; N2224-I2227 PolarHBondContact O-N 3.38Å; Q2225-I2227 PolarHBondContact O-N 3.47Å; I2227-N2229 VanDerWaalsContact C-N 3.28Å; I2227-N2229 PolarHBondContact O-N 2.9Å; I2227-F2230 WeakPolarHBondContact O-CB 3.38Å; I2227-F2230 PolarHBondContact O-N 3.29Å; I2227-L2231 HydrophobicContact CG2-CD1 4.47Å; I2227-L2231 HydrophobicContact CG2-CG 4.47Å; I2227-L2231 WeakPolarHBondContact O-CB 3.45Å; I2227-L2231 WeakPolarHBondContact O-CG 3.18Å; I2227-L2231 PolarHBondContact O-N 3.44Å; I2227-L2294 HydrophobicContact CG2-CD1 4.33Å; I2227-L2294 HydrophobicContact CG2-CD2 3.96Å; I2227-L2294 VanDerWaalsContact CG2-CD2 3.43Å; I2227-L2294 HydrophobicContact CG2-CG 4.33Å; I2227-I2298 HydrophobicContact CB-CD1 4.34Å; I2227-I2298 HydrophobicContact CG2-CD1 3.81Å; I2227-I2298 HydrophobicContact CG2-CG1 4.41Å
2228V76Confident76.9Confident9 Ų935.7 Ų35.76%0.05520%0.199CC..Hα-helixtrans-58.8-44.5170.1168.30000109.6N2224 Q2225 F2230 L2231 H2232 I2298 F2302 R2344 I2347N2224-V2228 VanDerWaalsContact O-CB 3.23Å; N2224-V2228 WeakPolarHBondContact O-CB 3.41Å; N2224-V2228 VanDerWaalsContact O-CG2 3.24Å; N2224-V2228 WeakPolarHBondContact O-CG2 3.22Å; N2224-V2228 PolarHBondContact O-N 2.92Å; Q2225-V2228 PolarHBondContact O-N 3.09Å; V2228-F2230 VanDerWaalsContact C-N 3.34Å; V2228-F2230 PolarHBondContact O-N 2.98Å; V2228-L2231 PolarHBondContact O-N 3.43Å; V2228-H2232 VanDerWaalsContact O-CB 3.32Å; V2228-H2232 WeakPolarHBondContact O-CB 3.45Å; V2228-H2232 PolarHBondContact O-N 3.09Å; V2228-I2298 HydrophobicContact CG2-CD1 4.01Å; V2228-I2298 HydrophobicContact CG2-CG2 4.01Å; V2228-F2302 HydrophobicContact CG1-CE1 4.36Å; V2228-F2302 HydrophobicContact CG2-CE1 3.51Å; V2228-F2302 HydrophobicContact CG2-CZ 3.83Å; V2228-R2344 HydrophobicContact CG1-CG 3.96Å; V2228-I2347 HydrophobicContact CB-CD1 4.28Å; V2228-I2347 HydrophobicContact CG1-CD1 3.46Å; V2228-I2347 VanDerWaalsContact CG1-CD1 3.46Å; V2228-I2347 WeakPolarHBondContact O-CD1 3.26Å
2229N81Confident76.8Confident51.5 Ų51.534.5 Ų34.528%0.27519%0.191SC..Hα-helixtrans-60.4-44.8175.5-169.543.8000111.8Q2225 Q2226 I2227 L2231 H2232 T2233Q2225-N2229 WeakPolarHBondContact O-CB 3.36Å; Q2225-N2229 PolarHBondContact O-N 3.21Å; Q2226-N2229 WeakPolarHBondContact O-CB 3.4Å; Q2226-N2229 PolarHBondContact O-N 3.05Å; I2227-N2229 VanDerWaalsContact C-N 3.28Å; I2227-N2229 PolarHBondContact O-N 2.9Å; N2229-L2231 PolarHBondContact O-N 3.04Å; N2229-H2232 WeakPolarHBondContact O-CB 3.46Å; N2229-H2232 PolarHBondContact O-N 2.62Å; N2229-H2232 VanDerWaalsContact O-N 3.1Å; N2229-T2233 WeakPolarHBondContact O-CG2 3.43Å; N2229-T2233 PolarHBondContact O-N 2.99Å; N2229-T2233 PolarHBondContact O-OG1 3.3Å
2230F83.7Confident76.4Confident0.5 Ų0.530.4 Ų30.40%0.00217%0.166CC..Hα-helixtrans-56.2-48.1175.1176.9-96.5000112.4I2082 L2085 T2086 L2091 T2205 L2206 Q2226 I2227 V2228 H2232 T2233 H2234 L2238I2082-F2230 HydrophobicContact CG2-CB 3.88Å; I2082-F2230 HydrophobicContact CG2-CG 4.46Å; L2085-F2230 HydrophobicContact CB-CD2 4.39Å; L2085-F2230 HydrophobicContact CB-CE2 4.35Å; T2086-F2230 HydrophobicContact CG2-CB 3.48Å; T2086-F2230 VanDerWaalsContact CG2-CB 3.48Å; T2086-F2230 HydrophobicContact CG2-CD2 3.95Å; T2086-F2230 HydrophobicContact CG2-CG 4.21Å; L2091-F2230 HydrophobicContact CD1-CE2 3.8Å; L2091-F2230 HydrophobicContact CD1-CZ 4.23Å; T2205-F2230 HydrophobicContact CG2-CD2 4.35Å; T2205-F2230 HydrophobicContact CG2-CE1 4.13Å; T2205-F2230 HydrophobicContact CG2-CE2 3.63Å; T2205-F2230 HydrophobicContact CG2-CZ 3.4Å; L2206-F2230 HydrophobicContact CD2-CE1 4.26Å; Q2226-F2230 PolarHBondContact O-N 3.21Å; I2227-F2230 WeakPolarHBondContact O-CB 3.38Å; I2227-F2230 PolarHBondContact O-N 3.29Å; V2228-F2230 VanDerWaalsContact C-N 3.34Å; V2228-F2230 PolarHBondContact O-N 2.98Å; F2230-H2232 VanDerWaalsContact C-N 3.26Å; F2230-H2232 PolarHBondContact O-N 3.14Å; F2230-T2233 PolarHBondContact O-N 3.17Å; F2230-T2233 PolarHBondContact O-OG1 3.32Å; F2230-H2234 AromaticContact CD2-CD2 3.55Å; F2230-H2234 AromaticContact CD2-NE2 3.98Å; F2230-H2234 AromaticContact CE2-CD2 3.36Å; F2230-H2234 WeakPolarHBondContact CE2-CD2 3.39Å; F2230-H2234 AromaticContact CE2-NE2 3.81Å; F2230-H2234 AromaticContact CZ-CD2 3.87Å; F2230-H2234 PolarHBondContact O-CD2 3.23Å; F2230-H2234 VanDerWaalsContact O-CD2 3.3Å; F2230-H2234 PolarHBondContact O-N 3.19Å; F2230-H2234 VanDerWaalsContact O-N 3.1Å; F2230-L2238 HydrophobicContact CE1-CD1 4.1Å
2231L77.5Confident75.5Confident3.5 Ų3.531.2 Ų31.22%0.01817%0.173CC..Hα-helixtrans-65.8-33.2177.8-68.6-179.1000111.7L2206 I2227 V2228 N2229 S2235 L2238 L2291 L2294 F2295 I2298 I2347L2206-L2231 HydrophobicContact CD2-CD2 3.95Å; I2227-L2231 HydrophobicContact CG2-CD1 4.47Å; I2227-L2231 HydrophobicContact CG2-CG 4.47Å; I2227-L2231 WeakPolarHBondContact O-CB 3.45Å; I2227-L2231 WeakPolarHBondContact O-CG 3.18Å; I2227-L2231 PolarHBondContact O-N 3.44Å; V2228-L2231 PolarHBondContact O-N 3.43Å; N2229-L2231 PolarHBondContact O-N 3.04Å; L2231-S2235 VanDerWaalsContact O-CA 3.25Å; L2231-S2235 WeakPolarHBondContact O-CA 3.33Å; L2231-S2235 VanDerWaalsContact O-CB 3.27Å; L2231-S2235 WeakPolarHBondContact O-CB 3.31Å; L2231-S2235 PolarHBondContact O-N 2.88Å; L2231-L2238 HydrophobicContact CD2-CD1 3.65Å; L2231-L2291 HydrophobicContact CD1-CD2 3.96Å; L2231-L2291 HydrophobicContact CD2-CD2 3.64Å; L2231-L2291 HydrophobicContact CG-CD2 4.48Å; L2231-L2294 HydrophobicContact CD1-CD2 4.03Å; L2231-L2294 HydrophobicContact CD2-CD2 3.85Å; L2231-L2294 HydrophobicContact CG-CD2 4.37Å; L2231-F2295 HydrophobicContact CD1-CD1 4.05Å; L2231-F2295 HydrophobicContact CD1-CE1 4.15Å; L2231-F2295 HydrophobicContact CD1-CE2 3.8Å; L2231-F2295 HydrophobicContact CD1-CZ 3.66Å; L2231-F2295 HydrophobicContact CD2-CE1 3.81Å; L2231-I2298 HydrophobicContact CD1-CD1 3.6Å; L2231-I2347 HydrophobicContact CB-CD1 4.38Å; L2231-I2347 HydrophobicContact CB-CG2 4.25Å
2232H75.8Confident74.6Confident41 Ų4127.9 Ų27.919%0.1916%0.156CC..Hα-helixtrans-68.6-47.6178-173.3-11.5000111.4V2228 N2229 F2230 H2234 S2235 I2347V2228-H2232 VanDerWaalsContact O-CB 3.32Å; V2228-H2232 WeakPolarHBondContact O-CB 3.45Å; V2228-H2232 PolarHBondContact O-N 3.09Å; N2229-H2232 WeakPolarHBondContact O-CB 3.46Å; N2229-H2232 PolarHBondContact O-N 2.62Å; N2229-H2232 VanDerWaalsContact O-N 3.1Å; F2230-H2232 VanDerWaalsContact C-N 3.26Å; F2230-H2232 PolarHBondContact O-N 3.14Å; H2232-H2234 PolarHBondContact O-N 3.39Å; H2232-S2235 PolarHBondContact O-N 3.2Å; H2232-S2235 PolarHBondContact O-OG 3.2Å; H2232-I2347 HydrophobicContact CB-CD1 3.87Å; H2232-I2347 HydrophobicContact CB-CG1 4.1Å; H2232-I2347 WeakPolarHBondContact ND1-CG1 3.46Å
2233T78.6Confident73.3Confident55.5 Ų55.528.7 Ų28.734%0.3416%0.155SC..Hα-helixtrans-63.5-43.7-17954.90000111.5N2229 F2230N2229-T2233 WeakPolarHBondContact O-CG2 3.43Å; N2229-T2233 PolarHBondContact O-N 2.99Å; N2229-T2233 PolarHBondContact O-OG1 3.3Å; F2230-T2233 PolarHBondContact O-N 3.17Å; F2230-T2233 PolarHBondContact O-OG1 3.32Å
2234H79.8Confident72Confident2.5 Ų2.535.5 Ų35.51%0.01219%0.187CC..THydrogen-bonded Turntrans-98.914.8-177.7-54.5-64.6000113.7L2085 T2086 C2088 S2092 F2230 H2232 S2236 S2237 L2238L2085-H2234 PolarHBondContact O-NE2 3.39Å; T2086-H2234 PolarHBondContact O-NE2 3.24Å; C2088-H2234 PolarHBondContact O-CE1 2.9Å; S2092-H2234 PolarHBondContact N-ND1 3.33Å; F2230-H2234 AromaticContact CD2-CD2 3.55Å; F2230-H2234 AromaticContact CD2-NE2 3.98Å; F2230-H2234 AromaticContact CE2-CD2 3.36Å; F2230-H2234 WeakPolarHBondContact CE2-CD2 3.39Å; F2230-H2234 AromaticContact CE2-NE2 3.81Å; F2230-H2234 AromaticContact CZ-CD2 3.87Å; F2230-H2234 PolarHBondContact O-CD2 3.23Å; F2230-H2234 VanDerWaalsContact O-CD2 3.3Å; F2230-H2234 PolarHBondContact O-N 3.19Å; F2230-H2234 VanDerWaalsContact O-N 3.1Å; H2232-H2234 PolarHBondContact O-N 3.39Å; H2234-S2236 PolarHBondContact O-N 3.14Å; H2234-S2236 VanDerWaalsContact O-N 3.17Å; H2234-S2237 PolarHBondContact O-N 2.82Å; H2234-S2237 PolarHBondContact O-OG 2.81Å; H2234-L2238 HydrophobicContact CB-CD1 3.99Å; H2234-L2238 HydrophobicContact CB-CG 4.19Å; H2234-L2238 WeakPolarHBondContact O-CB 3.02Å; H2234-L2238 WeakPolarHBondContact O-CG 3.1Å; H2234-L2238 PolarHBondContact O-N 3.2Å; H2234-L2238 VanDerWaalsContact O-N 3.12Å
2235S75.3Confident71Confident7.5 Ų7.535.8 Ų35.85%0.05219%0.188CC..Hα-helixtrans-58.3-33.4-176.358.70000113.4L2231 H2232 S2237 M2239 K2350L2231-S2235 VanDerWaalsContact O-CA 3.25Å; L2231-S2235 WeakPolarHBondContact O-CA 3.33Å; L2231-S2235 VanDerWaalsContact O-CB 3.27Å; L2231-S2235 WeakPolarHBondContact O-CB 3.31Å; L2231-S2235 PolarHBondContact O-N 2.88Å; H2232-S2235 PolarHBondContact O-N 3.2Å; H2232-S2235 PolarHBondContact O-OG 3.2Å; S2235-S2237 VanDerWaalsContact C-N 3.31Å; S2235-S2237 PolarHBondContact O-N 3Å; S2235-M2239 WeakPolarHBondContact O-CB 2.98Å; S2235-M2239 WeakPolarHBondContact O-CG 3.41Å; S2235-M2239 PolarHBondContact O-N 3.21Å; S2235-K2350 WeakPolarHBondContact OG-CD 3.28Å; S2235-K2350 PolarHBondContact OG-NZ 2.74Å
2236S70.9Confident69.9Low63 Ų6331.5 Ų31.544%0.44117%0.169SC..Hα-helixtrans-67.5-39.2178.5490000112.6H2234 M2239 C2240H2234-S2236 PolarHBondContact O-N 3.14Å; H2234-S2236 VanDerWaalsContact O-N 3.17Å; S2236-M2239 PolarHBondContact O-N 3.38Å; S2236-C2240 PolarHBondContact O-N 3.33Å; S2236-C2240 PolarHBondContact O-SG 3.16Å
2237S72.3Confident68.5Low3 Ų331.9 Ų31.92%0.02118%0.175CC..Hα-helixtrans-75.5-40.2178103.20000111.6L2091 S2094 N2095 H2234 S2235 M2239 C2240 N2241L2091-S2237 WeakPolarHBondContact O-CB 3.41Å; L2091-S2237 PolarHBondContact O-OG 2.97Å; S2094-S2237 WeakPolarHBondContact O-CB 3.41Å; S2094-S2237 PolarHBondContact O-OG 3.36Å; S2094-S2237 VanDerWaalsContact OG-CA 3.31Å; S2094-S2237 WeakPolarHBondContact OG-CA 3.48Å; S2094-S2237 WeakPolarHBondContact OG-CB 3.3Å; N2095-S2237 WeakPolarHBondContact CA-O 3.34Å; N2095-S2237 WeakPolarHBondContact CB-O 3.19Å; H2234-S2237 PolarHBondContact O-N 2.82Å; H2234-S2237 PolarHBondContact O-OG 2.81Å; S2235-S2237 VanDerWaalsContact C-N 3.31Å; S2235-S2237 PolarHBondContact O-N 3Å; S2237-M2239 PolarHBondContact O-N 3.34Å; S2237-C2240 PolarHBondContact O-N 3.26Å; S2237-C2240 VanDerWaalsContact O-N 3.14Å; S2237-N2241 PolarHBondContact O-N 3.39Å; S2237-N2241 PolarHBondContact O-ND2 3.2Å
2238L70.2Confident67.2Low6 Ų632.8 Ų32.83%0.03118%0.181CC..Hα-helixtrans-69.1-30.3-179.9-69.5174.4000113.6L2202 L2206 F2230 L2231 H2234 L2291L2202-L2238 HydrophobicContact CD1-CD2 3.69Å; L2202-L2238 HydrophobicContact CD2-CD2 3.97Å; L2202-L2238 HydrophobicContact CG-CD2 4.19Å; L2206-L2238 HydrophobicContact CD1-CD2 3.78Å; L2206-L2238 HydrophobicContact CD2-CD2 4.01Å; L2206-L2238 HydrophobicContact CG-CD2 4.27Å; F2230-L2238 HydrophobicContact CE1-CD1 4.1Å; L2231-L2238 HydrophobicContact CD2-CD1 3.65Å; H2234-L2238 HydrophobicContact CB-CD1 3.99Å; H2234-L2238 HydrophobicContact CB-CG 4.19Å; H2234-L2238 WeakPolarHBondContact O-CB 3.02Å; H2234-L2238 WeakPolarHBondContact O-CG 3.1Å; H2234-L2238 PolarHBondContact O-N 3.2Å; H2234-L2238 VanDerWaalsContact O-N 3.12Å; L2238-L2291 HydrophobicContact CB-CD1 4.04Å; L2238-L2291 HydrophobicContact CD2-CD1 3.74Å; L2238-L2291 HydrophobicContact CG-CD1 4.43Å; L2238-L2291 WeakPolarHBondContact O-CD1 3.25Å
2239M65.7Low66.3Low24 Ų2432.5 Ų32.512%0.11818%0.18CC..THydrogen-bonded Turntrans-103.716.2-177.7-64-120.2-174.300112.2S2235 S2236 S2237 A2246 I2249 F2295 K2350 I2351 H2354S2235-M2239 WeakPolarHBondContact O-CB 2.98Å; S2235-M2239 WeakPolarHBondContact O-CG 3.41Å; S2235-M2239 PolarHBondContact O-N 3.21Å; S2236-M2239 PolarHBondContact O-N 3.38Å; S2237-M2239 PolarHBondContact O-N 3.34Å; M2239-A2246 HydrophobicContact CE-CB 4.4Å; M2239-A2246 VanDerWaalsContact SD-CA 3.55Å; M2239-A2246 HydrophobicContact SD-CB 3.44Å; M2239-A2246 WeakPolarHBondContact SD-CB 3.1Å; M2239-I2249 HydrophobicContact CE-CB 3.9Å; M2239-I2249 HydrophobicContact CE-CD1 4.01Å; M2239-I2249 HydrophobicContact CE-CG2 3.72Å; M2239-F2295 HydrophobicContact CE-CD1 4.32Å; M2239-F2295 HydrophobicContact CE-CE1 3.47Å; M2239-F2295 VanDerWaalsContact CE-CE1 3.47Å; M2239-F2295 HydrophobicContact CE-CE2 3.92Å; M2239-F2295 HydrophobicContact CE-CZ 3.24Å; M2239-F2295 HydrophobicContact CG-CE2 4.33Å; M2239-F2295 HydrophobicContact CG-CZ 3.96Å; M2239-F2295 HydrophobicContact SD-CZ 4.37Å; M2239-K2350 HydrophobicContact SD-CB 3.53Å; M2239-K2350 VanDerWaalsContact SD-CB 3.53Å; M2239-I2351 HydrophobicContact CE-CB 4.02Å; M2239-I2351 HydrophobicContact CE-CD1 3.73Å; M2239-I2351 HydrophobicContact CE-CG1 3.28Å; M2239-I2351 HydrophobicContact CE-CG2 3.73Å; M2239-I2351 HydrophobicContact CG-CG1 4.25Å; M2239-I2351 HydrophobicContact SD-CG1 4.32Å; M2239-H2354 HydrophobicContact CB-CB 4.26Å; M2239-H2354 HydrophobicContact CG-CB 4.49Å
2240C61.6Low65Low25 Ų2531 Ų3117%0.16917%0.172CC..  trans-84.1-120.4176.3-79.10000112.1N2095 S2236 S2237 E2242N2095-C2240 HydrophobicContact CB-CB 4.05Å; N2095-C2240 PolarHBondContact ND2-SG 3.02Å; S2236-C2240 PolarHBondContact O-N 3.33Å; S2236-C2240 PolarHBondContact O-SG 3.16Å; S2237-C2240 PolarHBondContact O-N 3.26Å; S2237-C2240 VanDerWaalsContact O-N 3.14Å; C2240-E2242 VanDerWaalsContact O-CG 3.3Å; C2240-E2242 WeakPolarHBondContact O-CG 3.19Å; C2240-E2242 PolarHBondContact O-N 3.37Å
2241N56.8Low63.6Low72.5 Ų72.534 Ų3439%0.38819%0.191SC..  trans-76.538.3-175-68.24.5000113.3S2094 C2099 L2202 S2237 I2243 E2357S2094-N2241 WeakPolarHBondContact CB-ND2 3.43Å; S2094-N2241 PolarHBondContact OG-ND2 3.2Å; C2099-N2241 PolarHBondContact SG-OD1 3.37Å; L2202-N2241 WeakPolarHBondContact CD1-ND2 3.29Å; S2237-N2241 PolarHBondContact O-N 3.39Å; S2237-N2241 PolarHBondContact O-ND2 3.2Å; N2241-I2243 HydrophobicContact CB-CD1 4.35Å; N2241-I2243 HydrophobicContact CB-CG1 4.27Å; N2241-I2243 PolarHBondContact O-N 3.43Å; N2241-E2357 WeakPolarHBondContact CB-OE1 3.34Å; N2241-E2357 PolarHBondContact ND2-OE1 3.33Å; N2241-E2357 PolarHBondContact ND2-OE2 3.39Å
2242E57.1Low62.4Low37.5 Ų37.534.8 Ų34.818%0.17519%0.194CC..  trans-114.968.7-179.8-62.7-168.115800112.7A2097 I2203 C2240 Q2244 L2245 A2246 W2284 L2358A2097-E2242 HydrophobicContact CB-CG 4.21Å; I2203-E2242 WeakPolarHBondContact CD1-OE1 3.37Å; C2240-E2242 VanDerWaalsContact O-CG 3.3Å; C2240-E2242 WeakPolarHBondContact O-CG 3.19Å; C2240-E2242 PolarHBondContact O-N 3.37Å; E2242-Q2244 VanDerWaalsContact C-N 3.3Å; E2242-Q2244 PolarHBondContact O-N 3.15Å; E2242-L2245 HydrophobicContact CB-CB 3.42Å; E2242-L2245 VanDerWaalsContact CB-CB 3.42Å; E2242-L2245 HydrophobicContact CB-CD1 4.07Å; E2242-L2245 HydrophobicContact CB-CG 4.38Å; E2242-L2245 HydrophobicContact CG-CB 4.5Å; E2242-L2245 HydrophobicContact CG-CD1 4.43Å; E2242-L2245 WeakPolarHBondContact O-CB 3.17Å; E2242-L2245 PolarHBondContact O-N 3.12Å; E2242-L2245 VanDerWaalsContact O-N 3.14Å; E2242-L2245 VanDerWaalsContact OE2-CD1 3.31Å; E2242-L2245 WeakPolarHBondContact OE2-CD1 3.29Å; E2242-A2246 PolarHBondContact O-N 3.17Å; E2242-W2284 HydrophobicContact CB-CZ2 3.89Å; E2242-W2284 HydrophobicContact CG-CZ2 4.45Å; E2242-W2284 PolarHBondContact OE1-NE1 2.9Å; E2242-W2284 WeakPolarHBondContact OE2-CZ2 3.39Å; E2242-W2284 PolarHBondContact OE2-NE1 3.12Å; E2242-L2358 HydrophobicContact CB-CD2 4.1Å
2243I54.4Low61.3Low69 Ų6933.6 Ų33.635%0.35419%0.189SC..Hα-helixtrans-58.2-39.1-175.2-57.7170.9000111.7N2241 S2247 E2357 T2396 Y2398N2241-I2243 HydrophobicContact CB-CD1 4.35Å; N2241-I2243 HydrophobicContact CB-CG1 4.27Å; N2241-I2243 PolarHBondContact O-N 3.43Å; I2243-S2247 WeakPolarHBondContact O-CB 3.16Å; I2243-S2247 PolarHBondContact O-N 3.23Å; I2243-S2247 PolarHBondContact O-OG 3.23Å; I2243-E2357 VanDerWaalsContact CD1-OE1 3.29Å; I2243-E2357 WeakPolarHBondContact CD1-OE1 3.38Å; I2243-E2357 HydrophobicContact CG1-CG 4.36Å; I2243-E2357 WeakPolarHBondContact CG1-OE1 3.39Å; I2243-T2396 HydrophobicContact CB-CG2 4.39Å; I2243-T2396 HydrophobicContact CD1-CG2 3.61Å; I2243-T2396 HydrophobicContact CG2-CG2 3.68Å; I2243-Y2398 HydrophobicContact CG2-CE2 3.88Å
2244Q54.1Low59.9Low145.5 Ų145.534.1 Ų34.168%0.6820%0.195SC*.Hα-helixtrans-68.3-35.9178.6-67.1179.3-1300112.6L2104 E2242 S2247 S2248L2104-Q2244 HydrophobicContact CD1-CB 3.73Å; E2242-Q2244 VanDerWaalsContact C-N 3.3Å; E2242-Q2244 PolarHBondContact O-N 3.15Å; Q2244-S2247 WeakPolarHBondContact CA-OG 3.36Å; Q2244-S2247 PolarHBondContact O-OG 3.3Å; Q2244-S2248 WeakPolarHBondContact O-CB 3.18Å; Q2244-S2248 PolarHBondContact O-N 3.17Å; Q2244-S2248 VanDerWaalsContact O-N 3.09Å; Q2244-S2248 PolarHBondContact O-OG 2.89Å
2245L56Low58.4Low12.5 Ų12.540.8 Ų40.87%0.06522%0.22CC..Hα-helixtrans-73.3-42180-113.3166.8000110.2A2097 L2104 L2206 E2242 S2247 S2248 I2249 W2280 W2284 L2291A2097-L2245 VanDerWaalsContact CA-CD1 3.43Å; A2097-L2245 HydrophobicContact CB-CD1 3.63Å; L2104-L2245 HydrophobicContact CD1-CB 4.41Å; L2104-L2245 HydrophobicContact CD1-CD2 3.42Å; L2104-L2245 VanDerWaalsContact CD1-CD2 3.42Å; L2104-L2245 HydrophobicContact CD1-CG 3.64Å; L2104-L2245 HydrophobicContact CG-CD2 4.14Å; L2206-L2245 HydrophobicContact CD1-CD1 4.15Å; E2242-L2245 HydrophobicContact CB-CB 3.42Å; E2242-L2245 VanDerWaalsContact CB-CB 3.42Å; E2242-L2245 HydrophobicContact CB-CD1 4.07Å; E2242-L2245 HydrophobicContact CB-CG 4.38Å; E2242-L2245 HydrophobicContact CG-CB 4.5Å; E2242-L2245 HydrophobicContact CG-CD1 4.43Å; E2242-L2245 WeakPolarHBondContact O-CB 3.17Å; E2242-L2245 PolarHBondContact O-N 3.12Å; E2242-L2245 VanDerWaalsContact O-N 3.14Å; E2242-L2245 VanDerWaalsContact OE2-CD1 3.31Å; E2242-L2245 WeakPolarHBondContact OE2-CD1 3.29Å; L2245-S2247 VanDerWaalsContact C-N 3.33Å; L2245-S2247 PolarHBondContact O-N 3.08Å; L2245-S2248 WeakPolarHBondContact CA-OG 3.48Å; L2245-S2248 WeakPolarHBondContact O-CB 3.5Å; L2245-S2248 PolarHBondContact O-N 3.3Å; L2245-S2248 PolarHBondContact O-OG 2.85Å; L2245-I2249 HydrophobicContact CD2-CD1 3.41Å; L2245-I2249 VanDerWaalsContact CD2-CD1 3.41Å; L2245-I2249 HydrophobicContact CD2-CG1 4.11Å; L2245-I2249 WeakPolarHBondContact O-CG1 3.4Å; L2245-I2249 PolarHBondContact O-N 3.02Å; L2245-I2249 VanDerWaalsContact O-N 3.1Å; L2245-W2280 HydrophobicContact CD2-CE3 4.23Å; L2245-W2280 HydrophobicContact CD2-CH2 4.32Å; L2245-W2280 HydrophobicContact CD2-CZ3 3.46Å; L2245-W2280 VanDerWaalsContact CD2-CZ3 3.46Å; L2245-W2284 HydrophobicContact CB-CD2 4.14Å; L2245-W2284 HydrophobicContact CB-CH2 4.31Å; L2245-W2284 HydrophobicContact CB-CZ2 3.72Å; L2245-W2284 HydrophobicContact CD1-CD2 4.45Å; L2245-W2284 HydrophobicContact CD1-CG 4.26Å; L2245-L2291 HydrophobicContact CD1-CD1 3.93Å; L2245-L2291 HydrophobicContact CD2-CD1 3.24Å; L2245-L2291 HydrophobicContact CG-CD1 3.87Å
2246A56.4Low56.9Low4 Ų447 Ų473%0.03325%0.248CC..Hα-helixtrans-60.6-45.6173.400000112.3M2239 E2242 S2248 I2249 V2250 W2284 L2358 N2361 L2362M2239-A2246 HydrophobicContact CE-CB 4.4Å; M2239-A2246 VanDerWaalsContact SD-CA 3.55Å; M2239-A2246 HydrophobicContact SD-CB 3.44Å; M2239-A2246 WeakPolarHBondContact SD-CB 3.1Å; E2242-A2246 PolarHBondContact O-N 3.17Å; A2246-S2248 VanDerWaalsContact C-N 3.34Å; A2246-S2248 PolarHBondContact O-N 2.87Å; A2246-I2249 PolarHBondContact O-N 3.27Å; A2246-V2250 WeakPolarHBondContact O-CG2 3.47Å; A2246-V2250 PolarHBondContact O-N 2.75Å; A2246-W2284 HydrophobicContact CB-CH2 4.41Å; A2246-L2358 HydrophobicContact CB-CD2 4.22Å; A2246-N2361 HydrophobicContact CB-CB 3.73Å; A2246-L2362 HydrophobicContact CB-CD2 4.14Å; A2246-L2362 HydrophobicContact CB-CG 4.39Å
2247S54.6Low55.5Low37 Ų3750.2 Ų50.226%0.25926%0.26SS..Hα-helixtrans-65.3-37.6177.970.70000112.2I2243 Q2244 L2245 I2249 V2250 T2251I2243-S2247 WeakPolarHBondContact O-CB 3.16Å; I2243-S2247 PolarHBondContact O-N 3.23Å; I2243-S2247 PolarHBondContact O-OG 3.23Å; Q2244-S2247 WeakPolarHBondContact CA-OG 3.36Å; Q2244-S2247 PolarHBondContact O-OG 3.3Å; L2245-S2247 VanDerWaalsContact C-N 3.33Å; L2245-S2247 PolarHBondContact O-N 3.08Å; S2247-I2249 VanDerWaalsContact C-N 3.29Å; S2247-I2249 PolarHBondContact O-N 3.28Å; S2247-V2250 PolarHBondContact O-N 3.26Å; S2247-V2250 VanDerWaalsContact O-N 3.14Å; S2247-T2251 WeakPolarHBondContact O-CG2 3.47Å; S2247-T2251 PolarHBondContact O-N 3.12Å; S2247-T2251 PolarHBondContact O-OG1 3.08Å
2248S53.8Low54Low18 Ų1853.6 Ų53.613%0.12627%0.273CS..Hα-helixtrans-63.6-37.7176.3770000112.9Q2244 L2245 A2246 T2251 F2252 I2292Q2244-S2248 WeakPolarHBondContact O-CB 3.18Å; Q2244-S2248 PolarHBondContact O-N 3.17Å; Q2244-S2248 VanDerWaalsContact O-N 3.09Å; Q2244-S2248 PolarHBondContact O-OG 2.89Å; L2245-S2248 WeakPolarHBondContact CA-OG 3.48Å; L2245-S2248 WeakPolarHBondContact O-CB 3.5Å; L2245-S2248 PolarHBondContact O-N 3.3Å; L2245-S2248 PolarHBondContact O-OG 2.85Å; A2246-S2248 VanDerWaalsContact C-N 3.34Å; A2246-S2248 PolarHBondContact O-N 2.87Å; S2248-T2251 WeakPolarHBondContact CA-OG1 3.19Å; S2248-T2251 PolarHBondContact O-OG1 3.06Å; S2248-F2252 WeakPolarHBondContact O-CB 3.4Å; S2248-F2252 PolarHBondContact O-N 3.33Å; S2248-I2292 WeakPolarHBondContact O-CD1 3.33Å
2249I56.5Low52.5Low4.5 Ų4.556.6 Ų56.62%0.02329%0.294CS..Hα-helixtrans-67.8-43.3174.3-68.5171.8000110.7M2239 L2245 A2246 S2247 T2251 F2252 L2253 L2281 W2284 I2285 L2291 I2351 Y2398M2239-I2249 HydrophobicContact CE-CB 3.9Å; M2239-I2249 HydrophobicContact CE-CD1 4.01Å; M2239-I2249 HydrophobicContact CE-CG2 3.72Å; L2245-I2249 HydrophobicContact CD2-CD1 3.41Å; L2245-I2249 VanDerWaalsContact CD2-CD1 3.41Å; L2245-I2249 HydrophobicContact CD2-CG1 4.11Å; L2245-I2249 WeakPolarHBondContact O-CG1 3.4Å; L2245-I2249 PolarHBondContact O-N 3.02Å; L2245-I2249 VanDerWaalsContact O-N 3.1Å; A2246-I2249 PolarHBondContact O-N 3.27Å; S2247-I2249 VanDerWaalsContact C-N 3.29Å; S2247-I2249 PolarHBondContact O-N 3.28Å; I2249-T2251 VanDerWaalsContact C-N 3.34Å; I2249-F2252 PolarHBondContact O-N 3.14Å; I2249-L2253 HydrophobicContact CG2-CD1 3.64Å; I2249-L2253 VanDerWaalsContact CG2-CD1 3.46Å; I2249-L2253 HydrophobicContact CG2-CG 4.17Å; I2249-L2253 VanDerWaalsContact O-CB 3.29Å; I2249-L2253 WeakPolarHBondContact O-CB 3.44Å; I2249-L2253 VanDerWaalsContact O-CG 3.3Å; I2249-L2253 WeakPolarHBondContact O-CG 3.29Å; I2249-L2253 PolarHBondContact O-N 3.31Å; I2249-L2281 HydrophobicContact CD1-CD1 4.07Å; I2249-L2281 HydrophobicContact CD1-CG 4.5Å; I2249-L2281 HydrophobicContact CG1-CD1 3.32Å; I2249-L2281 HydrophobicContact CG1-CD2 4.03Å; I2249-L2281 HydrophobicContact CG1-CG 3.82Å; I2249-W2284 HydrophobicContact CD1-CE3 3.5Å; I2249-W2284 VanDerWaalsContact CD1-CE3 3.5Å; I2249-W2284 HydrophobicContact CD1-CH2 4.02Å; I2249-W2284 HydrophobicContact CD1-CZ3 3.04Å; I2249-W2284 HydrophobicContact CG1-CZ3 4.33Å; I2249-I2285 HydrophobicContact CD1-CD1 3.75Å; I2249-I2285 HydrophobicContact CD1-CG1 3.49Å; I2249-I2285 VanDerWaalsContact CD1-CG1 3.49Å; I2249-I2285 HydrophobicContact CG1-CD1 4.3Å; I2249-I2285 HydrophobicContact CG1-CG1 4.46Å; I2249-L2291 HydrophobicContact CD1-CD1 4.35Å; I2249-I2351 HydrophobicContact CG2-CD1 3.56Å; I2249-Y2398 HydrophobicContact CG2-CD2 3.71Å; I2249-Y2398 HydrophobicContact CG2-CE2 4.31Å; I2249-Y2398 HydrophobicContact CG2-CG 4.34Å
2250V54.5Low51Low20 Ų2063.9 Ų63.912%0.12132%0.322CS..Hα-helixtrans-62.4-45.2179.1172.90000110.8A2246 S2247 F2252 L2253 S2254 I2351 N2361 L2362 H2364A2246-V2250 WeakPolarHBondContact O-CG2 3.47Å; A2246-V2250 PolarHBondContact O-N 2.75Å; S2247-V2250 PolarHBondContact O-N 3.26Å; S2247-V2250 VanDerWaalsContact O-N 3.14Å; V2250-F2252 VanDerWaalsContact C-N 3.34Å; V2250-F2252 PolarHBondContact O-N 3.42Å; V2250-L2253 PolarHBondContact O-N 2.87Å; V2250-S2254 WeakPolarHBondContact O-CB 3.31Å; V2250-S2254 PolarHBondContact O-N 3.04Å; V2250-S2254 VanDerWaalsContact O-N 3.07Å; V2250-S2254 PolarHBondContact O-OG 2.77Å; V2250-S2254 VanDerWaalsContact O-OG 3.07Å; V2250-I2351 HydrophobicContact CG2-CG2 3.29Å; V2250-N2361 WeakPolarHBondContact CG2-O 3.28Å; V2250-L2362 WeakPolarHBondContact CG2-O 3.29Å; V2250-H2364 HydrophobicContact CG1-CB 4.46Å
2251T52.9Low49.9Very low63.5 Ų63.566.4 Ų66.439%0.3933%0.332SS..Hα-helixtrans-65.8-38.1177.253.70000112S2247 S2248 I2249 S2254 R2255S2247-T2251 WeakPolarHBondContact O-CG2 3.47Å; S2247-T2251 PolarHBondContact O-N 3.12Å; S2247-T2251 PolarHBondContact O-OG1 3.08Å; S2248-T2251 WeakPolarHBondContact CA-OG1 3.19Å; S2248-T2251 PolarHBondContact O-OG1 3.06Å; I2249-T2251 VanDerWaalsContact C-N 3.34Å; T2251-S2254 WeakPolarHBondContact CA-OG 3.31Å; T2251-S2254 PolarHBondContact O-OG 3.17Å; T2251-S2254 VanDerWaalsContact O-OG 3.12Å; T2251-R2255 WeakPolarHBondContact O-CG 3.43Å; T2251-R2255 PolarHBondContact O-N 2.85Å
2252F52.9Low48.7Very low19.5 Ų19.567.4 Ų67.49%0.08634%0.338CS..Hα-helixtrans-64.3-47.4174-179.1-90.1000112S2248 I2249 V2250 S2254 R2255 W2258 L2281 I2292 F2295 Y2391 I2394S2248-F2252 WeakPolarHBondContact O-CB 3.4Å; S2248-F2252 PolarHBondContact O-N 3.33Å; I2249-F2252 PolarHBondContact O-N 3.14Å; V2250-F2252 VanDerWaalsContact C-N 3.34Å; V2250-F2252 PolarHBondContact O-N 3.42Å; F2252-S2254 VanDerWaalsContact C-N 3.31Å; F2252-S2254 PolarHBondContact O-N 3.44Å; F2252-R2255 PolarHBondContact O-N 3.39Å; F2252-W2258 HydrophobicContact CD1-CH2 4.05Å; F2252-W2258 HydrophobicContact CD1-CZ2 4.46Å; F2252-W2258 AromaticContact CD2-CH2 3.44Å; F2252-W2258 HydrophobicContact CD2-CH2 3.44Å; F2252-W2258 VanDerWaalsContact CD2-CH2 3.44Å; F2252-W2258 AromaticContact CD2-CZ3 3.97Å; F2252-W2258 HydrophobicContact CD2-CZ3 3.97Å; F2252-W2258 AromaticContact CE1-CH2 3.98Å; F2252-W2258 HydrophobicContact CE1-CH2 3.98Å; F2252-W2258 HydrophobicContact CE1-CZ2 4.32Å; F2252-W2258 AromaticContact CE2-CH2 3.36Å; F2252-W2258 HydrophobicContact CE2-CH2 3.83Å; F2252-W2258 AromaticContact CE2-CZ2 3.9Å; F2252-W2258 HydrophobicContact CE2-CZ2 4.14Å; F2252-W2258 AromaticContact CE2-CZ3 3.71Å; F2252-W2258 HydrophobicContact CE2-CZ3 3.71Å; F2252-W2258 AromaticContact CG-CH2 3.77Å; F2252-W2258 HydrophobicContact CG-CH2 3.77Å; F2252-W2258 AromaticContact CZ-CH2 3.64Å; F2252-W2258 HydrophobicContact CZ-CH2 3.64Å; F2252-W2258 HydrophobicContact CZ-CZ2 4.29Å; F2252-W2258 HydrophobicContact CZ-CZ3 4.26Å; F2252-W2258 VanDerWaalsContact O-CH2 3.29Å; F2252-W2258 WeakPolarHBondContact O-CH2 3.46Å; F2252-W2258 WeakPolarHBondContact O-CZ2 3.31Å; F2252-L2281 HydrophobicContact CB-CD2 4.35Å; F2252-L2281 HydrophobicContact CD1-CD2 4.39Å; F2252-L2281 HydrophobicContact CD2-CD2 4.48Å; F2252-L2281 HydrophobicContact CG-CD2 4.16Å; F2252-I2292 HydrophobicContact CB-CD1 4.09Å; F2252-I2292 HydrophobicContact CB-CG1 3.87Å; F2252-I2292 HydrophobicContact CD2-CB 4.36Å; F2252-I2292 HydrophobicContact CD2-CG1 4.41Å; F2252-I2292 HydrophobicContact CD2-CG2 3.5Å; F2252-I2292 HydrophobicContact CE2-CG2 3.99Å; F2252-I2292 HydrophobicContact CG-CG1 4.26Å; F2252-I2292 HydrophobicContact CG-CG2 4.19Å; F2252-F2295 HydrophobicContact CD1-CB 3.88Å; F2252-F2295 HydrophobicContact CD1-CG 4.4Å; F2252-F2295 HydrophobicContact CE1-CB 3.27Å; F2252-F2295 HydrophobicContact CE1-CG 4.07Å; F2252-F2295 HydrophobicContact CZ-CB 3.67Å; F2252-Y2391 HydrophobicContact CE1-CD2 4.31Å; F2252-I2394 HydrophobicContact CD1-CD1 4.24Å; F2252-I2394 HydrophobicContact CD1-CG2 4.3Å; F2252-I2394 HydrophobicContact CE1-CB 4.48Å; F2252-I2394 HydrophobicContact CE1-CD1 3.48Å; F2252-I2394 VanDerWaalsContact CE1-CD1 3.48Å; F2252-I2394 HydrophobicContact CE1-CG2 4.37Å; F2252-I2394 HydrophobicContact CZ-CD1 3.68Å
2253L52.3Low47.4Very low15 Ų1572 Ų728%0.07936%0.359CS..Hα-helixtrans-72.3-25.6-177.5-71.5176.7000113.4I2249 V2250 R2344 I2347 Q2348 I2351 Y2391 I2394 E2395 Y2398I2249-L2253 HydrophobicContact CG2-CD1 3.64Å; I2249-L2253 VanDerWaalsContact CG2-CD1 3.46Å; I2249-L2253 HydrophobicContact CG2-CG 4.17Å; I2249-L2253 VanDerWaalsContact O-CB 3.29Å; I2249-L2253 WeakPolarHBondContact O-CB 3.44Å; I2249-L2253 VanDerWaalsContact O-CG 3.3Å; I2249-L2253 WeakPolarHBondContact O-CG 3.29Å; I2249-L2253 PolarHBondContact O-N 3.31Å; V2250-L2253 PolarHBondContact O-N 2.87Å; L2253-R2344 HydrophobicContact CD2-CG 4.37Å; L2253-I2347 HydrophobicContact CD1-CG2 4.26Å; L2253-Q2348 HydrophobicContact CB-CG 3.94Å; L2253-Q2348 HydrophobicContact CD1-CG 3.76Å; L2253-Q2348 HydrophobicContact CD2-CG 4.3Å; L2253-Q2348 HydrophobicContact CG-CG 4.22Å; L2253-Q2348 PolarHBondContact O-NE2 3.21Å; L2253-I2351 HydrophobicContact CD1-CD1 3.56Å; L2253-Y2391 HydrophobicContact CB-CE2 4.46Å; L2253-Y2391 HydrophobicContact CD2-CD2 4.08Å; L2253-Y2391 HydrophobicContact CD2-CE1 4.4Å; L2253-Y2391 HydrophobicContact CD2-CE2 3.73Å; L2253-Y2391 WeakPolarHBondContact O-CE2 3.23Å; L2253-Y2391 PolarHBondContact O-OH 3.48Å; L2253-I2394 HydrophobicContact CD2-CG2 4.17Å; L2253-E2395 HydrophobicContact CD2-CB 4.08Å; L2253-Y2398 HydrophobicContact CD1-CD1 3.72Å; L2253-Y2398 HydrophobicContact CD1-CD2 4.11Å; L2253-Y2398 HydrophobicContact CD1-CE1 4.15Å; L2253-Y2398 HydrophobicContact CD1-CE2 4.49Å; L2253-Y2398 HydrophobicContact CD1-CG 3.69Å
2254S50.5Low46.3Very low67 Ų6773.1 Ų73.147%0.46937%0.373SS..Hα-helixtrans-82.9-12.4-179.662.60000114.5V2250 T2251 F2252 Q2256V2250-S2254 WeakPolarHBondContact O-CB 3.31Å; V2250-S2254 PolarHBondContact O-N 3.04Å; V2250-S2254 VanDerWaalsContact O-N 3.07Å; V2250-S2254 PolarHBondContact O-OG 2.77Å; V2250-S2254 VanDerWaalsContact O-OG 3.07Å; T2251-S2254 WeakPolarHBondContact CA-OG 3.31Å; T2251-S2254 PolarHBondContact O-OG 3.17Å; T2251-S2254 VanDerWaalsContact O-OG 3.12Å; F2252-S2254 VanDerWaalsContact C-N 3.31Å; F2252-S2254 PolarHBondContact O-N 3.44Å; S2254-Q2256 PolarHBondContact O-N 3.2Å
2255R47.7Very low45.2Very low142 Ų14273.7 Ų73.754%0.53638%0.381SS..  trans-73.7113.3179.4-84.2177.2174.1-172.3-1.3111.3E2111 T2251 F2252 W2258E2111-R2255 IonicContact OE1-CZ 3.97Å; E2111-R2255 IonicContact OE1-NH1 2.75Å; E2111-R2255 IonicContact OE1-NH2 2.71Å; E2111-R2255 PolarHBondContact OE1-NH2 2.82Å; T2251-R2255 WeakPolarHBondContact O-CG 3.43Å; T2251-R2255 PolarHBondContact O-N 2.85Å; F2252-R2255 PolarHBondContact O-N 3.39Å; R2255-W2258 HydrophobicContact CB-CH2 4.41Å; R2255-W2258 HydrophobicContact CB-CZ2 4.16Å; R2255-W2258 PolarHBondContact O-NE1 3.07Å
2256Q44Very low44Very low139 Ų13977.2 Ų77.265%0.6541%0.406SS*.  trans-84.4-23.4176.5-68.6-177.3-7.300113.3S2254 W2258S2254-Q2256 PolarHBondContact O-N 3.2Å; Q2256-W2258 VanDerWaalsContact C-N 3.32Å; Q2256-W2258 PolarHBondContact O-N 3.37Å
2257D40.8Very low42.9Very low129.5 Ų129.583 Ų8369%0.69345%0.447SS*.  trans-99.371.8-169.7-65.5-29.6000113.8S2259D2257-S2259 VanDerWaalsContact C-N 3.28Å; D2257-S2259 PolarHBondContact O-N 3.13Å
2258W41.3Very low41.9Very low74.5 Ų74.585.8 Ų85.828%0.28247%0.466SS..  trans-82.1-0.4176.8-64.896000113.9F2252 R2255 Q2256 Y2260 I2261 F2382 Y2391F2252-W2258 HydrophobicContact CD1-CH2 4.05Å; F2252-W2258 HydrophobicContact CD1-CZ2 4.46Å; F2252-W2258 AromaticContact CD2-CH2 3.44Å; F2252-W2258 HydrophobicContact CD2-CH2 3.44Å; F2252-W2258 VanDerWaalsContact CD2-CH2 3.44Å; F2252-W2258 AromaticContact CD2-CZ3 3.97Å; F2252-W2258 HydrophobicContact CD2-CZ3 3.97Å; F2252-W2258 AromaticContact CE1-CH2 3.98Å; F2252-W2258 HydrophobicContact CE1-CH2 3.98Å; F2252-W2258 HydrophobicContact CE1-CZ2 4.32Å; F2252-W2258 AromaticContact CE2-CH2 3.36Å; F2252-W2258 HydrophobicContact CE2-CH2 3.83Å; F2252-W2258 AromaticContact CE2-CZ2 3.9Å; F2252-W2258 HydrophobicContact CE2-CZ2 4.14Å; F2252-W2258 AromaticContact CE2-CZ3 3.71Å; F2252-W2258 HydrophobicContact CE2-CZ3 3.71Å; F2252-W2258 AromaticContact CG-CH2 3.77Å; F2252-W2258 HydrophobicContact CG-CH2 3.77Å; F2252-W2258 AromaticContact CZ-CH2 3.64Å; F2252-W2258 HydrophobicContact CZ-CH2 3.64Å; F2252-W2258 HydrophobicContact CZ-CZ2 4.29Å; F2252-W2258 HydrophobicContact CZ-CZ3 4.26Å; F2252-W2258 VanDerWaalsContact O-CH2 3.29Å; F2252-W2258 WeakPolarHBondContact O-CH2 3.46Å; F2252-W2258 WeakPolarHBondContact O-CZ2 3.31Å; R2255-W2258 HydrophobicContact CB-CH2 4.41Å; R2255-W2258 HydrophobicContact CB-CZ2 4.16Å; R2255-W2258 PolarHBondContact O-NE1 3.07Å; Q2256-W2258 VanDerWaalsContact C-N 3.32Å; Q2256-W2258 PolarHBondContact O-N 3.37Å; W2258-Y2260 VanDerWaalsContact C-N 3.35Å; W2258-Y2260 PolarHBondContact O-N 3.08Å; W2258-Y2260 VanDerWaalsContact O-N 3.17Å; W2258-I2261 HydrophobicContact CE3-CD1 3.41Å; W2258-I2261 VanDerWaalsContact CE3-CD1 3.41Å; W2258-I2261 HydrophobicContact CE3-CG1 4.12Å; W2258-I2261 HydrophobicContact CZ3-CD1 3.53Å; W2258-I2261 PolarHBondContact O-N 3.46Å; W2258-I2261 VanDerWaalsContact O-N 3.16Å; W2258-F2382 AromaticContact CD1-CE1 3.95Å; W2258-F2382 AromaticContact NE1-CE1 3.89Å; W2258-Y2391 HydrophobicContact CZ2-CD2 4.18Å
2259S38Very low40.7Very low68.5 Ų68.590.5 Ų90.548%0.47950%0.499SS..THydrogen-bonded Turntrans-66.2-25-176.8540000113.8D2257 N2262 H2263D2257-S2259 VanDerWaalsContact C-N 3.28Å; D2257-S2259 PolarHBondContact O-N 3.13Å; S2259-N2262 CarbonylContact O-C 3.6Å; S2259-N2262 PolarHBondContact O-N 3.08Å; S2259-N2262 VanDerWaalsContact O-N 3.16Å; S2259-H2263 PolarHBondContact O-N 3.26Å
2260Y35.5Very low39.5Very low178 Ų17895.5 Ų95.570%0.69854%0.535SS*.THydrogen-bonded Turntrans-74.4-24.7-177.2-93.3-83.2000114.7W2258 N2262 H2263W2258-Y2260 VanDerWaalsContact C-N 3.35Å; W2258-Y2260 PolarHBondContact O-N 3.08Å; W2258-Y2260 VanDerWaalsContact O-N 3.17Å; Y2260-N2262 PolarHBondContact O-N 3.3Å; Y2260-H2263 AromaticContact CD1-CD2 3.93Å
2261I36.6Very low38.3Very low77 Ų7799.2 Ų99.240%0.39556%0.561SS.*THydrogen-bonded Turntrans-74.7-23179.7-58.1-175.1000111.5W2258 F2387W2258-I2261 HydrophobicContact CE3-CD1 3.41Å; W2258-I2261 VanDerWaalsContact CE3-CD1 3.41Å; W2258-I2261 HydrophobicContact CE3-CG1 4.12Å; W2258-I2261 HydrophobicContact CZ3-CD1 3.53Å; W2258-I2261 PolarHBondContact O-N 3.46Å; W2258-I2261 VanDerWaalsContact O-N 3.16Å; I2261-F2387 HydrophobicContact CB-CZ 4.33Å; I2261-F2387 HydrophobicContact CG2-CE1 3.95Å; I2261-F2387 HydrophobicContact CG2-CE2 4.02Å; I2261-F2387 HydrophobicContact CG2-CZ 3.36Å
2262N33.3Very low37.1Very low93.5 Ų93.5102.6 Ų102.650%0.558%0.582SS.*THydrogen-bonded Turntrans-92.41-178.1-84-5.5000115.1S2259 Y2260 S2264 Q2383S2259-N2262 CarbonylContact O-C 3.6Å; S2259-N2262 PolarHBondContact O-N 3.08Å; S2259-N2262 VanDerWaalsContact O-N 3.16Å; Y2260-N2262 PolarHBondContact O-N 3.3Å; N2262-S2264 PolarHBondContact O-N 3.21Å; N2262-Q2383 PolarHBondContact ND2-OE1 2.92Å
2263H30.2Very low36Very low133.5 Ų133.5108.6 Ų108.662%0.61862%0.615SS**THydrogen-bonded Turntrans-90.531.6-180-79.5-56.5000114.1S2259 Y2260S2259-H2263 PolarHBondContact O-N 3.26Å; Y2260-H2263 AromaticContact CD1-CD2 3.93Å
2264S30.7Very low34.9Very low94 Ų94116.3 Ų116.366%0.65765%0.651SS**THydrogen-bonded Turntrans-93.54.717460.90000114.4N2262N2262-S2264 PolarHBondContact O-N 3.21Å
2265N30.7Very low34.2Very low157.5 Ų157.5118 Ų11884%0.84266%0.66SS**  trans-116.111.3-176.2-82.2-7.6000116.2S2267N2265-S2267 PolarHBondContact O-N 3.47Å
2266S30.1Very low33.7Very low85.5 Ų85.5115.8 Ų115.860%0.59866%0.658SS**SBendtrans-10690.5171.654.70000111.2S2268S2266-S2268 VanDerWaalsContact C-N 3.27Å; S2266-S2268 PolarHBondContact O-N 3.48Å
2267S34.6Very low33.6Very low126.5 Ų126.5114.2 Ų114.289%0.88565%0.654SS**  trans-112.2102.4161.1340000112.2N2265N2265-S2267 PolarHBondContact O-N 3.47Å
2268S32.2Very low33.9Very low96 Ų96109.9 Ų109.967%0.67163%0.634SS**  trans-102.4121.7171.647.80000111.4S2266 S2270S2266-S2268 VanDerWaalsContact C-N 3.27Å; S2266-S2268 PolarHBondContact O-N 3.48Å; S2268-S2270 PolarHBondContact O-N 3.25Å
2269S30.2Very low34.2Very low115 Ų115109.3 Ų109.380%0.80464%0.636SS**SBendtrans-4.591.6164.558.40000115.8
2270S29.9Very low34.8Very low111 Ų111110 Ų11078%0.77663%0.629SS**SBendtrans166.4104.413351.70000112.4S2268S2268-S2270 PolarHBondContact O-N 3.25Å
2271S29Very low35.4Very low97 Ų97103.5 Ų103.568%0.67861%0.605SS**  trans118.5102.3157.344.20000114.1N2273S2271-N2273 VanDerWaalsContact C-N 3.33Å; S2271-N2273 PolarHBondContact O-N 2.93Å
2272T29.2Very low36Very low134.5 Ų134.5102.3 Ų102.383%0.82560%0.599SS**  trans-20.380.1152.352.90000113Q2274T2272-Q2274 PolarHBondContact O-N 3.38Å
2273N29.7Very low36.8Very low146 Ų146103.2 Ų103.278%0.78160%0.601SS**  trans-114.8103.1158-85.2-14.8000107.2S2271 P2275S2271-N2273 VanDerWaalsContact C-N 3.33Å; S2271-N2273 PolarHBondContact O-N 2.93Å; N2273-P2275 WeakPolarHBondContact O-CD 3.35Å; N2273-P2275 VanDerWaalsContact O-N 3.1Å
2274Q29.5Very low38Very low176.5 Ų176.599.4 Ų99.483%0.82558%0.581SS**PPolyproline II helixtrans-68.1128.3175.6-71.1-177.8-23.600109.1T2272 I2276T2272-Q2274 PolarHBondContact O-N 3.38Å; Q2274-I2276 PolarHBondContact O-N 3.44Å
2275P35Very low39.1Very low102.5 Ų102.597.1 Ų97.167%0.66656%0.56SS**PPolyproline II helixtrans-71.7125.1174.822.2-16.8000108.4N2273 N2277N2273-P2275 WeakPolarHBondContact O-CD 3.35Å; N2273-P2275 VanDerWaalsContact O-N 3.1Å; P2275-N2277 PolarHBondContact O-N 3.11Å
2276I37.3Very low40.2Very low96 Ų9692.2 Ų92.249%0.49254%0.542SS..PPolyproline II helixtrans-50.3107.7173-64.3152.7000109.2L2107 Q2274 S2278 N2279L2107-I2276 HydrophobicContact CD2-CD1 4.34Å; L2107-I2276 HydrophobicContact CD2-CG2 3.68Å; L2107-I2276 HydrophobicContact CG-CG2 4.36Å; Q2274-I2276 PolarHBondContact O-N 3.44Å; I2276-S2278 PolarHBondContact O-N 3.17Å; I2276-N2279 HydrophobicContact CG2-CB 4.35Å
2277N42.7Very low41.4Very low106 Ų10689.8 Ų89.857%0.56753%0.526SS*.  trans-99.768.6-177.4-148.5-2.6000111.7P2275 N2279 W2280P2275-N2277 PolarHBondContact O-N 3.11Å; N2277-N2279 VanDerWaalsContact C-N 3.26Å; N2277-N2279 PolarHBondContact O-N 3.09Å; N2277-N2279 WeakPolarHBondContact OD1-CB 3.45Å; N2277-N2279 PolarHBondContact OD1-N 2.95Å; N2277-N2279 VanDerWaalsContact OD1-N 3.11Å; N2277-N2279 PolarHBondContact OD1-ND2 3.26Å; N2277-W2280 VanDerWaalsContact O-CD1 3.28Å; N2277-W2280 PolarHBondContact O-NE1 3.2Å; N2277-W2280 PolarHBondContact OD1-NE1 3.47Å
2278S47Very low42.6Very low38 Ų3885.3 Ų85.327%0.26649%0.49SS..THydrogen-bonded Turntrans-90.6-10176.3610000113.8I2276 W2280 L2281 I2282 E2390I2276-S2278 PolarHBondContact O-N 3.17Å; S2278-W2280 VanDerWaalsContact C-N 3.27Å; S2278-W2280 PolarHBondContact O-N 3.06Å; S2278-L2281 VanDerWaalsContact O-CB 3.25Å; S2278-L2281 WeakPolarHBondContact O-CB 3.36Å; S2278-L2281 PolarHBondContact O-N 3.41Å; S2278-I2282 PolarHBondContact O-N 3.35Å; S2278-E2390 PolarHBondContact OG-OE1 3.13Å; S2278-E2390 PolarHBondContact OG-OE2 2.82Å
2279N46.5Very low43.9Very low62.5 Ų62.582.9 Ų82.933%0.33447%0.472SS..Hα-helixtrans-63.5-32.8-177.2-84.2-3.9000114.1S2175 I2276 N2277 L2281 I2282 Q2283S2175-N2279 PolarHBondContact OG-ND2 3.15Å; S2175-N2279 PolarHBondContact OG-OD1 2.79Å; I2276-N2279 HydrophobicContact CG2-CB 4.35Å; N2277-N2279 VanDerWaalsContact C-N 3.26Å; N2277-N2279 PolarHBondContact O-N 3.09Å; N2277-N2279 WeakPolarHBondContact OD1-CB 3.45Å; N2277-N2279 PolarHBondContact OD1-N 2.95Å; N2277-N2279 VanDerWaalsContact OD1-N 3.11Å; N2277-N2279 PolarHBondContact OD1-ND2 3.26Å; N2279-L2281 VanDerWaalsContact C-N 3.28Å; N2279-L2281 PolarHBondContact O-N 3.06Å; N2279-I2282 PolarHBondContact O-N 2.83Å; N2279-Q2283 WeakPolarHBondContact O-CG 3.09Å; N2279-Q2283 PolarHBondContact O-N 3.33Å
2280W50.4Low45.4Very low84.5 Ų84.580.4 Ų80.432%0.3245%0.449SS..Hα-helixtrans-69.2-32.6175.769-91.7000111.5Y2100 G2103 L2104 L2107 L2245 N2277 S2278 I2282 Q2283 W2284Y2100-W2280 HydrophobicContact CD1-CB 4.26Å; Y2100-W2280 WeakPolarHBondContact CD1-O 3.31Å; G2103-W2280 VanDerWaalsContact C-CE2 3.41Å; G2103-W2280 VanDerWaalsContact C-CZ2 3.43Å; G2103-W2280 VanDerWaalsContact CA-CE2 3.47Å; G2103-W2280 WeakPolarHBondContact O-CZ2 3.25Å; L2104-W2280 HydrophobicContact CB-CH2 4.41Å; L2104-W2280 HydrophobicContact CG-CH2 4.16Å; L2107-W2280 HydrophobicContact CD1-CH2 3.99Å; L2107-W2280 HydrophobicContact CD1-CZ2 3.48Å; L2107-W2280 VanDerWaalsContact CD1-CZ2 3.48Å; L2107-W2280 HydrophobicContact CG-CZ2 4.12Å; L2245-W2280 HydrophobicContact CD2-CE3 4.23Å; L2245-W2280 HydrophobicContact CD2-CH2 4.32Å; L2245-W2280 HydrophobicContact CD2-CZ3 3.46Å; L2245-W2280 VanDerWaalsContact CD2-CZ3 3.46Å; N2277-W2280 VanDerWaalsContact O-CD1 3.28Å; N2277-W2280 PolarHBondContact O-NE1 3.2Å; N2277-W2280 PolarHBondContact OD1-NE1 3.47Å; S2278-W2280 VanDerWaalsContact C-N 3.27Å; S2278-W2280 PolarHBondContact O-N 3.06Å; W2280-I2282 VanDerWaalsContact C-N 3.33Å; W2280-Q2283 PolarHBondContact O-N 3.18Å; W2280-W2284 HydrophobicContact CE3-CB 4.38Å; W2280-W2284 WeakPolarHBondContact O-CA 3.32Å; W2280-W2284 WeakPolarHBondContact O-CB 3.45Å; W2280-W2284 PolarHBondContact O-N 3.35Å
2281L48.4Very low46.9Very low40.5 Ų40.575.3 Ų75.321%0.21241%0.413CS..Hα-helixtrans-66.3-41.7176.4-16576000110.5I2249 F2252 S2278 N2279 Q2283 W2284 I2285 I2394I2249-L2281 HydrophobicContact CD1-CD1 4.07Å; I2249-L2281 HydrophobicContact CD1-CG 4.5Å; I2249-L2281 HydrophobicContact CG1-CD1 3.32Å; I2249-L2281 HydrophobicContact CG1-CD2 4.03Å; I2249-L2281 HydrophobicContact CG1-CG 3.82Å; F2252-L2281 HydrophobicContact CB-CD2 4.35Å; F2252-L2281 HydrophobicContact CD1-CD2 4.39Å; F2252-L2281 HydrophobicContact CD2-CD2 4.48Å; F2252-L2281 HydrophobicContact CG-CD2 4.16Å; S2278-L2281 VanDerWaalsContact O-CB 3.25Å; S2278-L2281 WeakPolarHBondContact O-CB 3.36Å; S2278-L2281 PolarHBondContact O-N 3.41Å; N2279-L2281 VanDerWaalsContact C-N 3.28Å; N2279-L2281 PolarHBondContact O-N 3.06Å; L2281-Q2283 VanDerWaalsContact C-N 3.32Å; L2281-Q2283 PolarHBondContact O-N 2.84Å; L2281-W2284 HydrophobicContact CD1-CE3 4.33Å; L2281-W2284 PolarHBondContact O-N 3.17Å; L2281-I2285 HydrophobicContact CD2-CD1 4.42Å; L2281-I2285 HydrophobicContact CG-CD1 4.28Å; L2281-I2285 WeakPolarHBondContact O-CB 3.48Å; L2281-I2285 WeakPolarHBondContact O-CD1 3.44Å; L2281-I2285 VanDerWaalsContact O-CG1 3.29Å; L2281-I2285 WeakPolarHBondContact O-CG1 3.31Å; L2281-I2285 PolarHBondContact O-N 3.28Å; L2281-I2394 HydrophobicContact CD2-CD1 4.34Å; L2281-I2394 HydrophobicContact CD2-CG2 4.2Å
2282I49.6Very low48.4Very low52.5 Ų52.571.6 Ų71.627%0.26939%0.386SS..Hα-helixtrans-65.9-42.9176.8-66.1168.9000111S2278 N2279 W2280 W2284 I2285 A2286 F2393 I2394 Q2397S2278-I2282 PolarHBondContact O-N 3.35Å; N2279-I2282 PolarHBondContact O-N 2.83Å; W2280-I2282 VanDerWaalsContact C-N 3.33Å; I2282-W2284 VanDerWaalsContact C-N 3.29Å; I2282-W2284 PolarHBondContact O-N 3.19Å; I2282-I2285 PolarHBondContact O-N 3.24Å; I2282-A2286 WeakPolarHBondContact O-CB 3.43Å; I2282-A2286 PolarHBondContact O-N 3.28Å; I2282-F2393 HydrophobicContact CD1-CD1 3.99Å; I2282-F2393 HydrophobicContact CD1-CE1 4.17Å; I2282-F2393 HydrophobicContact CG1-CD1 4.26Å; I2282-F2393 HydrophobicContact CG1-CE1 4.28Å; I2282-F2393 HydrophobicContact CG2-CE1 3.73Å; I2282-I2394 HydrophobicContact CD1-CG1 4.28Å; I2282-I2394 HydrophobicContact CG1-CD1 4.33Å; I2282-I2394 HydrophobicContact CG1-CG1 3.79Å; I2282-Q2397 PolarHBondContact O-OE1 3.29Å
2283Q49.6Very low50Low112.5 Ų112.566.6 Ų66.653%0.52635%0.354SS..Hα-helixtrans-68.3-33.5175.9-72.5-179.4-7.600112.5Y2100 N2279 W2280 L2281 S2287Y2100-Q2283 HydrophobicContact CD1-CB 4.36Å; Y2100-Q2283 HydrophobicContact CE1-CB 3.45Å; Y2100-Q2283 VanDerWaalsContact CE1-CB 3.45Å; N2279-Q2283 WeakPolarHBondContact O-CG 3.09Å; N2279-Q2283 PolarHBondContact O-N 3.33Å; W2280-Q2283 PolarHBondContact O-N 3.18Å; L2281-Q2283 VanDerWaalsContact C-N 3.32Å; L2281-Q2283 PolarHBondContact O-N 2.84Å; Q2283-S2287 WeakPolarHBondContact O-CB 3.39Å; Q2283-S2287 PolarHBondContact O-N 3.14Å; Q2283-S2287 VanDerWaalsContact O-N 3.13Å; Q2283-S2287 PolarHBondContact O-OG 3.01Å
2284W56.1Low51.5Low52 Ų5259.7 Ų59.720%0.19732%0.317CS..Hα-helixtrans-66.2-50.3173.4-178.276.4000110.8Y2100 E2242 L2245 A2246 I2249 W2280 L2281 I2282 A2286 S2287 E2288 L2358 L2401Y2100-W2284 HydrophobicContact CD1-CB 4.41Å; Y2100-W2284 HydrophobicContact CD2-CB 3.68Å; Y2100-W2284 AromaticContact CD2-CD1 3.66Å; Y2100-W2284 HydrophobicContact CD2-CG 4.06Å; Y2100-W2284 HydrophobicContact CE2-CB 4.08Å; Y2100-W2284 HydrophobicContact CG-CB 3.84Å; E2242-W2284 HydrophobicContact CB-CZ2 3.89Å; E2242-W2284 HydrophobicContact CG-CZ2 4.45Å; E2242-W2284 PolarHBondContact OE1-NE1 2.9Å; E2242-W2284 WeakPolarHBondContact OE2-CZ2 3.39Å; E2242-W2284 PolarHBondContact OE2-NE1 3.12Å; L2245-W2284 HydrophobicContact CB-CD2 4.14Å; L2245-W2284 HydrophobicContact CB-CH2 4.31Å; L2245-W2284 HydrophobicContact CB-CZ2 3.72Å; L2245-W2284 HydrophobicContact CD1-CD2 4.45Å; L2245-W2284 HydrophobicContact CD1-CG 4.26Å; A2246-W2284 HydrophobicContact CB-CH2 4.41Å; I2249-W2284 HydrophobicContact CD1-CE3 3.5Å; I2249-W2284 VanDerWaalsContact CD1-CE3 3.5Å; I2249-W2284 HydrophobicContact CD1-CH2 4.02Å; I2249-W2284 HydrophobicContact CD1-CZ3 3.04Å; I2249-W2284 HydrophobicContact CG1-CZ3 4.33Å; W2280-W2284 HydrophobicContact CE3-CB 4.38Å; W2280-W2284 WeakPolarHBondContact O-CA 3.32Å; W2280-W2284 WeakPolarHBondContact O-CB 3.45Å; W2280-W2284 PolarHBondContact O-N 3.35Å; L2281-W2284 HydrophobicContact CD1-CE3 4.33Å; L2281-W2284 PolarHBondContact O-N 3.17Å; I2282-W2284 VanDerWaalsContact C-N 3.29Å; I2282-W2284 PolarHBondContact O-N 3.19Å; W2284-A2286 VanDerWaalsContact C-N 3.28Å; W2284-A2286 PolarHBondContact O-N 3.24Å; W2284-S2287 WeakPolarHBondContact CA-OG 3.17Å; W2284-S2287 PolarHBondContact O-N 3.09Å; W2284-S2287 VanDerWaalsContact O-N 3.15Å; W2284-S2287 PolarHBondContact O-OG 3.31Å; W2284-E2288 HydrophobicContact CZ2-CG 4.37Å; W2284-E2288 WeakPolarHBondContact O-CB 3.42Å; W2284-E2288 VanDerWaalsContact O-CG 3.29Å; W2284-E2288 WeakPolarHBondContact O-CG 3.21Å; W2284-E2288 PolarHBondContact O-N 3.23Å; W2284-E2288 VanDerWaalsContact O-N 3.16Å; W2284-L2358 HydrophobicContact CH2-CD2 4.27Å; W2284-L2358 HydrophobicContact CZ2-CD2 4.33Å; W2284-L2401 HydrophobicContact CZ3-CD2 4.39Å
2285I53.3Low53.1Low46 Ų4651.6 Ų51.624%0.23628%0.279CS..Hα-helixtrans-57.7-41.9176.6-65.4164.8000111I2249 L2281 I2282 S2287 E2288 T2289 I2394 Q2397 L2401I2249-I2285 HydrophobicContact CD1-CD1 3.75Å; I2249-I2285 HydrophobicContact CD1-CG1 3.49Å; I2249-I2285 VanDerWaalsContact CD1-CG1 3.49Å; I2249-I2285 HydrophobicContact CG1-CD1 4.3Å; I2249-I2285 HydrophobicContact CG1-CG1 4.46Å; L2281-I2285 HydrophobicContact CD2-CD1 4.42Å; L2281-I2285 HydrophobicContact CG-CD1 4.28Å; L2281-I2285 WeakPolarHBondContact O-CB 3.48Å; L2281-I2285 WeakPolarHBondContact O-CD1 3.44Å; L2281-I2285 VanDerWaalsContact O-CG1 3.29Å; L2281-I2285 WeakPolarHBondContact O-CG1 3.31Å; L2281-I2285 PolarHBondContact O-N 3.28Å; I2282-I2285 PolarHBondContact O-N 3.24Å; I2285-S2287 VanDerWaalsContact C-N 3.32Å; I2285-S2287 PolarHBondContact O-N 2.92Å; I2285-E2288 PolarHBondContact O-N 3.46Å; I2285-T2289 WeakPolarHBondContact O-CB 3.41Å; I2285-T2289 PolarHBondContact O-N 3.2Å; I2285-T2289 PolarHBondContact O-OG1 3.44Å; I2285-I2394 HydrophobicContact CD1-CG2 4.02Å; I2285-Q2397 HydrophobicContact CB-CB 4.42Å; I2285-Q2397 HydrophobicContact CG2-CB 3.58Å; I2285-L2401 HydrophobicContact CG2-CB 4.47Å; I2285-L2401 HydrophobicContact CG2-CD2 4.49Å
2286A54.6Low54.4Low55.5 Ų55.547.6 Ų47.646%0.45925%0.253SS..Hα-helixtrans-69-30.4179.200000113.3I2282 W2284 N2290I2282-A2286 WeakPolarHBondContact O-CB 3.43Å; I2282-A2286 PolarHBondContact O-N 3.28Å; W2284-A2286 VanDerWaalsContact C-N 3.28Å; W2284-A2286 PolarHBondContact O-N 3.24Å; A2286-N2290 WeakPolarHBondContact O-CB 3.35Å; A2286-N2290 VanDerWaalsContact O-CG 3.31Å; A2286-N2290 PolarHBondContact O-N 3.47Å; A2286-N2290 VanDerWaalsContact O-N 3.08Å; A2286-N2290 PolarHBondContact O-ND2 3.5Å
2287S54.9Low55.4Low35.5 Ų35.544.8 Ų44.825%0.24824%0.24CC..Hα-helixtrans-84.2-21.9177.8610000113L2096 Q2283 W2284 I2285 T2289 N2290 L2291L2096-S2287 WeakPolarHBondContact CD1-OG 3.29Å; L2096-S2287 WeakPolarHBondContact CD2-OG 3.2Å; Q2283-S2287 WeakPolarHBondContact O-CB 3.39Å; Q2283-S2287 PolarHBondContact O-N 3.14Å; Q2283-S2287 VanDerWaalsContact O-N 3.13Å; Q2283-S2287 PolarHBondContact O-OG 3.01Å; W2284-S2287 WeakPolarHBondContact CA-OG 3.17Å; W2284-S2287 PolarHBondContact O-N 3.09Å; W2284-S2287 VanDerWaalsContact O-N 3.15Å; W2284-S2287 PolarHBondContact O-OG 3.31Å; I2285-S2287 VanDerWaalsContact C-N 3.32Å; I2285-S2287 PolarHBondContact O-N 2.92Å; S2287-T2289 PolarHBondContact O-N 3.07Å; S2287-N2290 VanDerWaalsContact O-CB 3.31Å; S2287-N2290 WeakPolarHBondContact O-CB 3.48Å; S2287-N2290 PolarHBondContact O-N 3.01Å; S2287-N2290 VanDerWaalsContact O-N 3.16Å; S2287-L2291 PolarHBondContact O-N 3.14Å; S2287-L2291 VanDerWaalsContact O-N 3.12Å
2288E58.6Low56.2Low30.5 Ų30.539.8 Ų39.814%0.14321%0.213CC..Hα-helixtrans-67.943.7174.4-114.6121.8165.200110.2L2096 W2284 I2285 N2290 L2291 I2292 N2293 H2354 L2358 L2401L2096-E2288 HydrophobicContact CD2-CB 3.99Å; L2096-E2288 WeakPolarHBondContact CD2-OE2 3.43Å; W2284-E2288 HydrophobicContact CZ2-CG 4.37Å; W2284-E2288 WeakPolarHBondContact O-CB 3.42Å; W2284-E2288 VanDerWaalsContact O-CG 3.29Å; W2284-E2288 WeakPolarHBondContact O-CG 3.21Å; W2284-E2288 PolarHBondContact O-N 3.23Å; W2284-E2288 VanDerWaalsContact O-N 3.16Å; I2285-E2288 PolarHBondContact O-N 3.46Å; E2288-N2290 PolarHBondContact O-N 3.21Å; E2288-L2291 PolarHBondContact O-N 3.3Å; E2288-L2291 VanDerWaalsContact O-N 3.11Å; E2288-I2292 HydrophobicContact CG-CD1 3.88Å; E2288-I2292 WeakPolarHBondContact O-CG1 3.37Å; E2288-I2292 PolarHBondContact O-N 2.95Å; E2288-N2293 VanDerWaalsContact CD-ND2 3.31Å; E2288-N2293 WeakPolarHBondContact CG-ND2 3.27Å; E2288-N2293 PolarHBondContact OE1-ND2 3.48Å; E2288-H2354 IonicContact OE1-CD2 2.79Å; E2288-H2354 IonicContact OE1-CE1 3.7Å; E2288-H2354 IonicContact OE1-NE2 2.76Å; E2288-H2354 PolarHBondContact OE1-NE2 2.98Å; E2288-L2358 HydrophobicContact CG-CD1 4.02Å; E2288-L2358 VanDerWaalsContact OE1-CD1 3.25Å; E2288-L2358 WeakPolarHBondContact OE1-CD1 3.45Å; E2288-L2401 HydrophobicContact CB-CD1 4.45Å; E2288-L2401 HydrophobicContact CG-CD1 4.22Å
2289T60Low56.8Low46 Ų4638.6 Ų38.628%0.28220%0.203SC..Hα-helix-111.8-23.2123-15.60000115.2K2210 I2285 S2287 N2293 L2401K2210-T2289 WeakPolarHBondContact CD-O 3.37Å; K2210-T2289 WeakPolarHBondContact CE-O 3.41Å; K2210-T2289 VanDerWaalsContact NZ-CG2 3.27Å; K2210-T2289 PolarHBondContact NZ-O 2.97Å; I2285-T2289 WeakPolarHBondContact O-CB 3.41Å; I2285-T2289 PolarHBondContact O-N 3.2Å; I2285-T2289 PolarHBondContact O-OG1 3.44Å; S2287-T2289 PolarHBondContact O-N 3.07Å; T2289-N2293 WeakPolarHBondContact O-CB 3.34Å; T2289-N2293 VanDerWaalsContact O-CG 3.23Å; T2289-N2293 PolarHBondContact O-N 3.01Å; T2289-N2293 PolarHBondContact O-ND2 3.42Å; T2289-L2401 WeakPolarHBondContact OG1-CD1 3.43Å
2290N62.7Low57.1Low62 Ų6238.4 Ų38.433%0.33221%0.205SC..Hα-helixtrans-84.5-43.7-175.1-82.6-29.6000115.4K2210 A2286 S2287 E2288 L2294K2210-N2290 PolarHBondContact NZ-O 3.09Å; K2210-N2290 VanDerWaalsContact NZ-O 3.07Å; K2210-N2290 PolarHBondContact NZ-OD1 2.94Å; A2286-N2290 WeakPolarHBondContact O-CB 3.35Å; A2286-N2290 VanDerWaalsContact O-CG 3.31Å; A2286-N2290 PolarHBondContact O-N 3.47Å; A2286-N2290 VanDerWaalsContact O-N 3.08Å; A2286-N2290 PolarHBondContact O-ND2 3.5Å; S2287-N2290 VanDerWaalsContact O-CB 3.31Å; S2287-N2290 WeakPolarHBondContact O-CB 3.48Å; S2287-N2290 PolarHBondContact O-N 3.01Å; S2287-N2290 VanDerWaalsContact O-N 3.16Å; E2288-N2290 PolarHBondContact O-N 3.21Å; N2290-L2294 PolarHBondContact O-N 2.83Å
2291L61.6Low57.2Low4.5 Ų4.535.2 Ų35.22%0.02420%0.195CC..Hα-helixtrans-95.1-39.9-177.5-137.7153.2000113.5L2206 L2231 L2238 L2245 I2249 S2287 E2288 N2293 L2294 F2295L2206-L2291 HydrophobicContact CD1-CB 4.18Å; L2206-L2291 HydrophobicContact CD1-CD1 3.8Å; L2206-L2291 HydrophobicContact CD2-CD1 3.96Å; L2206-L2291 HydrophobicContact CD2-CD2 4.08Å; L2206-L2291 HydrophobicContact CD2-CG 4.23Å; L2206-L2291 HydrophobicContact CG-CD1 4.47Å; L2231-L2291 HydrophobicContact CD1-CD2 3.96Å; L2231-L2291 HydrophobicContact CD2-CD2 3.64Å; L2231-L2291 HydrophobicContact CG-CD2 4.48Å; L2238-L2291 HydrophobicContact CB-CD1 4.04Å; L2238-L2291 HydrophobicContact CD2-CD1 3.74Å; L2238-L2291 HydrophobicContact CG-CD1 4.43Å; L2238-L2291 WeakPolarHBondContact O-CD1 3.25Å; L2245-L2291 HydrophobicContact CD1-CD1 3.93Å; L2245-L2291 HydrophobicContact CD2-CD1 3.24Å; L2245-L2291 HydrophobicContact CG-CD1 3.87Å; I2249-L2291 HydrophobicContact CD1-CD1 4.35Å; S2287-L2291 PolarHBondContact O-N 3.14Å; S2287-L2291 VanDerWaalsContact O-N 3.12Å; E2288-L2291 PolarHBondContact O-N 3.3Å; E2288-L2291 VanDerWaalsContact O-N 3.11Å; L2291-N2293 VanDerWaalsContact C-N 3.31Å; L2291-N2293 PolarHBondContact O-N 3.36Å; L2291-L2294 HydrophobicContact CD2-CB 4.38Å; L2291-L2294 WeakPolarHBondContact O-CA 3.32Å; L2291-L2294 VanDerWaalsContact O-CB 3.29Å; L2291-L2294 WeakPolarHBondContact O-CB 3.4Å; L2291-L2294 PolarHBondContact O-N 2.83Å; L2291-L2294 VanDerWaalsContact O-N 3.14Å; L2291-F2295 HydrophobicContact CD1-CZ 4.32Å; L2291-F2295 HydrophobicContact CD2-CD2 3.99Å; L2291-F2295 HydrophobicContact CD2-CE1 4.15Å; L2291-F2295 HydrophobicContact CD2-CE2 3.78Å; L2291-F2295 HydrophobicContact CD2-CZ 3.23Å; L2291-F2295 HydrophobicContact CG-CE1 4.19Å; L2291-F2295 HydrophobicContact CG-CE2 4.07Å; L2291-F2295 HydrophobicContact CG-CZ 3.66Å; L2291-F2295 WeakPolarHBondContact O-CD2 3.21Å; L2291-F2295 PolarHBondContact O-N 2.87Å; L2291-F2295 VanDerWaalsContact O-N 3.14Å
2292I60.6Low57.4Low19 Ų1934.6 Ų34.610%0.09719%0.191CC..Hα-helixtrans-62-40.9173.9-70.6170.2000110.9S2248 F2252 E2288 L2294 F2295 S2296 L2358 L2401 S2404 L2405 I2408S2248-I2292 WeakPolarHBondContact O-CD1 3.33Å; F2252-I2292 HydrophobicContact CB-CD1 4.09Å; F2252-I2292 HydrophobicContact CB-CG1 3.87Å; F2252-I2292 HydrophobicContact CD2-CB 4.36Å; F2252-I2292 HydrophobicContact CD2-CG1 4.41Å; F2252-I2292 HydrophobicContact CD2-CG2 3.5Å; F2252-I2292 HydrophobicContact CE2-CG2 3.99Å; F2252-I2292 HydrophobicContact CG-CG1 4.26Å; F2252-I2292 HydrophobicContact CG-CG2 4.19Å; E2288-I2292 HydrophobicContact CG-CD1 3.88Å; E2288-I2292 WeakPolarHBondContact O-CG1 3.37Å; E2288-I2292 PolarHBondContact O-N 2.95Å; I2292-L2294 VanDerWaalsContact C-N 3.27Å; I2292-L2294 PolarHBondContact O-N 3.29Å; I2292-F2295 WeakPolarHBondContact O-CB 3.27Å; I2292-F2295 PolarHBondContact O-N 3.17Å; I2292-F2295 VanDerWaalsContact O-N 3.13Å; I2292-S2296 WeakPolarHBondContact O-CB 3.38Å; I2292-S2296 PolarHBondContact O-N 3.18Å; I2292-S2296 PolarHBondContact O-OG 2.86Å; I2292-L2358 HydrophobicContact CD1-CD1 4.06Å; I2292-L2401 HydrophobicContact CD1-CD1 3.27Å; I2292-L2401 HydrophobicContact CD1-CG 4.36Å; I2292-S2404 VanDerWaalsContact CG2-C 3.5Å; I2292-L2405 HydrophobicContact CD1-CD2 3.47Å; I2292-L2405 VanDerWaalsContact CD1-CD2 3.47Å; I2292-L2405 HydrophobicContact CD1-CG 3.89Å; I2292-L2405 HydrophobicContact CG1-CD2 3.86Å; I2292-L2405 HydrophobicContact CG2-CD2 4.09Å; I2292-L2405 HydrophobicContact CG2-CG 4.29Å; I2292-I2408 HydrophobicContact CB-CD1 4.37Å; I2292-I2408 HydrophobicContact CG2-CD1 3.63Å; I2292-I2408 HydrophobicContact CG2-CG1 4.5Å
2293N62.3Low57.2Low30.5 Ų30.534.8 Ų34.816%0.16319%0.193CC..Hα-helixtrans-60.7-37.8173.4-83.1-18.8000112K2210 E2288 T2289 L2291 F2295 S2296 L2297K2210-N2293 HydrophobicContact CD-CB 4.16Å; E2288-N2293 VanDerWaalsContact CD-ND2 3.31Å; E2288-N2293 WeakPolarHBondContact CG-ND2 3.27Å; E2288-N2293 PolarHBondContact OE1-ND2 3.48Å; T2289-N2293 WeakPolarHBondContact O-CB 3.34Å; T2289-N2293 VanDerWaalsContact O-CG 3.23Å; T2289-N2293 PolarHBondContact O-N 3.01Å; T2289-N2293 PolarHBondContact O-ND2 3.42Å; L2291-N2293 VanDerWaalsContact C-N 3.31Å; L2291-N2293 PolarHBondContact O-N 3.36Å; N2293-F2295 PolarHBondContact O-N 3Å; N2293-S2296 WeakPolarHBondContact CA-OG 3.41Å; N2293-S2296 CarbonylContact O-C 3.54Å; N2293-S2296 WeakPolarHBondContact O-CB 3.23Å; N2293-S2296 PolarHBondContact O-N 2.88Å; N2293-S2296 PolarHBondContact O-OG 3.37Å; N2293-S2296 VanDerWaalsContact O-OG 3.04Å; N2293-L2297 HydrophobicContact CB-CD1 4.36Å; N2293-L2297 WeakPolarHBondContact O-CB 3.46Å; N2293-L2297 VanDerWaalsContact O-CD1 3.29Å; N2293-L2297 WeakPolarHBondContact O-CD1 3.16Å; N2293-L2297 WeakPolarHBondContact O-CG 3.28Å; N2293-L2297 PolarHBondContact O-N 2.93Å
2294L61.4Low56.8Low0 Ų032.4 Ų32.40%019%0.188CC..Hα-helixtrans-62.6-47.5175.7-167.3115.5000111.1L2206 S2209 K2210 I2213 I2227 L2231 N2290 L2291 I2292 S2296 L2297 I2298L2206-L2294 HydrophobicContact CD2-CD2 4.02Å; S2209-L2294 VanDerWaalsContact OG-CD1 3.31Å; S2209-L2294 WeakPolarHBondContact OG-CD1 3.34Å; K2210-L2294 HydrophobicContact CB-CD1 4.28Å; K2210-L2294 HydrophobicContact CD-CB 4.36Å; K2210-L2294 HydrophobicContact CG-CB 4.03Å; K2210-L2294 HydrophobicContact CG-CD1 3.66Å; K2210-L2294 HydrophobicContact CG-CG 4.48Å; I2213-L2294 HydrophobicContact CD1-CD1 4.03Å; I2213-L2294 HydrophobicContact CD1-CD2 3.66Å; I2213-L2294 HydrophobicContact CD1-CG 3.44Å; I2213-L2294 VanDerWaalsContact CD1-CG 3.44Å; I2227-L2294 HydrophobicContact CG2-CD1 4.33Å; I2227-L2294 HydrophobicContact CG2-CD2 3.96Å; I2227-L2294 VanDerWaalsContact CG2-CD2 3.43Å; I2227-L2294 HydrophobicContact CG2-CG 4.33Å; L2231-L2294 HydrophobicContact CD1-CD2 4.03Å; L2231-L2294 HydrophobicContact CD2-CD2 3.85Å; L2231-L2294 HydrophobicContact CG-CD2 4.37Å; N2290-L2294 PolarHBondContact O-N 2.83Å; L2291-L2294 HydrophobicContact CD2-CB 4.38Å; L2291-L2294 WeakPolarHBondContact O-CA 3.32Å; L2291-L2294 VanDerWaalsContact O-CB 3.29Å; L2291-L2294 WeakPolarHBondContact O-CB 3.4Å; L2291-L2294 PolarHBondContact O-N 2.83Å; L2291-L2294 VanDerWaalsContact O-N 3.14Å; I2292-L2294 VanDerWaalsContact C-N 3.27Å; I2292-L2294 PolarHBondContact O-N 3.29Å; L2294-S2296 PolarHBondContact O-N 3.15Å; L2294-L2297 PolarHBondContact O-N 3.1Å; L2294-L2297 VanDerWaalsContact O-N 3.12Å; L2294-I2298 HydrophobicContact CD1-CD1 4.22Å; L2294-I2298 HydrophobicContact CD2-CD1 3.82Å; L2294-I2298 VanDerWaalsContact CD2-CD1 3.42Å; L2294-I2298 HydrophobicContact CD2-CG1 4.42Å; L2294-I2298 HydrophobicContact CG-CD1 3.8Å; L2294-I2298 WeakPolarHBondContact O-CB 3.36Å; L2294-I2298 WeakPolarHBondContact O-CG1 3.38Å; L2294-I2298 PolarHBondContact O-N 3.44Å; L2294-I2298 VanDerWaalsContact O-N 3.13Å
2295F63.3Low55.9Low8 Ų834.5 Ų34.54%0.03521%0.209CC..Hα-helixtrans-64.4-38.4175.9-71.2-44.5000112.5L2231 M2239 F2252 L2291 I2292 N2293 L2297 I2298 M2299 I2351 I2408L2231-F2295 HydrophobicContact CD1-CD1 4.05Å; L2231-F2295 HydrophobicContact CD1-CE1 4.15Å; L2231-F2295 HydrophobicContact CD1-CE2 3.8Å; L2231-F2295 HydrophobicContact CD1-CZ 3.66Å; L2231-F2295 HydrophobicContact CD2-CE1 3.81Å; M2239-F2295 HydrophobicContact CE-CD1 4.32Å; M2239-F2295 HydrophobicContact CE-CE1 3.47Å; M2239-F2295 VanDerWaalsContact CE-CE1 3.47Å; M2239-F2295 HydrophobicContact CE-CE2 3.92Å; M2239-F2295 HydrophobicContact CE-CZ 3.24Å; M2239-F2295 HydrophobicContact CG-CE2 4.33Å; M2239-F2295 HydrophobicContact CG-CZ 3.96Å; M2239-F2295 HydrophobicContact SD-CZ 4.37Å; F2252-F2295 HydrophobicContact CD1-CB 3.88Å; F2252-F2295 HydrophobicContact CD1-CG 4.4Å; F2252-F2295 HydrophobicContact CE1-CB 3.27Å; F2252-F2295 HydrophobicContact CE1-CG 4.07Å; F2252-F2295 HydrophobicContact CZ-CB 3.67Å; L2291-F2295 HydrophobicContact CD1-CZ 4.32Å; L2291-F2295 HydrophobicContact CD2-CD2 3.99Å; L2291-F2295 HydrophobicContact CD2-CE1 4.15Å; L2291-F2295 HydrophobicContact CD2-CE2 3.78Å; L2291-F2295 HydrophobicContact CD2-CZ 3.23Å; L2291-F2295 HydrophobicContact CG-CE1 4.19Å; L2291-F2295 HydrophobicContact CG-CE2 4.07Å; L2291-F2295 HydrophobicContact CG-CZ 3.66Å; L2291-F2295 WeakPolarHBondContact O-CD2 3.21Å; L2291-F2295 PolarHBondContact O-N 2.87Å; L2291-F2295 VanDerWaalsContact O-N 3.14Å; I2292-F2295 WeakPolarHBondContact O-CB 3.27Å; I2292-F2295 PolarHBondContact O-N 3.17Å; I2292-F2295 VanDerWaalsContact O-N 3.13Å; N2293-F2295 PolarHBondContact O-N 3Å; F2295-L2297 VanDerWaalsContact C-N 3.29Å; F2295-L2297 PolarHBondContact O-N 3.06Å; F2295-I2298 PolarHBondContact O-N 3.19Å; F2295-M2299 WeakPolarHBondContact O-CB 3.41Å; F2295-M2299 PolarHBondContact O-N 3.02Å; F2295-I2351 HydrophobicContact CB-CD1 4.28Å; F2295-I2351 HydrophobicContact CB-CG1 4.48Å; F2295-I2351 HydrophobicContact CB-CG2 3.9Å; F2295-I2351 HydrophobicContact CD1-CD1 4.02Å; F2295-I2351 HydrophobicContact CD1-CG1 4.08Å; F2295-I2351 HydrophobicContact CD2-CB 4.48Å; F2295-I2351 HydrophobicContact CD2-CG1 4.1Å; F2295-I2351 HydrophobicContact CD2-CG2 3.89Å; F2295-I2351 HydrophobicContact CE1-CG1 4.36Å; F2295-I2351 HydrophobicContact CE2-CG1 4.34Å; F2295-I2351 HydrophobicContact CG-CD1 4.1Å; F2295-I2351 HydrophobicContact CG-CG1 3.97Å; F2295-I2351 HydrophobicContact CG-CG2 4.01Å; F2295-I2351 HydrophobicContact CZ-CG1 4.49Å; F2295-I2408 HydrophobicContact CB-CD1 3.61Å; F2295-I2408 HydrophobicContact CB-CG1 4.16Å; F2295-I2408 HydrophobicContact CD2-CD1 4.23Å; F2295-I2408 HydrophobicContact CG-CD1 4.46Å
2296S61Low55.1Low17 Ų1737.6 Ų37.612%0.11923%0.229CC..Hα-helixtrans-65.4-30.2177.587.10000112.8I2292 N2293 L2294 P2300I2292-S2296 WeakPolarHBondContact O-CB 3.38Å; I2292-S2296 PolarHBondContact O-N 3.18Å; I2292-S2296 PolarHBondContact O-OG 2.86Å; N2293-S2296 WeakPolarHBondContact CA-OG 3.41Å; N2293-S2296 CarbonylContact O-C 3.54Å; N2293-S2296 WeakPolarHBondContact O-CB 3.23Å; N2293-S2296 PolarHBondContact O-N 2.88Å; N2293-S2296 PolarHBondContact O-OG 3.37Å; N2293-S2296 VanDerWaalsContact O-OG 3.04Å; L2294-S2296 PolarHBondContact O-N 3.15Å; S2296-P2300 VanDerWaalsContact O-CD 3.28Å; S2296-P2300 WeakPolarHBondContact O-CD 3.43Å; S2296-P2300 WeakPolarHBondContact O-CG 3.39Å
2297L59.7Low54Low38.5 Ų38.538 Ų3820%0.20223%0.229CC..Hα-helixtrans-79.9-36.5176.3-75.2165.5000111.4K2210 I2213 N2214 T2218 N2293 L2294 F2295K2210-L2297 HydrophobicContact CB-CD1 4.16Å; K2210-L2297 HydrophobicContact CG-CD1 4.06Å; I2213-L2297 HydrophobicContact CD1-CB 4.33Å; I2213-L2297 HydrophobicContact CG2-CB 3.79Å; I2213-L2297 HydrophobicContact CG2-CD1 3.77Å; I2213-L2297 HydrophobicContact CG2-CD2 4.46Å; I2213-L2297 HydrophobicContact CG2-CG 4.1Å; N2214-L2297 WeakPolarHBondContact OD1-CD1 3.43Å; N2214-L2297 WeakPolarHBondContact OD1-CD2 3.46Å; T2218-L2297 WeakPolarHBondContact CB-O 3.49Å; T2218-L2297 HydrophobicContact CG2-CB 3.78Å; T2218-L2297 HydrophobicContact CG2-CD2 3.4Å; T2218-L2297 HydrophobicContact CG2-CG 4.21Å; T2218-L2297 WeakPolarHBondContact CG2-O 3.36Å; N2293-L2297 HydrophobicContact CB-CD1 4.36Å; N2293-L2297 WeakPolarHBondContact O-CB 3.46Å; N2293-L2297 VanDerWaalsContact O-CD1 3.29Å; N2293-L2297 WeakPolarHBondContact O-CD1 3.16Å; N2293-L2297 WeakPolarHBondContact O-CG 3.28Å; N2293-L2297 PolarHBondContact O-N 2.93Å; L2294-L2297 PolarHBondContact O-N 3.1Å; L2294-L2297 VanDerWaalsContact O-N 3.12Å; F2295-L2297 VanDerWaalsContact C-N 3.29Å; F2295-L2297 PolarHBondContact O-N 3.06Å
2298I59.1Low53Low0.5 Ų0.542.2 Ų42.20%0.00325%0.247CC..Hα-helixtrans-76.8-33.7179.3-67170.1000111.4I2213 N2224 I2227 V2228 L2231 L2294 F2295 P2300 S2301 F2302I2213-I2298 HydrophobicContact CD1-CD1 4Å; I2213-I2298 HydrophobicContact CD1-CG1 3.78Å; N2224-I2298 HydrophobicContact CB-CG1 4.18Å; I2227-I2298 HydrophobicContact CB-CD1 4.34Å; I2227-I2298 HydrophobicContact CG2-CD1 3.81Å; I2227-I2298 HydrophobicContact CG2-CG1 4.41Å; V2228-I2298 HydrophobicContact CG2-CD1 4.01Å; V2228-I2298 HydrophobicContact CG2-CG2 4.01Å; L2231-I2298 HydrophobicContact CD1-CD1 3.6Å; L2294-I2298 HydrophobicContact CD1-CD1 4.22Å; L2294-I2298 HydrophobicContact CD2-CD1 3.82Å; L2294-I2298 VanDerWaalsContact CD2-CD1 3.42Å; L2294-I2298 HydrophobicContact CD2-CG1 4.42Å; L2294-I2298 HydrophobicContact CG-CD1 3.8Å; L2294-I2298 WeakPolarHBondContact O-CB 3.36Å; L2294-I2298 WeakPolarHBondContact O-CG1 3.38Å; L2294-I2298 PolarHBondContact O-N 3.44Å; L2294-I2298 VanDerWaalsContact O-N 3.13Å; F2295-I2298 PolarHBondContact O-N 3.19Å; I2298-P2300 VanDerWaalsContact C-CD 3.47Å; I2298-P2300 VanDerWaalsContact C-N 3.33Å; I2298-S2301 WeakPolarHBondContact O-CA 3.41Å; I2298-S2301 VanDerWaalsContact O-CB 3.28Å; I2298-S2301 WeakPolarHBondContact O-CB 3.32Å; I2298-S2301 PolarHBondContact O-N 3.46Å; I2298-S2301 PolarHBondContact O-OG 3.11Å; I2298-F2302 HydrophobicContact CG2-CD2 4.12Å; I2298-F2302 HydrophobicContact CG2-CE1 4.37Å; I2298-F2302 HydrophobicContact CG2-CE2 3.47Å; I2298-F2302 HydrophobicContact CG2-CZ 3.94Å; I2298-F2302 WeakPolarHBondContact O-CD2 3.36Å
2299M59.2Low51.5Low13 Ų1348 Ų486%0.06428%0.276CS..THydrogen-bonded Turntrans-59.9-41.1-173.7-146.962.9150.600115.1F2295 S2301 F2302 N2303 R2344 Q2348 I2351 L2352 I2408 Y2412F2295-M2299 WeakPolarHBondContact O-CB 3.41Å; F2295-M2299 PolarHBondContact O-N 3.02Å; M2299-S2301 VanDerWaalsContact C-N 3.28Å; M2299-S2301 PolarHBondContact O-N 3.2Å; M2299-F2302 HydrophobicContact CE-CD2 4.11Å; M2299-F2302 PolarHBondContact O-N 3.05Å; M2299-F2302 VanDerWaalsContact O-N 3.08Å; M2299-F2302 HydrophobicContact SD-CD2 4.17Å; M2299-N2303 PolarHBondContact O-N 3.27Å; M2299-R2344 VanDerWaalsContact CE-CZ 3.44Å; M2299-R2344 PolarHBondContact SD-NH2 3.13Å; M2299-R2344 VanDerWaalsContact SD-NH2 3.43Å; M2299-Q2348 HydrophobicContact CE-CG 4.45Å; M2299-Q2348 HydrophobicContact SD-CG 4.19Å; M2299-I2351 HydrophobicContact CE-CG2 3.94Å; M2299-L2352 HydrophobicContact CE-CD2 3.8Å; M2299-L2352 HydrophobicContact CE-CG 3.95Å; M2299-I2408 HydrophobicContact CE-CG2 3.37Å; M2299-I2408 HydrophobicContact CG-CG2 4.37Å; M2299-Y2412 HydrophobicContact CE-CD2 4.42Å; M2299-Y2412 HydrophobicContact SD-CD2 3.99Å; M2299-Y2412 HydrophobicContact SD-CG 4.46Å
2300P53.6Low50Low57.5 Ų57.551 Ų5137%0.37330%0.298SS..THydrogen-bonded Turntrans-61.7-29.6173.4-24.534.1000113.3S2296 I2298 F2302 N2303 S2304S2296-P2300 VanDerWaalsContact O-CD 3.28Å; S2296-P2300 WeakPolarHBondContact O-CD 3.43Å; S2296-P2300 WeakPolarHBondContact O-CG 3.39Å; I2298-P2300 VanDerWaalsContact C-CD 3.47Å; I2298-P2300 VanDerWaalsContact C-N 3.33Å; P2300-F2302 VanDerWaalsContact C-N 3.34Å; P2300-F2302 PolarHBondContact O-N 3.24Å; P2300-N2303 VanDerWaalsContact O-CB 3.31Å; P2300-N2303 WeakPolarHBondContact O-CB 3.46Å; P2300-N2303 PolarHBondContact O-N 3.22Å; P2300-N2303 VanDerWaalsContact O-N 3.09Å; P2300-S2304 PolarHBondContact O-N 3.33Å
2301S51.9Low48.5Very low17.5 Ų17.551.7 Ų51.712%0.12231%0.308CS..G310 helixtrans-67.9-28.5179.579.60000113T2218 N2224 I2298 M2299 N2303 S2304T2218-S2301 WeakPolarHBondContact O-CB 3.43Å; N2224-S2301 VanDerWaalsContact ND2-CB 3.34Å; N2224-S2301 WeakPolarHBondContact ND2-CB 3.29Å; N2224-S2301 PolarHBondContact ND2-OG 2.99Å; N2224-S2301 VanDerWaalsContact ND2-OG 3.11Å; I2298-S2301 WeakPolarHBondContact O-CA 3.41Å; I2298-S2301 VanDerWaalsContact O-CB 3.28Å; I2298-S2301 WeakPolarHBondContact O-CB 3.32Å; I2298-S2301 PolarHBondContact O-N 3.46Å; I2298-S2301 PolarHBondContact O-OG 3.11Å; M2299-S2301 VanDerWaalsContact C-N 3.28Å; M2299-S2301 PolarHBondContact O-N 3.2Å; S2301-N2303 PolarHBondContact O-N 2.9Å; S2301-S2304 PolarHBondContact O-N 3.36Å; S2301-S2304 PolarHBondContact O-OG 3.3Å; S2301-S2304 VanDerWaalsContact O-OG 3.09Å
2302F52.3Low47Very low28.5 Ų28.557.4 Ų57.413%0.12534%0.338CS..G310 helixtrans-72.2-22.5171.5-64.5-60.4000112.3V2228 I2298 M2299 P2300 F2337 R2344 I2347 Q2348 I2351V2228-F2302 HydrophobicContact CG1-CE1 4.36Å; V2228-F2302 HydrophobicContact CG2-CE1 3.51Å; V2228-F2302 HydrophobicContact CG2-CZ 3.83Å; I2298-F2302 HydrophobicContact CG2-CD2 4.12Å; I2298-F2302 HydrophobicContact CG2-CE1 4.37Å; I2298-F2302 HydrophobicContact CG2-CE2 3.47Å; I2298-F2302 HydrophobicContact CG2-CZ 3.94Å; I2298-F2302 WeakPolarHBondContact O-CD2 3.36Å; M2299-F2302 HydrophobicContact CE-CD2 4.11Å; M2299-F2302 PolarHBondContact O-N 3.05Å; M2299-F2302 VanDerWaalsContact O-N 3.08Å; M2299-F2302 HydrophobicContact SD-CD2 4.17Å; P2300-F2302 VanDerWaalsContact C-N 3.34Å; P2300-F2302 PolarHBondContact O-N 3.24Å; F2302-F2337 HydrophobicContact CB-CE2 4.28Å; F2302-F2337 WeakPolarHBondContact O-CD2 3.4Å; F2302-F2337 WeakPolarHBondContact O-CE2 3.47Å; F2302-R2344 HydrophobicContact CD1-CB 3.83Å; F2302-R2344 HydrophobicContact CD1-CG 3.86Å; F2302-R2344 HydrophobicContact CE1-CB 3.95Å; F2302-R2344 HydrophobicContact CE1-CG 3.87Å; F2302-I2347 HydrophobicContact CZ-CB 4.5Å; F2302-I2347 HydrophobicContact CZ-CG2 4.08Å; F2302-Q2348 HydrophobicContact CD2-CB 4.35Å; F2302-Q2348 HydrophobicContact CE2-CB 4.44Å; F2302-I2351 HydrophobicContact CE2-CD1 4.14Å
2303N45.2Very low45.6Very low57 Ų5765.8 Ų65.831%0.30538%0.377SS..G310 helixtrans-99.8-5.9-173.6-71.7-15.3000115.3M2299 P2300 S2301 P2305 G2411 R2419 R2435M2299-N2303 PolarHBondContact O-N 3.27Å; P2300-N2303 VanDerWaalsContact O-CB 3.31Å; P2300-N2303 WeakPolarHBondContact O-CB 3.46Å; P2300-N2303 PolarHBondContact O-N 3.22Å; P2300-N2303 VanDerWaalsContact O-N 3.09Å; S2301-N2303 PolarHBondContact O-N 2.9Å; N2303-P2305 WeakPolarHBondContact O-CD 3.21Å; N2303-G2411 PolarHBondContact ND2-O 2.8Å; N2303-R2419 PolarHBondContact O-NH1 2.89Å; N2303-R2419 PolarHBondContact O-NH2 2.73Å; N2303-R2435 PolarHBondContact OD1-NH1 3.37Å
2304S41.6Very low44.1Very low61.5 Ų61.567.5 Ų67.543%0.4340%0.396SS..  trans-79.8122.8-177.568.30000112.5P2300 S2301 V2306P2300-S2304 PolarHBondContact O-N 3.33Å; S2301-S2304 PolarHBondContact O-N 3.36Å; S2301-S2304 PolarHBondContact O-OG 3.3Å; S2301-S2304 VanDerWaalsContact O-OG 3.09Å; S2304-V2306 PolarHBondContact O-N 3.36Å
2305P38.2Very low42.6Very low96 Ų9676.7 Ų76.762%0.62344%0.436SS*.G310 helixtrans-72.556.3177.930.1-33.6000110.8N2303 S2307 I2308N2303-P2305 WeakPolarHBondContact O-CD 3.21Å; P2305-S2307 VanDerWaalsContact C-N 3.32Å; P2305-S2307 PolarHBondContact O-N 3.21Å; P2305-S2307 VanDerWaalsContact O-N 3.08Å; P2305-I2308 PolarHBondContact O-N 3.05Å
2306V34.9Very low41Very low110.5 Ų110.585.9 Ų85.967%0.6748%0.479SS*.G310 helixtrans-62.947.6-178.1-178.70000109.5M2221 S2304 I2308M2221-V2306 HydrophobicContact CE-CB 3.17Å; M2221-V2306 HydrophobicContact CE-CG1 3.19Å; M2221-V2306 HydrophobicContact CE-CG2 4.4Å; S2304-V2306 PolarHBondContact O-N 3.36Å; V2306-I2308 VanDerWaalsContact C-N 3.31Å; V2306-I2308 PolarHBondContact O-N 3.1Å
2307S32.7Very low39.6Very low64 Ų6488 Ų8845%0.44850%0.504SS..G310 helixtrans-74.433.1171.956.70000109.9P2305 M2309 F2337P2305-S2307 VanDerWaalsContact C-N 3.32Å; P2305-S2307 PolarHBondContact O-N 3.21Å; P2305-S2307 VanDerWaalsContact O-N 3.08Å; S2307-M2309 PolarHBondContact O-N 2.9Å; S2307-F2337 WeakPolarHBondContact O-CE1 3.34Å; S2307-F2337 WeakPolarHBondContact O-CZ 3.47Å
2308I33Very low38.3Very low124 Ų12494 Ų9464%0.63654%0.536SS*.THydrogen-bonded Turntrans-73.525.5176.3-59.9169.9000108.8P2305 V2306 C2310 S2311P2305-I2308 PolarHBondContact O-N 3.05Å; V2306-I2308 VanDerWaalsContact C-N 3.31Å; V2306-I2308 PolarHBondContact O-N 3.1Å; I2308-C2310 HydrophobicContact CG2-CB 3.94Å; I2308-C2310 PolarHBondContact O-N 3.13Å; I2308-C2310 VanDerWaalsContact O-N 3.1Å; I2308-S2311 PolarHBondContact O-N 3.25Å; I2308-S2311 PolarHBondContact O-OG 3.14Å
2309M27Very low37Very low152 Ų15298.5 Ų98.575%0.74957%0.568SS**THydrogen-bonded Turntrans-76.627166.3-70-134.296.200110.9S2307 S2311S2307-M2309 PolarHBondContact O-N 2.9Å; M2309-S2311 PolarHBondContact O-N 3.19Å; M2309-S2311 VanDerWaalsContact O-N 3.09Å
2310C29.7Very low35.9Very low109.5 Ų109.5106.4 Ų106.474%0.7460%0.602SS**THydrogen-bonded Turntrans-75.440.5162.8-73.60000109.7I2308 D2312I2308-C2310 HydrophobicContact CG2-CB 3.94Å; I2308-C2310 PolarHBondContact O-N 3.13Å; I2308-C2310 VanDerWaalsContact O-N 3.1Å; C2310-D2312 PolarHBondContact O-N 3.47Å
2311S30.8Very low35Very low76.5 Ų76.5114.5 Ų114.554%0.53563%0.627SS.*THydrogen-bonded Turntrans-69.845.2159.954.40000110.5I2308 M2309I2308-S2311 PolarHBondContact O-N 3.25Å; I2308-S2311 PolarHBondContact O-OG 3.14Å; M2309-S2311 PolarHBondContact O-N 3.19Å; M2309-S2311 VanDerWaalsContact O-N 3.09Å
2312D29.1Very low34.3Very low124.5 Ų124.5118.1 Ų118.167%0.66665%0.648SS**THydrogen-bonded Turntrans-131.536.1171-78.9-12.1000110.8C2310 A2314 F2315C2310-D2312 PolarHBondContact O-N 3.47Å; D2312-A2314 PolarHBondContact O-N 3.41Å; D2312-F2315 PolarHBondContact O-N 2.89Å
2313E31.1Very low33.8Very low195 Ų195120.1 Ų120.191%0.91167%0.666SS**THydrogen-bonded Turntrans-64.441.6162.4-69-173.8161.800111.3
2314A31.4Very low33.5Very low67 Ų67125.2 Ų125.255%0.55469%0.686SS**THydrogen-bonded Turntrans-130.851.3169.400000113D2312D2312-A2314 PolarHBondContact O-N 3.41Å
2315F30.8Very low33.3Very low193.5 Ų193.5126.7 Ų126.785%0.84969%0.692SS**SBendtrans-11.148.6166.6-89-85.1000117D2312 G2317D2312-F2315 PolarHBondContact O-N 2.89Å; F2315-G2317 PolarHBondContact O-N 3.08Å
2316E29.8Very low33.3Very low199.5 Ų199.5126.3 Ų126.393%0.93269%0.685SS**SBendtrans-75.992.7164.4-67.6-173.6153.600111.6
2317G31Very low33.5Very low63 Ų63128.1 Ų128.165%0.64968%0.684SS**  trans-177.188.1171.300000112.9F2315F2315-G2317 PolarHBondContact O-N 3.08Å
2318N31.2Very low33.8Very low162.5 Ų162.5129.7 Ų129.787%0.86969%0.687SS**  trans16.2103.9164.3-70.6-27.9000114.3F2320N2318-F2320 PolarHBondContact O-N 3.47Å
2319S32.2Very low34Very low96.5 Ų96.5127.7 Ų127.768%0.67568%0.684SS**  trans-4.974.7173.971.20000116.4
2320F35.6Very low34.6Very low179 Ų179126.8 Ų126.879%0.78568%0.676SS**THydrogen-bonded Turntrans-151.363.1141.5-102.9-82.6000112.6N2318 T2322N2318-F2320 PolarHBondContact O-N 3.47Å; F2320-T2322 PolarHBondContact O-N 3.37Å
2321Y35.4Very low34.9Very low226.5 Ų226.5124.6 Ų124.689%0.88866%0.661SS**  trans-7442.1177.4-83.4-91.7000113
2322T36.8Very low35.2Very low94.5 Ų94.5128.2 Ų128.258%0.5867%0.668SS**  trans-9956.5173.1600000111.9F2320 F2324 T2325 D2326F2320-T2322 PolarHBondContact O-N 3.37Å; T2322-F2324 VanDerWaalsContact C-N 3.27Å; T2322-F2324 PolarHBondContact O-N 2.9Å; T2322-F2324 VanDerWaalsContact O-N 3.16Å; T2322-T2325 PolarHBondContact O-OG1 3.39Å; T2322-T2325 VanDerWaalsContact O-OG1 3.1Å; T2322-D2326 WeakPolarHBondContact CB-OD2 3.34Å; T2322-D2326 PolarHBondContact O-N 3.36Å; T2322-D2326 PolarHBondContact OG1-OD2 3.1Å
2323S42.2Very low35.5Very low70.5 Ų70.5125.8 Ų125.849%0.49366%0.661SS.*  trans-62.466.4-165.557.60000114.8T2325 D2326 F2327S2323-T2325 PolarHBondContact O-N 2.65Å; S2323-T2325 PolarHBondContact OG-OG1 2.87Å; S2323-T2325 VanDerWaalsContact OG-OG1 3.05Å; S2323-D2326 PolarHBondContact O-N 3.01Å; S2323-F2327 WeakPolarHBondContact O-CB 3.3Å; S2323-F2327 PolarHBondContact O-N 3.49Å
2324F39.5Very low35.9Very low163 Ų163121.3 Ų121.372%0.71564%0.638SS**Hα-helixtrans-64.4-31.2-179.1-156.3-97.4000113.6T2322 I2328T2322-F2324 VanDerWaalsContact C-N 3.27Å; T2322-F2324 PolarHBondContact O-N 2.9Å; T2322-F2324 VanDerWaalsContact O-N 3.16Å; F2324-I2328 HydrophobicContact CD1-CD1 3.89Å; F2324-I2328 HydrophobicContact CD1-CG1 4.32Å; F2324-I2328 HydrophobicContact CE1-CD1 3.89Å; F2324-I2328 HydrophobicContact CE1-CG1 4.32Å; F2324-I2328 WeakPolarHBondContact O-CG1 3.31Å; F2324-I2328 PolarHBondContact O-N 3.17Å; F2324-I2328 VanDerWaalsContact O-N 3.17Å
2325T37.2Very low36.1Very low93 Ų93124.2 Ų124.257%0.57164%0.639SS**Hα-helixtrans-66.7-38.217241.90000112.7T2322 S2323 F2327 I2328 S2329T2322-T2325 PolarHBondContact O-OG1 3.39Å; T2322-T2325 VanDerWaalsContact O-OG1 3.1Å; S2323-T2325 PolarHBondContact O-N 2.65Å; S2323-T2325 PolarHBondContact OG-OG1 2.87Å; S2323-T2325 VanDerWaalsContact OG-OG1 3.05Å; T2325-F2327 VanDerWaalsContact C-N 3.32Å; T2325-F2327 PolarHBondContact O-N 3.37Å; T2325-I2328 PolarHBondContact O-N 3.02Å; T2325-S2329 WeakPolarHBondContact O-CB 3.2Å; T2325-S2329 PolarHBondContact O-N 2.96Å; T2325-S2329 VanDerWaalsContact O-N 3.1Å
2326D37.2Very low36.3Very low88.5 Ų88.5117.7 Ų117.747%0.47362%0.616SS.*Hα-helixtrans-68.5-37.5179.4-65.2-11.4000111T2322 S2323 S2329 F2330T2322-D2326 WeakPolarHBondContact CB-OD2 3.34Å; T2322-D2326 PolarHBondContact O-N 3.36Å; T2322-D2326 PolarHBondContact OG1-OD2 3.1Å; S2323-D2326 PolarHBondContact O-N 3.01Å; D2326-S2329 PolarHBondContact O-N 3.4Å; D2326-F2330 VanDerWaalsContact O-CB 3.26Å; D2326-F2330 WeakPolarHBondContact O-CB 3.49Å; D2326-F2330 PolarHBondContact O-N 3.07Å
2327F40.4Very low36.8Very low148.5 Ų148.5111.9 Ų111.965%0.65159%0.588SS**Hα-helixtrans-66.9-39177.1-165.4-94.5000112.6S2323 T2325 F2330 S2331S2323-F2327 WeakPolarHBondContact O-CB 3.3Å; S2323-F2327 PolarHBondContact O-N 3.49Å; T2325-F2327 VanDerWaalsContact C-N 3.32Å; T2325-F2327 PolarHBondContact O-N 3.37Å; F2327-F2330 PolarHBondContact O-N 2.84Å; F2327-S2331 VanDerWaalsContact O-CB 3.3Å; F2327-S2331 WeakPolarHBondContact O-CB 3.37Å; F2327-S2331 PolarHBondContact O-N 3.3Å
2328I38.6Very low37.2Very low97.5 Ų97.5115.2 Ų115.250%0.558%0.581SS.*Hα-helixtrans-67-44.2175.6-66.5170.5000110.3F2324 T2325 F2330 S2331 F2332F2324-I2328 HydrophobicContact CD1-CD1 3.89Å; F2324-I2328 HydrophobicContact CD1-CG1 4.32Å; F2324-I2328 HydrophobicContact CE1-CD1 3.89Å; F2324-I2328 HydrophobicContact CE1-CG1 4.32Å; F2324-I2328 WeakPolarHBondContact O-CG1 3.31Å; F2324-I2328 PolarHBondContact O-N 3.17Å; F2324-I2328 VanDerWaalsContact O-N 3.17Å; T2325-I2328 PolarHBondContact O-N 3.02Å; I2328-F2330 VanDerWaalsContact C-N 3.35Å; I2328-F2330 PolarHBondContact O-N 3.08Å; I2328-S2331 PolarHBondContact O-N 2.82Å; I2328-F2332 WeakPolarHBondContact O-CB 3.41Å; I2328-F2332 PolarHBondContact O-N 3.02Å; I2328-F2332 VanDerWaalsContact O-N 3.13Å
2329S37.1Very low37.8Very low82 Ų82113.4 Ų113.457%0.57356%0.563SS**Hα-helixtrans-60.5-45.1176.2-177.80000111.9T2325 D2326 F2332 S2333T2325-S2329 WeakPolarHBondContact O-CB 3.2Å; T2325-S2329 PolarHBondContact O-N 2.96Å; T2325-S2329 VanDerWaalsContact O-N 3.1Å; D2326-S2329 PolarHBondContact O-N 3.4Å; S2329-F2332 PolarHBondContact O-N 2.95Å; S2329-S2333 WeakPolarHBondContact O-CB 3.43Å; S2329-S2333 PolarHBondContact O-N 3.09Å
2330F38.6Very low38.9Very low132 Ų132109.3 Ų109.358%0.57953%0.534SS*.Hα-helixtrans-65.1-45.1179.3-167.2-94.1000112.3D2326 F2327 I2328 F2332 S2333 F2334D2326-F2330 VanDerWaalsContact O-CB 3.26Å; D2326-F2330 WeakPolarHBondContact O-CB 3.49Å; D2326-F2330 PolarHBondContact O-N 3.07Å; F2327-F2330 PolarHBondContact O-N 2.84Å; I2328-F2330 VanDerWaalsContact C-N 3.35Å; I2328-F2330 PolarHBondContact O-N 3.08Å; F2330-F2332 VanDerWaalsContact C-N 3.33Å; F2330-F2332 PolarHBondContact O-N 3.14Å; F2330-S2333 PolarHBondContact O-N 3.11Å; F2330-F2334 VanDerWaalsContact O-CB 3.28Å; F2330-F2334 WeakPolarHBondContact O-CB 3.37Å; F2330-F2334 PolarHBondContact O-N 3.15Å
2331S36.1Very low39.8Very low63 Ų63102.8 Ų102.844%0.44151%0.508SS..Hα-helixtrans-63.4-39.5178.1-164.80000111.8F2327 I2328 F2334 F2335F2327-S2331 VanDerWaalsContact O-CB 3.3Å; F2327-S2331 WeakPolarHBondContact O-CB 3.37Å; F2327-S2331 PolarHBondContact O-N 3.3Å; I2328-S2331 PolarHBondContact O-N 2.82Å; S2331-F2334 PolarHBondContact O-N 3.37Å; S2331-F2335 WeakPolarHBondContact O-CB 3.31Å; S2331-F2335 PolarHBondContact O-N 3Å; S2331-F2335 VanDerWaalsContact O-N 3.08Å
2332F37Very low40.9Very low152 Ų15295.5 Ų95.567%0.66748%0.484SS*.Hα-helixtrans-68-43.7177.4-147.9-92.8000111.8I2328 S2329 F2330 F2334 F2335 C2336I2328-F2332 WeakPolarHBondContact O-CB 3.41Å; I2328-F2332 PolarHBondContact O-N 3.02Å; I2328-F2332 VanDerWaalsContact O-N 3.13Å; S2329-F2332 PolarHBondContact O-N 2.95Å; F2330-F2332 VanDerWaalsContact C-N 3.33Å; F2330-F2332 PolarHBondContact O-N 3.14Å; F2332-F2334 PolarHBondContact O-N 3.22Å; F2332-F2335 PolarHBondContact O-N 2.95Å; F2332-C2336 WeakPolarHBondContact O-CB 3.48Å; F2332-C2336 PolarHBondContact O-N 3.16Å; F2332-C2336 VanDerWaalsContact O-N 3.16Å; F2332-C2336 PolarHBondContact O-SG 3.31Å
2333S37.1Very low41.9Very low74.5 Ų74.592 Ų9252%0.52146%0.461SS..Hα-helixtrans-60.9-43.6174.7-175.90000112S2329 F2330 F2335 C2336 F2337S2329-S2333 WeakPolarHBondContact O-CB 3.43Å; S2329-S2333 PolarHBondContact O-N 3.09Å; F2330-S2333 PolarHBondContact O-N 3.11Å; S2333-F2335 PolarHBondContact O-N 2.95Å; S2333-C2336 PolarHBondContact O-N 3.47Å; S2333-F2337 WeakPolarHBondContact O-CB 3.32Å; S2333-F2337 PolarHBondContact O-N 3.24Å
2334F38.7Very low42.7Very low100.5 Ų100.591.2 Ų91.244%0.44145%0.447SS..Hα-helixtrans-65-39.5178.6-167.5-95.7000112.2F2330 S2331 F2332 F2337 R2338F2330-F2334 VanDerWaalsContact O-CB 3.28Å; F2330-F2334 WeakPolarHBondContact O-CB 3.37Å; F2330-F2334 PolarHBondContact O-N 3.15Å; S2331-F2334 PolarHBondContact O-N 3.37Å; F2332-F2334 PolarHBondContact O-N 3.22Å; F2334-F2337 PolarHBondContact O-N 3.42Å; F2334-R2338 HydrophobicContact CE1-CG 4.33Å; F2334-R2338 VanDerWaalsContact CE1-NE 3.32Å; F2334-R2338 PolarHBondContact O-N 2.74Å; F2334-R2338 VanDerWaalsContact O-N 3.09Å
2335F34.8Very low43.8Very low129 Ų12988.7 Ų88.757%0.56644%0.437SS*.Hα-helixtrans-65.7-44.4177.1-138.1-97.6000112.3S2331 F2332 S2333 F2337 R2338 Y2339S2331-F2335 WeakPolarHBondContact O-CB 3.31Å; S2331-F2335 PolarHBondContact O-N 3Å; S2331-F2335 VanDerWaalsContact O-N 3.08Å; F2332-F2335 PolarHBondContact O-N 2.95Å; S2333-F2335 PolarHBondContact O-N 2.95Å; F2335-F2337 VanDerWaalsContact C-N 3.29Å; F2335-F2337 PolarHBondContact O-N 3.04Å; F2335-R2338 PolarHBondContact O-N 2.91Å; F2335-Y2339 WeakPolarHBondContact O-CB 3.48Å; F2335-Y2339 PolarHBondContact O-N 3.09Å
2336C36.2Very low45Very low55.5 Ų55.585.6 Ų85.638%0.37542%0.418SS..Hα-helixtrans-61.8-36.7175.9-71.60000112.3F2332 S2333 Y2339 S2340F2332-C2336 WeakPolarHBondContact O-CB 3.48Å; F2332-C2336 PolarHBondContact O-N 3.16Å; F2332-C2336 VanDerWaalsContact O-N 3.16Å; F2332-C2336 PolarHBondContact O-SG 3.31Å; S2333-C2336 PolarHBondContact O-N 3.47Å; C2336-Y2339 PolarHBondContact O-N 2.95Å; C2336-S2340 PolarHBondContact O-N 3.48Å; C2336-S2340 VanDerWaalsContact O-N 3.07Å
2337F39.1Very low46.2Very low77.5 Ų77.581.7 Ų81.734%0.3440%0.398SS..Hα-helixtrans-64.9-45.8-179.7-158-93.5000112.4F2302 S2307 S2333 F2334 F2335 Y2339 S2340 N2341F2302-F2337 HydrophobicContact CB-CE2 4.28Å; F2302-F2337 WeakPolarHBondContact O-CD2 3.4Å; F2302-F2337 WeakPolarHBondContact O-CE2 3.47Å; S2307-F2337 WeakPolarHBondContact O-CE1 3.34Å; S2307-F2337 WeakPolarHBondContact O-CZ 3.47Å; S2333-F2337 WeakPolarHBondContact O-CB 3.32Å; S2333-F2337 PolarHBondContact O-N 3.24Å; F2334-F2337 PolarHBondContact O-N 3.42Å; F2335-F2337 VanDerWaalsContact C-N 3.29Å; F2335-F2337 PolarHBondContact O-N 3.04Å; F2337-Y2339 VanDerWaalsContact C-N 3.31Å; F2337-Y2339 PolarHBondContact O-N 2.91Å; F2337-S2340 PolarHBondContact O-N 3.02Å; F2337-S2340 PolarHBondContact O-OG 3.43Å; F2337-N2341 WeakPolarHBondContact CE1-ND2 3.49Å; F2337-N2341 PolarHBondContact O-N 2.9Å; F2337-N2341 VanDerWaalsContact O-N 3.08Å
2338R40.3Very low47.4Very low133.5 Ų133.575.9 Ų75.950%0.50437%0.372SS..Hα-helixtrans-64.2-38.5177.8-78-168.8170.9-172.4-4.4113F2334 F2335 S2340 N2341 L2342F2334-R2338 HydrophobicContact CE1-CG 4.33Å; F2334-R2338 VanDerWaalsContact CE1-NE 3.32Å; F2334-R2338 PolarHBondContact O-N 2.74Å; F2334-R2338 VanDerWaalsContact O-N 3.09Å; F2335-R2338 PolarHBondContact O-N 2.91Å; R2338-S2340 VanDerWaalsContact C-N 3.3Å; R2338-S2340 PolarHBondContact O-N 3.23Å; R2338-N2341 PolarHBondContact O-N 3.48Å; R2338-L2342 WeakPolarHBondContact O-CB 3.41Å; R2338-L2342 PolarHBondContact O-N 3.34Å
2339Y44.3Very low48.6Very low125 Ų12572.5 Ų72.549%0.4936%0.357SS..Hα-helixtrans-62.4-40.8178.9-166.1-100.1000111.9F2335 C2336 F2337 N2341 L2342 Q2343F2335-Y2339 WeakPolarHBondContact O-CB 3.48Å; F2335-Y2339 PolarHBondContact O-N 3.09Å; C2336-Y2339 PolarHBondContact O-N 2.95Å; F2337-Y2339 VanDerWaalsContact C-N 3.31Å; F2337-Y2339 PolarHBondContact O-N 2.91Å; Y2339-N2341 PolarHBondContact O-N 3.38Å; Y2339-L2342 PolarHBondContact O-N 3.31Å; Y2339-Q2343 HydrophobicContact CD1-CG 4.26Å; Y2339-Q2343 HydrophobicContact CE1-CG 4Å; Y2339-Q2343 WeakPolarHBondContact O-CG 3.31Å; Y2339-Q2343 PolarHBondContact O-N 3.25Å
2340S54.5Low49.9Very low9.5 Ų9.571.9 Ų71.97%0.06634%0.344CS..Hα-helixtrans-67.7-38.8178.7126.80000113.7C2336 F2337 R2338 L2342 Q2343 R2344C2336-S2340 PolarHBondContact O-N 3.48Å; C2336-S2340 VanDerWaalsContact O-N 3.07Å; F2337-S2340 PolarHBondContact O-N 3.02Å; F2337-S2340 PolarHBondContact O-OG 3.43Å; R2338-S2340 VanDerWaalsContact C-N 3.3Å; R2338-S2340 PolarHBondContact O-N 3.23Å; S2340-L2342 VanDerWaalsContact C-N 3.34Å; S2340-L2342 PolarHBondContact O-N 3.26Å; S2340-Q2343 PolarHBondContact O-N 3.36Å; S2340-R2344 WeakPolarHBondContact O-CG 3.2Å; S2340-R2344 PolarHBondContact O-N 3.08Å; S2340-R2344 VanDerWaalsContact O-N 3.12Å; S2340-R2344 PolarHBondContact OG-NH1 3.35Å; S2340-R2344 PolarHBondContact OG-NH2 3.45Å
2341N55.6Low51.1Low43.5 Ų43.565.8 Ų65.823%0.23332%0.318CS..Hα-helixtrans-65.5-40.9177.3-75.9-19.8000112F2337 R2338 Y2339 Q2343 R2344 E2345F2337-N2341 WeakPolarHBondContact CE1-ND2 3.49Å; F2337-N2341 PolarHBondContact O-N 2.9Å; F2337-N2341 VanDerWaalsContact O-N 3.08Å; R2338-N2341 PolarHBondContact O-N 3.48Å; Y2339-N2341 PolarHBondContact O-N 3.38Å; N2341-Q2343 PolarHBondContact O-N 2.86Å; N2341-R2344 WeakPolarHBondContact O-CB 3.25Å; N2341-R2344 PolarHBondContact O-N 3.32Å; N2341-R2344 PolarHBondContact OD1-NH2 3.07Å; N2341-E2345 PolarHBondContact O-N 3.21Å; N2341-E2345 VanDerWaalsContact O-N 3.13Å
2342L57.6Low52.5Low73.5 Ų73.564.6 Ų64.639%0.38531%0.306SS..Hα-helixtrans-66.9-39.8179.8-157.1140.6000111.4R2338 Y2339 S2340 R2344 E2345 V2346R2338-L2342 WeakPolarHBondContact O-CB 3.41Å; R2338-L2342 PolarHBondContact O-N 3.34Å; Y2339-L2342 PolarHBondContact O-N 3.31Å; S2340-L2342 VanDerWaalsContact C-N 3.34Å; S2340-L2342 PolarHBondContact O-N 3.26Å; L2342-R2344 VanDerWaalsContact C-N 3.32Å; L2342-R2344 PolarHBondContact O-N 3.15Å; L2342-E2345 PolarHBondContact O-N 3.02Å; L2342-V2346 HydrophobicContact CD2-CG2 4.28Å; L2342-V2346 VanDerWaalsContact O-CG2 3.27Å; L2342-V2346 WeakPolarHBondContact O-CG2 3.28Å; L2342-V2346 PolarHBondContact O-N 3.39Å; L2342-V2346 VanDerWaalsContact O-N 3.13Å
2343Q58.4Low53.9Low20 Ų2058.9 Ų58.99%0.09328%0.283CS..Hα-helixtrans-60.1-40.9171.9-73.5-178.4-33.400112.4Y2339 S2340 N2341 V2346 I2347Y2339-Q2343 HydrophobicContact CD1-CG 4.26Å; Y2339-Q2343 HydrophobicContact CE1-CG 4Å; Y2339-Q2343 WeakPolarHBondContact O-CG 3.31Å; Y2339-Q2343 PolarHBondContact O-N 3.25Å; S2340-Q2343 PolarHBondContact O-N 3.36Å; N2341-Q2343 PolarHBondContact O-N 2.86Å; Q2343-V2346 PolarHBondContact O-N 2.95Å; Q2343-I2347 VanDerWaalsContact O-CG1 3.3Å; Q2343-I2347 WeakPolarHBondContact O-CG1 3.44Å; Q2343-I2347 PolarHBondContact O-N 3.12Å
2344R59.5Low55.2Low54 Ų5456.7 Ų56.720%0.20426%0.264CS..Hα-helixtrans-61-46.9177.3-122.4-172.5-113.6-133.92.3112.1V2228 L2253 M2299 F2302 S2340 N2341 L2342 V2346 I2347 Q2348V2228-R2344 HydrophobicContact CG1-CG 3.96Å; L2253-R2344 HydrophobicContact CD2-CG 4.37Å; M2299-R2344 VanDerWaalsContact CE-CZ 3.44Å; M2299-R2344 PolarHBondContact SD-NH2 3.13Å; M2299-R2344 VanDerWaalsContact SD-NH2 3.43Å; F2302-R2344 HydrophobicContact CD1-CB 3.83Å; F2302-R2344 HydrophobicContact CD1-CG 3.86Å; F2302-R2344 HydrophobicContact CE1-CB 3.95Å; F2302-R2344 HydrophobicContact CE1-CG 3.87Å; S2340-R2344 WeakPolarHBondContact O-CG 3.2Å; S2340-R2344 PolarHBondContact O-N 3.08Å; S2340-R2344 VanDerWaalsContact O-N 3.12Å; S2340-R2344 PolarHBondContact OG-NH1 3.35Å; S2340-R2344 PolarHBondContact OG-NH2 3.45Å; N2341-R2344 WeakPolarHBondContact O-CB 3.25Å; N2341-R2344 PolarHBondContact O-N 3.32Å; N2341-R2344 PolarHBondContact OD1-NH2 3.07Å; L2342-R2344 VanDerWaalsContact C-N 3.32Å; L2342-R2344 PolarHBondContact O-N 3.15Å; R2344-V2346 VanDerWaalsContact C-N 3.34Å; R2344-V2346 PolarHBondContact O-N 2.93Å; R2344-I2347 PolarHBondContact O-N 3.36Å; R2344-Q2348 WeakPolarHBondContact O-CB 3.27Å; R2344-Q2348 PolarHBondContact O-N 3.35Å
2345E60.9Low56.4Low110 Ų11052.6 Ų52.651%0.51425%0.248SC..Hα-helixtrans-64.5-40.7178.6-71.3-123162.300111.9N2341 L2342 I2347 Q2348 S2349N2341-E2345 PolarHBondContact O-N 3.21Å; N2341-E2345 VanDerWaalsContact O-N 3.13Å; L2342-E2345 PolarHBondContact O-N 3.02Å; E2345-I2347 PolarHBondContact O-N 3.23Å; E2345-Q2348 PolarHBondContact O-N 3.19Å; E2345-S2349 WeakPolarHBondContact O-CB 3.48Å; E2345-S2349 PolarHBondContact O-N 2.84Å
2346V62.7Low57.8Low28.5 Ų28.547.6 Ų47.617%0.17323%0.226CC..Hα-helixtrans-62.2-44.2176172.90000110.9L2342 Q2343 R2344 S2349 K2350L2342-V2346 HydrophobicContact CD2-CG2 4.28Å; L2342-V2346 VanDerWaalsContact O-CG2 3.27Å; L2342-V2346 WeakPolarHBondContact O-CG2 3.28Å; L2342-V2346 PolarHBondContact O-N 3.39Å; L2342-V2346 VanDerWaalsContact O-N 3.13Å; Q2343-V2346 PolarHBondContact O-N 2.95Å; R2344-V2346 VanDerWaalsContact C-N 3.34Å; R2344-V2346 PolarHBondContact O-N 2.93Å; V2346-S2349 WeakPolarHBondContact O-CB 3.36Å; V2346-S2349 PolarHBondContact O-N 2.99Å; V2346-K2350 HydrophobicContact CG1-CD 4.47Å; V2346-K2350 WeakPolarHBondContact O-CG 3.36Å; V2346-K2350 PolarHBondContact O-N 3.02Å
2347I63.9Low59.2Low6.5 Ų6.547.5 Ų47.53%0.03322%0.22CC..Hα-helixtrans-65.1-47177.3-67.6166.8000110.5V2228 L2231 H2232 L2253 F2302 Q2343 R2344 E2345 S2349 K2350 I2351V2228-I2347 HydrophobicContact CB-CD1 4.28Å; V2228-I2347 HydrophobicContact CG1-CD1 3.46Å; V2228-I2347 VanDerWaalsContact CG1-CD1 3.46Å; V2228-I2347 WeakPolarHBondContact O-CD1 3.26Å; L2231-I2347 HydrophobicContact CB-CD1 4.38Å; L2231-I2347 HydrophobicContact CB-CG2 4.25Å; H2232-I2347 HydrophobicContact CB-CD1 3.87Å; H2232-I2347 HydrophobicContact CB-CG1 4.1Å; H2232-I2347 WeakPolarHBondContact ND1-CG1 3.46Å; L2253-I2347 HydrophobicContact CD1-CG2 4.26Å; F2302-I2347 HydrophobicContact CZ-CB 4.5Å; F2302-I2347 HydrophobicContact CZ-CG2 4.08Å; Q2343-I2347 VanDerWaalsContact O-CG1 3.3Å; Q2343-I2347 WeakPolarHBondContact O-CG1 3.44Å; Q2343-I2347 PolarHBondContact O-N 3.12Å; R2344-I2347 PolarHBondContact O-N 3.36Å; E2345-I2347 PolarHBondContact O-N 3.23Å; I2347-S2349 VanDerWaalsContact C-N 3.28Å; I2347-S2349 PolarHBondContact O-N 2.97Å; I2347-K2350 PolarHBondContact O-N 2.83Å; I2347-K2350 VanDerWaalsContact O-N 3.14Å; I2347-I2351 HydrophobicContact CG2-CD1 3.65Å; I2347-I2351 HydrophobicContact CG2-CG1 4.21Å; I2347-I2351 WeakPolarHBondContact O-CB 3.44Å; I2347-I2351 WeakPolarHBondContact O-CD1 3.46Å; I2347-I2351 VanDerWaalsContact O-CG1 3.31Å; I2347-I2351 WeakPolarHBondContact O-CG1 3.44Å; I2347-I2351 PolarHBondContact O-N 2.87Å
2348Q63.8Low60.4Low25.5 Ų25.545.3 Ų45.312%0.11921%0.211CC..Hα-helixtrans-56.2-42.2176.3-127174.524.400111.9L2253 M2299 F2302 R2344 E2345 I2351 L2352 Y2412L2253-Q2348 HydrophobicContact CB-CG 3.94Å; L2253-Q2348 HydrophobicContact CD1-CG 3.76Å; L2253-Q2348 HydrophobicContact CD2-CG 4.3Å; L2253-Q2348 HydrophobicContact CG-CG 4.22Å; L2253-Q2348 PolarHBondContact O-NE2 3.21Å; M2299-Q2348 HydrophobicContact CE-CG 4.45Å; M2299-Q2348 HydrophobicContact SD-CG 4.19Å; F2302-Q2348 HydrophobicContact CD2-CB 4.35Å; F2302-Q2348 HydrophobicContact CE2-CB 4.44Å; R2344-Q2348 WeakPolarHBondContact O-CB 3.27Å; R2344-Q2348 PolarHBondContact O-N 3.35Å; E2345-Q2348 PolarHBondContact O-N 3.19Å; Q2348-I2351 PolarHBondContact O-N 3.1Å; Q2348-L2352 HydrophobicContact CG-CD1 4.2Å; Q2348-L2352 WeakPolarHBondContact O-CB 3.5Å; Q2348-L2352 VanDerWaalsContact O-CG 3.26Å; Q2348-L2352 WeakPolarHBondContact O-CG 3.48Å; Q2348-L2352 PolarHBondContact O-N 3.2Å; Q2348-Y2412 HydrophobicContact CG-CD2 4.16Å; Q2348-Y2412 HydrophobicContact CG-CE2 4.03Å; Q2348-Y2412 VanDerWaalsContact NE2-CE2 3.33Å
2349S63.6Low61.4Low27 Ų2739.9 Ų39.919%0.18919%0.192CC..Hα-helixtrans-63-45.9174.9-175.50000112.4E2345 V2346 I2347 I2351 L2352 N2353 Y2440E2345-S2349 WeakPolarHBondContact O-CB 3.48Å; E2345-S2349 PolarHBondContact O-N 2.84Å; V2346-S2349 WeakPolarHBondContact O-CB 3.36Å; V2346-S2349 PolarHBondContact O-N 2.99Å; I2347-S2349 VanDerWaalsContact C-N 3.28Å; I2347-S2349 PolarHBondContact O-N 2.97Å; S2349-I2351 PolarHBondContact O-N 3.5Å; S2349-L2352 PolarHBondContact O-N 3.13Å; S2349-N2353 WeakPolarHBondContact O-CB 3.44Å; S2349-N2353 PolarHBondContact O-N 3.06Å; S2349-N2353 PolarHBondContact O-OD1 2.95Å; S2349-Y2440 WeakPolarHBondContact OG-CE1 3.32Å
2350K65.6Low62.4Low68.5 Ų68.535.1 Ų35.130%0.29818%0.175SC..Hα-helixtrans-62.1-40.1178.3-75-175.1179.1-173.70112.2S2235 M2239 V2346 I2347 L2352 N2353 H2354S2235-K2350 WeakPolarHBondContact OG-CD 3.28Å; S2235-K2350 PolarHBondContact OG-NZ 2.74Å; M2239-K2350 HydrophobicContact SD-CB 3.53Å; M2239-K2350 VanDerWaalsContact SD-CB 3.53Å; V2346-K2350 HydrophobicContact CG1-CD 4.47Å; V2346-K2350 WeakPolarHBondContact O-CG 3.36Å; V2346-K2350 PolarHBondContact O-N 3.02Å; I2347-K2350 PolarHBondContact O-N 2.83Å; I2347-K2350 VanDerWaalsContact O-N 3.14Å; K2350-L2352 VanDerWaalsContact C-N 3.34Å; K2350-L2352 PolarHBondContact O-N 3.48Å; K2350-N2353 PolarHBondContact O-N 2.64Å; K2350-H2354 WeakPolarHBondContact O-CB 3.1Å; K2350-H2354 PolarHBondContact O-N 3.31Å
2351I64.4Low62.7Low5 Ų537.2 Ų37.23%0.02619%0.185CC..Hα-helixtrans-62.7-50.2176.6-67.3170.9000110.3M2239 I2249 V2250 L2253 F2295 M2299 F2302 I2347 Q2348 S2349 N2353 H2354 T2355 I2408M2239-I2351 HydrophobicContact CE-CB 4.02Å; M2239-I2351 HydrophobicContact CE-CD1 3.73Å; M2239-I2351 HydrophobicContact CE-CG1 3.28Å; M2239-I2351 HydrophobicContact CE-CG2 3.73Å; M2239-I2351 HydrophobicContact CG-CG1 4.25Å; M2239-I2351 HydrophobicContact SD-CG1 4.32Å; I2249-I2351 HydrophobicContact CG2-CD1 3.56Å; V2250-I2351 HydrophobicContact CG2-CG2 3.29Å; L2253-I2351 HydrophobicContact CD1-CD1 3.56Å; F2295-I2351 HydrophobicContact CB-CD1 4.28Å; F2295-I2351 HydrophobicContact CB-CG1 4.48Å; F2295-I2351 HydrophobicContact CB-CG2 3.9Å; F2295-I2351 HydrophobicContact CD1-CD1 4.02Å; F2295-I2351 HydrophobicContact CD1-CG1 4.08Å; F2295-I2351 HydrophobicContact CD2-CB 4.48Å; F2295-I2351 HydrophobicContact CD2-CG1 4.1Å; F2295-I2351 HydrophobicContact CD2-CG2 3.89Å; F2295-I2351 HydrophobicContact CE1-CG1 4.36Å; F2295-I2351 HydrophobicContact CE2-CG1 4.34Å; F2295-I2351 HydrophobicContact CG-CD1 4.1Å; F2295-I2351 HydrophobicContact CG-CG1 3.97Å; F2295-I2351 HydrophobicContact CG-CG2 4.01Å; F2295-I2351 HydrophobicContact CZ-CG1 4.49Å; M2299-I2351 HydrophobicContact CE-CG2 3.94Å; F2302-I2351 HydrophobicContact CE2-CD1 4.14Å; I2347-I2351 HydrophobicContact CG2-CD1 3.65Å; I2347-I2351 HydrophobicContact CG2-CG1 4.21Å; I2347-I2351 WeakPolarHBondContact O-CB 3.44Å; I2347-I2351 WeakPolarHBondContact O-CD1 3.46Å; I2347-I2351 VanDerWaalsContact O-CG1 3.31Å; I2347-I2351 WeakPolarHBondContact O-CG1 3.44Å; I2347-I2351 PolarHBondContact O-N 2.87Å; Q2348-I2351 PolarHBondContact O-N 3.1Å; S2349-I2351 PolarHBondContact O-N 3.5Å; I2351-N2353 VanDerWaalsContact C-N 3.29Å; I2351-N2353 PolarHBondContact O-N 3.16Å; I2351-H2354 PolarHBondContact O-N 3.15Å; I2351-T2355 HydrophobicContact CG2-CG2 4.3Å; I2351-T2355 VanDerWaalsContact O-CG2 3.26Å; I2351-T2355 WeakPolarHBondContact O-CG2 3.32Å; I2351-T2355 PolarHBondContact O-N 3.17Å; I2351-T2355 PolarHBondContact O-OG1 3.1Å; I2351-I2408 HydrophobicContact CG2-CG2 3.74Å
2352L64.4Low62.9Low37 Ų3737 Ų3719%0.19418%0.184CC..Hα-helixtrans-59.6-44.9178-78.9164.6000111.2M2299 Q2348 S2349 K2350 H2354 T2355 F2356 L2409 Y2412 L2437 Y2440M2299-L2352 HydrophobicContact CE-CD2 3.8Å; M2299-L2352 HydrophobicContact CE-CG 3.95Å; Q2348-L2352 HydrophobicContact CG-CD1 4.2Å; Q2348-L2352 WeakPolarHBondContact O-CB 3.5Å; Q2348-L2352 VanDerWaalsContact O-CG 3.26Å; Q2348-L2352 WeakPolarHBondContact O-CG 3.48Å; Q2348-L2352 PolarHBondContact O-N 3.2Å; S2349-L2352 PolarHBondContact O-N 3.13Å; K2350-L2352 VanDerWaalsContact C-N 3.34Å; K2350-L2352 PolarHBondContact O-N 3.48Å; L2352-H2354 PolarHBondContact O-N 3.21Å; L2352-T2355 WeakPolarHBondContact CA-OG1 3.31Å; L2352-T2355 PolarHBondContact O-N 3.09Å; L2352-T2355 PolarHBondContact O-OG1 3.14Å; L2352-F2356 HydrophobicContact CB-CD2 4.31Å; L2352-F2356 HydrophobicContact CB-CE2 4.3Å; L2352-F2356 HydrophobicContact CD2-CD2 4.23Å; L2352-F2356 HydrophobicContact CD2-CE2 3.51Å; L2352-F2356 HydrophobicContact CD2-CZ 4.13Å; L2352-F2356 WeakPolarHBondContact O-CB 3.49Å; L2352-F2356 WeakPolarHBondContact O-CD2 3.22Å; L2352-F2356 PolarHBondContact O-N 2.92Å; L2352-L2409 HydrophobicContact CD2-CD2 3.87Å; L2352-Y2412 HydrophobicContact CD1-CD1 4.28Å; L2352-Y2412 HydrophobicContact CD1-CD2 3.92Å; L2352-Y2412 HydrophobicContact CD1-CE1 4.24Å; L2352-Y2412 HydrophobicContact CD1-CE2 3.9Å; L2352-Y2412 HydrophobicContact CD1-CG 4.11Å; L2352-Y2412 HydrophobicContact CD2-CG 4.28Å; L2352-L2437 HydrophobicContact CD2-CD2 4.16Å; L2352-Y2440 HydrophobicContact CB-CD1 4.12Å; L2352-Y2440 HydrophobicContact CB-CD2 4.41Å; L2352-Y2440 HydrophobicContact CB-CG 3.94Å; L2352-Y2440 HydrophobicContact CD1-CD1 4.14Å; L2352-Y2440 HydrophobicContact CD1-CD2 3.57Å; L2352-Y2440 HydrophobicContact CD1-CE1 4.1Å; L2352-Y2440 HydrophobicContact CD1-CE2 3.49Å; L2352-Y2440 VanDerWaalsContact CD1-CE2 3.49Å; L2352-Y2440 HydrophobicContact CD1-CG 3.88Å
2353N66.4Low62.9Low32.5 Ų32.534.5 Ų34.517%0.17417%0.171CC..Hα-helixtrans-57.6-49.4176-73.7-10.1000111.7S2349 K2350 I2351 T2355 F2356 E2357 Y2440S2349-N2353 WeakPolarHBondContact O-CB 3.44Å; S2349-N2353 PolarHBondContact O-N 3.06Å; S2349-N2353 PolarHBondContact O-OD1 2.95Å; K2350-N2353 PolarHBondContact O-N 2.64Å; I2351-N2353 VanDerWaalsContact C-N 3.29Å; I2351-N2353 PolarHBondContact O-N 3.16Å; N2353-T2355 VanDerWaalsContact C-N 3.34Å; N2353-T2355 PolarHBondContact O-N 3.17Å; N2353-F2356 PolarHBondContact O-N 3.18Å; N2353-E2357 VanDerWaalsContact O-CB 3.23Å; N2353-E2357 WeakPolarHBondContact O-CB 3.3Å; N2353-E2357 PolarHBondContact O-N 3.1Å; N2353-Y2440 PolarHBondContact OD1-O 2.78Å
2354H65.5Low62.5Low29 Ų2937.2 Ų37.213%0.13418%0.183CC..Hα-helixtrans-58.3-46.1177.4-140.83.7000112M2239 E2288 K2350 I2351 L2352 F2356 E2357 L2358M2239-H2354 HydrophobicContact CB-CB 4.26Å; M2239-H2354 HydrophobicContact CG-CB 4.49Å; E2288-H2354 IonicContact OE1-CD2 2.79Å; E2288-H2354 IonicContact OE1-CE1 3.7Å; E2288-H2354 IonicContact OE1-NE2 2.76Å; E2288-H2354 PolarHBondContact OE1-NE2 2.98Å; K2350-H2354 WeakPolarHBondContact O-CB 3.1Å; K2350-H2354 PolarHBondContact O-N 3.31Å; I2351-H2354 PolarHBondContact O-N 3.15Å; L2352-H2354 PolarHBondContact O-N 3.21Å; H2354-F2356 PolarHBondContact O-N 3.5Å; H2354-E2357 PolarHBondContact O-N 3.32Å; H2354-L2358 VanDerWaalsContact NE2-CD1 3.32Å; H2354-L2358 WeakPolarHBondContact NE2-CD1 3.39Å; H2354-L2358 PolarHBondContact O-N 3.14Å
2355T63.9Low61.8Low14.5 Ų14.536.9 Ų36.99%0.08919%0.188CC..Hα-helixtrans-64.2-40.5178.954.30000112.7I2351 L2352 N2353 L2359 L2405 I2408I2351-T2355 HydrophobicContact CG2-CG2 4.3Å; I2351-T2355 VanDerWaalsContact O-CG2 3.26Å; I2351-T2355 WeakPolarHBondContact O-CG2 3.32Å; I2351-T2355 PolarHBondContact O-N 3.17Å; I2351-T2355 PolarHBondContact O-OG1 3.1Å; L2352-T2355 WeakPolarHBondContact CA-OG1 3.31Å; L2352-T2355 PolarHBondContact O-N 3.09Å; L2352-T2355 PolarHBondContact O-OG1 3.14Å; N2353-T2355 VanDerWaalsContact C-N 3.34Å; N2353-T2355 PolarHBondContact O-N 3.17Å; T2355-L2359 WeakPolarHBondContact O-CB 3.39Å; T2355-L2359 PolarHBondContact O-N 3.19Å; T2355-L2405 HydrophobicContact CG2-CD2 3.8Å; T2355-I2408 HydrophobicContact CG2-CB 4.17Å; T2355-I2408 HydrophobicContact CG2-CD1 3.44Å; T2355-I2408 VanDerWaalsContact CG2-CD1 3.44Å; T2355-I2408 HydrophobicContact CG2-CG1 4.41Å; T2355-I2408 HydrophobicContact CG2-CG2 4.02Å
2356F64.3Low61.1Low24.5 Ų24.534.9 Ų34.911%0.10719%0.186CC..Hα-helixtrans-72.1-38.5178.3-78.2-58.5000112.4L2352 N2353 H2354 L2359 I2360 L2409 L2437 F2441 L2465L2352-F2356 HydrophobicContact CB-CD2 4.31Å; L2352-F2356 HydrophobicContact CB-CE2 4.3Å; L2352-F2356 HydrophobicContact CD2-CD2 4.23Å; L2352-F2356 HydrophobicContact CD2-CE2 3.51Å; L2352-F2356 HydrophobicContact CD2-CZ 4.13Å; L2352-F2356 WeakPolarHBondContact O-CB 3.49Å; L2352-F2356 WeakPolarHBondContact O-CD2 3.22Å; L2352-F2356 PolarHBondContact O-N 2.92Å; N2353-F2356 PolarHBondContact O-N 3.18Å; H2354-F2356 PolarHBondContact O-N 3.5Å; F2356-L2359 PolarHBondContact O-N 3.3Å; F2356-I2360 WeakPolarHBondContact O-CB 3.27Å; F2356-I2360 WeakPolarHBondContact O-CD1 3.47Å; F2356-I2360 WeakPolarHBondContact O-CG1 3.17Å; F2356-I2360 PolarHBondContact O-N 3.42Å; F2356-L2409 HydrophobicContact CE1-CD1 4.31Å; F2356-L2409 HydrophobicContact CE1-CD2 4.33Å; F2356-L2409 HydrophobicContact CE2-CD2 3.99Å; F2356-L2409 HydrophobicContact CZ-CD1 4.48Å; F2356-L2409 HydrophobicContact CZ-CD2 3.81Å; F2356-L2437 HydrophobicContact CE2-CB 4.33Å; F2356-L2437 HydrophobicContact CE2-CD2 4.25Å; F2356-L2437 HydrophobicContact CZ-CB 3.86Å; F2356-L2437 HydrophobicContact CZ-CD1 3.93Å; F2356-L2437 HydrophobicContact CZ-CD2 4.16Å; F2356-L2437 HydrophobicContact CZ-CG 4.2Å; F2356-F2441 HydrophobicContact CD1-CD2 4.18Å; F2356-L2465 HydrophobicContact CD1-CD1 4.38Å
2357E65Low60.1Low53.5 Ų53.536.4 Ų36.425%0.2519%0.193CC..Hα-helixtrans-65.2-43.2179.6-168.5167.6-164.900111.5N2241 I2243 N2353 H2354 I2360 N2361N2241-E2357 WeakPolarHBondContact CB-OE1 3.34Å; N2241-E2357 PolarHBondContact ND2-OE1 3.33Å; N2241-E2357 PolarHBondContact ND2-OE2 3.39Å; I2243-E2357 VanDerWaalsContact CD1-OE1 3.29Å; I2243-E2357 WeakPolarHBondContact CD1-OE1 3.38Å; I2243-E2357 HydrophobicContact CG1-CG 4.36Å; I2243-E2357 WeakPolarHBondContact CG1-OE1 3.39Å; N2353-E2357 VanDerWaalsContact O-CB 3.23Å; N2353-E2357 WeakPolarHBondContact O-CB 3.3Å; N2353-E2357 PolarHBondContact O-N 3.1Å; H2354-E2357 PolarHBondContact O-N 3.32Å; E2357-I2360 PolarHBondContact O-N 3.49Å; E2357-N2361 PolarHBondContact O-N 3.11Å; E2357-N2361 VanDerWaalsContact O-N 3.07Å; E2357-N2361 PolarHBondContact O-ND2 3.1Å
2358L63.3Low59Low29.5 Ų29.538.7 Ų38.715%0.15421%0.205CC..Hα-helixtrans-60-46.3170.9-93168000111.7L2096 E2242 A2246 W2284 E2288 I2292 H2354 I2360 N2361 L2362 L2405L2096-L2358 HydrophobicContact CD1-CD1 4.21Å; L2096-L2358 HydrophobicContact CD2-CG 4.38Å; E2242-L2358 HydrophobicContact CB-CD2 4.1Å; A2246-L2358 HydrophobicContact CB-CD2 4.22Å; W2284-L2358 HydrophobicContact CH2-CD2 4.27Å; W2284-L2358 HydrophobicContact CZ2-CD2 4.33Å; E2288-L2358 HydrophobicContact CG-CD1 4.02Å; E2288-L2358 VanDerWaalsContact OE1-CD1 3.25Å; E2288-L2358 WeakPolarHBondContact OE1-CD1 3.45Å; I2292-L2358 HydrophobicContact CD1-CD1 4.06Å; H2354-L2358 VanDerWaalsContact NE2-CD1 3.32Å; H2354-L2358 WeakPolarHBondContact NE2-CD1 3.39Å; H2354-L2358 PolarHBondContact O-N 3.14Å; L2358-I2360 PolarHBondContact O-N 3.08Å; L2358-N2361 PolarHBondContact O-N 3.38Å; L2358-L2362 HydrophobicContact CB-CD1 4.43Å; L2358-L2362 HydrophobicContact CD2-CD1 4.26Å; L2358-L2362 WeakPolarHBondContact O-CB 3.26Å; L2358-L2362 WeakPolarHBondContact O-CG 3.27Å; L2358-L2362 PolarHBondContact O-N 3.01Å; L2358-L2405 HydrophobicContact CB-CD1 4.12Å; L2358-L2405 HydrophobicContact CB-CD2 4.48Å; L2358-L2405 HydrophobicContact CD1-CD2 4.34Å
2359L62.2Low57.8Low20.5 Ų20.544.5 Ų44.511%0.10723%0.232CC..Hα-helixtrans-66.6-36.4-176.2-162139.6000112.3T2355 F2356 I2363 L2405 L2406 L2465 L2469T2355-L2359 WeakPolarHBondContact O-CB 3.39Å; T2355-L2359 PolarHBondContact O-N 3.19Å; F2356-L2359 PolarHBondContact O-N 3.3Å; L2359-I2363 HydrophobicContact CD1-CD1 4.38Å; L2359-I2363 HydrophobicContact CD2-CD1 3.62Å; L2359-I2363 HydrophobicContact CD2-CG1 4.38Å; L2359-I2363 HydrophobicContact CG-CD1 3.9Å; L2359-I2363 WeakPolarHBondContact O-CB 3.2Å; L2359-I2363 VanDerWaalsContact O-CG1 3.26Å; L2359-I2363 WeakPolarHBondContact O-CG1 3.36Å; L2359-I2363 PolarHBondContact O-N 3.19Å; L2359-I2363 VanDerWaalsContact O-N 3.13Å; L2359-L2405 HydrophobicContact CB-CD1 4.37Å; L2359-L2405 HydrophobicContact CD1-CB 4.15Å; L2359-L2406 HydrophobicContact CD1-CD2 4.01Å; L2359-L2406 HydrophobicContact CD1-CG 4.27Å; L2359-L2465 HydrophobicContact CD2-CD1 3.75Å; L2359-L2465 HydrophobicContact CD2-CD2 3.32Å; L2359-L2465 HydrophobicContact CD2-CG 3.75Å; L2359-L2469 HydrophobicContact CD1-CD1 3.78Å; L2359-L2469 HydrophobicContact CD2-CD1 3.96Å; L2359-L2469 HydrophobicContact CG-CD1 4.17Å
2360I63.9Low56.5Low25.5 Ų25.547.2 Ų47.213%0.13125%0.251CS..Hα-helixtrans-63.7-47.7172.7-70.7161000110.5F2356 E2357 L2358 L2362 I2363 H2364 F2441 I2445 L2465F2356-I2360 WeakPolarHBondContact O-CB 3.27Å; F2356-I2360 WeakPolarHBondContact O-CD1 3.47Å; F2356-I2360 WeakPolarHBondContact O-CG1 3.17Å; F2356-I2360 PolarHBondContact O-N 3.42Å; E2357-I2360 PolarHBondContact O-N 3.49Å; L2358-I2360 PolarHBondContact O-N 3.08Å; I2360-L2362 VanDerWaalsContact C-N 3.28Å; I2360-L2362 PolarHBondContact O-N 3.34Å; I2360-I2363 PolarHBondContact O-N 3.14Å; I2360-H2364 VanDerWaalsContact O-CB 3.29Å; I2360-H2364 WeakPolarHBondContact O-CB 3.13Å; I2360-H2364 PolarHBondContact O-N 3.33Å; I2360-F2441 HydrophobicContact CD1-CD2 4.34Å; I2360-F2441 HydrophobicContact CD1-CE2 3.55Å; I2360-F2441 HydrophobicContact CD1-CZ 3.9Å; I2360-F2441 HydrophobicContact CG1-CE2 4.03Å; I2360-F2441 HydrophobicContact CG1-CZ 4.48Å; I2360-I2445 HydrophobicContact CG2-CD1 4.22Å; I2360-L2465 HydrophobicContact CD1-CD1 4.39Å; I2360-L2465 HydrophobicContact CG1-CD1 3.52Å
2361N61.5Low55Low53 Ų5349.1 Ų49.128%0.28326%0.259SS..Hα-helixtrans-67.6-32.9-177.6-71.2-29.6000112.6A2246 V2250 E2357 L2358 N2367A2246-N2361 HydrophobicContact CB-CB 3.73Å; V2250-N2361 WeakPolarHBondContact CG2-O 3.28Å; E2357-N2361 PolarHBondContact O-N 3.11Å; E2357-N2361 VanDerWaalsContact O-N 3.07Å; E2357-N2361 PolarHBondContact O-ND2 3.1Å; L2358-N2361 PolarHBondContact O-N 3.38Å; N2361-N2367 PolarHBondContact O-ND2 3.37Å
2362L60.4Low53.6Low38 Ų3852.8 Ų52.820%0.19928%0.282CS..Hα-helixtrans-75-29.8176.7-69.7169.5000112.8A2246 V2250 L2358 I2360 Y2398 L2401 I2402 L2405A2246-L2362 HydrophobicContact CB-CD2 4.14Å; A2246-L2362 HydrophobicContact CB-CG 4.39Å; V2250-L2362 WeakPolarHBondContact CG2-O 3.29Å; L2358-L2362 HydrophobicContact CB-CD1 4.43Å; L2358-L2362 HydrophobicContact CD2-CD1 4.26Å; L2358-L2362 WeakPolarHBondContact O-CB 3.26Å; L2358-L2362 WeakPolarHBondContact O-CG 3.27Å; L2358-L2362 PolarHBondContact O-N 3.01Å; I2360-L2362 VanDerWaalsContact C-N 3.28Å; I2360-L2362 PolarHBondContact O-N 3.34Å; L2362-Y2398 HydrophobicContact CB-CE2 3.92Å; L2362-Y2398 HydrophobicContact CD2-CD2 3.89Å; L2362-Y2398 HydrophobicContact CD2-CE2 3.62Å; L2362-Y2398 HydrophobicContact CG-CE2 4.26Å; L2362-Y2398 PolarHBondContact O-OH 2.72Å; L2362-L2401 HydrophobicContact CD1-CD2 3.76Å; L2362-L2401 HydrophobicContact CD1-CG 4.27Å; L2362-L2401 HydrophobicContact CD2-CD2 4.42Å; L2362-I2402 HydrophobicContact CB-CD1 4.48Å; L2362-I2402 HydrophobicContact CD1-CG1 4.27Å; L2362-L2405 HydrophobicContact CD1-CD1 3.81Å
2363I56.8Low52.5Low21.5 Ų21.556.6 Ų56.611%0.1130%0.303CS..THydrogen-bonded Turntrans-101.45-174.3-58.5178000112.1L2359 I2360 P2365 L2469L2359-I2363 HydrophobicContact CD1-CD1 4.38Å; L2359-I2363 HydrophobicContact CD2-CD1 3.62Å; L2359-I2363 HydrophobicContact CD2-CG1 4.38Å; L2359-I2363 HydrophobicContact CG-CD1 3.9Å; L2359-I2363 WeakPolarHBondContact O-CB 3.2Å; L2359-I2363 VanDerWaalsContact O-CG1 3.26Å; L2359-I2363 WeakPolarHBondContact O-CG1 3.36Å; L2359-I2363 PolarHBondContact O-N 3.19Å; L2359-I2363 VanDerWaalsContact O-N 3.13Å; I2360-I2363 PolarHBondContact O-N 3.14Å; I2363-P2365 WeakPolarHBondContact O-CD 3.48Å; I2363-P2365 VanDerWaalsContact O-N 3.12Å; I2363-L2469 HydrophobicContact CD1-CB 3.77Å; I2363-L2469 HydrophobicContact CD1-CD1 3.41Å; I2363-L2469 VanDerWaalsContact CD1-CD1 3.41Å; I2363-L2469 HydrophobicContact CD1-CG 3.62Å
2364H51.2Low51.2Low77 Ų7762 Ų6236%0.35633%0.332SS..  trans-56.1128-174.1-163.8-89000111.7V2250 I2360 S2366 N2367V2250-H2364 HydrophobicContact CG1-CB 4.46Å; I2360-H2364 VanDerWaalsContact O-CB 3.29Å; I2360-H2364 WeakPolarHBondContact O-CB 3.13Å; I2360-H2364 PolarHBondContact O-N 3.33Å; H2364-S2366 PolarHBondContact CE1-OG 3.42Å; H2364-S2366 WeakPolarHBondContact ND1-CB 3.49Å; H2364-S2366 PolarHBondContact ND1-N 3.27Å; H2364-S2366 PolarHBondContact ND1-OG 3.46Å; H2364-S2366 PolarHBondContact O-N 3.28Å; H2364-N2367 WeakPolarHBondContact O-CB 3.44Å; H2364-N2367 PolarHBondContact O-N 2.94Å
2365P44.4Very low49.8Very low48.5 Ų48.564.8 Ų64.832%0.31535%0.348SS..G310 helixtrans-62.3-15.3-171.216.9-27.4000114.7I2363 N2367 I2368I2363-P2365 WeakPolarHBondContact O-CD 3.48Å; I2363-P2365 VanDerWaalsContact O-N 3.12Å; P2365-N2367 PolarHBondContact O-N 3.21Å; P2365-I2368 HydrophobicContact CB-CD1 4.43Å; P2365-I2368 CarbonylContact O-C 3.5Å; P2365-I2368 WeakPolarHBondContact O-CA 3.46Å; P2365-I2368 WeakPolarHBondContact O-CB 3.42Å; P2365-I2368 PolarHBondContact O-N 3.14Å; P2365-I2368 VanDerWaalsContact O-N 3.13Å; P2365-I2368 VanDerWaalsContact O-O 3.13Å
2366S45.1Very low48.6Very low66.5 Ų66.568 Ų6847%0.46536%0.364SS..G310 helixtrans-62.5-24.8169.758.70000113.3H2364 I2368 H2369H2364-S2366 PolarHBondContact CE1-OG 3.42Å; H2364-S2366 WeakPolarHBondContact ND1-CB 3.49Å; H2364-S2366 PolarHBondContact ND1-N 3.27Å; H2364-S2366 PolarHBondContact ND1-OG 3.46Å; H2364-S2366 PolarHBondContact O-N 3.28Å; S2366-I2368 VanDerWaalsContact C-N 3.27Å; S2366-I2368 PolarHBondContact O-N 3.45Å; S2366-H2369 PolarHBondContact O-N 2.99Å
2367N43.5Very low47.4Very low60.5 Ų60.570.6 Ų70.632%0.32439%0.385SS..G310 helixtrans-77-13173.2-73.9-8.7000112.4N2361 H2364 P2365 H2369N2361-N2367 PolarHBondContact O-ND2 3.37Å; H2364-N2367 WeakPolarHBondContact O-CB 3.44Å; H2364-N2367 PolarHBondContact O-N 2.94Å; P2365-N2367 PolarHBondContact O-N 3.21Å; N2367-H2369 VanDerWaalsContact C-N 3.27Å; N2367-H2369 PolarHBondContact O-N 3.12Å
2368I40.7Very low46.1Very low55.5 Ų55.570.5 Ų70.529%0.28539%0.39SS..G310 helixtrans-9856.5176.7-45.9172.6000108P2365 S2366 S2370 K2475P2365-I2368 HydrophobicContact CB-CD1 4.43Å; P2365-I2368 CarbonylContact O-C 3.5Å; P2365-I2368 WeakPolarHBondContact O-CA 3.46Å; P2365-I2368 WeakPolarHBondContact O-CB 3.42Å; P2365-I2368 PolarHBondContact O-N 3.14Å; P2365-I2368 VanDerWaalsContact O-N 3.13Å; P2365-I2368 VanDerWaalsContact O-O 3.13Å; S2366-I2368 VanDerWaalsContact C-N 3.27Å; S2366-I2368 PolarHBondContact O-N 3.45Å; I2368-S2370 PolarHBondContact O-N 3.08Å; I2368-K2475 HydrophobicContact CG2-CD 4.33Å; I2368-K2475 VanDerWaalsContact CG2-NZ 3.32Å
2369H37.1Very low44.9Very low147 Ų14772.1 Ų72.168%0.68140%0.398SS*.  trans-53.7125.7170.6-106.7-69.8000108.8S2366 N2367 F2371S2366-H2369 PolarHBondContact O-N 2.99Å; N2367-H2369 VanDerWaalsContact C-N 3.27Å; N2367-H2369 PolarHBondContact O-N 3.12Å; H2369-F2371 PolarHBondContact O-N 3.36Å; H2369-F2371 VanDerWaalsContact O-N 3.16Å
2370S37Very low43.8Very low83.5 Ų83.575.9 Ų75.958%0.58441%0.412SS*.  trans-54.4111177.650.90000108.6I2368 T2372I2368-S2370 PolarHBondContact O-N 3.08Å; S2370-T2372 PolarHBondContact O-N 3.18Å
2371F32.9Very low42.6Very low108 Ų10882.3 Ų82.347%0.47444%0.439SS..  trans-56.195.7170.6-70.6-84.2000108.5H2369 F2382 K2475H2369-F2371 PolarHBondContact O-N 3.36Å; H2369-F2371 VanDerWaalsContact O-N 3.16Å; F2371-F2382 HydrophobicContact CE1-CD2 4.31Å; F2371-F2382 HydrophobicContact CE2-CD2 4.44Å; F2371-F2382 HydrophobicContact CE2-CE2 4.09Å; F2371-F2382 AromaticContact CZ-CD2 3.61Å; F2371-F2382 HydrophobicContact CZ-CD2 3.61Å; F2371-F2382 AromaticContact CZ-CE2 3.53Å; F2371-F2382 HydrophobicContact CZ-CE2 3.53Å; F2371-F2382 HydrophobicContact CZ-CG 4.33Å; F2371-F2382 HydrophobicContact CZ-CZ 4.18Å; F2371-K2475 HydrophobicContact CD2-CB 4.46Å; F2371-K2475 HydrophobicContact CE2-CB 4.47Å
2372T36.2Very low41.6Very low84 Ų8482.7 Ų82.752%0.51544%0.438SS..  trans-90.9125.316362.20000106S2370 N2374 D2375S2370-T2372 PolarHBondContact O-N 3.18Å; T2372-N2374 PolarHBondContact O-N 3.24Å; T2372-D2375 PolarHBondContact O-N 3.39Å; T2372-D2375 PolarHBondContact OG1-OD2 3.36Å
2373D40.6Very low40.6Very low115.5 Ų115.587 Ų8762%0.61846%0.457SS*.THydrogen-bonded Turntrans-58-3.6-163.5-76.5-42.6000116.1K2482D2373-K2482 IonicContact OD1-NZ 3.63Å; D2373-K2482 PolarHBondContact OD1-NZ 3.37Å
2374N38.8Very low40Very low146 Ų14689 Ų8978%0.78147%0.468SS*.THydrogen-bonded Turntrans-101.8-11.4-176.7-74.3-15.2000116.1T2372 L2376 S2377T2372-N2374 PolarHBondContact O-N 3.24Å; N2374-L2376 VanDerWaalsContact C-N 3.3Å; N2374-L2376 PolarHBondContact O-N 3.38Å; N2374-S2377 PolarHBondContact O-OG 3.49Å
2375D37.5Very low39.7Very low88.5 Ų88.588.4 Ų88.447%0.47347%0.468SS..G310 helixtrans-9344.9-178.8-72.3-29.7000112.4T2372 S2377 S2378 I2379T2372-D2375 PolarHBondContact O-N 3.39Å; T2372-D2375 PolarHBondContact OG1-OD2 3.36Å; D2375-S2377 PolarHBondContact O-N 3.09Å; D2375-S2377 VanDerWaalsContact O-N 3.1Å; D2375-S2378 WeakPolarHBondContact O-CB 3.33Å; D2375-S2378 PolarHBondContact O-N 3.26Å; D2375-S2378 VanDerWaalsContact O-N 3.13Å; D2375-S2378 PolarHBondContact O-OG 3.11Å; D2375-I2379 HydrophobicContact CB-CD1 4.3Å; D2375-I2379 WeakPolarHBondContact O-CD1 2.98Å; D2375-I2379 VanDerWaalsContact O-CG1 3.27Å; D2375-I2379 WeakPolarHBondContact O-CG1 3.29Å
2376L38.1Very low39.6Very low81 Ų8190.2 Ų90.242%0.42447%0.469SS..Hα-helixtrans-56.3-23.9176.8-82.2159.1000113.3N2374 S2378 I2379 K2482N2374-L2376 VanDerWaalsContact C-N 3.3Å; N2374-L2376 PolarHBondContact O-N 3.38Å; L2376-S2378 VanDerWaalsContact C-N 3.3Å; L2376-S2378 PolarHBondContact O-N 3.02Å; L2376-I2379 HydrophobicContact CD2-CD1 4.35Å; L2376-I2379 PolarHBondContact O-N 3.47Å; L2376-K2482 HydrophobicContact CD1-CD 3.78Å
2377S38.2Very low39.8Very low80 Ų8090.4 Ų90.456%0.55946%0.461SS*.G310 helixtrans-70-22.4176.965.50000113.9N2374 D2375 K2381N2374-S2377 PolarHBondContact O-OG 3.49Å; D2375-S2377 PolarHBondContact O-N 3.09Å; D2375-S2377 VanDerWaalsContact O-N 3.1Å; S2377-K2381 PolarHBondContact O-N 3.44Å
2378S37.7Very low40Very low51.5 Ų51.588.7 Ų88.736%0.3646%0.455SS..THydrogen-bonded Turntrans-88.1-24.5-17962.80000113.6D2375 L2376 Y2380 K2381 F2382D2375-S2378 WeakPolarHBondContact O-CB 3.33Å; D2375-S2378 PolarHBondContact O-N 3.26Å; D2375-S2378 VanDerWaalsContact O-N 3.13Å; D2375-S2378 PolarHBondContact O-OG 3.11Å; L2376-S2378 VanDerWaalsContact C-N 3.3Å; L2376-S2378 PolarHBondContact O-N 3.02Å; S2378-Y2380 PolarHBondContact O-N 3.21Å; S2378-K2381 PolarHBondContact O-N 3.11Å; S2378-F2382 PolarHBondContact O-N 3.48Å
2379I38.2Very low40.4Very low63 Ų6388.8 Ų88.832%0.32345%0.454SS..THydrogen-bonded Turntrans-71.2-32.5-172-66.3168000112.5D2375 L2376 F2382 Q2383D2375-I2379 HydrophobicContact CB-CD1 4.3Å; D2375-I2379 WeakPolarHBondContact O-CD1 2.98Å; D2375-I2379 VanDerWaalsContact O-CG1 3.27Å; D2375-I2379 WeakPolarHBondContact O-CG1 3.29Å; L2376-I2379 HydrophobicContact CD2-CD1 4.35Å; L2376-I2379 PolarHBondContact O-N 3.47Å; I2379-F2382 PolarHBondContact O-N 3.14Å; I2379-Q2383 PolarHBondContact O-N 3.4Å
2380Y40.3Very low40.9Very low100 Ų10083.7 Ų83.739%0.39243%0.43SS..THydrogen-bonded Turntrans-956.7-179.5-71.4-72.5000112.9S2378 F2382 Q2383 N2384 Y2391 N2530S2378-Y2380 PolarHBondContact O-N 3.21Å; Y2380-F2382 VanDerWaalsContact C-N 3.31Å; Y2380-F2382 HydrophobicContact CD1-CD2 4.5Å; Y2380-F2382 AromaticContact CD1-CE2 3.61Å; Y2380-F2382 HydrophobicContact CD1-CE2 3.61Å; Y2380-F2382 HydrophobicContact CD1-CZ 4.15Å; Y2380-F2382 HydrophobicContact CE1-CE2 4.46Å; Y2380-F2382 HydrophobicContact CG-CE2 4.37Å; Y2380-F2382 PolarHBondContact O-N 3.39Å; Y2380-Q2383 PolarHBondContact O-N 3.03Å; Y2380-N2384 PolarHBondContact O-N 3.38Å; Y2380-N2384 VanDerWaalsContact O-N 3.17Å; Y2380-Y2391 HydrophobicContact CE1-CE1 4.44Å; Y2380-N2530 WeakPolarHBondContact O-CA 3.43Å; Y2380-N2530 WeakPolarHBondContact O-CB 2.95Å; Y2380-N2530 PolarHBondContact O-OD1 2.98Å
2381K39Very low41.7Very low159.5 Ų159.584 Ų8469%0.69342%0.419SS*.  trans-75.918.2169.7-77.9-175178.1177.20111.7S2377 S2378 Q2383 N2384 N2385S2377-K2381 PolarHBondContact O-N 3.44Å; S2378-K2381 PolarHBondContact O-N 3.11Å; K2381-Q2383 PolarHBondContact O-N 3.15Å; K2381-Q2383 VanDerWaalsContact O-N 3.13Å; K2381-N2384 PolarHBondContact O-N 3.26Å; K2381-N2385 PolarHBondContact O-N 3.4Å
2382F39.5Very low42.6Very low61 Ų6180 Ų8027%0.26841%0.405SS..  trans-70.434.5172.1-112.3-81.6000110.4W2258 F2371 S2378 I2379 Y2380 N2384 N2385 Y2386 F2387 A2388 Y2391W2258-F2382 AromaticContact CD1-CE1 3.95Å; W2258-F2382 AromaticContact NE1-CE1 3.89Å; F2371-F2382 HydrophobicContact CE1-CD2 4.31Å; F2371-F2382 HydrophobicContact CE2-CD2 4.44Å; F2371-F2382 HydrophobicContact CE2-CE2 4.09Å; F2371-F2382 AromaticContact CZ-CD2 3.61Å; F2371-F2382 HydrophobicContact CZ-CD2 3.61Å; F2371-F2382 AromaticContact CZ-CE2 3.53Å; F2371-F2382 HydrophobicContact CZ-CE2 3.53Å; F2371-F2382 HydrophobicContact CZ-CG 4.33Å; F2371-F2382 HydrophobicContact CZ-CZ 4.18Å; S2378-F2382 PolarHBondContact O-N 3.48Å; I2379-F2382 PolarHBondContact O-N 3.14Å; Y2380-F2382 VanDerWaalsContact C-N 3.31Å; Y2380-F2382 HydrophobicContact CD1-CD2 4.5Å; Y2380-F2382 AromaticContact CD1-CE2 3.61Å; Y2380-F2382 HydrophobicContact CD1-CE2 3.61Å; Y2380-F2382 HydrophobicContact CD1-CZ 4.15Å; Y2380-F2382 HydrophobicContact CE1-CE2 4.46Å; Y2380-F2382 HydrophobicContact CG-CE2 4.37Å; Y2380-F2382 PolarHBondContact O-N 3.39Å; F2382-N2384 VanDerWaalsContact C-N 3.34Å; F2382-N2384 PolarHBondContact O-N 3.39Å; F2382-N2385 PolarHBondContact O-N 2.98Å; F2382-Y2386 WeakPolarHBondContact O-CB 3.26Å; F2382-Y2386 PolarHBondContact O-N 3.13Å; F2382-F2387 HydrophobicContact CD1-CB 4.36Å; F2382-A2388 HydrophobicContact CB-CB 3.94Å; F2382-A2388 HydrophobicContact CD1-CB 4.12Å; F2382-A2388 HydrophobicContact CD2-CB 3.57Å; F2382-A2388 HydrophobicContact CE2-CB 4.04Å; F2382-A2388 HydrophobicContact CG-CB 3.61Å; F2382-Y2391 HydrophobicContact CE1-CG 4.46Å; F2382-Y2391 HydrophobicContact CZ-CD1 4.21Å; F2382-Y2391 HydrophobicContact CZ-CD2 4.36Å; F2382-Y2391 AromaticContact CZ-CG 3.97Å; F2382-Y2391 HydrophobicContact CZ-CG 3.97Å
2383Q40.3Very low43.4Very low130 Ų13077.2 Ų77.261%0.60739%0.386SS*.SBendtrans-65.3-32.5171.9-78.6180-2200111.8N2262 I2379 Y2380 K2381 N2385 Y2386 F2387N2262-Q2383 PolarHBondContact ND2-OE1 2.92Å; I2379-Q2383 PolarHBondContact O-N 3.4Å; Y2380-Q2383 PolarHBondContact O-N 3.03Å; K2381-Q2383 PolarHBondContact O-N 3.15Å; K2381-Q2383 VanDerWaalsContact O-N 3.13Å; Q2383-N2385 PolarHBondContact O-N 2.92Å; Q2383-Y2386 PolarHBondContact O-N 3.46Å; Q2383-F2387 HydrophobicContact CB-CE2 4.49Å; Q2383-F2387 WeakPolarHBondContact O-CD2 3.35Å; Q2383-F2387 PolarHBondContact O-N 3.25Å
2384N42.7Very low44Very low61.5 Ų61.574 Ų7433%0.32937%0.368SS..SBendtrans-97.438.9179.7-126.5-3.5000111.2Y2380 K2381 F2382 Y2386 F2387 A2388Y2380-N2384 PolarHBondContact O-N 3.38Å; Y2380-N2384 VanDerWaalsContact O-N 3.17Å; K2381-N2384 PolarHBondContact O-N 3.26Å; F2382-N2384 VanDerWaalsContact C-N 3.34Å; F2382-N2384 PolarHBondContact O-N 3.39Å; N2384-Y2386 VanDerWaalsContact C-N 3.34Å; N2384-Y2386 PolarHBondContact O-N 2.93Å; N2384-Y2386 WeakPolarHBondContact OD1-CB 3.21Å; N2384-Y2386 PolarHBondContact OD1-N 2.92Å; N2384-F2387 HydrophobicContact CB-CD2 3.96Å; N2384-F2387 HydrophobicContact CB-CE2 4.49Å; N2384-F2387 PolarHBondContact O-N 2.86Å; N2384-A2388 VanDerWaalsContact O-CB 3.27Å; N2384-A2388 WeakPolarHBondContact O-CB 3.48Å; N2384-A2388 PolarHBondContact O-N 2.86Å
2385N45Very low44.9Very low66 Ų6670 Ų7035%0.35335%0.345SS..Hα-helixtrans-66.2-28.1179-69-20.6000112.7Y2169 K2381 F2382 Q2383 A2388 F2389Y2169-N2385 HydrophobicContact CE1-CB 3.66Å; Y2169-N2385 VanDerWaalsContact OH-CB 3.27Å; Y2169-N2385 WeakPolarHBondContact OH-CB 3.45Å; Y2169-N2385 PolarHBondContact OH-ND2 3.47Å; K2381-N2385 PolarHBondContact O-N 3.4Å; F2382-N2385 PolarHBondContact O-N 2.98Å; Q2383-N2385 PolarHBondContact O-N 2.92Å; N2385-A2388 PolarHBondContact O-N 2.74Å; N2385-F2389 WeakPolarHBondContact O-CB 3.32Å; N2385-F2389 PolarHBondContact O-N 3.01Å
2386Y43.4Very low45.9Very low86 Ų8666.6 Ų66.634%0.33733%0.327SS..Hα-helixtrans-62-48.2174.3-177.7-90.5000111.1I2168 F2172 F2382 Q2383 N2384 A2388 F2389 E2390I2168-Y2386 HydrophobicContact CG2-CD2 3.43Å; I2168-Y2386 VanDerWaalsContact CG2-CD2 3.43Å; I2168-Y2386 HydrophobicContact CG2-CE2 4.18Å; I2168-Y2386 HydrophobicContact CG2-CG 3.8Å; F2172-Y2386 HydrophobicContact CB-CD2 3.69Å; F2172-Y2386 HydrophobicContact CB-CE2 3.41Å; F2172-Y2386 VanDerWaalsContact CB-CE2 3.41Å; F2172-Y2386 AromaticContact CD2-CD2 3.96Å; F2172-Y2386 HydrophobicContact CD2-CD2 3.96Å; F2172-Y2386 AromaticContact CD2-CE2 3.34Å; F2172-Y2386 HydrophobicContact CD2-CE2 3.34Å; F2172-Y2386 AromaticContact CD2-CZ 3.61Å; F2172-Y2386 HydrophobicContact CE2-CE2 4.36Å; F2172-Y2386 AromaticContact CG-CD2 3.81Å; F2172-Y2386 HydrophobicContact CG-CD2 3.81Å; F2172-Y2386 AromaticContact CG-CE2 3.56Å; F2172-Y2386 HydrophobicContact CG-CE2 3.56Å; F2382-Y2386 WeakPolarHBondContact O-CB 3.26Å; F2382-Y2386 PolarHBondContact O-N 3.13Å; Q2383-Y2386 PolarHBondContact O-N 3.46Å; N2384-Y2386 VanDerWaalsContact C-N 3.34Å; N2384-Y2386 PolarHBondContact O-N 2.93Å; N2384-Y2386 WeakPolarHBondContact OD1-CB 3.21Å; N2384-Y2386 PolarHBondContact OD1-N 2.92Å; Y2386-A2388 VanDerWaalsContact C-N 3.29Å; Y2386-A2388 PolarHBondContact O-N 3.07Å; Y2386-F2389 CarbonylContact O-C 3.58Å; Y2386-F2389 PolarHBondContact O-N 3.34Å; Y2386-E2390 HydrophobicContact CD1-CG 3.91Å; Y2386-E2390 HydrophobicContact CE1-CG 3.59Å; Y2386-E2390 WeakPolarHBondContact CE1-OE1 3.3Å; Y2386-E2390 WeakPolarHBondContact O-CB 3.49Å; Y2386-E2390 WeakPolarHBondContact O-CG 3.14Å; Y2386-E2390 PolarHBondContact O-N 3.22Å; Y2386-E2390 PolarHBondContact OH-OE1 3.14Å
2387F49.1Very low46.9Very low70.5 Ų70.566.3 Ų66.331%0.30932%0.323SS..Hα-helixtrans-64.7-36.4176.7-73.5-61.6000112.4I2261 F2382 Q2383 N2384 F2389 E2390 Y2391I2261-F2387 HydrophobicContact CB-CZ 4.33Å; I2261-F2387 HydrophobicContact CG2-CE1 3.95Å; I2261-F2387 HydrophobicContact CG2-CE2 4.02Å; I2261-F2387 HydrophobicContact CG2-CZ 3.36Å; F2382-F2387 HydrophobicContact CD1-CB 4.36Å; Q2383-F2387 HydrophobicContact CB-CE2 4.49Å; Q2383-F2387 WeakPolarHBondContact O-CD2 3.35Å; Q2383-F2387 PolarHBondContact O-N 3.25Å; N2384-F2387 HydrophobicContact CB-CD2 3.96Å; N2384-F2387 HydrophobicContact CB-CE2 4.49Å; N2384-F2387 PolarHBondContact O-N 2.86Å; F2387-F2389 VanDerWaalsContact C-N 3.32Å; F2387-F2389 PolarHBondContact O-N 3.39Å; F2387-E2390 PolarHBondContact O-N 3.2Å; F2387-Y2391 WeakPolarHBondContact O-CB 3.49Å; F2387-Y2391 PolarHBondContact O-N 3.36Å
2388A48.6Very low47.9Very low24 Ų2464 Ų6420%0.19830%0.303CS..Hα-helixtrans-62.6-40.5174.600000111.4F2382 N2384 N2385 Y2386 S2392 L2529F2382-A2388 HydrophobicContact CB-CB 3.94Å; F2382-A2388 HydrophobicContact CD1-CB 4.12Å; F2382-A2388 HydrophobicContact CD2-CB 3.57Å; F2382-A2388 HydrophobicContact CE2-CB 4.04Å; F2382-A2388 HydrophobicContact CG-CB 3.61Å; N2384-A2388 VanDerWaalsContact O-CB 3.27Å; N2384-A2388 WeakPolarHBondContact O-CB 3.48Å; N2384-A2388 PolarHBondContact O-N 2.86Å; N2385-A2388 PolarHBondContact O-N 2.74Å; Y2386-A2388 VanDerWaalsContact C-N 3.29Å; Y2386-A2388 PolarHBondContact O-N 3.07Å; A2388-S2392 WeakPolarHBondContact O-CA 3.22Å; A2388-S2392 WeakPolarHBondContact O-CB 3.24Å; A2388-S2392 PolarHBondContact O-N 3.14Å; A2388-S2392 PolarHBondContact O-OG 3.38Å; A2388-L2529 HydrophobicContact CB-CB 4.22Å; A2388-L2529 HydrophobicContact CB-CD1 4Å; A2388-L2529 HydrophobicContact CB-CD2 4.02Å; A2388-L2529 HydrophobicContact CB-CG 4.3Å
2389F47.8Very low48.9Very low58.5 Ų58.563.3 Ų63.326%0.25730%0.295SS..Hα-helixtrans-70.5-42.9175.3-125.2-85.1000112.1F2172 N2385 Y2386 F2387 Y2391 S2392 F2393 L2529 L2581 L2584F2172-F2389 HydrophobicContact CD1-CB 4.25Å; F2172-F2389 HydrophobicContact CE1-CB 3.44Å; F2172-F2389 VanDerWaalsContact CE1-CB 3.44Å; F2172-F2389 HydrophobicContact CE1-CG 4.34Å; F2172-F2389 HydrophobicContact CZ-CB 4.05Å; N2385-F2389 WeakPolarHBondContact O-CB 3.32Å; N2385-F2389 PolarHBondContact O-N 3.01Å; Y2386-F2389 CarbonylContact O-C 3.58Å; Y2386-F2389 PolarHBondContact O-N 3.34Å; F2387-F2389 VanDerWaalsContact C-N 3.32Å; F2387-F2389 PolarHBondContact O-N 3.39Å; F2389-Y2391 VanDerWaalsContact C-N 3.29Å; F2389-Y2391 PolarHBondContact O-N 3.1Å; F2389-S2392 PolarHBondContact O-N 3.07Å; F2389-F2393 HydrophobicContact CD1-CB 4.23Å; F2389-F2393 HydrophobicContact CD2-CD2 4.38Å; F2389-F2393 HydrophobicContact CE1-CB 4.2Å; F2389-F2393 HydrophobicContact CE1-CD1 4.21Å; F2389-F2393 HydrophobicContact CE1-CG 4.11Å; F2389-F2393 AromaticContact CE2-CD2 3.96Å; F2389-F2393 HydrophobicContact CE2-CD2 3.96Å; F2389-F2393 HydrophobicContact CE2-CE2 4.05Å; F2389-F2393 HydrophobicContact CE2-CG 4.35Å; F2389-F2393 HydrophobicContact CZ-CD1 4.08Å; F2389-F2393 HydrophobicContact CZ-CD2 4.04Å; F2389-F2393 HydrophobicContact CZ-CE1 4.22Å; F2389-F2393 HydrophobicContact CZ-CE2 4.16Å; F2389-F2393 HydrophobicContact CZ-CG 4Å; F2389-F2393 HydrophobicContact CZ-CZ 4.25Å; F2389-F2393 WeakPolarHBondContact O-CA 3.27Å; F2389-F2393 WeakPolarHBondContact O-CB 3.44Å; F2389-F2393 PolarHBondContact O-N 3.29Å; F2389-L2529 HydrophobicContact CD2-CD1 4.36Å; F2389-L2529 HydrophobicContact CE2-CD1 4Å; F2389-L2581 HydrophobicContact CE1-CB 4.46Å; F2389-L2581 HydrophobicContact CE1-CD2 4.06Å; F2389-L2581 HydrophobicContact CE2-CD2 4.1Å; F2389-L2581 HydrophobicContact CZ-CB 3.83Å; F2389-L2581 HydrophobicContact CZ-CD2 3.78Å; F2389-L2581 HydrophobicContact CZ-CG 4.27Å; F2389-L2584 HydrophobicContact CD1-CD2 4.12Å; F2389-L2584 HydrophobicContact CE1-CD2 4.25Å
2390E48.2Very low50Low39.5 Ų39.564.9 Ų64.919%0.18530%0.301CS..Hα-helixtrans-60.9-47.8176.7-101.5-162.7160.100110.8F2172 S2278 Y2386 F2387 S2392 F2393 I2394F2172-E2390 HydrophobicContact CD2-CG 4.15Å; F2172-E2390 HydrophobicContact CE2-CB 4.3Å; F2172-E2390 HydrophobicContact CE2-CG 3.42Å; F2172-E2390 VanDerWaalsContact CE2-CG 3.42Å; F2172-E2390 WeakPolarHBondContact CE2-OE1 3.38Å; F2172-E2390 HydrophobicContact CZ-CB 4.31Å; F2172-E2390 HydrophobicContact CZ-CG 3.78Å; S2278-E2390 PolarHBondContact OG-OE1 3.13Å; S2278-E2390 PolarHBondContact OG-OE2 2.82Å; Y2386-E2390 HydrophobicContact CD1-CG 3.91Å; Y2386-E2390 HydrophobicContact CE1-CG 3.59Å; Y2386-E2390 WeakPolarHBondContact CE1-OE1 3.3Å; Y2386-E2390 WeakPolarHBondContact O-CB 3.49Å; Y2386-E2390 WeakPolarHBondContact O-CG 3.14Å; Y2386-E2390 PolarHBondContact O-N 3.22Å; Y2386-E2390 PolarHBondContact OH-OE1 3.14Å; F2387-E2390 PolarHBondContact O-N 3.2Å; E2390-S2392 PolarHBondContact O-N 2.78Å; E2390-F2393 PolarHBondContact O-N 3.24Å; E2390-I2394 HydrophobicContact CB-CD1 4.48Å; E2390-I2394 HydrophobicContact CG-CD1 3.68Å; E2390-I2394 HydrophobicContact CG-CG1 4.39Å; E2390-I2394 WeakPolarHBondContact O-CA 3.28Å; E2390-I2394 VanDerWaalsContact O-CB 3.25Å; E2390-I2394 WeakPolarHBondContact O-CB 3.41Å; E2390-I2394 VanDerWaalsContact O-CG1 3.29Å; E2390-I2394 WeakPolarHBondContact O-CG1 3.27Å; E2390-I2394 PolarHBondContact O-N 3.39Å
2391Y52.9Low52.2Low89 Ų8960.1 Ų60.135%0.34928%0.282SS..Hα-helixtrans-60.9-49.6177.1-171.8-89.4000111.4F2252 L2253 W2258 Y2380 F2382 F2387 F2389 F2393 I2394 E2395F2252-Y2391 HydrophobicContact CE1-CD2 4.31Å; L2253-Y2391 HydrophobicContact CB-CE2 4.46Å; L2253-Y2391 HydrophobicContact CD2-CD2 4.08Å; L2253-Y2391 HydrophobicContact CD2-CE1 4.4Å; L2253-Y2391 HydrophobicContact CD2-CE2 3.73Å; L2253-Y2391 WeakPolarHBondContact O-CE2 3.23Å; L2253-Y2391 PolarHBondContact O-OH 3.48Å; W2258-Y2391 HydrophobicContact CZ2-CD2 4.18Å; Y2380-Y2391 HydrophobicContact CE1-CE1 4.44Å; F2382-Y2391 HydrophobicContact CE1-CG 4.46Å; F2382-Y2391 HydrophobicContact CZ-CD1 4.21Å; F2382-Y2391 HydrophobicContact CZ-CD2 4.36Å; F2382-Y2391 AromaticContact CZ-CG 3.97Å; F2382-Y2391 HydrophobicContact CZ-CG 3.97Å; F2387-Y2391 WeakPolarHBondContact O-CB 3.49Å; F2387-Y2391 PolarHBondContact O-N 3.36Å; F2389-Y2391 VanDerWaalsContact C-N 3.29Å; F2389-Y2391 PolarHBondContact O-N 3.1Å; Y2391-F2393 VanDerWaalsContact C-N 3.25Å; Y2391-F2393 PolarHBondContact O-N 3.24Å; Y2391-I2394 PolarHBondContact O-N 3.03Å; Y2391-E2395 VanDerWaalsContact CD2-OE2 3.25Å; Y2391-E2395 WeakPolarHBondContact CD2-OE2 3.09Å; Y2391-E2395 WeakPolarHBondContact CE2-OE2 3.23Å; Y2391-E2395 WeakPolarHBondContact O-CB 3.47Å; Y2391-E2395 PolarHBondContact O-N 3.21Å
2392S53Low54.5Low25.5 Ų25.552.5 Ų52.518%0.17825%0.249CC..Hα-helixtrans-69.4-27-178.8125.70000113.5A2388 F2389 E2390 T2396 Y2398 Q2592A2388-S2392 WeakPolarHBondContact O-CA 3.22Å; A2388-S2392 WeakPolarHBondContact O-CB 3.24Å; A2388-S2392 PolarHBondContact O-N 3.14Å; A2388-S2392 PolarHBondContact O-OG 3.38Å; F2389-S2392 PolarHBondContact O-N 3.07Å; E2390-S2392 PolarHBondContact O-N 2.78Å; S2392-T2396 WeakPolarHBondContact O-CB 3.19Å; S2392-T2396 PolarHBondContact O-N 3.2Å; S2392-T2396 PolarHBondContact O-OG1 3.07Å; S2392-Y2398 VanDerWaalsContact O-CD2 3.3Å; S2392-Y2398 WeakPolarHBondContact O-CD2 3.44Å; S2392-Q2592 PolarHBondContact O-NE2 3.35Å
2393F53.1Low56.8Low24.5 Ų24.552.8 Ų52.811%0.10725%0.249CC..Hα-helixtrans-93.1-38.6-177.2-153.2-101.4000112.6I2176 I2180 I2282 F2389 E2390 Y2391 E2395 T2396 Q2397 I2399I2176-F2393 HydrophobicContact CG2-CE2 4.24Å; I2176-F2393 HydrophobicContact CG2-CZ 4.22Å; I2180-F2393 HydrophobicContact CD1-CE2 3.47Å; I2180-F2393 VanDerWaalsContact CD1-CE2 3.47Å; I2180-F2393 HydrophobicContact CD1-CZ 3.49Å; I2180-F2393 VanDerWaalsContact CD1-CZ 3.49Å; I2180-F2393 HydrophobicContact CG1-CE2 4.1Å; I2180-F2393 HydrophobicContact CG1-CZ 3.57Å; I2282-F2393 HydrophobicContact CD1-CD1 3.99Å; I2282-F2393 HydrophobicContact CD1-CE1 4.17Å; I2282-F2393 HydrophobicContact CG1-CD1 4.26Å; I2282-F2393 HydrophobicContact CG1-CE1 4.28Å; I2282-F2393 HydrophobicContact CG2-CE1 3.73Å; F2389-F2393 HydrophobicContact CD1-CB 4.23Å; F2389-F2393 HydrophobicContact CD2-CD2 4.38Å; F2389-F2393 HydrophobicContact CE1-CB 4.2Å; F2389-F2393 HydrophobicContact CE1-CD1 4.21Å; F2389-F2393 HydrophobicContact CE1-CG 4.11Å; F2389-F2393 AromaticContact CE2-CD2 3.96Å; F2389-F2393 HydrophobicContact CE2-CD2 3.96Å; F2389-F2393 HydrophobicContact CE2-CE2 4.05Å; F2389-F2393 HydrophobicContact CE2-CG 4.35Å; F2389-F2393 HydrophobicContact CZ-CD1 4.08Å; F2389-F2393 HydrophobicContact CZ-CD2 4.04Å; F2389-F2393 HydrophobicContact CZ-CE1 4.22Å; F2389-F2393 HydrophobicContact CZ-CE2 4.16Å; F2389-F2393 HydrophobicContact CZ-CG 4Å; F2389-F2393 HydrophobicContact CZ-CZ 4.25Å; F2389-F2393 WeakPolarHBondContact O-CA 3.27Å; F2389-F2393 WeakPolarHBondContact O-CB 3.44Å; F2389-F2393 PolarHBondContact O-N 3.29Å; E2390-F2393 PolarHBondContact O-N 3.24Å; Y2391-F2393 VanDerWaalsContact C-N 3.25Å; Y2391-F2393 PolarHBondContact O-N 3.24Å; F2393-E2395 VanDerWaalsContact C-N 3.32Å; F2393-E2395 PolarHBondContact O-N 3.09Å; F2393-T2396 WeakPolarHBondContact O-CB 3.49Å; F2393-T2396 PolarHBondContact O-N 3.27Å; F2393-T2396 VanDerWaalsContact O-N 3.08Å; F2393-Q2397 HydrophobicContact CE1-CG 4.16Å; F2393-Q2397 VanDerWaalsContact CE1-NE2 3.31Å; F2393-Q2397 HydrophobicContact CZ-CG 4.12Å; F2393-Q2397 PolarHBondContact O-N 3.42Å; F2393-I2399 HydrophobicContact CD1-CD1 4.11Å; F2393-I2399 HydrophobicContact CD1-CG1 3.65Å; F2393-I2399 HydrophobicContact CE1-CG1 4.01Å
2394I51.9Low59Low48.5 Ų48.546.8 Ų46.825%0.24922%0.221CC..Hα-helixtrans-78.5-47.8177.9-63.6174.1000111F2252 L2253 L2281 I2282 I2285 E2390 Y2391 T2396 Q2397 Y2398F2252-I2394 HydrophobicContact CD1-CD1 4.24Å; F2252-I2394 HydrophobicContact CD1-CG2 4.3Å; F2252-I2394 HydrophobicContact CE1-CB 4.48Å; F2252-I2394 HydrophobicContact CE1-CD1 3.48Å; F2252-I2394 VanDerWaalsContact CE1-CD1 3.48Å; F2252-I2394 HydrophobicContact CE1-CG2 4.37Å; F2252-I2394 HydrophobicContact CZ-CD1 3.68Å; L2253-I2394 HydrophobicContact CD2-CG2 4.17Å; L2281-I2394 HydrophobicContact CD2-CD1 4.34Å; L2281-I2394 HydrophobicContact CD2-CG2 4.2Å; I2282-I2394 HydrophobicContact CD1-CG1 4.28Å; I2282-I2394 HydrophobicContact CG1-CD1 4.33Å; I2282-I2394 HydrophobicContact CG1-CG1 3.79Å; I2285-I2394 HydrophobicContact CD1-CG2 4.02Å; E2390-I2394 HydrophobicContact CB-CD1 4.48Å; E2390-I2394 HydrophobicContact CG-CD1 3.68Å; E2390-I2394 HydrophobicContact CG-CG1 4.39Å; E2390-I2394 WeakPolarHBondContact O-CA 3.28Å; E2390-I2394 VanDerWaalsContact O-CB 3.25Å; E2390-I2394 WeakPolarHBondContact O-CB 3.41Å; E2390-I2394 VanDerWaalsContact O-CG1 3.29Å; E2390-I2394 WeakPolarHBondContact O-CG1 3.27Å; E2390-I2394 PolarHBondContact O-N 3.39Å; Y2391-I2394 PolarHBondContact O-N 3.03Å; I2394-T2396 VanDerWaalsContact C-N 3.3Å; I2394-T2396 PolarHBondContact O-N 3.28Å; I2394-Q2397 PolarHBondContact O-N 2.86Å; I2394-Y2398 VanDerWaalsContact O-CB 3.3Å; I2394-Y2398 WeakPolarHBondContact O-CB 3.12Å; I2394-Y2398 PolarHBondContact O-N 2.87Å
2395E57.7Low61.2Low63 Ų6343.9 Ų43.929%0.29421%0.205SC..Hα-helixtrans-64.2-34.7178.3-124.3-165.917400112.3L2253 Y2391 F2393 Q2397 Y2398 I2399 K2480 Q2592L2253-E2395 HydrophobicContact CD2-CB 4.08Å; Y2391-E2395 VanDerWaalsContact CD2-OE2 3.25Å; Y2391-E2395 WeakPolarHBondContact CD2-OE2 3.09Å; Y2391-E2395 WeakPolarHBondContact CE2-OE2 3.23Å; Y2391-E2395 WeakPolarHBondContact O-CB 3.47Å; Y2391-E2395 PolarHBondContact O-N 3.21Å; F2393-E2395 VanDerWaalsContact C-N 3.32Å; F2393-E2395 PolarHBondContact O-N 3.09Å; E2395-Q2397 PolarHBondContact O-N 2.85Å; E2395-Y2398 PolarHBondContact O-N 3.42Å; E2395-I2399 HydrophobicContact CG-CD1 4.17Å; E2395-I2399 WeakPolarHBondContact O-CG1 3.36Å; E2395-I2399 PolarHBondContact O-N 3.25Å; E2395-K2480 WeakPolarHBondContact OE1-CE 3.46Å; E2395-K2480 IonicContact OE1-NZ 2.72Å; E2395-K2480 PolarHBondContact OE1-NZ 3.4Å; E2395-K2480 IonicContact OE2-NZ 4Å; E2395-K2480 PolarHBondContact OE2-NZ 2.85Å; E2395-Q2592 PolarHBondContact OE2-NE2 2.92Å
2396T59.4Low63.3Low15.5 Ų15.540.8 Ų40.810%0.09519%0.189CC..Hα-helixtrans-75.2-22.2-178.80.80000113.4I2243 S2392 F2393 I2394 Y2398 Q2400 V2591 Q2592I2243-T2396 HydrophobicContact CB-CG2 4.39Å; I2243-T2396 HydrophobicContact CD1-CG2 3.61Å; I2243-T2396 HydrophobicContact CG2-CG2 3.68Å; S2392-T2396 WeakPolarHBondContact O-CB 3.19Å; S2392-T2396 PolarHBondContact O-N 3.2Å; S2392-T2396 PolarHBondContact O-OG1 3.07Å; F2393-T2396 WeakPolarHBondContact O-CB 3.49Å; F2393-T2396 PolarHBondContact O-N 3.27Å; F2393-T2396 VanDerWaalsContact O-N 3.08Å; I2394-T2396 VanDerWaalsContact C-N 3.3Å; I2394-T2396 PolarHBondContact O-N 3.28Å; T2396-Y2398 HydrophobicContact CG2-CD2 4.43Å; T2396-Y2398 HydrophobicContact CG2-CE2 4.33Å; T2396-Y2398 PolarHBondContact O-N 3.3Å; T2396-Y2398 VanDerWaalsContact O-N 3.11Å; T2396-Y2398 WeakPolarHBondContact OG1-CD2 3.31Å; T2396-Q2400 PolarHBondContact O-N 2.87Å; T2396-Q2400 VanDerWaalsContact O-N 3.14Å; T2396-V2591 HydrophobicContact CG2-CB 3.86Å; T2396-V2591 HydrophobicContact CG2-CG1 3.61Å; T2396-Q2592 HydrophobicContact CG2-CG 4.1Å; T2396-Q2592 WeakPolarHBondContact OG1-CG 3.22Å; T2396-Q2592 PolarHBondContact OG1-NE2 3.21Å; T2396-Q2592 VanDerWaalsContact OG1-NE2 3.09Å
2397Q58.5Low65.2Low74.5 Ų74.540.8 Ų40.835%0.34819%0.191SC..Hα-helixtrans-4.2-12.2179.1-59.8-172.4-17.800113.9I2282 I2285 F2393 I2394 E2395 I2399 Q2400 L2401I2282-Q2397 PolarHBondContact O-OE1 3.29Å; I2285-Q2397 HydrophobicContact CB-CB 4.42Å; I2285-Q2397 HydrophobicContact CG2-CB 3.58Å; F2393-Q2397 HydrophobicContact CE1-CG 4.16Å; F2393-Q2397 VanDerWaalsContact CE1-NE2 3.31Å; F2393-Q2397 HydrophobicContact CZ-CG 4.12Å; F2393-Q2397 PolarHBondContact O-N 3.42Å; I2394-Q2397 PolarHBondContact O-N 2.86Å; E2395-Q2397 PolarHBondContact O-N 2.85Å; Q2397-I2399 PolarHBondContact O-N 3.19Å; Q2397-I2399 VanDerWaalsContact O-N 3.16Å; Q2397-Q2400 WeakPolarHBondContact O-CB 3.35Å; Q2397-Q2400 PolarHBondContact O-N 3.15Å; Q2397-L2401 PolarHBondContact O-N 3.3Å
2398Y59.3Low66.9Low31.5 Ų31.537.5 Ų37.512%0.12418%0.176CC..Hα-helixtrans-59.8-36.4176.3-138-83.4000112.7I2243 I2249 L2253 L2362 S2392 I2394 E2395 T2396 Q2400 L2401 I2402 W2472I2243-Y2398 HydrophobicContact CG2-CE2 3.88Å; I2249-Y2398 HydrophobicContact CG2-CD2 3.71Å; I2249-Y2398 HydrophobicContact CG2-CE2 4.31Å; I2249-Y2398 HydrophobicContact CG2-CG 4.34Å; L2253-Y2398 HydrophobicContact CD1-CD1 3.72Å; L2253-Y2398 HydrophobicContact CD1-CD2 4.11Å; L2253-Y2398 HydrophobicContact CD1-CE1 4.15Å; L2253-Y2398 HydrophobicContact CD1-CE2 4.49Å; L2253-Y2398 HydrophobicContact CD1-CG 3.69Å; L2362-Y2398 HydrophobicContact CB-CE2 3.92Å; L2362-Y2398 HydrophobicContact CD2-CD2 3.89Å; L2362-Y2398 HydrophobicContact CD2-CE2 3.62Å; L2362-Y2398 HydrophobicContact CG-CE2 4.26Å; L2362-Y2398 PolarHBondContact O-OH 2.72Å; S2392-Y2398 VanDerWaalsContact O-CD2 3.3Å; S2392-Y2398 WeakPolarHBondContact O-CD2 3.44Å; I2394-Y2398 VanDerWaalsContact O-CB 3.3Å; I2394-Y2398 WeakPolarHBondContact O-CB 3.12Å; I2394-Y2398 PolarHBondContact O-N 2.87Å; E2395-Y2398 PolarHBondContact O-N 3.42Å; T2396-Y2398 HydrophobicContact CG2-CD2 4.43Å; T2396-Y2398 HydrophobicContact CG2-CE2 4.33Å; T2396-Y2398 PolarHBondContact O-N 3.3Å; T2396-Y2398 VanDerWaalsContact O-N 3.11Å; T2396-Y2398 WeakPolarHBondContact OG1-CD2 3.31Å; Y2398-Q2400 VanDerWaalsContact C-N 3.31Å; Y2398-Q2400 PolarHBondContact O-N 3.01Å; Y2398-L2401 WeakPolarHBondContact O-CB 3.4Å; Y2398-L2401 PolarHBondContact O-N 3.13Å; Y2398-I2402 HydrophobicContact CD1-CD1 4.28Å; Y2398-I2402 HydrophobicContact CD2-CD1 4.38Å; Y2398-I2402 HydrophobicContact CE1-CD1 3.64Å; Y2398-I2402 HydrophobicContact CE2-CD1 3.78Å; Y2398-I2402 HydrophobicContact CE2-CG1 4.47Å; Y2398-I2402 PolarHBondContact O-N 3.08Å; Y2398-I2402 VanDerWaalsContact O-N 3.1Å; Y2398-I2402 WeakPolarHBondContact OH-CD1 3.17Å; Y2398-W2472 AromaticContact CE1-CH2 3.91Å; Y2398-W2472 HydrophobicContact CE1-CH2 3.91Å; Y2398-W2472 AromaticContact CE1-CZ2 3.64Å; Y2398-W2472 HydrophobicContact CE1-CZ2 3.64Å
2399I59.4Low68.6Low38.5 Ų38.536.5 Ų36.520%0.19717%0.168CC..Hα-helixtrans-59.2-39172.6-75.3171.1000111F2393 E2395 Q2397 L2401 I2402 Y2403 Q2592 L2596 I2599F2393-I2399 HydrophobicContact CD1-CD1 4.11Å; F2393-I2399 HydrophobicContact CD1-CG1 3.65Å; F2393-I2399 HydrophobicContact CE1-CG1 4.01Å; E2395-I2399 HydrophobicContact CG-CD1 4.17Å; E2395-I2399 WeakPolarHBondContact O-CG1 3.36Å; E2395-I2399 PolarHBondContact O-N 3.25Å; Q2397-I2399 PolarHBondContact O-N 3.19Å; Q2397-I2399 VanDerWaalsContact O-N 3.16Å; I2399-L2401 VanDerWaalsContact C-N 3.33Å; I2399-L2401 PolarHBondContact O-N 3.23Å; I2399-I2402 PolarHBondContact O-N 3.4Å; I2399-Y2403 WeakPolarHBondContact O-CB 3.48Å; I2399-Y2403 PolarHBondContact O-N 3.27Å; I2399-Q2592 HydrophobicContact CD1-CB 3.92Å; I2399-Q2592 HydrophobicContact CD1-CG 3.86Å; I2399-L2596 HydrophobicContact CD1-CD1 4.45Å; I2399-L2596 HydrophobicContact CD1-CG 4.33Å; I2399-L2596 HydrophobicContact CG2-CG 4.27Å; I2399-I2599 HydrophobicContact CG2-CD1 4.04Å
2400Q60.2Low70.2Confident96 Ų9634.4 Ų34.445%0.44916%0.16SC..Hα-helixtrans-69.1-35178.8-149.5112.6900112T2396 Q2397 Y2398 S2404T2396-Q2400 PolarHBondContact O-N 2.87Å; T2396-Q2400 VanDerWaalsContact O-N 3.14Å; Q2397-Q2400 WeakPolarHBondContact O-CB 3.35Å; Q2397-Q2400 PolarHBondContact O-N 3.15Å; Y2398-Q2400 VanDerWaalsContact C-N 3.31Å; Y2398-Q2400 PolarHBondContact O-N 3.01Å; Q2400-S2404 WeakPolarHBondContact O-CB 3.38Å; Q2400-S2404 PolarHBondContact O-N 3.48Å; Q2400-S2404 PolarHBondContact O-OG 3.21Å
2401L87.3Confident71.5Confident0 Ų032.8 Ų32.80%015%0.154CC..Hα-helixtrans-62.1-51.3173.8-17967.8000110.7W2284 I2285 E2288 T2289 I2292 L2362 Q2397 Y2398 I2399 Y2403 S2404 L2405W2284-L2401 HydrophobicContact CZ3-CD2 4.39Å; I2285-L2401 HydrophobicContact CG2-CB 4.47Å; I2285-L2401 HydrophobicContact CG2-CD2 4.49Å; E2288-L2401 HydrophobicContact CB-CD1 4.45Å; E2288-L2401 HydrophobicContact CG-CD1 4.22Å; T2289-L2401 WeakPolarHBondContact OG1-CD1 3.43Å; I2292-L2401 HydrophobicContact CD1-CD1 3.27Å; I2292-L2401 HydrophobicContact CD1-CG 4.36Å; L2362-L2401 HydrophobicContact CD1-CD2 3.76Å; L2362-L2401 HydrophobicContact CD1-CG 4.27Å; L2362-L2401 HydrophobicContact CD2-CD2 4.42Å; Q2397-L2401 PolarHBondContact O-N 3.3Å; Y2398-L2401 WeakPolarHBondContact O-CB 3.4Å; Y2398-L2401 PolarHBondContact O-N 3.13Å; I2399-L2401 VanDerWaalsContact C-N 3.33Å; I2399-L2401 PolarHBondContact O-N 3.23Å; L2401-Y2403 VanDerWaalsContact C-N 3.34Å; L2401-Y2403 PolarHBondContact O-N 2.74Å; L2401-S2404 PolarHBondContact O-N 2.92Å; L2401-S2404 VanDerWaalsContact O-N 3.1Å; L2401-L2405 HydrophobicContact CG-CD1 4.44Å; L2401-L2405 WeakPolarHBondContact O-CG 3.11Å; L2401-L2405 PolarHBondContact O-N 3.41Å
2402I87.6Confident72.7Confident0 Ų028.9 Ų28.90%014%0.139CC..Hα-helixtrans-60.1-44.4177.6-66.1174.3000111.2L2362 Y2398 I2399 S2404 L2405 L2406 W2472 I2599L2362-I2402 HydrophobicContact CB-CD1 4.48Å; L2362-I2402 HydrophobicContact CD1-CG1 4.27Å; Y2398-I2402 HydrophobicContact CD1-CD1 4.28Å; Y2398-I2402 HydrophobicContact CD2-CD1 4.38Å; Y2398-I2402 HydrophobicContact CE1-CD1 3.64Å; Y2398-I2402 HydrophobicContact CE2-CD1 3.78Å; Y2398-I2402 HydrophobicContact CE2-CG1 4.47Å; Y2398-I2402 PolarHBondContact O-N 3.08Å; Y2398-I2402 VanDerWaalsContact O-N 3.1Å; Y2398-I2402 WeakPolarHBondContact OH-CD1 3.17Å; I2399-I2402 PolarHBondContact O-N 3.4Å; I2402-S2404 VanDerWaalsContact C-N 3.26Å; I2402-S2404 PolarHBondContact O-N 2.98Å; I2402-L2405 PolarHBondContact O-N 2.97Å; I2402-L2406 HydrophobicContact CG2-CD1 4.27Å; I2402-L2406 PolarHBondContact O-N 3.37Å; I2402-L2406 VanDerWaalsContact O-N 3.08Å; I2402-W2472 HydrophobicContact CD1-CH2 3.62Å; I2402-W2472 HydrophobicContact CD1-CZ2 4.34Å; I2402-W2472 HydrophobicContact CD1-CZ3 3.84Å; I2402-W2472 HydrophobicContact CG2-CZ3 4.37Å; I2402-I2599 HydrophobicContact CB-CD1 4.1Å; I2402-I2599 HydrophobicContact CG2-CD1 3.8Å; I2402-I2599 HydrophobicContact CG2-CG1 4.19Å
2403Y88.2Confident73.7Confident67 Ų6728 Ų2826%0.26313%0.132SC..Hα-helixtrans-57.7-40.5175.8174.9-103.9000112.2I2399 L2401 F2407 I2599 Q2602I2399-Y2403 WeakPolarHBondContact O-CB 3.48Å; I2399-Y2403 PolarHBondContact O-N 3.27Å; L2401-Y2403 VanDerWaalsContact C-N 3.34Å; L2401-Y2403 PolarHBondContact O-N 2.74Å; Y2403-F2407 PolarHBondContact O-N 3.5Å; Y2403-I2599 HydrophobicContact CD2-CG1 4.25Å; Y2403-Q2602 PolarHBondContact O-OE1 3.44Å
2404S86.7Confident74.3Confident3 Ų329.5 Ų29.52%0.02115%0.146CC..Hα-helixtrans-72.1-36.3179.8-52.90000112.2I2292 Q2400 L2401 I2402 F2407 I2408I2292-S2404 VanDerWaalsContact CG2-C 3.5Å; Q2400-S2404 WeakPolarHBondContact O-CB 3.38Å; Q2400-S2404 PolarHBondContact O-N 3.48Å; Q2400-S2404 PolarHBondContact O-OG 3.21Å; L2401-S2404 PolarHBondContact O-N 2.92Å; L2401-S2404 VanDerWaalsContact O-N 3.1Å; I2402-S2404 VanDerWaalsContact C-N 3.26Å; I2402-S2404 PolarHBondContact O-N 2.98Å; S2404-F2407 WeakPolarHBondContact O-CB 3.18Å; S2404-F2407 PolarHBondContact O-N 3.4Å; S2404-I2408 PolarHBondContact O-N 3.23Å
2405L89.1Confident74.5Confident0 Ų029.5 Ų29.50%015%0.145CC..Hα-helixtrans-61.6-45.8174.3-73.9170.1000111.9I2292 T2355 L2358 L2359 L2362 L2401 I2402 F2407 I2408 L2409I2292-L2405 HydrophobicContact CD1-CD2 3.47Å; I2292-L2405 VanDerWaalsContact CD1-CD2 3.47Å; I2292-L2405 HydrophobicContact CD1-CG 3.89Å; I2292-L2405 HydrophobicContact CG1-CD2 3.86Å; I2292-L2405 HydrophobicContact CG2-CD2 4.09Å; I2292-L2405 HydrophobicContact CG2-CG 4.29Å; T2355-L2405 HydrophobicContact CG2-CD2 3.8Å; L2358-L2405 HydrophobicContact CB-CD1 4.12Å; L2358-L2405 HydrophobicContact CB-CD2 4.48Å; L2358-L2405 HydrophobicContact CD1-CD2 4.34Å; L2359-L2405 HydrophobicContact CB-CD1 4.37Å; L2359-L2405 HydrophobicContact CD1-CB 4.15Å; L2362-L2405 HydrophobicContact CD1-CD1 3.81Å; L2401-L2405 HydrophobicContact CG-CD1 4.44Å; L2401-L2405 WeakPolarHBondContact O-CG 3.11Å; L2401-L2405 PolarHBondContact O-N 3.41Å; I2402-L2405 PolarHBondContact O-N 2.97Å; L2405-F2407 PolarHBondContact O-N 3.19Å; L2405-I2408 WeakPolarHBondContact O-CB 3.41Å; L2405-I2408 PolarHBondContact O-N 3.37Å; L2405-I2408 VanDerWaalsContact O-N 3.14Å; L2405-L2409 PolarHBondContact O-N 3.26Å
2406L87.1Confident74.1Confident2 Ų230.4 Ų30.41%0.0116%0.157CC..Hα-helixtrans-65-29.7177.4-71.9171.9000112.6L2359 I2402 I2408 L2409 T2410 L2469 I2599 Q2602 L2606L2359-L2406 HydrophobicContact CD1-CD2 4.01Å; L2359-L2406 HydrophobicContact CD1-CG 4.27Å; I2402-L2406 HydrophobicContact CG2-CD1 4.27Å; I2402-L2406 PolarHBondContact O-N 3.37Å; I2402-L2406 VanDerWaalsContact O-N 3.08Å; L2406-I2408 PolarHBondContact O-N 3.33Å; L2406-L2409 HydrophobicContact CD2-CD1 4.06Å; L2406-L2409 PolarHBondContact O-N 2.83Å; L2406-T2410 WeakPolarHBondContact O-CG2 3.34Å; L2406-T2410 PolarHBondContact O-N 2.65Å; L2406-T2410 PolarHBondContact O-OG1 2.76Å; L2406-T2410 VanDerWaalsContact O-OG1 3.05Å; L2406-L2469 HydrophobicContact CD1-CD1 3.94Å; L2406-L2469 HydrophobicContact CD1-CD2 3.89Å; L2406-L2469 HydrophobicContact CD1-CG 4.49Å; L2406-L2469 HydrophobicContact CD2-CD1 3.53Å; L2406-L2469 HydrophobicContact CD2-CD2 4.4Å; L2406-L2469 HydrophobicContact CG-CD1 4.05Å; L2406-I2599 HydrophobicContact CD1-CB 4.03Å; L2406-I2599 HydrophobicContact CD1-CG1 3.95Å; L2406-I2599 HydrophobicContact CD1-CG2 3.67Å; L2406-Q2602 HydrophobicContact CB-CB 4.17Å; L2406-Q2602 PolarHBondContact O-OE1 3.12Å; L2406-L2606 HydrophobicContact CD2-CD1 3.85Å
2407F85.3Confident73Confident86 Ų8637.1 Ų37.138%0.37719%0.187SC..Hα-helixtrans-63.3-32.7176.2-164.7-86000111.4Y2403 S2404 L2405 T2410 G2411Y2403-F2407 PolarHBondContact O-N 3.5Å; S2404-F2407 WeakPolarHBondContact O-CB 3.18Å; S2404-F2407 PolarHBondContact O-N 3.4Å; L2405-F2407 PolarHBondContact O-N 3.19Å; F2407-T2410 VanDerWaalsContact CA-OG1 3.3Å; F2407-T2410 WeakPolarHBondContact CA-OG1 3.21Å; F2407-T2410 PolarHBondContact O-OG1 3.06Å; F2407-G2411 PolarHBondContact O-N 3.14Å
2408I84.4Confident72.2Confident0 Ų042.3 Ų42.30%021%0.205CC..Hα-helixtrans-66.1-47174.1-61.7168.3000110.6I2292 F2295 M2299 I2351 T2355 S2404 L2405 L2406 T2410 G2411 Y2412I2292-I2408 HydrophobicContact CB-CD1 4.37Å; I2292-I2408 HydrophobicContact CG2-CD1 3.63Å; I2292-I2408 HydrophobicContact CG2-CG1 4.5Å; F2295-I2408 HydrophobicContact CB-CD1 3.61Å; F2295-I2408 HydrophobicContact CB-CG1 4.16Å; F2295-I2408 HydrophobicContact CD2-CD1 4.23Å; F2295-I2408 HydrophobicContact CG-CD1 4.46Å; M2299-I2408 HydrophobicContact CE-CG2 3.37Å; M2299-I2408 HydrophobicContact CG-CG2 4.37Å; I2351-I2408 HydrophobicContact CG2-CG2 3.74Å; T2355-I2408 HydrophobicContact CG2-CB 4.17Å; T2355-I2408 HydrophobicContact CG2-CD1 3.44Å; T2355-I2408 VanDerWaalsContact CG2-CD1 3.44Å; T2355-I2408 HydrophobicContact CG2-CG1 4.41Å; T2355-I2408 HydrophobicContact CG2-CG2 4.02Å; S2404-I2408 PolarHBondContact O-N 3.23Å; L2405-I2408 WeakPolarHBondContact O-CB 3.41Å; L2405-I2408 PolarHBondContact O-N 3.37Å; L2405-I2408 VanDerWaalsContact O-N 3.14Å; L2406-I2408 PolarHBondContact O-N 3.33Å; I2408-T2410 PolarHBondContact O-N 2.92Å; I2408-G2411 PolarHBondContact O-N 2.85Å; I2408-Y2412 PolarHBondContact O-N 3.28Å
2409L84.5Confident71Confident3 Ų344.5 Ų44.52%0.01621%0.213CC..Hα-helixtrans-63-44179.9-60.1-179000111.7L2352 F2356 L2405 L2406 Y2412 I2413 L2437 L2606L2352-L2409 HydrophobicContact CD2-CD2 3.87Å; F2356-L2409 HydrophobicContact CE1-CD1 4.31Å; F2356-L2409 HydrophobicContact CE1-CD2 4.33Å; F2356-L2409 HydrophobicContact CE2-CD2 3.99Å; F2356-L2409 HydrophobicContact CZ-CD1 4.48Å; F2356-L2409 HydrophobicContact CZ-CD2 3.81Å; L2405-L2409 PolarHBondContact O-N 3.26Å; L2406-L2409 HydrophobicContact CD2-CD1 4.06Å; L2406-L2409 PolarHBondContact O-N 2.83Å; L2409-Y2412 PolarHBondContact O-N 3.36Å; L2409-I2413 PolarHBondContact O-N 3.49Å; L2409-L2437 HydrophobicContact CB-CD1 4.31Å; L2409-L2437 HydrophobicContact CD2-CD1 4.23Å; L2409-L2437 HydrophobicContact CD2-CD2 4.14Å; L2409-L2606 HydrophobicContact CB-CD1 3.96Å; L2409-L2606 HydrophobicContact CB-CD2 4.08Å; L2409-L2606 HydrophobicContact CD1-CD1 4.25Å
2410T80.3Confident70.1Confident16 Ų1647.4 Ų47.410%0.09823%0.228CC..Hα-helixtrans-65.4-40.9175.953.70000111.5L2406 F2407 I2408 Y2412 I2413 S2414 Q2602 F2605 L2606L2406-T2410 WeakPolarHBondContact O-CG2 3.34Å; L2406-T2410 PolarHBondContact O-N 2.65Å; L2406-T2410 PolarHBondContact O-OG1 2.76Å; L2406-T2410 VanDerWaalsContact O-OG1 3.05Å; F2407-T2410 VanDerWaalsContact CA-OG1 3.3Å; F2407-T2410 WeakPolarHBondContact CA-OG1 3.21Å; F2407-T2410 PolarHBondContact O-OG1 3.06Å; I2408-T2410 PolarHBondContact O-N 2.92Å; T2410-Y2412 PolarHBondContact O-N 3.02Å; T2410-I2413 PolarHBondContact O-N 2.95Å; T2410-S2414 VanDerWaalsContact O-CB 3.22Å; T2410-S2414 WeakPolarHBondContact O-CB 3.43Å; T2410-S2414 PolarHBondContact O-N 2.82Å; T2410-S2414 PolarHBondContact O-OG 3.15Å; T2410-Q2602 HydrophobicContact CG2-CB 3.73Å; T2410-Q2602 HydrophobicContact CG2-CG 3.93Å; T2410-F2605 HydrophobicContact CG2-CD1 4.09Å; T2410-L2606 HydrophobicContact CG2-CD1 4.12Å; T2410-L2606 HydrophobicContact CG2-CD2 3.92Å; T2410-L2606 HydrophobicContact CG2-CG 3.83Å
2411G76Confident68.9Low6 Ų652.8 Ų52.86%0.06224%0.244CC..Hα-helixtrans-57.4-45.5173.600000113N2303 F2407 I2408 I2413 S2414N2303-G2411 PolarHBondContact ND2-O 2.8Å; F2407-G2411 PolarHBondContact O-N 3.14Å; I2408-G2411 PolarHBondContact O-N 2.85Å; G2411-I2413 PolarHBondContact O-N 3.29Å; G2411-S2414 PolarHBondContact O-N 2.9Å; G2411-S2414 PolarHBondContact O-OG 3.43Å; G2411-S2414 VanDerWaalsContact O-OG 3.08Å
2412Y77.5Confident66.4Low6 Ų659.9 Ų59.92%0.02428%0.275CS..Hα-helixtrans-59.9-45.3177.3176.8-109.1000112.2M2299 Q2348 L2352 I2408 L2409 T2410 R2435 L2437 Y2440M2299-Y2412 HydrophobicContact CE-CD2 4.42Å; M2299-Y2412 HydrophobicContact SD-CD2 3.99Å; M2299-Y2412 HydrophobicContact SD-CG 4.46Å; Q2348-Y2412 HydrophobicContact CG-CD2 4.16Å; Q2348-Y2412 HydrophobicContact CG-CE2 4.03Å; Q2348-Y2412 VanDerWaalsContact NE2-CE2 3.33Å; L2352-Y2412 HydrophobicContact CD1-CD1 4.28Å; L2352-Y2412 HydrophobicContact CD1-CD2 3.92Å; L2352-Y2412 HydrophobicContact CD1-CE1 4.24Å; L2352-Y2412 HydrophobicContact CD1-CE2 3.9Å; L2352-Y2412 HydrophobicContact CD1-CG 4.11Å; L2352-Y2412 HydrophobicContact CD2-CG 4.28Å; I2408-Y2412 PolarHBondContact O-N 3.28Å; L2409-Y2412 PolarHBondContact O-N 3.36Å; T2410-Y2412 PolarHBondContact O-N 3.02Å; Y2412-R2435 HydrophobicContact CE1-CB 4.18Å; Y2412-L2437 HydrophobicContact CD1-CD2 3.46Å; Y2412-L2437 VanDerWaalsContact CD1-CD2 3.46Å; Y2412-L2437 HydrophobicContact CD1-CG 4.48Å; Y2412-L2437 HydrophobicContact CE1-CD2 3.89Å; Y2412-L2437 HydrophobicContact CG-CD2 4.42Å; Y2412-Y2440 HydrophobicContact CE1-CE2 4.3Å; Y2412-Y2440 AromaticContact CZ-CE2 3.93Å
2413I73.7Confident63.7Low6 Ų666.3 Ų66.33%0.03130%0.303CS..Hα-helixtrans-75.4-36.6-176.8-79.5168.1000111.5L2409 T2410 G2411 I2415 L2437 F2605 L2606 K2609L2409-I2413 PolarHBondContact O-N 3.49Å; T2410-I2413 PolarHBondContact O-N 2.95Å; G2411-I2413 PolarHBondContact O-N 3.29Å; I2413-I2415 PolarHBondContact O-N 3.12Å; I2413-L2437 HydrophobicContact CD1-CD1 3.54Å; I2413-L2437 HydrophobicContact CD1-CD2 4.33Å; I2413-L2437 HydrophobicContact CD1-CG 3.73Å; I2413-L2437 HydrophobicContact CG1-CG 4.29Å; I2413-F2605 HydrophobicContact CG2-CE1 4.19Å; I2413-L2606 HydrophobicContact CD1-CD2 3.31Å; I2413-L2606 HydrophobicContact CG1-CD2 4.48Å; I2413-K2609 HydrophobicContact CG2-CB 4.21Å; I2413-K2609 HydrophobicContact CG2-CD 3.15Å; I2413-K2609 HydrophobicContact CG2-CG 3.55Å; I2413-K2609 VanDerWaalsContact CG2-NZ 3.3Å; I2413-K2609 PolarHBondContact O-NZ 3.12Å
2414S66.6Low61.3Low57 Ų5768.8 Ų68.840%0.39932%0.32SS..  trans-65.9104.3-175.867.80000111.8T2410 G2411T2410-S2414 VanDerWaalsContact O-CB 3.22Å; T2410-S2414 WeakPolarHBondContact O-CB 3.43Å; T2410-S2414 PolarHBondContact O-N 2.82Å; T2410-S2414 PolarHBondContact O-OG 3.15Å; G2411-S2414 PolarHBondContact O-N 2.9Å; G2411-S2414 PolarHBondContact O-OG 3.43Å; G2411-S2414 VanDerWaalsContact O-OG 3.08Å
2415I56.3Low59.4Low48 Ų4873.6 Ų73.625%0.24635%0.349CS..  trans-123.7125.8176.7-70.1177.5000106.3I2413 E2417 R2419I2413-I2415 PolarHBondContact O-N 3.12Å; I2415-E2417 PolarHBondContact O-N 3.24Å; I2415-R2419 VanDerWaalsContact CG1-NH1 3.31Å; I2415-R2419 HydrophobicContact CG2-CB 4.29Å; I2415-R2419 VanDerWaalsContact CG2-CD 3.45Å; I2415-R2419 HydrophobicContact CG2-CG 4.09Å; I2415-R2419 VanDerWaalsContact CG2-NH1 3.31Å
2416P48.4Very low56.8Low83 Ų8378.7 Ų78.754%0.53938%0.376SS..  trans-60.9125.1173.221.1-30.9000110.9Y2418 R2419P2416-Y2418 PolarHBondContact O-N 2.73Å; P2416-R2419 WeakPolarHBondContact O-CG 3.33Å; P2416-R2419 PolarHBondContact O-N 3.05Å; P2416-R2419 VanDerWaalsContact O-N 3.16Å
2417E36.6Very low54.3Low156 Ų15686.2 Ų86.273%0.72942%0.416SS*.THydrogen-bonded Turntrans-57.8-17-175.4-70.3179.6164.600114.5I2415 R2419 I2420I2415-E2417 PolarHBondContact O-N 3.24Å; E2417-R2419 PolarHBondContact O-N 2.85Å; E2417-I2420 PolarHBondContact O-N 2.93Å
2418Y40.8Very low51.9Low184 Ų18489.3 Ų89.372%0.72244%0.435SS*.Hα-helixtrans-58.3-19.7174.5-153.8-90.3000112.7P2416 I2420P2416-Y2418 PolarHBondContact O-N 2.73Å; Y2418-I2420 VanDerWaalsContact C-N 3.33Å; Y2418-I2420 PolarHBondContact O-N 3.34Å
2419R34.9Very low49.4Very low77 Ų7795.4 Ų95.429%0.29147%0.468SS..Hα-helixtrans-63.1-31.1171.8-68.3-165.9-152.4159.59.9114.2N2303 I2415 P2416 E2417N2303-R2419 PolarHBondContact O-NH1 2.89Å; N2303-R2419 PolarHBondContact O-NH2 2.73Å; I2415-R2419 VanDerWaalsContact CG1-NH1 3.31Å; I2415-R2419 HydrophobicContact CG2-CB 4.29Å; I2415-R2419 VanDerWaalsContact CG2-CD 3.45Å; I2415-R2419 HydrophobicContact CG2-CG 4.09Å; I2415-R2419 VanDerWaalsContact CG2-NH1 3.31Å; P2416-R2419 WeakPolarHBondContact O-CG 3.33Å; P2416-R2419 PolarHBondContact O-N 3.05Å; P2416-R2419 VanDerWaalsContact O-N 3.16Å; E2417-R2419 PolarHBondContact O-N 2.85Å
2420I40.8Very low47Very low100 Ų100103 Ų10351%0.51351%0.509SS..Hα-helixtrans-80.1-36.6-174.2-59.9174.2000110.1E2417 Y2418 I2424E2417-I2420 PolarHBondContact O-N 2.93Å; Y2418-I2420 VanDerWaalsContact C-N 3.33Å; Y2418-I2420 PolarHBondContact O-N 3.34Å; I2420-I2424 HydrophobicContact CG2-CD1 3.75Å; I2420-I2424 WeakPolarHBondContact O-CD1 3.25Å; I2420-I2424 VanDerWaalsContact O-CG1 3.25Å; I2420-I2424 WeakPolarHBondContact O-CG1 3.41Å; I2420-I2424 PolarHBondContact O-N 2.69Å
2421R34Very low44.7Very low208 Ų208108.6 Ų108.679%0.78553%0.534SS*.Hα-helixtrans-77.7-29.7-170.9-155.5179.1-79.2-159.2-2.4113.9
2422K35.1Very low42.8Very low149 Ų149113.3 Ų113.365%0.64856%0.561SS**Hα-helixtrans-80.9-23.2-179.7-138.5-176.6-177.1-168.90113.6T2425K2422-T2425 PolarHBondContact O-OG1 3.04Å
2423F31.7Very low41.2Very low136 Ų136117.8 Ų117.860%0.59659%0.589SS**Hα-helixtrans-85.1-20.4174.2-86.3-77.9000113.4T2425 D2426F2423-T2425 PolarHBondContact O-N 3.15Å; F2423-D2426 PolarHBondContact O-N 3.39Å; F2423-D2426 VanDerWaalsContact O-O 3.12Å
2424I38.3Very low40Very low118 Ų118119.1 Ų119.161%0.60560%0.601SS**THydrogen-bonded Turntrans-66.8-19.5175.9-72166.4000112.2I2420 D2426I2420-I2424 HydrophobicContact CG2-CD1 3.75Å; I2420-I2424 WeakPolarHBondContact O-CD1 3.25Å; I2420-I2424 VanDerWaalsContact O-CG1 3.25Å; I2420-I2424 WeakPolarHBondContact O-CG1 3.41Å; I2420-I2424 PolarHBondContact O-N 2.69Å; I2424-D2426 VanDerWaalsContact C-N 3.35Å
2425T46.8Very low39.4Very low104 Ų104121 Ų12164%0.63860%0.6SS**THydrogen-bonded Turntrans-77.1-21.9175.5490000113.4K2422 F2423K2422-T2425 PolarHBondContact O-OG1 3.04Å; F2423-T2425 PolarHBondContact O-N 3.15Å
2426D33.5Very low39.7Very low107 Ų107119.4 Ų119.457%0.57259%0.592SS**SBendtrans-101.8107178.4-64.2-20000108.7F2423 I2424 I2428F2423-D2426 PolarHBondContact O-N 3.39Å; F2423-D2426 VanDerWaalsContact O-O 3.12Å; I2424-D2426 VanDerWaalsContact C-N 3.35Å; D2426-I2428 PolarHBondContact O-N 3.31Å
2427N34.2Very low40.5Very low160 Ų160115.5 Ų115.586%0.85657%0.567SS**  trans-63.939.2-170.6-93.3-22.8000116N2429N2427-N2429 PolarHBondContact O-N 3.13Å
2428I35.8Very low41.8Very low151 Ų151108.3 Ų108.377%0.77453%0.533SS*.  trans-95.990.9173.4-56.6177.7000109.1D2426D2426-I2428 PolarHBondContact O-N 3.31Å
2429N32.5Very low42.9Very low129 Ų129105.5 Ų105.569%0.6953%0.527SS*.  trans27.692.1152.3-66.8-19.6000117.4N2427 H2431N2427-N2429 PolarHBondContact O-N 3.13Å; N2429-H2431 PolarHBondContact O-N 3Å
2430N33.9Very low44.2Very low163 Ų163103.4 Ų103.487%0.87252%0.519SS*.SBendtrans35.911.8136.4-73.9-9.5000122.4
2431H31.7Very low45.1Very low133 Ų13399.7 Ų99.762%0.61650%0.499SS*.  trans-109.332.5179.7-70.7-70.1000112.7N2429 T2433N2429-H2431 PolarHBondContact O-N 3Å; H2431-T2433 PolarHBondContact O-N 3.34Å
2432T36.7Very low45.9Very low104 Ų10494.3 Ų94.364%0.63849%0.486SS*.  trans-71.376157.456.30000107.8A2434T2432-A2434 PolarHBondContact O-N 2.91Å
2433T43.2Very low46.3Very low100 Ų10090.6 Ų90.661%0.61347%0.471SS*.  trans-52.6110.8174.445.30000107.7H2431 R2435H2431-T2433 PolarHBondContact O-N 3.34Å; T2433-R2435 PolarHBondContact O-N 3.26Å
2434A48.5Very low46.6Very low35 Ų3587.5 Ų87.529%0.28947%0.466SS..  trans-54.4115.4166.900000106.5T2432 T2436 S2613T2432-A2434 PolarHBondContact O-N 2.91Å; A2434-T2436 WeakPolarHBondContact O-CG2 3.49Å; A2434-T2436 PolarHBondContact O-N 2.86Å; A2434-S2613 WeakPolarHBondContact CB-OG 3.23Å
2435R54.4Low46.5Very low96 Ų9686.8 Ų86.836%0.36246%0.462SS..  trans-58.8116.6179.1-78.5-173177.9166.1-4.7108.1N2303 Y2412 T2433N2303-R2435 PolarHBondContact OD1-NH1 3.37Å; Y2412-R2435 HydrophobicContact CE1-CB 4.18Å; T2433-R2435 PolarHBondContact O-N 3.26Å
2436T62.6Low46Very low14 Ų1486.9 Ų86.99%0.08646%0.458CS..  trans-110.1148.5177.355.40000109.7A2434 F2438A2434-T2436 WeakPolarHBondContact O-CG2 3.49Å; A2434-T2436 PolarHBondContact O-N 2.86Å; T2436-F2438 HydrophobicContact CG2-CD2 3.64Å; T2436-F2438 HydrophobicContact CG2-CE2 3.49Å; T2436-F2438 VanDerWaalsContact CG2-CE2 3.49Å; T2436-F2438 HydrophobicContact CG2-CZ 4.47Å; T2436-F2438 PolarHBondContact O-N 3.13Å; T2436-F2438 VanDerWaalsContact OG1-CD2 3.32Å; T2436-F2438 WeakPolarHBondContact OG1-CD2 3.47Å
2437L65.1Low46Very low2 Ų289.3 Ų89.31%0.0147%0.466CS..G310 helixtrans-73.5-9174.5-63.6172.8000113.4L2352 F2356 L2409 Y2412 I2413 Q2439 Y2440 L2606 H2610L2352-L2437 HydrophobicContact CD2-CD2 4.16Å; F2356-L2437 HydrophobicContact CE2-CB 4.33Å; F2356-L2437 HydrophobicContact CE2-CD2 4.25Å; F2356-L2437 HydrophobicContact CZ-CB 3.86Å; F2356-L2437 HydrophobicContact CZ-CD1 3.93Å; F2356-L2437 HydrophobicContact CZ-CD2 4.16Å; F2356-L2437 HydrophobicContact CZ-CG 4.2Å; L2409-L2437 HydrophobicContact CB-CD1 4.31Å; L2409-L2437 HydrophobicContact CD2-CD1 4.23Å; L2409-L2437 HydrophobicContact CD2-CD2 4.14Å; Y2412-L2437 HydrophobicContact CD1-CD2 3.46Å; Y2412-L2437 VanDerWaalsContact CD1-CD2 3.46Å; Y2412-L2437 HydrophobicContact CD1-CG 4.48Å; Y2412-L2437 HydrophobicContact CE1-CD2 3.89Å; Y2412-L2437 HydrophobicContact CG-CD2 4.42Å; I2413-L2437 HydrophobicContact CD1-CD1 3.54Å; I2413-L2437 HydrophobicContact CD1-CD2 4.33Å; I2413-L2437 HydrophobicContact CD1-CG 3.73Å; I2413-L2437 HydrophobicContact CG1-CG 4.29Å; L2437-Q2439 PolarHBondContact O-N 3.22Å; L2437-Q2439 VanDerWaalsContact O-N 3.08Å; L2437-Y2440 PolarHBondContact O-N 3.08Å; L2437-Y2440 VanDerWaalsContact O-N 3.13Å; L2437-L2606 HydrophobicContact CD1-CD2 4.42Å; L2437-H2610 VanDerWaalsContact CD1-NE2 3.27Å; L2437-H2610 WeakPolarHBondContact CD1-NE2 3.41Å; L2437-H2610 WeakPolarHBondContact CG-NE2 2.74Å; L2437-H2610 PolarHBondContact N-CE1 3.09Å
2438F64.4Low46.2Very low4 Ų487.5 Ų87.52%0.01847%0.466CS..G310 helixtrans-57.9-28.6-171.8-53.1-44.9000114.2T2436 Y2440 I2459 T2462 H2610 L2614T2436-F2438 HydrophobicContact CG2-CD2 3.64Å; T2436-F2438 HydrophobicContact CG2-CE2 3.49Å; T2436-F2438 VanDerWaalsContact CG2-CE2 3.49Å; T2436-F2438 HydrophobicContact CG2-CZ 4.47Å; T2436-F2438 PolarHBondContact O-N 3.13Å; T2436-F2438 VanDerWaalsContact OG1-CD2 3.32Å; T2436-F2438 WeakPolarHBondContact OG1-CD2 3.47Å; F2438-Y2440 VanDerWaalsContact C-N 3.32Å; F2438-Y2440 PolarHBondContact O-N 3.28Å; F2438-I2459 HydrophobicContact CB-CG1 4.3Å; F2438-I2459 HydrophobicContact CD1-CB 4.07Å; F2438-I2459 HydrophobicContact CD1-CG1 3.82Å; F2438-I2459 HydrophobicContact CD1-CG2 4.3Å; F2438-I2459 HydrophobicContact CD2-CD1 4.42Å; F2438-I2459 HydrophobicContact CD2-CG1 3.69Å; F2438-I2459 HydrophobicContact CE1-CB 4.02Å; F2438-I2459 HydrophobicContact CE1-CG1 4Å; F2438-I2459 HydrophobicContact CE1-CG2 3.72Å; F2438-I2459 HydrophobicContact CE2-CD1 4.43Å; F2438-I2459 HydrophobicContact CE2-CG1 3.89Å; F2438-I2459 HydrophobicContact CE2-CG2 4.43Å; F2438-I2459 HydrophobicContact CG-CB 4.43Å; F2438-I2459 HydrophobicContact CG-CG1 3.67Å; F2438-I2459 HydrophobicContact CZ-CB 4.34Å; F2438-I2459 HydrophobicContact CZ-CG1 4.05Å; F2438-I2459 HydrophobicContact CZ-CG2 3.81Å; F2438-T2462 HydrophobicContact CD1-CG2 4.19Å; F2438-T2462 WeakPolarHBondContact CD1-OG1 3.47Å; F2438-T2462 WeakPolarHBondContact CE1-OG1 3.49Å; F2438-H2610 AromaticContact CE1-CE1 3.85Å; F2438-H2610 AromaticContact CE1-ND1 3.33Å; F2438-H2610 VanDerWaalsContact CE1-ND1 3.33Å; F2438-H2610 WeakPolarHBondContact CE1-ND1 3.17Å; F2438-H2610 AromaticContact CZ-ND1 3.35Å; F2438-H2610 VanDerWaalsContact CZ-ND1 3.35Å; F2438-H2610 WeakPolarHBondContact CZ-ND1 3.28Å; F2438-L2614 HydrophobicContact CE2-CD2 3.69Å; F2438-L2614 HydrophobicContact CE2-CG 4.17Å; F2438-L2614 HydrophobicContact CZ-CD1 3.94Å; F2438-L2614 HydrophobicContact CZ-CD2 3.79Å; F2438-L2614 HydrophobicContact CZ-CG 3.89Å
2439Q62.7Low46.4Very low126 Ų12689 Ų8959%0.58947%0.469SS*.G310 helixtrans-73.1-23.9-177-67.4179.6-16.100113.4L2437L2437-Q2439 PolarHBondContact O-N 3.22Å; L2437-Q2439 VanDerWaalsContact O-N 3.08Å
2440Y61.4Low46.7Very low33 Ų3388.8 Ų88.813%0.12946%0.464CS..THydrogen-bonded Turntrans-98.8-10.5-171.5-58.5-75.1000113.5S2349 L2352 N2353 Y2412 L2437 F2438 N2442S2349-Y2440 WeakPolarHBondContact OG-CE1 3.32Å; L2352-Y2440 HydrophobicContact CB-CD1 4.12Å; L2352-Y2440 HydrophobicContact CB-CD2 4.41Å; L2352-Y2440 HydrophobicContact CB-CG 3.94Å; L2352-Y2440 HydrophobicContact CD1-CD1 4.14Å; L2352-Y2440 HydrophobicContact CD1-CD2 3.57Å; L2352-Y2440 HydrophobicContact CD1-CE1 4.1Å; L2352-Y2440 HydrophobicContact CD1-CE2 3.49Å; L2352-Y2440 VanDerWaalsContact CD1-CE2 3.49Å; L2352-Y2440 HydrophobicContact CD1-CG 3.88Å; N2353-Y2440 PolarHBondContact OD1-O 2.78Å; Y2412-Y2440 HydrophobicContact CE1-CE2 4.3Å; Y2412-Y2440 AromaticContact CZ-CE2 3.93Å; L2437-Y2440 PolarHBondContact O-N 3.08Å; L2437-Y2440 VanDerWaalsContact O-N 3.13Å; F2438-Y2440 VanDerWaalsContact C-N 3.32Å; F2438-Y2440 PolarHBondContact O-N 3.28Å; Y2440-N2442 PolarHBondContact O-N 3.36Å; Y2440-N2442 VanDerWaalsContact O-N 3.17Å
2441F60.1Low47Very low21 Ų2189.9 Ų89.99%0.09246%0.464CS..  trans-79.1100.7175.5-166.3-85.8000110F2356 I2360 N2461 T2462 L2465F2356-F2441 HydrophobicContact CD1-CD2 4.18Å; I2360-F2441 HydrophobicContact CD1-CD2 4.34Å; I2360-F2441 HydrophobicContact CD1-CE2 3.55Å; I2360-F2441 HydrophobicContact CD1-CZ 3.9Å; I2360-F2441 HydrophobicContact CG1-CE2 4.03Å; I2360-F2441 HydrophobicContact CG1-CZ 4.48Å; F2441-N2461 HydrophobicContact CD1-CB 3.56Å; F2441-N2461 HydrophobicContact CE1-CB 3.25Å; F2441-N2461 HydrophobicContact CG-CB 4.37Å; F2441-N2461 HydrophobicContact CZ-CB 3.81Å; F2441-T2462 HydrophobicContact CB-CG2 3.51Å; F2441-T2462 HydrophobicContact CD2-CG2 4.07Å; F2441-T2462 HydrophobicContact CG-CG2 3.89Å; F2441-L2465 HydrophobicContact CD2-CD1 4.42Å; F2441-L2465 HydrophobicContact CE2-CD1 3.7Å
2442N52Low47.4Very low96 Ų9691.1 Ų91.151%0.51348%0.475SS..  trans-98.5130.3172.8-79.9-20.8000110.3Y2440 S2444Y2440-N2442 PolarHBondContact O-N 3.36Å; Y2440-N2442 VanDerWaalsContact O-N 3.17Å; N2442-S2444 PolarHBondContact O-N 2.68Å
2443H41.9Very low47.9Very low70 Ų7087.7 Ų87.732%0.32446%0.455SS..  trans-64.490170.8-90.1-51.3000109.8N2461H2443-N2461 PolarHBondContact CE1-ND2 2.88Å; H2443-N2461 PolarHBondContact NE2-ND2 3.44Å
2444S38Very low48.4Very low72 Ų7287.1 Ų87.150%0.50345%0.452SS..SBendtrans-87.1-1.316750.80000113.5N2442N2442-S2444 PolarHBondContact O-N 2.68Å
2445I38Very low48.8Very low102 Ų10289 Ų8952%0.52345%0.454SS..SBendtrans-127.2-5.2-172.7-59.5-179.2000115.7I2360I2360-I2445 HydrophobicContact CG2-CD1 4.22Å
2446I35.8Very low49.2Very low106 Ų10686 Ų8654%0.54445%0.445SS..SBendtrans-127.1103.4178-53.1178.4000110.4
2447H33.5Very low49.3Very low159 Ų15986.9 Ų86.974%0.73645%0.45SS*.  trans39.4116.9163.4-66.2-73.6000117.3E2449H2447-E2449 PolarHBondContact O-N 3.38Å
2448S37.9Very low49.2Very low122 Ų12289.7 Ų89.785%0.85346%0.462SS*.THydrogen-bonded Turntrans-55.811.1172.748.30000116.4
2449E39.9Very low49.2Very low183 Ų18389.7 Ų89.786%0.85546%0.462SS*.THydrogen-bonded Turntrans-970.5179.1-66.3-164.4159.100114.5H2447H2447-E2449 PolarHBondContact O-N 3.38Å
2450Q38.5Very low49.5Very low123 Ų12386.4 Ų86.458%0.57545%0.447SS*.  trans-120.342.9-179.1-63.6-166.70.200115N2452 S2453Q2450-N2452 PolarHBondContact O-N 2.7Å; Q2450-N2452 VanDerWaalsContact O-N 3.07Å; Q2450-S2453 WeakPolarHBondContact O-CB 3.4Å; Q2450-S2453 PolarHBondContact O-N 3.17Å
2451E40.7Very low49.9Very low187 Ų18786.1 Ų86.187%0.87445%0.447SS*.THydrogen-bonded Turntrans-58.6-17.8170.6-73.4-168.715500113.4
2452N40.3Very low50.5Low159 Ų15985.1 Ų85.185%0.8544%0.443SS*.THydrogen-bonded Turntrans-9521174.3-71.8-19.8000114.1Q2450 T2454Q2450-N2452 PolarHBondContact O-N 2.7Å; Q2450-N2452 VanDerWaalsContact O-N 3.07Å; N2452-T2454 PolarHBondContact O-N 3.47Å
2453S46.1Very low51.6Low32 Ų3280.8 Ų80.822%0.22442%0.42CS..  trans-51.6117.5178.755.30000111Q2450Q2450-S2453 WeakPolarHBondContact O-CB 3.4Å; Q2450-S2453 PolarHBondContact O-N 3.17Å
2454T55.5Low53.2Low87 Ų8779.3 Ų79.353%0.53442%0.416SS..  trans-59.5147.7-177.555.10000109.4N2452 N2456 V2457N2452-T2454 PolarHBondContact O-N 3.47Å; T2454-N2456 PolarHBondContact O-N 3Å; T2454-V2457 WeakPolarHBondContact O-CB 3.17Å; T2454-V2457 PolarHBondContact O-N 3.14Å
2455F56.6Low55.2Low76 Ų7676.7 Ų76.733%0.33340%0.396SS..Hα-helixtrans-46-31.4179.8-176.7-106.7000113.2V2457 K2458 I2459 I2620F2455-V2457 PolarHBondContact O-N 3.08Å; F2455-K2458 PolarHBondContact O-N 2.77Å; F2455-I2459 HydrophobicContact CD1-CD1 3.73Å; F2455-I2459 HydrophobicContact CE1-CD1 3.59Å; F2455-I2459 HydrophobicContact CE1-CG1 4.37Å; F2455-I2459 HydrophobicContact CZ-CD1 4.35Å; F2455-I2459 WeakPolarHBondContact O-CG1 3.44Å; F2455-I2459 PolarHBondContact O-N 2.91Å; F2455-I2620 HydrophobicContact CE1-CG2 3.82Å; F2455-I2620 HydrophobicContact CZ-CG2 3.62Å
2456N61.7Low57.3Low32 Ų3272.1 Ų72.117%0.17137%0.373CS..Hα-helixtrans-60.8-37.6174.7-67.2-6.5000114.2T2454 I2459 Q2460 N2688 W2691T2454-N2456 PolarHBondContact O-N 3Å; N2456-I2459 PolarHBondContact O-N 3.42Å; N2456-Q2460 PolarHBondContact O-N 3.13Å; N2456-N2688 PolarHBondContact ND2-OD1 3.46Å; N2456-W2691 HydrophobicContact CB-CH2 4.2Å; N2456-W2691 HydrophobicContact CB-CZ3 4.29Å
2457V64.9Low59.5Low32 Ų3267.5 Ų67.519%0.19435%0.349CS..Hα-helixtrans-67.1-39.7179.9178.60000111.1T2454 F2455 I2459 Q2460 N2461T2454-V2457 WeakPolarHBondContact O-CB 3.17Å; T2454-V2457 PolarHBondContact O-N 3.14Å; F2455-V2457 PolarHBondContact O-N 3.08Å; V2457-I2459 VanDerWaalsContact C-N 3.34Å; V2457-I2459 PolarHBondContact O-N 3.2Å; V2457-Q2460 WeakPolarHBondContact O-CB 3.14Å; V2457-Q2460 PolarHBondContact O-N 3.44Å; V2457-N2461 PolarHBondContact O-N 2.66Å; V2457-N2461 PolarHBondContact O-ND2 3.47Å
2458K62.9Low61.8Low62 Ų6262.7 Ų62.727%0.2733%0.329SS..Hα-helixtrans-64.1-40.8176.4-66.1-171.3178.7-170.10111.9F2455 N2461 T2462F2455-K2458 PolarHBondContact O-N 2.77Å; K2458-N2461 PolarHBondContact O-N 2.95Å; K2458-T2462 PolarHBondContact O-N 3.17Å; K2458-T2462 PolarHBondContact O-OG1 3.36Å
2459I65.8Low64Low3 Ų356.9 Ų56.92%0.01529%0.289CS..Hα-helixtrans-59.3-50.2173.9-64.2168.4000110.2F2438 F2455 N2456 V2457 N2461 T2462 L2463 L2614F2438-I2459 HydrophobicContact CB-CG1 4.3Å; F2438-I2459 HydrophobicContact CD1-CB 4.07Å; F2438-I2459 HydrophobicContact CD1-CG1 3.82Å; F2438-I2459 HydrophobicContact CD1-CG2 4.3Å; F2438-I2459 HydrophobicContact CD2-CD1 4.42Å; F2438-I2459 HydrophobicContact CD2-CG1 3.69Å; F2438-I2459 HydrophobicContact CE1-CB 4.02Å; F2438-I2459 HydrophobicContact CE1-CG1 4Å; F2438-I2459 HydrophobicContact CE1-CG2 3.72Å; F2438-I2459 HydrophobicContact CE2-CD1 4.43Å; F2438-I2459 HydrophobicContact CE2-CG1 3.89Å; F2438-I2459 HydrophobicContact CE2-CG2 4.43Å; F2438-I2459 HydrophobicContact CG-CB 4.43Å; F2438-I2459 HydrophobicContact CG-CG1 3.67Å; F2438-I2459 HydrophobicContact CZ-CB 4.34Å; F2438-I2459 HydrophobicContact CZ-CG1 4.05Å; F2438-I2459 HydrophobicContact CZ-CG2 3.81Å; F2455-I2459 HydrophobicContact CD1-CD1 3.73Å; F2455-I2459 HydrophobicContact CE1-CD1 3.59Å; F2455-I2459 HydrophobicContact CE1-CG1 4.37Å; F2455-I2459 HydrophobicContact CZ-CD1 4.35Å; F2455-I2459 WeakPolarHBondContact O-CG1 3.44Å; F2455-I2459 PolarHBondContact O-N 2.91Å; N2456-I2459 PolarHBondContact O-N 3.42Å; V2457-I2459 VanDerWaalsContact C-N 3.34Å; V2457-I2459 PolarHBondContact O-N 3.2Å; I2459-N2461 PolarHBondContact O-N 3.31Å; I2459-T2462 PolarHBondContact O-N 3.2Å; I2459-T2462 PolarHBondContact O-OG1 3.45Å; I2459-L2463 HydrophobicContact CG2-CD1 3.87Å; I2459-L2463 PolarHBondContact O-N 3.28Å; I2459-L2463 VanDerWaalsContact O-N 3.11Å; I2459-L2614 HydrophobicContact CD1-CD2 3.85Å; I2459-L2614 HydrophobicContact CG1-CD2 4.39Å; I2459-L2614 HydrophobicContact CG2-CD1 3.72Å; I2459-L2614 HydrophobicContact CG2-CD2 3.88Å; I2459-L2614 HydrophobicContact CG2-CG 4.45Å
2460Q68.5Low66.1Low57 Ų5748.2 Ų48.227%0.26625%0.248SC..Hα-helixtrans-55-49.7179175.3164.215.500111.9N2456 V2457 T2462 L2463 T2464 W2691 H2695N2456-Q2460 PolarHBondContact O-N 3.13Å; V2457-Q2460 WeakPolarHBondContact O-CB 3.14Å; V2457-Q2460 PolarHBondContact O-N 3.44Å; Q2460-T2462 PolarHBondContact O-N 3.13Å; Q2460-L2463 PolarHBondContact O-N 3.22Å; Q2460-T2464 HydrophobicContact CG-CG2 4.22Å; Q2460-T2464 VanDerWaalsContact O-CG2 3.3Å; Q2460-T2464 WeakPolarHBondContact O-CG2 3.4Å; Q2460-T2464 PolarHBondContact O-N 2.91Å; Q2460-T2464 PolarHBondContact O-OG1 3.08Å; Q2460-W2691 HydrophobicContact CB-CH2 4.06Å; Q2460-W2691 HydrophobicContact CB-CZ2 4.41Å; Q2460-H2695 VanDerWaalsContact CG-NE2 3.35Å; Q2460-H2695 WeakPolarHBondContact CG-NE2 3.43Å; Q2460-H2695 PolarHBondContact NE2-CE1 3.08Å; Q2460-H2695 VanDerWaalsContact NE2-CE1 3.26Å; Q2460-H2695 PolarHBondContact NE2-NE2 3.04Å; Q2460-H2695 VanDerWaalsContact NE2-NE2 3.19Å
2461N70Confident68.3Low27 Ų2743.8 Ų43.814%0.14423%0.227CC..Hα-helixtrans-65.8-36.4-175.7-64.2-24.3000113.7F2441 H2443 V2457 K2458 I2459 T2464 L2465F2441-N2461 HydrophobicContact CD1-CB 3.56Å; F2441-N2461 HydrophobicContact CE1-CB 3.25Å; F2441-N2461 HydrophobicContact CG-CB 4.37Å; F2441-N2461 HydrophobicContact CZ-CB 3.81Å; H2443-N2461 PolarHBondContact CE1-ND2 2.88Å; H2443-N2461 PolarHBondContact NE2-ND2 3.44Å; V2457-N2461 PolarHBondContact O-N 2.66Å; V2457-N2461 PolarHBondContact O-ND2 3.47Å; K2458-N2461 PolarHBondContact O-N 2.95Å; I2459-N2461 PolarHBondContact O-N 3.31Å; N2461-T2464 VanDerWaalsContact CA-OG1 3.31Å; N2461-T2464 WeakPolarHBondContact CA-OG1 3.46Å; N2461-T2464 PolarHBondContact O-OG1 3.4Å; N2461-L2465 WeakPolarHBondContact O-CB 3.47Å; N2461-L2465 PolarHBondContact O-N 3Å
2462T72.2Confident70.3Confident1 Ų135.6 Ų35.61%0.00619%0.188CC..Hα-helixtrans-68.5-39174.957.80000112.2F2438 F2441 K2458 I2459 Q2460 L2465 I2466F2438-T2462 HydrophobicContact CD1-CG2 4.19Å; F2438-T2462 WeakPolarHBondContact CD1-OG1 3.47Å; F2438-T2462 WeakPolarHBondContact CE1-OG1 3.49Å; F2441-T2462 HydrophobicContact CB-CG2 3.51Å; F2441-T2462 HydrophobicContact CD2-CG2 4.07Å; F2441-T2462 HydrophobicContact CG-CG2 3.89Å; K2458-T2462 PolarHBondContact O-N 3.17Å; K2458-T2462 PolarHBondContact O-OG1 3.36Å; I2459-T2462 PolarHBondContact O-N 3.2Å; I2459-T2462 PolarHBondContact O-OG1 3.45Å; Q2460-T2462 PolarHBondContact O-N 3.13Å; T2462-L2465 PolarHBondContact O-N 3.2Å; T2462-I2466 VanDerWaalsContact O-CG1 3.29Å; T2462-I2466 WeakPolarHBondContact O-CG1 3.29Å; T2462-I2466 PolarHBondContact O-N 3.45Å
2463L74.6Confident72.5Confident4 Ų428 Ų282%0.02115%0.148CC..Hα-helixtrans-66.4-45.4177-75.9170.5000110.8I2459 Q2460 L2465 I2466 V2467 L2607 H2610 L2611 L2614 L2699I2459-L2463 HydrophobicContact CG2-CD1 3.87Å; I2459-L2463 PolarHBondContact O-N 3.28Å; I2459-L2463 VanDerWaalsContact O-N 3.11Å; Q2460-L2463 PolarHBondContact O-N 3.22Å; L2463-L2465 VanDerWaalsContact C-N 3.3Å; L2463-L2465 PolarHBondContact O-N 3.42Å; L2463-I2466 PolarHBondContact O-N 3.34Å; L2463-V2467 WeakPolarHBondContact O-CB 3.47Å; L2463-V2467 VanDerWaalsContact O-CG2 3.24Å; L2463-V2467 WeakPolarHBondContact O-CG2 3.23Å; L2463-V2467 PolarHBondContact O-N 2.83Å; L2463-L2607 HydrophobicContact CD2-CD1 4.09Å; L2463-H2610 HydrophobicContact CD2-CB 4.08Å; L2463-L2611 HydrophobicContact CD2-CD2 4.11Å; L2463-L2611 HydrophobicContact CD2-CG 4.42Å; L2463-L2614 HydrophobicContact CD1-CD1 3.94Å; L2463-L2699 HydrophobicContact CB-CD1 4.14Å; L2463-L2699 HydrophobicContact CD1-CD1 4.43Å
2464T76.3Confident74.3Confident39 Ų3926.8 Ų26.824%0.23914%0.139CC..Hα-helixtrans-60.5-41.4177.4560000111.2Q2460 N2461 V2467 N2468 L2699Q2460-T2464 HydrophobicContact CG-CG2 4.22Å; Q2460-T2464 VanDerWaalsContact O-CG2 3.3Å; Q2460-T2464 WeakPolarHBondContact O-CG2 3.4Å; Q2460-T2464 PolarHBondContact O-N 2.91Å; Q2460-T2464 PolarHBondContact O-OG1 3.08Å; N2461-T2464 VanDerWaalsContact CA-OG1 3.31Å; N2461-T2464 WeakPolarHBondContact CA-OG1 3.46Å; N2461-T2464 PolarHBondContact O-OG1 3.4Å; T2464-V2467 PolarHBondContact O-N 3.18Å; T2464-N2468 VanDerWaalsContact O-CB 3.28Å; T2464-N2468 WeakPolarHBondContact O-CB 3.44Å; T2464-N2468 PolarHBondContact O-N 3.25Å; T2464-N2468 PolarHBondContact O-ND2 3.39Å; T2464-N2468 PolarHBondContact O-OD1 3.21Å; T2464-L2699 HydrophobicContact CG2-CD2 3.71Å
2465L80.2Confident75.5Confident17 Ų1725.3 Ų25.39%0.08913%0.125CC..Hα-helixtrans-63.1-45.5175.8173.3156.4000112.6F2356 L2359 I2360 F2441 N2461 T2462 L2463 V2467 N2468 L2469F2356-L2465 HydrophobicContact CD1-CD1 4.38Å; L2359-L2465 HydrophobicContact CD2-CD1 3.75Å; L2359-L2465 HydrophobicContact CD2-CD2 3.32Å; L2359-L2465 HydrophobicContact CD2-CG 3.75Å; I2360-L2465 HydrophobicContact CD1-CD1 4.39Å; I2360-L2465 HydrophobicContact CG1-CD1 3.52Å; F2441-L2465 HydrophobicContact CD2-CD1 4.42Å; F2441-L2465 HydrophobicContact CE2-CD1 3.7Å; N2461-L2465 WeakPolarHBondContact O-CB 3.47Å; N2461-L2465 PolarHBondContact O-N 3Å; T2462-L2465 PolarHBondContact O-N 3.2Å; L2463-L2465 VanDerWaalsContact C-N 3.3Å; L2463-L2465 PolarHBondContact O-N 3.42Å; L2465-V2467 VanDerWaalsContact C-N 3.33Å; L2465-V2467 PolarHBondContact O-N 3.26Å; L2465-N2468 PolarHBondContact O-N 2.71Å; L2465-L2469 VanDerWaalsContact O-CB 3.29Å; L2465-L2469 WeakPolarHBondContact O-CB 3.5Å; L2465-L2469 PolarHBondContact O-N 3.41Å
2466I81.5Confident76.7Confident7 Ų722.6 Ų22.64%0.03612%0.115CC..Hα-helixtrans-64.1-41.4178.3-66.8164.8000110.5T2462 L2463 L2469 L2470 L2606 L2607T2462-I2466 VanDerWaalsContact O-CG1 3.29Å; T2462-I2466 WeakPolarHBondContact O-CG1 3.29Å; T2462-I2466 PolarHBondContact O-N 3.45Å; L2463-I2466 PolarHBondContact O-N 3.34Å; I2466-L2469 PolarHBondContact O-N 3.05Å; I2466-L2470 VanDerWaalsContact O-CB 3.32Å; I2466-L2470 WeakPolarHBondContact O-CB 3.15Å; I2466-L2470 PolarHBondContact O-N 3.49Å; I2466-L2606 HydrophobicContact CD1-CB 4.23Å; I2466-L2606 HydrophobicContact CG2-CB 4.44Å; I2466-L2607 HydrophobicContact CG2-CB 3.81Å; I2466-L2607 HydrophobicContact CG2-CD1 4.21Å
2467V81.5Confident77.7Confident8 Ų821.2 Ų21.25%0.04811%0.108CC..Hα-helixtrans-64.2-46.6176.9168.90000110.9L2463 T2464 L2465 L2469 L2470 Q2471 L2607 L2699 I2704L2463-V2467 WeakPolarHBondContact O-CB 3.47Å; L2463-V2467 VanDerWaalsContact O-CG2 3.24Å; L2463-V2467 WeakPolarHBondContact O-CG2 3.23Å; L2463-V2467 PolarHBondContact O-N 2.83Å; T2464-V2467 PolarHBondContact O-N 3.18Å; L2465-V2467 VanDerWaalsContact C-N 3.33Å; L2465-V2467 PolarHBondContact O-N 3.26Å; V2467-L2469 VanDerWaalsContact C-N 3.34Å; V2467-L2469 PolarHBondContact O-N 3.05Å; V2467-L2470 PolarHBondContact O-N 2.95Å; V2467-Q2471 WeakPolarHBondContact O-CB 3.09Å; V2467-Q2471 PolarHBondContact O-N 3.29Å; V2467-L2607 HydrophobicContact CG2-CD1 3.93Å; V2467-L2699 WeakPolarHBondContact CG1-O 3.47Å; V2467-I2704 HydrophobicContact CG1-CD1 3.71Å
2468N81.8Confident78.2Confident58 Ų5825.1 Ų25.131%0.3112%0.119SC..Hα-helixtrans-61.4-42.5177.7-72.7-9.5000111.6T2464 L2465 Q2471 W2472T2464-N2468 VanDerWaalsContact O-CB 3.28Å; T2464-N2468 WeakPolarHBondContact O-CB 3.44Å; T2464-N2468 PolarHBondContact O-N 3.25Å; T2464-N2468 PolarHBondContact O-ND2 3.39Å; T2464-N2468 PolarHBondContact O-OD1 3.21Å; L2465-N2468 PolarHBondContact O-N 2.71Å; N2468-Q2471 PolarHBondContact O-N 2.91Å; N2468-W2472 WeakPolarHBondContact O-CB 3.26Å; N2468-W2472 PolarHBondContact O-N 3.38Å
2469L85Confident78.7Confident1 Ų123.1 Ų23.11%0.00511%0.112CC..Hα-helixtrans-62.8-43.4175.9178.4159.7000111.4L2359 I2363 L2406 L2465 I2466 V2467 W2472 S2473 I2599L2359-L2469 HydrophobicContact CD1-CD1 3.78Å; L2359-L2469 HydrophobicContact CD2-CD1 3.96Å; L2359-L2469 HydrophobicContact CG-CD1 4.17Å; I2363-L2469 HydrophobicContact CD1-CB 3.77Å; I2363-L2469 HydrophobicContact CD1-CD1 3.41Å; I2363-L2469 VanDerWaalsContact CD1-CD1 3.41Å; I2363-L2469 HydrophobicContact CD1-CG 3.62Å; L2406-L2469 HydrophobicContact CD1-CD1 3.94Å; L2406-L2469 HydrophobicContact CD1-CD2 3.89Å; L2406-L2469 HydrophobicContact CD1-CG 4.49Å; L2406-L2469 HydrophobicContact CD2-CD1 3.53Å; L2406-L2469 HydrophobicContact CD2-CD2 4.4Å; L2406-L2469 HydrophobicContact CG-CD1 4.05Å; L2465-L2469 VanDerWaalsContact O-CB 3.29Å; L2465-L2469 WeakPolarHBondContact O-CB 3.5Å; L2465-L2469 PolarHBondContact O-N 3.41Å; I2466-L2469 PolarHBondContact O-N 3.05Å; V2467-L2469 VanDerWaalsContact C-N 3.34Å; V2467-L2469 PolarHBondContact O-N 3.05Å; L2469-W2472 PolarHBondContact O-N 3.14Å; L2469-S2473 WeakPolarHBondContact O-CB 3.4Å; L2469-S2473 PolarHBondContact O-N 3.35Å; L2469-S2473 PolarHBondContact O-OG 3.05Å; L2469-I2599 HydrophobicContact CD2-CG2 3.68Å
2470L84.2Confident79.3Confident0 Ų023.4 Ų23.40%011%0.114CC..Hα-helixtrans-64.4-46.4177.2-173.9151.3000110.8I2466 V2467 W2472 S2473 L2474 T2604 L2607 I2704I2466-L2470 VanDerWaalsContact O-CB 3.32Å; I2466-L2470 WeakPolarHBondContact O-CB 3.15Å; I2466-L2470 PolarHBondContact O-N 3.49Å; V2467-L2470 PolarHBondContact O-N 2.95Å; L2470-W2472 PolarHBondContact O-N 3.42Å; L2470-S2473 PolarHBondContact O-N 2.77Å; L2470-S2473 PolarHBondContact O-OG 2.93Å; L2470-L2474 HydrophobicContact CD2-CD1 3.45Å; L2470-L2474 VanDerWaalsContact CD2-CD1 3.45Å; L2470-L2474 HydrophobicContact CD2-CG 4.3Å; L2470-L2474 HydrophobicContact CG-CD1 4.39Å; L2470-L2474 WeakPolarHBondContact O-CG 3.13Å; L2470-L2474 PolarHBondContact O-N 3.13Å; L2470-T2604 HydrophobicContact CD1-CG2 3.47Å; L2470-T2604 VanDerWaalsContact CD1-CG2 3.47Å; L2470-L2607 HydrophobicContact CD1-CD2 4.39Å; L2470-I2704 HydrophobicContact CD2-CB 4.28Å; L2470-I2704 HydrophobicContact CD2-CD1 4.17Å; L2470-I2704 HydrophobicContact CD2-CG1 4.04Å; L2470-I2704 HydrophobicContact CD2-CG2 3.37Å
2471Q83.3Confident79.4Confident30 Ų3022.9 Ų22.914%0.1411%0.111CC..Hα-helixtrans-61.7-44.7176.8-168-174.618.700111.6V2467 N2468 L2474 K2475V2467-Q2471 WeakPolarHBondContact O-CB 3.09Å; V2467-Q2471 PolarHBondContact O-N 3.29Å; N2468-Q2471 PolarHBondContact O-N 2.91Å; Q2471-L2474 PolarHBondContact O-N 3.09Å; Q2471-K2475 HydrophobicContact CG-CD 4.33Å; Q2471-K2475 WeakPolarHBondContact O-CB 3.4Å; Q2471-K2475 WeakPolarHBondContact O-CG 3.43Å; Q2471-K2475 PolarHBondContact O-N 3.47Å
2472W84.4Confident79.3Confident15 Ų1524.2 Ų24.26%0.05712%0.116CC..Hα-helixtrans-58.3-50.4174.7172.179.7000111.1Y2398 I2402 N2468 L2469 L2470 L2474 K2475 C2476 L2596 I2599Y2398-W2472 AromaticContact CE1-CH2 3.91Å; Y2398-W2472 HydrophobicContact CE1-CH2 3.91Å; Y2398-W2472 AromaticContact CE1-CZ2 3.64Å; Y2398-W2472 HydrophobicContact CE1-CZ2 3.64Å; I2402-W2472 HydrophobicContact CD1-CH2 3.62Å; I2402-W2472 HydrophobicContact CD1-CZ2 4.34Å; I2402-W2472 HydrophobicContact CD1-CZ3 3.84Å; I2402-W2472 HydrophobicContact CG2-CZ3 4.37Å; N2468-W2472 WeakPolarHBondContact O-CB 3.26Å; N2468-W2472 PolarHBondContact O-N 3.38Å; L2469-W2472 PolarHBondContact O-N 3.14Å; L2470-W2472 PolarHBondContact O-N 3.42Å; W2472-L2474 VanDerWaalsContact C-N 3.34Å; W2472-L2474 PolarHBondContact O-N 3.33Å; W2472-K2475 PolarHBondContact O-N 2.94Å; W2472-C2476 PolarHBondContact NE1-SG 2.89Å; W2472-C2476 VanDerWaalsContact NE1-SG 3.42Å; W2472-C2476 WeakPolarHBondContact O-CB 3.41Å; W2472-C2476 PolarHBondContact O-N 3.28Å; W2472-C2476 PolarHBondContact O-SG 3.32Å; W2472-L2596 HydrophobicContact CH2-CD2 4.37Å; W2472-L2596 HydrophobicContact CZ3-CD2 4.43Å; W2472-I2599 HydrophobicContact CZ3-CD1 4.33Å
2473S86.4Confident79.1Confident0 Ų025.4 Ų25.40%012%0.122CC..Hα-helixtrans-63.1-37-179690000113.2L2469 L2470 L2477 I2600L2469-S2473 WeakPolarHBondContact O-CB 3.4Å; L2469-S2473 PolarHBondContact O-N 3.35Å; L2469-S2473 PolarHBondContact O-OG 3.05Å; L2470-S2473 PolarHBondContact O-N 2.77Å; L2470-S2473 PolarHBondContact O-OG 2.93Å; S2473-L2477 VanDerWaalsContact O-CB 3.29Å; S2473-L2477 WeakPolarHBondContact O-CB 3.15Å; S2473-L2477 PolarHBondContact O-N 3.3Å; S2473-I2600 VanDerWaalsContact OG-CG1 3.23Å; S2473-I2600 WeakPolarHBondContact OG-CG1 3.21Å
2474L83.4Confident78.7Confident6 Ų625.8 Ų25.83%0.03113%0.125CC..Hα-helixtrans-68.4-41.2174.7-73.4171.7000112L2470 Q2471 W2472 L2477 R2478 I2600 M2707 L2711L2470-L2474 HydrophobicContact CD2-CD1 3.45Å; L2470-L2474 VanDerWaalsContact CD2-CD1 3.45Å; L2470-L2474 HydrophobicContact CD2-CG 4.3Å; L2470-L2474 HydrophobicContact CG-CD1 4.39Å; L2470-L2474 WeakPolarHBondContact O-CG 3.13Å; L2470-L2474 PolarHBondContact O-N 3.13Å; Q2471-L2474 PolarHBondContact O-N 3.09Å; W2472-L2474 VanDerWaalsContact C-N 3.34Å; W2472-L2474 PolarHBondContact O-N 3.33Å; L2474-L2477 PolarHBondContact O-N 3.14Å; L2474-R2478 WeakPolarHBondContact O-CB 3.27Å; L2474-R2478 PolarHBondContact O-N 3.19Å; L2474-I2600 HydrophobicContact CD2-CD1 3.87Å; L2474-I2600 HydrophobicContact CD2-CG1 4.3Å; L2474-I2600 HydrophobicContact CG-CD1 4.49Å; L2474-M2707 HydrophobicContact CB-CE 4.28Å; L2474-M2707 HydrophobicContact CD1-CB 3.8Å; L2474-M2707 HydrophobicContact CD2-CB 4.3Å; L2474-M2707 HydrophobicContact CG-CB 4.5Å; L2474-L2711 HydrophobicContact CD2-CD1 4.05Å
2475K81.2Confident78Confident57 Ų5725.9 Ų25.925%0.24812%0.123CC..Hα-helixtrans-64.5-46.5175.9-75.5177.1178.4176.40111.4I2368 F2371 Q2471 W2472 L2477 R2478 S2479I2368-K2475 HydrophobicContact CG2-CD 4.33Å; I2368-K2475 VanDerWaalsContact CG2-NZ 3.32Å; F2371-K2475 HydrophobicContact CD2-CB 4.46Å; F2371-K2475 HydrophobicContact CE2-CB 4.47Å; Q2471-K2475 HydrophobicContact CG-CD 4.33Å; Q2471-K2475 WeakPolarHBondContact O-CB 3.4Å; Q2471-K2475 WeakPolarHBondContact O-CG 3.43Å; Q2471-K2475 PolarHBondContact O-N 3.47Å; W2472-K2475 PolarHBondContact O-N 2.94Å; K2475-L2477 VanDerWaalsContact C-N 3.33Å; K2475-L2477 PolarHBondContact O-N 3.45Å; K2475-R2478 PolarHBondContact O-N 3.31Å; K2475-S2479 PolarHBondContact O-N 3.4Å
2476C81.7Confident77.1Confident18 Ų1825.8 Ų25.812%0.12213%0.125CC..Hα-helixtrans-61.1-41.1174.2-72.10000111.8W2472 R2478 S2479 K2480 L2596W2472-C2476 PolarHBondContact NE1-SG 2.89Å; W2472-C2476 VanDerWaalsContact NE1-SG 3.42Å; W2472-C2476 WeakPolarHBondContact O-CB 3.41Å; W2472-C2476 PolarHBondContact O-N 3.28Å; W2472-C2476 PolarHBondContact O-SG 3.32Å; C2476-R2478 PolarHBondContact O-N 3.33Å; C2476-S2479 PolarHBondContact O-N 2.87Å; C2476-S2479 PolarHBondContact O-OG 3.38Å; C2476-K2480 WeakPolarHBondContact O-CG 3.05Å; C2476-K2480 PolarHBondContact O-N 3.12Å; C2476-L2596 HydrophobicContact CB-CD1 4.15Å; C2476-L2596 HydrophobicContact CB-CD2 3.87Å
2477L82.3Confident76Confident3 Ų326.6 Ų26.62%0.01613%0.129CC..Hα-helixtrans-62.5-44.9176.1-17767000111.4S2473 L2474 K2475 S2479 K2480 E2481 L2593 L2596 I2600 L2711S2473-L2477 VanDerWaalsContact O-CB 3.29Å; S2473-L2477 WeakPolarHBondContact O-CB 3.15Å; S2473-L2477 PolarHBondContact O-N 3.3Å; L2474-L2477 PolarHBondContact O-N 3.14Å; K2475-L2477 VanDerWaalsContact C-N 3.33Å; K2475-L2477 PolarHBondContact O-N 3.45Å; L2477-S2479 VanDerWaalsContact C-N 3.32Å; L2477-S2479 PolarHBondContact O-N 3.2Å; L2477-K2480 PolarHBondContact O-N 3.33Å; L2477-E2481 WeakPolarHBondContact O-CG 3.19Å; L2477-E2481 PolarHBondContact O-N 2.89Å; L2477-L2593 HydrophobicContact CD1-CD2 3.7Å; L2477-L2596 HydrophobicContact CD1-CB 4.41Å; L2477-I2600 HydrophobicContact CB-CD1 4.37Å; L2477-I2600 HydrophobicContact CD2-CD1 3.63Å; L2477-L2711 HydrophobicContact CD2-CD1 3.27Å
2478R76Confident74.5Confident115 Ų11528 Ų2843%0.43414%0.136SC..Hα-helixtrans-61.5-39.2177.2-171.5174.4176.4178.3-7.2112L2474 K2475 C2476 E2481 K2482 M2707L2474-R2478 WeakPolarHBondContact O-CB 3.27Å; L2474-R2478 PolarHBondContact O-N 3.19Å; K2475-R2478 PolarHBondContact O-N 3.31Å; C2476-R2478 PolarHBondContact O-N 3.33Å; R2478-E2481 PolarHBondContact O-N 3.41Å; R2478-K2482 WeakPolarHBondContact O-CG 3.44Å; R2478-K2482 PolarHBondContact O-N 2.89Å; R2478-M2707 HydrophobicContact CB-CE 4.27Å
2479S73.1Confident73Confident19 Ų1928 Ų2813%0.13314%0.136CC..Hα-helixtrans-66-43175.673.20000111.7K2475 C2476 L2477 E2481 K2482 I2483K2475-S2479 PolarHBondContact O-N 3.4Å; C2476-S2479 PolarHBondContact O-N 2.87Å; C2476-S2479 PolarHBondContact O-OG 3.38Å; L2477-S2479 VanDerWaalsContact C-N 3.32Å; L2477-S2479 PolarHBondContact O-N 3.2Å; S2479-E2481 VanDerWaalsContact C-N 3.34Å; S2479-E2481 PolarHBondContact O-N 3.05Å; S2479-K2482 WeakPolarHBondContact O-CB 3.42Å; S2479-K2482 PolarHBondContact O-N 3.11Å; S2479-I2483 PolarHBondContact O-N 3.4Å; S2479-I2483 VanDerWaalsContact O-N 3.15Å
2480K76.9Confident71.4Confident9 Ų929.8 Ų29.84%0.03915%0.147CC..Hα-helixtrans-67.2-32175.2-62-53.8-179.3179.20112.9E2395 C2476 L2477 I2483 C2484 L2593 L2596E2395-K2480 WeakPolarHBondContact OE1-CE 3.46Å; E2395-K2480 IonicContact OE1-NZ 2.72Å; E2395-K2480 PolarHBondContact OE1-NZ 3.4Å; E2395-K2480 IonicContact OE2-NZ 4Å; E2395-K2480 PolarHBondContact OE2-NZ 2.85Å; C2476-K2480 WeakPolarHBondContact O-CG 3.05Å; C2476-K2480 PolarHBondContact O-N 3.12Å; L2477-K2480 PolarHBondContact O-N 3.33Å; K2480-I2483 HydrophobicContact CD-CD1 3.93Å; K2480-I2483 PolarHBondContact O-N 2.97Å; K2480-C2484 PolarHBondContact O-N 3.39Å; K2480-C2484 PolarHBondContact O-SG 3.42Å; K2480-L2593 HydrophobicContact CB-CD2 3.73Å; K2480-L2596 HydrophobicContact CG-CD1 4.16Å
2481E71.3Confident69.5Low46 Ų4637.2 Ų37.222%0.21518%0.182CC..Hα-helixtrans-64.1-41.6170.9-77.3-178162.100111.8L2477 R2478 S2479 I2483 C2484 L2485 Y2716L2477-E2481 WeakPolarHBondContact O-CG 3.19Å; L2477-E2481 PolarHBondContact O-N 2.89Å; R2478-E2481 PolarHBondContact O-N 3.41Å; S2479-E2481 VanDerWaalsContact C-N 3.34Å; S2479-E2481 PolarHBondContact O-N 3.05Å; E2481-I2483 VanDerWaalsContact C-N 3.31Å; E2481-I2483 PolarHBondContact O-N 3.44Å; E2481-C2484 WeakPolarHBondContact O-CB 3.39Å; E2481-C2484 PolarHBondContact O-N 3.42Å; E2481-C2484 VanDerWaalsContact O-N 3.14Å; E2481-L2485 WeakPolarHBondContact O-CG 3.22Å; E2481-L2485 PolarHBondContact O-N 2.95Å; E2481-Y2716 WeakPolarHBondContact OE1-CE1 3.31Å; E2481-Y2716 PolarHBondContact OE1-OH 2.96Å
2482K68.2Low67.6Low56 Ų5638.6 Ų38.624%0.24319%0.187CC..Hα-helixtrans-59.4-40.8173.6-70.7-174.3-178.6-166.20111.4D2373 L2376 R2478 S2479 L2485 A2486 E2536D2373-K2482 IonicContact OD1-NZ 3.63Å; D2373-K2482 PolarHBondContact OD1-NZ 3.37Å; L2376-K2482 HydrophobicContact CD1-CD 3.78Å; R2478-K2482 WeakPolarHBondContact O-CG 3.44Å; R2478-K2482 PolarHBondContact O-N 2.89Å; S2479-K2482 WeakPolarHBondContact O-CB 3.42Å; S2479-K2482 PolarHBondContact O-N 3.11Å; K2482-L2485 PolarHBondContact O-N 3Å; K2482-A2486 PolarHBondContact O-N 2.85Å; K2482-E2536 IonicContact NZ-OE1 3.32Å
2483I67.6Low65.3Low26 Ų2641.5 Ų41.513%0.13320%0.204CC..Hα-helixtrans-62.6-44.2173.3-62.2172.9000111S2479 K2480 E2481 L2485 A2486 L2487 L2589S2479-I2483 PolarHBondContact O-N 3.4Å; S2479-I2483 VanDerWaalsContact O-N 3.15Å; K2480-I2483 HydrophobicContact CD-CD1 3.93Å; K2480-I2483 PolarHBondContact O-N 2.97Å; E2481-I2483 VanDerWaalsContact C-N 3.31Å; E2481-I2483 PolarHBondContact O-N 3.44Å; I2483-L2485 VanDerWaalsContact C-N 3.28Å; I2483-L2485 PolarHBondContact O-N 3.25Å; I2483-A2486 PolarHBondContact O-N 3.08Å; I2483-L2487 HydrophobicContact CG2-CD1 4.38Å; I2483-L2487 WeakPolarHBondContact O-CG 3.34Å; I2483-L2487 PolarHBondContact O-N 2.96Å; I2483-L2589 HydrophobicContact CG2-CD1 4.02Å
2484C66.3Low62.8Low12 Ų1247 Ų478%0.08123%0.233CC..Hα-helixtrans-61.1-36.4175.8-66.50000112.7K2480 E2481 L2487 I2488 I2550K2480-C2484 PolarHBondContact O-N 3.39Å; K2480-C2484 PolarHBondContact O-SG 3.42Å; E2481-C2484 WeakPolarHBondContact O-CB 3.39Å; E2481-C2484 PolarHBondContact O-N 3.42Å; E2481-C2484 VanDerWaalsContact O-N 3.14Å; C2484-L2487 WeakPolarHBondContact O-CB 3.17Å; C2484-I2488 WeakPolarHBondContact O-CG1 3.41Å; C2484-I2488 PolarHBondContact O-N 3.11Å; C2484-I2550 HydrophobicContact CB-CD1 3.86Å
2485L62.5Low60.2Low40 Ų4051.1 Ų51.121%0.20926%0.263CS..Hα-helixtrans-69.3-45.3176.3-73.4170.5000111.6E2481 K2482 I2483 L2487 I2488 N2489 L2543E2481-L2485 WeakPolarHBondContact O-CG 3.22Å; E2481-L2485 PolarHBondContact O-N 2.95Å; K2482-L2485 PolarHBondContact O-N 3Å; I2483-L2485 VanDerWaalsContact C-N 3.28Å; I2483-L2485 PolarHBondContact O-N 3.25Å; L2485-L2487 PolarHBondContact O-N 2.84Å; L2485-I2488 HydrophobicContact CD2-CD1 3.89Å; L2485-I2488 WeakPolarHBondContact O-CB 3.34Å; L2485-I2488 PolarHBondContact O-N 3.33Å; L2485-N2489 PolarHBondContact O-N 3.16Å; L2485-L2543 HydrophobicContact CD1-CD1 3.97Å; L2485-L2543 HydrophobicContact CD2-CB 4.03Å; L2485-L2543 HydrophobicContact CD2-CD1 3.95Å; L2485-L2543 HydrophobicContact CD2-CG 3.74Å; L2485-L2543 HydrophobicContact CG-CD1 4.23Å; L2485-L2543 HydrophobicContact CG-CG 4.31Å
2486A60.3Low57.7Low15 Ų1552.5 Ų52.512%0.12428%0.279CS..Hα-helixtrans-55.8-41.9174.700000111.1K2482 I2483 I2488 N2489 V2490K2482-A2486 PolarHBondContact O-N 2.85Å; I2483-A2486 PolarHBondContact O-N 3.08Å; A2486-I2488 VanDerWaalsContact C-N 3.29Å; A2486-I2488 PolarHBondContact O-N 3.07Å; A2486-N2489 PolarHBondContact O-N 3.25Å; A2486-N2489 VanDerWaalsContact O-N 3.15Å; A2486-V2490 VanDerWaalsContact O-CG2 3.3Å; A2486-V2490 WeakPolarHBondContact O-CG2 3.44Å; A2486-V2490 PolarHBondContact O-N 3.41Å; A2486-V2490 VanDerWaalsContact O-N 3.15Å
2487L57.9Low55.2Low24 Ų2456.1 Ų56.113%0.12631%0.305CS..Hα-helixtrans-57.9-32.8175.6-83171.8000114.8I2483 C2484 L2485 L2528 L2589I2483-L2487 HydrophobicContact CG2-CD1 4.38Å; I2483-L2487 WeakPolarHBondContact O-CG 3.34Å; I2483-L2487 PolarHBondContact O-N 2.96Å; C2484-L2487 WeakPolarHBondContact O-CB 3.17Å; L2485-L2487 PolarHBondContact O-N 2.84Å; L2487-L2528 HydrophobicContact CD2-CB 4.32Å; L2487-L2528 HydrophobicContact CD2-CD1 3.34Å; L2487-L2528 HydrophobicContact CD2-CG 3.43Å; L2487-L2528 VanDerWaalsContact CD2-CG 3.43Å; L2487-L2528 HydrophobicContact CG-CG 4.33Å; L2487-L2589 HydrophobicContact CD1-CD1 4.17Å
2488I51.8Low52.7Low37 Ų3763.2 Ų63.219%0.1934%0.343CS..Hα-helixtrans-72.7-46.6174.7-49.3156.6000110.3C2484 L2485 A2486 V2490 Q2491 A2546C2484-I2488 WeakPolarHBondContact O-CG1 3.41Å; C2484-I2488 PolarHBondContact O-N 3.11Å; L2485-I2488 HydrophobicContact CD2-CD1 3.89Å; L2485-I2488 WeakPolarHBondContact O-CB 3.34Å; L2485-I2488 PolarHBondContact O-N 3.33Å; A2486-I2488 VanDerWaalsContact C-N 3.29Å; A2486-I2488 PolarHBondContact O-N 3.07Å; I2488-V2490 PolarHBondContact O-N 2.88Å; I2488-Q2491 PolarHBondContact O-N 3.18Å; I2488-A2546 HydrophobicContact CD1-CB 3.02Å; I2488-A2546 HydrophobicContact CG1-CB 3.34Å
2489N50.1Low50.4Low59 Ų5963.6 Ų63.632%0.31636%0.363SS..Hα-helixtrans-62.4-29.3-173.4-75-11.8000111.6L2485 A2486 Q2491L2485-N2489 PolarHBondContact O-N 3.16Å; A2486-N2489 PolarHBondContact O-N 3.25Å; A2486-N2489 VanDerWaalsContact O-N 3.15Å; N2489-Q2491 PolarHBondContact O-N 3.47Å
2490V50.2Low48.3Very low39 Ų3973.7 Ų73.724%0.23640%0.398CS..THydrogen-bonded Turntrans-64.85.1172.9174.30000113A2486 I2488 F2492 S2524A2486-V2490 VanDerWaalsContact O-CG2 3.3Å; A2486-V2490 WeakPolarHBondContact O-CG2 3.44Å; A2486-V2490 PolarHBondContact O-N 3.41Å; A2486-V2490 VanDerWaalsContact O-N 3.15Å; I2488-V2490 PolarHBondContact O-N 2.88Å; V2490-F2492 HydrophobicContact CG1-CD2 4.24Å; V2490-F2492 PolarHBondContact O-N 2.92Å; V2490-S2524 WeakPolarHBondContact CG1-OG 3.32Å
2491Q45.5Very low46.2Very low156 Ų15680 Ų8073%0.72944%0.438SS*.THydrogen-bonded Turntrans54.919.6179.3-65.2-171.5-10.900113.7I2488 N2489 L2493 N2494I2488-Q2491 PolarHBondContact O-N 3.18Å; N2489-Q2491 PolarHBondContact O-N 3.47Å; Q2491-L2493 PolarHBondContact O-N 3.37Å; Q2491-N2494 PolarHBondContact O-N 3.46Å
2492F41.9Very low44.1Very low58 Ų5887.9 Ų87.925%0.25447%0.472SS..THydrogen-bonded Turntrans-56.8-20.5-177.8-144.7-85.3000112.4V2490 F2521 I2525 T2582V2490-F2492 HydrophobicContact CG1-CD2 4.24Å; V2490-F2492 PolarHBondContact O-N 2.92Å; F2492-F2521 HydrophobicContact CE1-CE2 4.19Å; F2492-F2521 HydrophobicContact CE1-CZ 4.46Å; F2492-F2521 HydrophobicContact CE2-CD2 4.3Å; F2492-F2521 AromaticContact CE2-CE2 3.83Å; F2492-F2521 HydrophobicContact CE2-CE2 3.83Å; F2492-F2521 HydrophobicContact CE2-CZ 4.29Å; F2492-F2521 HydrophobicContact CZ-CD2 4.4Å; F2492-F2521 AromaticContact CZ-CE2 3.5Å; F2492-F2521 HydrophobicContact CZ-CE2 3.5Å; F2492-F2521 AromaticContact CZ-CZ 3.68Å; F2492-F2521 HydrophobicContact CZ-CZ 3.68Å; F2492-I2525 HydrophobicContact CE2-CG1 4.45Å; F2492-T2582 HydrophobicContact CZ-CG2 4.08Å
2493L37.8Very low42.4Very low77 Ų7794.2 Ų94.240%0.40350%0.502SS..THydrogen-bonded Turntrans-122.5-9.1-171.8-66.4164.3000115.2Q2491 I2549Q2491-L2493 PolarHBondContact O-N 3.37Å; L2493-I2549 HydrophobicContact CD1-CB 4.43Å; L2493-I2549 HydrophobicContact CD1-CD1 4.3Å; L2493-I2549 HydrophobicContact CD1-CG2 3.71Å; L2493-I2549 HydrophobicContact CD2-CG2 4.16Å
2494N32.2Very low41.1Very low116 Ų11698.7 Ų98.762%0.6253%0.533SS*.  trans-102.923.3-165.2-1091.6000116.2Q2491 S2496Q2491-N2494 PolarHBondContact O-N 3.46Å; N2494-S2496 PolarHBondContact O-N 2.93Å
2495S30.6Very low39.4Very low92 Ų92104.4 Ų104.464%0.64357%0.567SS**  trans-81.253.716964.80000111.7R2563S2495-R2563 PolarHBondContact O-NH1 2.59Å
2496S28.3Very low38Very low86 Ų86110.6 Ų110.660%0.60159%0.593SS**  trans-134.739.5176.568.70000113.8N2494N2494-S2496 PolarHBondContact O-N 2.93Å
2497S27.8Very low36.9Very low94 Ų94115 Ų11566%0.65762%0.622SS**SBendtrans-156.9136.9166.353.90000112.3
2498N29.7Very low35.9Very low151 Ų151123 Ų12381%0.80766%0.656SS**  trans89.453.6161.7-54.2-14.8000117.9R2500N2498-R2500 VanDerWaalsContact C-N 3.3Å; N2498-R2500 PolarHBondContact O-N 3.11Å
2499S28.3Very low35.4Very low124 Ų124125.6 Ų125.687%0.86767%0.67SS**  trans-89.559.2153.258.10000111.4
2500R28.4Very low34.8Very low230 Ų230127.6 Ų127.687%0.86868%0.679SS**  trans-144.671170.3-76.4-167.9-179.8179.30.6112.2N2498N2498-R2500 VanDerWaalsContact C-N 3.3Å; N2498-R2500 PolarHBondContact O-N 3.11Å
2501T32.7Very low34Very low143 Ų143127.9 Ų127.988%0.87769%0.69SS**  trans-159.399.5145.741.40000107.1
2502K29.2Very low33.5Very low211 Ų211127.1 Ų127.192%0.91769%0.687SS**  trans-83.9114.5174.1-71.3178.2176-179.80108.1
2503E31.4Very low33.1Very low188 Ų188129.3 Ų129.388%0.87970%0.698SS**  trans-134.9130.1143.9-82-161.6159.800108.8
2504P41.1Very low32.8Very low120 Ų120131 Ų13178%0.77970%0.699SS**  trans-103.6112-166.235.1-24.9000110.9
2505T29.8Very low32.8Very low132 Ų132130.3 Ų130.381%0.8170%0.695SS**  trans-154140.115252.10000111.8
2506K33.9Very low33Very low170 Ų170131.3 Ų131.374%0.73969%0.69SS**  trans88.480.6164.2-55.8178.6-176.4176.60117.9K2508K2506-K2508 PolarHBondContact O-N 3.26Å
2507S36.8Very low33.1Very low107 Ų107132.8 Ų132.875%0.74869%0.687SS**THydrogen-bonded Turntrans-65.419.7169.250.50000116.8
2508K36.5Very low33.1Very low192 Ų192132.6 Ų132.684%0.83568%0.676SS**THydrogen-bonded Turntrans-103.5-12.1174.2-80.9-172.6175.4-177.30114.9K2506K2506-K2508 PolarHBondContact O-N 3.26Å
2509I42.3Very low33.3Very low93 Ų93131.9 Ų131.948%0.47767%0.668SS.*SBendtrans-85.5-16.6179.9-62.4172.1000112G2511 E2512 Q2513I2509-G2511 VanDerWaalsContact C-N 3.28Å; I2509-G2511 PolarHBondContact O-N 3.27Å; I2509-E2512 PolarHBondContact O-N 3.09Å; I2509-Q2513 HydrophobicContact CG2-CG 4.09Å; I2509-Q2513 PolarHBondContact O-N 3.37Å
2510I36.7Very low33.6Very low100 Ų100131.2 Ų131.251%0.51365%0.651SS.*Hα-helixtrans-68-27.2-176.2-58172.4000112.1R2514I2510-R2514 WeakPolarHBondContact O-CB 3.33Å; I2510-R2514 PolarHBondContact O-N 3.34Å
2511G32.9Very low33.7Very low46 Ų46124 Ų12447%0.47463%0.626SS.*Hα-helixtrans-71.9-43.2176.700000113.3I2509 R2514 N2515I2509-G2511 VanDerWaalsContact C-N 3.28Å; I2509-G2511 PolarHBondContact O-N 3.27Å; G2511-R2514 PolarHBondContact O-N 3.42Å; G2511-N2515 PolarHBondContact O-N 3.23Å
2512E35.5Very low33.6Very low139 Ų139118.3 Ų118.365%0.6560%0.595SS**Hα-helixtrans-73.6-36.3178.6-73.1-179.4165.600111.9I2509 R2514 N2515 Q2516I2509-E2512 PolarHBondContact O-N 3.09Å; E2512-R2514 VanDerWaalsContact C-N 3.32Å; E2512-R2514 PolarHBondContact O-N 2.9Å; E2512-N2515 PolarHBondContact O-N 3.3Å; E2512-Q2516 WeakPolarHBondContact O-CB 3.5Å; E2512-Q2516 WeakPolarHBondContact O-CG 3.2Å; E2512-Q2516 PolarHBondContact O-N 2.92Å
2513Q34Very low33.8Very low105 Ų105113.5 Ų113.549%0.49158%0.576SS.*Hα-helixtrans-65.2-33.3172.4-78.9-175-15.900112.7I2509 Q2517I2509-Q2513 HydrophobicContact CG2-CG 4.09Å; I2509-Q2513 PolarHBondContact O-N 3.37Å; Q2513-Q2517 WeakPolarHBondContact O-CB 3.36Å; Q2513-Q2517 VanDerWaalsContact O-CG 3.3Å; Q2513-Q2517 WeakPolarHBondContact O-CG 3.44Å; Q2513-Q2517 PolarHBondContact O-N 2.9Å
2514R30.1Very low34Very low111 Ų111105.2 Ų105.242%0.41954%0.539SS..Hα-helixtrans-67.8-43.2175-93.2-178.3172.7176.8-5.8112.8I2510 G2511 E2512 Q2516 Q2517 Q2518 T2565I2510-R2514 WeakPolarHBondContact O-CB 3.33Å; I2510-R2514 PolarHBondContact O-N 3.34Å; G2511-R2514 PolarHBondContact O-N 3.42Å; E2512-R2514 VanDerWaalsContact C-N 3.32Å; E2512-R2514 PolarHBondContact O-N 2.9Å; R2514-Q2516 VanDerWaalsContact C-N 3.34Å; R2514-Q2517 PolarHBondContact O-N 3.34Å; R2514-Q2518 PolarHBondContact O-N 2.94Å; R2514-T2565 PolarHBondContact NH2-O 2.63Å; R2514-T2565 VanDerWaalsContact NH2-O 3.16Å
2515N31.8Very low33.7Very low102 Ų102100.1 Ų100.155%0.54551%0.505SS..Hα-helixtrans-68.2-35.4176.2-75.2-5.7000111.7G2511 E2512 Q2518 Q2519G2511-N2515 PolarHBondContact O-N 3.23Å; E2512-N2515 PolarHBondContact O-N 3.3Å; N2515-Q2518 PolarHBondContact O-N 3.21Å; N2515-Q2519 PolarHBondContact O-N 2.81Å
2516Q35.3Very low33.9Very low113 Ų11396.5 Ų96.553%0.52848%0.483SS..Hα-helixtrans-66.4-39.2172.7-75.4177.9-5.600112.2E2512 R2514 Q2519 Q2520E2512-Q2516 WeakPolarHBondContact O-CB 3.5Å; E2512-Q2516 WeakPolarHBondContact O-CG 3.2Å; E2512-Q2516 PolarHBondContact O-N 2.92Å; R2514-Q2516 VanDerWaalsContact C-N 3.34Å; Q2516-Q2519 PolarHBondContact O-N 3.31Å; Q2516-Q2520 VanDerWaalsContact O-CB 3.27Å; Q2516-Q2520 WeakPolarHBondContact O-CB 3.45Å; Q2516-Q2520 WeakPolarHBondContact O-CG 3.49Å; Q2516-Q2520 PolarHBondContact O-N 3.33Å
2517Q30.5Very low34Very low117 Ų11791.6 Ų91.655%0.54746%0.463SS..Hα-helixtrans-66.9-36.8175.9-77.7177.7-7.300112.9Q2513 R2514 Q2520 F2521Q2513-Q2517 WeakPolarHBondContact O-CB 3.36Å; Q2513-Q2517 VanDerWaalsContact O-CG 3.3Å; Q2513-Q2517 WeakPolarHBondContact O-CG 3.44Å; Q2513-Q2517 PolarHBondContact O-N 2.9Å; R2514-Q2517 PolarHBondContact O-N 3.34Å; Q2517-Q2520 PolarHBondContact O-N 3.38Å; Q2517-F2521 PolarHBondContact O-N 3.11Å
2518Q29.1Very low34.1Very low91 Ų9188.1 Ų88.143%0.42544%0.435SS..Hα-helixtrans-68.2-43.1175.3-74.8-179.3-16.400112.2R2514 N2515 Q2520 F2521 G2522R2514-Q2518 PolarHBondContact O-N 2.94Å; N2515-Q2518 PolarHBondContact O-N 3.21Å; Q2518-Q2520 VanDerWaalsContact C-N 3.34Å; Q2518-F2521 PolarHBondContact O-N 3.16Å; Q2518-G2522 PolarHBondContact O-N 3.42Å; Q2518-G2522 VanDerWaalsContact O-N 3.17Å
2519Q33.6Very low34.1Very low135 Ų13580.2 Ų80.263%0.63140%0.402SS*.Hα-helixtrans-64.6-39.2172.9-75.7-176-16.900111.7N2515 Q2516 F2521 Q2523N2515-Q2519 PolarHBondContact O-N 2.81Å; Q2516-Q2519 PolarHBondContact O-N 3.31Å; Q2519-F2521 PolarHBondContact O-N 3.48Å; Q2519-Q2523 VanDerWaalsContact O-CB 3.22Å; Q2519-Q2523 WeakPolarHBondContact O-CB 3.48Å; Q2519-Q2523 VanDerWaalsContact O-CG 3.27Å; Q2519-Q2523 WeakPolarHBondContact O-CG 3.31Å; Q2519-Q2523 PolarHBondContact O-N 3.02Å
2520Q34.1Very low34Very low111 Ų11177.8 Ų77.852%0.51939%0.39SS..Hα-helixtrans-63.4-37.8174.8-79.5175.3-8.900112.2Q2516 Q2517 Q2518 S2524Q2516-Q2520 VanDerWaalsContact O-CB 3.27Å; Q2516-Q2520 WeakPolarHBondContact O-CB 3.45Å; Q2516-Q2520 WeakPolarHBondContact O-CG 3.49Å; Q2516-Q2520 PolarHBondContact O-N 3.33Å; Q2517-Q2520 PolarHBondContact O-N 3.38Å; Q2518-Q2520 VanDerWaalsContact C-N 3.34Å; Q2520-S2524 VanDerWaalsContact O-CB 3.26Å; Q2520-S2524 WeakPolarHBondContact O-CB 3.28Å; Q2520-S2524 PolarHBondContact O-N 3.36Å; Q2520-S2524 PolarHBondContact O-OG 3.24Å
2521F29.8Very low34.1Very low78 Ų7874 Ų7434%0.34237%0.373SS..Hα-helixtrans-70.7-43.4-179.8-163.8-98.4000112.5F2492 Q2517 Q2518 Q2519 S2524 I2525 M2578F2492-F2521 HydrophobicContact CE1-CE2 4.19Å; F2492-F2521 HydrophobicContact CE1-CZ 4.46Å; F2492-F2521 HydrophobicContact CE2-CD2 4.3Å; F2492-F2521 AromaticContact CE2-CE2 3.83Å; F2492-F2521 HydrophobicContact CE2-CE2 3.83Å; F2492-F2521 HydrophobicContact CE2-CZ 4.29Å; F2492-F2521 HydrophobicContact CZ-CD2 4.4Å; F2492-F2521 AromaticContact CZ-CE2 3.5Å; F2492-F2521 HydrophobicContact CZ-CE2 3.5Å; F2492-F2521 AromaticContact CZ-CZ 3.68Å; F2492-F2521 HydrophobicContact CZ-CZ 3.68Å; Q2517-F2521 PolarHBondContact O-N 3.11Å; Q2518-F2521 PolarHBondContact O-N 3.16Å; Q2519-F2521 PolarHBondContact O-N 3.48Å; F2521-S2524 WeakPolarHBondContact O-CB 3.46Å; F2521-S2524 PolarHBondContact O-N 3.31Å; F2521-I2525 HydrophobicContact CD1-CD1 3.85Å; F2521-I2525 HydrophobicContact CE1-CD1 3.49Å; F2521-I2525 VanDerWaalsContact CE1-CD1 3.49Å; F2521-I2525 HydrophobicContact CZ-CD1 4.14Å; F2521-I2525 PolarHBondContact O-N 3Å; F2521-I2525 VanDerWaalsContact O-N 3.15Å; F2521-M2578 HydrophobicContact CE1-CB 3.93Å
2522G31.6Very low34Very low23 Ų2377.3 Ų77.324%0.23738%0.376CS..Hα-helixtrans-62.7-43.8172.200000111.9Q2518 S2524 I2525 V2526Q2518-G2522 PolarHBondContact O-N 3.42Å; Q2518-G2522 VanDerWaalsContact O-N 3.17Å; G2522-S2524 VanDerWaalsContact C-N 3.31Å; G2522-S2524 PolarHBondContact O-N 3.37Å; G2522-I2525 PolarHBondContact O-N 3.45Å; G2522-V2526 WeakPolarHBondContact O-CB 3.43Å; G2522-V2526 VanDerWaalsContact O-CG2 3.3Å; G2522-V2526 WeakPolarHBondContact O-CG2 3.29Å; G2522-V2526 PolarHBondContact O-N 3.09Å
2523Q33.6Very low34Very low110 Ų11074.2 Ų74.251%0.51437%0.369SS..Hα-helixtrans-63.4-35172.7-78.5177.1-15.300112.4Q2519 I2525 V2526 Q2527Q2519-Q2523 VanDerWaalsContact O-CB 3.22Å; Q2519-Q2523 WeakPolarHBondContact O-CB 3.48Å; Q2519-Q2523 VanDerWaalsContact O-CG 3.27Å; Q2519-Q2523 WeakPolarHBondContact O-CG 3.31Å; Q2519-Q2523 PolarHBondContact O-N 3.02Å; Q2523-I2525 VanDerWaalsContact C-N 3.32Å; Q2523-I2525 PolarHBondContact O-N 3.38Å; Q2523-V2526 CarbonylContact O-C 3.51Å; Q2523-V2526 PolarHBondContact O-N 3.36Å; Q2523-Q2527 WeakPolarHBondContact O-CA 3.33Å; Q2523-Q2527 WeakPolarHBondContact O-CB 3.27Å; Q2523-Q2527 WeakPolarHBondContact O-CG 3.21Å; Q2523-Q2527 PolarHBondContact O-N 2.97Å
2524S34.9Very low33.9Very low15 Ų1575.4 Ų75.411%0.10537%0.373CS..Hα-helixtrans-65-37.3177.7-640000111.7V2490 Q2520 F2521 G2522 Q2527 L2528V2490-S2524 WeakPolarHBondContact CG1-OG 3.32Å; Q2520-S2524 VanDerWaalsContact O-CB 3.26Å; Q2520-S2524 WeakPolarHBondContact O-CB 3.28Å; Q2520-S2524 PolarHBondContact O-N 3.36Å; Q2520-S2524 PolarHBondContact O-OG 3.24Å; F2521-S2524 WeakPolarHBondContact O-CB 3.46Å; F2521-S2524 PolarHBondContact O-N 3.31Å; G2522-S2524 VanDerWaalsContact C-N 3.31Å; G2522-S2524 PolarHBondContact O-N 3.37Å; S2524-Q2527 CarbonylContact O-C 3.59Å; S2524-L2528 VanDerWaalsContact O-CB 3.28Å; S2524-L2528 WeakPolarHBondContact O-CB 3.32Å; S2524-L2528 PolarHBondContact O-N 3Å
2525I35.1Very low34.3Very low12 Ų1274.5 Ų74.56%0.06238%0.384CS..Hα-helixtrans-78.4-38.8177.4-69.5164.8000111.1F2492 F2521 G2522 Q2523 Q2527 L2528 L2529 M2578 T2582F2492-I2525 HydrophobicContact CE2-CG1 4.45Å; F2521-I2525 HydrophobicContact CD1-CD1 3.85Å; F2521-I2525 HydrophobicContact CE1-CD1 3.49Å; F2521-I2525 VanDerWaalsContact CE1-CD1 3.49Å; F2521-I2525 HydrophobicContact CZ-CD1 4.14Å; F2521-I2525 PolarHBondContact O-N 3Å; F2521-I2525 VanDerWaalsContact O-N 3.15Å; G2522-I2525 PolarHBondContact O-N 3.45Å; Q2523-I2525 VanDerWaalsContact C-N 3.32Å; Q2523-I2525 PolarHBondContact O-N 3.38Å; I2525-Q2527 VanDerWaalsContact C-N 3.29Å; I2525-L2528 VanDerWaalsContact O-CB 3.22Å; I2525-L2528 WeakPolarHBondContact O-CB 3.35Å; I2525-L2528 PolarHBondContact O-N 3.49Å; I2525-L2529 PolarHBondContact O-N 3.21Å; I2525-L2529 VanDerWaalsContact O-N 3.07Å; I2525-M2578 HydrophobicContact CB-CE 3.98Å; I2525-M2578 HydrophobicContact CD1-CB 4.05Å; I2525-M2578 HydrophobicContact CD1-CE 3.23Å; I2525-M2578 HydrophobicContact CD1-CG 4.5Å; I2525-M2578 HydrophobicContact CD1-SD 4.03Å; I2525-M2578 HydrophobicContact CG1-CE 4.16Å; I2525-M2578 HydrophobicContact CG2-CE 4.09Å; I2525-T2582 HydrophobicContact CD1-CG2 3.44Å; I2525-T2582 VanDerWaalsContact CD1-CG2 3.44Å; I2525-T2582 HydrophobicContact CG1-CG2 3.55Å
2526V34.3Very low34.7Very low56 Ų5676.4 Ų76.434%0.33939%0.39SS..Hα-helixtrans-64.4-36.9170.5172.40000110.5G2522 Q2523 L2529 N2530G2522-V2526 WeakPolarHBondContact O-CB 3.43Å; G2522-V2526 VanDerWaalsContact O-CG2 3.3Å; G2522-V2526 WeakPolarHBondContact O-CG2 3.29Å; G2522-V2526 PolarHBondContact O-N 3.09Å; Q2523-V2526 CarbonylContact O-C 3.51Å; Q2523-V2526 PolarHBondContact O-N 3.36Å; V2526-L2529 CarbonylContact O-C 3.6Å; V2526-L2529 PolarHBondContact O-N 2.94Å; V2526-N2530 WeakPolarHBondContact O-CA 3.2Å; V2526-N2530 WeakPolarHBondContact O-CB 3.2Å; V2526-N2530 PolarHBondContact O-N 3.05Å
2527Q36.1Very low34.9Very low68 Ų6878.5 Ų78.532%0.31840%0.404SS..Hα-helixtrans-71.3-32.4171.5-76.1170.6-7.600111.4Q2523 S2524 I2525 L2529 N2530 C2531Q2523-Q2527 WeakPolarHBondContact O-CA 3.33Å; Q2523-Q2527 WeakPolarHBondContact O-CB 3.27Å; Q2523-Q2527 WeakPolarHBondContact O-CG 3.21Å; Q2523-Q2527 PolarHBondContact O-N 2.97Å; S2524-Q2527 CarbonylContact O-C 3.59Å; I2525-Q2527 VanDerWaalsContact C-N 3.29Å; Q2527-L2529 PolarHBondContact O-N 3.35Å; Q2527-N2530 CarbonylContact O-C 3.58Å; Q2527-N2530 PolarHBondContact O-N 3.31Å; Q2527-C2531 WeakPolarHBondContact O-CA 3.2Å; Q2527-C2531 PolarHBondContact O-N 2.83Å; Q2527-C2531 PolarHBondContact O-SG 2.88Å
2528L38.4Very low35.4Very low33 Ų3375.9 Ų75.917%0.17339%0.394CS..Hα-helixtrans-59.3-35.5171.7-158154.8000110.8L2487 S2524 I2525L2487-L2528 HydrophobicContact CD2-CB 4.32Å; L2487-L2528 HydrophobicContact CD2-CD1 3.34Å; L2487-L2528 HydrophobicContact CD2-CG 3.43Å; L2487-L2528 VanDerWaalsContact CD2-CG 3.43Å; L2487-L2528 HydrophobicContact CG-CG 4.33Å; S2524-L2528 VanDerWaalsContact O-CB 3.28Å; S2524-L2528 WeakPolarHBondContact O-CB 3.32Å; S2524-L2528 PolarHBondContact O-N 3Å; I2525-L2528 VanDerWaalsContact O-CB 3.22Å; I2525-L2528 WeakPolarHBondContact O-CB 3.35Å; I2525-L2528 PolarHBondContact O-N 3.49Å
2529L37.4Very low36.2Very low27 Ų2774.8 Ų74.814%0.14140%0.395CS..Hα-helixtrans-88.9-30.5177.1-64.8171.8000113.4A2388 F2389 I2525 V2526 Q2527A2388-L2529 HydrophobicContact CB-CB 4.22Å; A2388-L2529 HydrophobicContact CB-CD1 4Å; A2388-L2529 HydrophobicContact CB-CD2 4.02Å; A2388-L2529 HydrophobicContact CB-CG 4.3Å; F2389-L2529 HydrophobicContact CD2-CD1 4.36Å; F2389-L2529 HydrophobicContact CE2-CD1 4Å; I2525-L2529 PolarHBondContact O-N 3.21Å; I2525-L2529 VanDerWaalsContact O-N 3.07Å; V2526-L2529 CarbonylContact O-C 3.6Å; V2526-L2529 PolarHBondContact O-N 2.94Å; Q2527-L2529 PolarHBondContact O-N 3.35Å
2530N38.3Very low36.9Very low41 Ų4174.1 Ų74.122%0.21939%0.394CS..SBendtrans-110.727.7-176.4-64.1-10.7000113Y2380 V2526 Q2527 E2532Y2380-N2530 WeakPolarHBondContact O-CA 3.43Å; Y2380-N2530 WeakPolarHBondContact O-CB 2.95Å; Y2380-N2530 PolarHBondContact O-OD1 2.98Å; V2526-N2530 WeakPolarHBondContact O-CA 3.2Å; V2526-N2530 WeakPolarHBondContact O-CB 3.2Å; V2526-N2530 PolarHBondContact O-N 3.05Å; Q2527-N2530 CarbonylContact O-C 3.58Å; Q2527-N2530 PolarHBondContact O-N 3.31Å; N2530-E2532 PolarHBondContact O-N 3.03Å
2531C38.8Very low37.6Very low22 Ų2273.8 Ų73.815%0.14940%0.396CS..  trans-41.799.8-166.6-84.70000114.5Q2527Q2527-C2531 WeakPolarHBondContact O-CA 3.2Å; Q2527-C2531 PolarHBondContact O-N 2.83Å; Q2527-C2531 PolarHBondContact O-SG 2.88Å
2532E31.8Very low38.5Very low115 Ų11573.6 Ų73.654%0.53740%0.396SS..  trans-72.8130.6163.9-68.3179.3160.200109.1N2530 F2534N2530-E2532 PolarHBondContact O-N 3.03Å; E2532-F2534 PolarHBondContact O-N 3.48Å
2533S35.2Very low39.2Very low74 Ų7474.8 Ų74.852%0.51740%0.397SS..  trans-68.1109.1-178.243.50000111.9
2534F33.1Very low39.9Very low129 Ų12973.8 Ų73.857%0.56639%0.391SS*.  trans-91.2120.8167.6-77.7-79.5000111.5E2532E2532-F2534 PolarHBondContact O-N 3.48Å
2535S37.6Very low40.6Very low93 Ų9378.9 Ų78.965%0.6541%0.413SS*.  trans21.1119.4165.863.30000119.5N2537S2535-N2537 PolarHBondContact O-N 3.24Å; S2535-N2537 VanDerWaalsContact O-N 3.16Å
2536E39.9Very low41.2Very low142 Ų14278.5 Ų78.566%0.66441%0.412SS*.SBendtrans-732.1-167.2-61.7-170.4132.900118.4K2482 L2538K2482-E2536 IonicContact NZ-OE1 3.32Å; E2536-L2538 PolarHBondContact O-N 3.25Å
2537N40.1Very low41.8Very low157 Ų15776.2 Ų76.284%0.8440%0.398SS*.  trans-106.457.5-168.1-70.3-23.1000114.2S2535S2535-N2537 PolarHBondContact O-N 3.24Å; S2535-N2537 VanDerWaalsContact O-N 3.16Å
2538L41.6Very low42.5Very low61 Ų6174.9 Ų74.932%0.31940%0.396SS..  trans-104.5131.9175.9-77.3151.4000111.9E2536 E2542E2536-L2538 PolarHBondContact O-N 3.25Å; L2538-E2542 WeakPolarHBondContact CD2-OE2 3.35Å
2539P45.3Very low43.1Very low69 Ų6976.4 Ų76.445%0.44840%0.404SS..  trans-69143.6-176.526.3-31.8000111.6N2541 E2542P2539-N2541 PolarHBondContact O-N 3.37Å; P2539-E2542 HydrophobicContact CG-CG 4.2Å; P2539-E2542 PolarHBondContact O-N 3.42Å
2540I48.1Very low43.6Very low120 Ų12076.1 Ų76.162%0.61540%0.402SS*.Hα-helixtrans-43-35.2-178.7-69.3160.1000113.4E2542 L2543 K2544I2540-E2542 VanDerWaalsContact C-N 3.32Å; I2540-E2542 PolarHBondContact O-N 3.19Å; I2540-L2543 PolarHBondContact O-N 2.77Å; I2540-K2544 HydrophobicContact CG2-CG 4.34Å; I2540-K2544 VanDerWaalsContact O-CG 3.25Å; I2540-K2544 WeakPolarHBondContact O-CG 3.09Å; I2540-K2544 PolarHBondContact O-N 3.33Å
2541N49.2Very low44.1Very low104 Ų10476.1 Ų76.156%0.55640%0.4SS*.Hα-helixtrans-61.9-33.1179.7-70.6-21.4000114P2539 K2544 Q2545P2539-N2541 PolarHBondContact O-N 3.37Å; N2541-K2544 WeakPolarHBondContact O-CB 3.23Å; N2541-K2544 PolarHBondContact O-N 2.98Å; N2541-Q2545 PolarHBondContact O-N 3.09Å
2542E47.8Very low44.6Very low74 Ų7483 Ų8335%0.34643%0.428SS..Hα-helixtrans-74.9-39.7177.9-67.1-174.2-154.100111.1L2538 P2539 I2540 K2544 Q2545 A2546L2538-E2542 WeakPolarHBondContact CD2-OE2 3.35Å; P2539-E2542 HydrophobicContact CG-CG 4.2Å; P2539-E2542 PolarHBondContact O-N 3.42Å; I2540-E2542 VanDerWaalsContact C-N 3.32Å; I2540-E2542 PolarHBondContact O-N 3.19Å; E2542-K2544 VanDerWaalsContact C-N 3.25Å; E2542-K2544 PolarHBondContact O-N 2.84Å; E2542-Q2545 WeakPolarHBondContact O-CB 3.43Å; E2542-Q2545 PolarHBondContact O-N 3.1Å; E2542-A2546 WeakPolarHBondContact O-CB 3.29Å; E2542-A2546 PolarHBondContact O-N 3.18Å
2543L46.3Very low45.1Very low48 Ų4878.8 Ų78.825%0.25141%0.411SS..Hα-helixtrans-60.2-37.3169.6-153.1159.7000110.7L2485 I2540 S2547 Y2716L2485-L2543 HydrophobicContact CD1-CD1 3.97Å; L2485-L2543 HydrophobicContact CD2-CB 4.03Å; L2485-L2543 HydrophobicContact CD2-CD1 3.95Å; L2485-L2543 HydrophobicContact CD2-CG 3.74Å; L2485-L2543 HydrophobicContact CG-CD1 4.23Å; L2485-L2543 HydrophobicContact CG-CG 4.31Å; I2540-L2543 PolarHBondContact O-N 2.77Å; L2543-S2547 VanDerWaalsContact O-CB 3.27Å; L2543-S2547 WeakPolarHBondContact O-CB 3.19Å; L2543-S2547 PolarHBondContact O-N 3Å; L2543-S2547 VanDerWaalsContact O-N 3.08Å; L2543-S2547 PolarHBondContact O-OG 2.87Å; L2543-Y2716 HydrophobicContact CD2-CD1 4.41Å; L2543-Y2716 HydrophobicContact CD2-CE1 4.34Å
2544K49Very low45.4Very low90 Ų9078.1 Ų78.139%0.39141%0.405SS..Hα-helixtrans-60.2-45.9171.1-57.5-162.2173.21560111.7I2540 N2541 E2542 S2547 S2548 A2715I2540-K2544 HydrophobicContact CG2-CG 4.34Å; I2540-K2544 VanDerWaalsContact O-CG 3.25Å; I2540-K2544 WeakPolarHBondContact O-CG 3.09Å; I2540-K2544 PolarHBondContact O-N 3.33Å; N2541-K2544 WeakPolarHBondContact O-CB 3.23Å; N2541-K2544 PolarHBondContact O-N 2.98Å; E2542-K2544 VanDerWaalsContact C-N 3.25Å; E2542-K2544 PolarHBondContact O-N 2.84Å; K2544-S2547 PolarHBondContact O-OG 2.64Å; K2544-S2548 WeakPolarHBondContact O-CB 3.47Å; K2544-S2548 PolarHBondContact O-N 3.43Å; K2544-S2548 PolarHBondContact O-OG 3.18Å; K2544-A2715 HydrophobicContact CB-CB 3.64Å; K2544-A2715 HydrophobicContact CD-CB 3.41Å; K2544-A2715 VanDerWaalsContact CD-CB 3.41Å; K2544-A2715 HydrophobicContact CG-CB 3.25Å
2545Q49.7Very low45.9Very low122 Ų12275.6 Ų75.657%0.5740%0.396SS*.Hα-helixtrans-63.4-51.3179.3-75.5-178.6-6.300110.8N2541 E2542 S2547 S2548 I2549N2541-Q2545 PolarHBondContact O-N 3.09Å; E2542-Q2545 WeakPolarHBondContact O-CB 3.43Å; E2542-Q2545 PolarHBondContact O-N 3.1Å; Q2545-S2547 PolarHBondContact O-N 3.39Å; Q2545-S2548 PolarHBondContact O-N 3.17Å; Q2545-S2548 PolarHBondContact O-OG 2.84Å; Q2545-I2549 VanDerWaalsContact O-CG1 3.23Å; Q2545-I2549 WeakPolarHBondContact O-CG1 3.34Å; Q2545-I2549 PolarHBondContact O-N 2.93Å
2546A46.8Very low46.1Very low4 Ų476.6 Ų76.63%0.03339%0.391CS..Hα-helixtrans-48.8-55178.200000113.4I2488 E2542 I2549 I2550I2488-A2546 HydrophobicContact CD1-CB 3.02Å; I2488-A2546 HydrophobicContact CG1-CB 3.34Å; E2542-A2546 WeakPolarHBondContact O-CB 3.29Å; E2542-A2546 PolarHBondContact O-N 3.18Å; A2546-I2549 CarbonylContact O-C 3.57Å; A2546-I2549 WeakPolarHBondContact O-CB 3.48Å; A2546-I2549 PolarHBondContact O-N 3.34Å; A2546-I2549 VanDerWaalsContact O-N 3.14Å; A2546-I2550 WeakPolarHBondContact O-CG1 3.24Å; A2546-I2550 PolarHBondContact O-N 3.28Å
2547S47.1Very low45.7Very low7 Ų774.9 Ų74.95%0.04939%0.386CS..Hα-helixtrans-75.9-36.4-171.665.10000109.2L2543 K2544 Q2545 I2549 I2550 F2551 Y2716L2543-S2547 VanDerWaalsContact O-CB 3.27Å; L2543-S2547 WeakPolarHBondContact O-CB 3.19Å; L2543-S2547 PolarHBondContact O-N 3Å; L2543-S2547 VanDerWaalsContact O-N 3.08Å; L2543-S2547 PolarHBondContact O-OG 2.87Å; K2544-S2547 PolarHBondContact O-OG 2.64Å; Q2545-S2547 PolarHBondContact O-N 3.39Å; S2547-I2549 VanDerWaalsContact C-N 3.26Å; S2547-I2549 PolarHBondContact O-N 2.85Å; S2547-I2550 PolarHBondContact O-N 3.28Å; S2547-F2551 WeakPolarHBondContact O-CB 3.45Å; S2547-F2551 WeakPolarHBondContact O-CD2 3.09Å; S2547-F2551 PolarHBondContact O-N 3.07Å; S2547-Y2716 WeakPolarHBondContact OG-CB 3.39Å
2548S52.1Low45.4Very low41 Ų4169.9 Ų69.929%0.28736%0.359SS..Hα-helixtrans-59.1-37.8168.282.70000112.1K2544 Q2545 K2552K2544-S2548 WeakPolarHBondContact O-CB 3.47Å; K2544-S2548 PolarHBondContact O-N 3.43Å; K2544-S2548 PolarHBondContact O-OG 3.18Å; Q2545-S2548 PolarHBondContact O-N 3.17Å; Q2545-S2548 PolarHBondContact O-OG 2.84Å; S2548-K2552 WeakPolarHBondContact O-CA 3.29Å; S2548-K2552 WeakPolarHBondContact O-CB 3.01Å; S2548-K2552 VanDerWaalsContact O-CG 3.23Å; S2548-K2552 WeakPolarHBondContact O-CG 3.34Å; S2548-K2552 PolarHBondContact O-N 2.96Å
2549I50.2Low45.2Very low65 Ų6571 Ų7133%0.33337%0.365SS..Hα-helixtrans-69.5-51.9176.1-64.1160.1000109.5L2493 Q2545 A2546 S2547 F2551 K2552 C2553L2493-I2549 HydrophobicContact CD1-CB 4.43Å; L2493-I2549 HydrophobicContact CD1-CD1 4.3Å; L2493-I2549 HydrophobicContact CD1-CG2 3.71Å; L2493-I2549 HydrophobicContact CD2-CG2 4.16Å; Q2545-I2549 VanDerWaalsContact O-CG1 3.23Å; Q2545-I2549 WeakPolarHBondContact O-CG1 3.34Å; Q2545-I2549 PolarHBondContact O-N 2.93Å; A2546-I2549 CarbonylContact O-C 3.57Å; A2546-I2549 WeakPolarHBondContact O-CB 3.48Å; A2546-I2549 PolarHBondContact O-N 3.34Å; A2546-I2549 VanDerWaalsContact O-N 3.14Å; S2547-I2549 VanDerWaalsContact C-N 3.26Å; S2547-I2549 PolarHBondContact O-N 2.85Å; I2549-F2551 VanDerWaalsContact C-N 3.31Å; I2549-F2551 PolarHBondContact O-N 3.45Å; I2549-K2552 PolarHBondContact O-N 3.36Å; I2549-C2553 HydrophobicContact CG2-CB 4.26Å; I2549-C2553 WeakPolarHBondContact O-CA 3.42Å; I2549-C2553 WeakPolarHBondContact O-CB 3.37Å; I2549-C2553 PolarHBondContact O-N 2.71Å
2550I48Very low44.6Very low21 Ų2171.9 Ų71.911%0.10837%0.373CS..Hα-helixtrans-60.6-39.1-178.9-65.9168.7000112.2C2484 A2546 S2547 L2589 R2590C2484-I2550 HydrophobicContact CB-CD1 3.86Å; A2546-I2550 WeakPolarHBondContact O-CG1 3.24Å; A2546-I2550 PolarHBondContact O-N 3.28Å; S2547-I2550 PolarHBondContact O-N 3.28Å; I2550-L2589 HydrophobicContact CG2-CD2 4.25Å; I2550-R2590 PolarHBondContact O-NE 3.48Å; I2550-R2590 PolarHBondContact O-NH2 3.45Å
2551F47.5Very low44.1Very low40 Ų4069 Ų6918%0.17536%0.361CS..Hα-helixtrans-84-31.8-179.8-75.4-75.2000114.3S2547 I2549 L2593 R2594 I2597 Y2716S2547-F2551 WeakPolarHBondContact O-CB 3.45Å; S2547-F2551 WeakPolarHBondContact O-CD2 3.09Å; S2547-F2551 PolarHBondContact O-N 3.07Å; I2549-F2551 VanDerWaalsContact C-N 3.31Å; I2549-F2551 PolarHBondContact O-N 3.45Å; F2551-L2593 HydrophobicContact CE1-CB 4.26Å; F2551-L2593 HydrophobicContact CE2-CD1 3.93Å; F2551-L2593 HydrophobicContact CZ-CB 3.74Å; F2551-L2593 HydrophobicContact CZ-CD1 3.66Å; F2551-L2593 HydrophobicContact CZ-CG 4.35Å; F2551-R2594 HydrophobicContact CE1-CG 4.15Å; F2551-I2597 HydrophobicContact CZ-CD1 4.25Å; F2551-Y2716 VanDerWaalsContact CD2-CB 3.49Å; F2551-Y2716 HydrophobicContact CD2-CG 4.26Å; F2551-Y2716 AromaticContact CE2-CD2 3.74Å; F2551-Y2716 HydrophobicContact CE2-CD2 3.74Å; F2551-Y2716 AromaticContact CE2-CG 3.77Å; F2551-Y2716 HydrophobicContact CE2-CG 3.77Å; F2551-Y2716 HydrophobicContact CZ-CD2 4.16Å
2552K50.1Low43.1Very low168 Ų16871.1 Ų71.173%0.7337%0.372SS*.Hα-helixtrans-97.2-20.3179.9-61.3-178.9173.4-179.30114.2S2548 I2549 P2554S2548-K2552 WeakPolarHBondContact O-CA 3.29Å; S2548-K2552 WeakPolarHBondContact O-CB 3.01Å; S2548-K2552 VanDerWaalsContact O-CG 3.23Å; S2548-K2552 WeakPolarHBondContact O-CG 3.34Å; S2548-K2552 PolarHBondContact O-N 2.96Å; I2549-K2552 PolarHBondContact O-N 3.36Å; K2552-P2554 WeakPolarHBondContact O-CD 3.31Å
2553C42Very low42.3Very low26 Ų2675.9 Ų75.918%0.17639%0.387CS..  trans-57.8110.7179.9-170.70000107.3I2549 L2555 R2590I2549-C2553 HydrophobicContact CG2-CB 4.26Å; I2549-C2553 WeakPolarHBondContact O-CA 3.42Å; I2549-C2553 WeakPolarHBondContact O-CB 3.37Å; I2549-C2553 PolarHBondContact O-N 2.71Å; C2553-L2555 PolarHBondContact O-N 2.92Å; C2553-R2590 PolarHBondContact O-NH2 2.97Å
2554P42.9Very low41.8Very low60 Ų6080.3 Ų80.339%0.3941%0.409SS..  trans-55.4135167.5-14.928.7000105.9K2552 Q2556 L2557K2552-P2554 WeakPolarHBondContact O-CD 3.31Å; P2554-Q2556 HydrophobicContact CB-CB 4.22Å; P2554-Q2556 PolarHBondContact O-N 2.88Å; P2554-L2557 HydrophobicContact CG-CD1 4.34Å; P2554-L2557 PolarHBondContact O-N 2.89Å
2555L42.4Very low41Very low75 Ų7581.6 Ų81.639%0.39343%0.425SS..G310 helixtrans-49.6-26.5174.4-116.375.6000111.4C2553 L2557C2553-L2555 PolarHBondContact O-N 2.92Å; L2555-L2557 PolarHBondContact O-N 3.43Å
2556Q41.2Very low40.2Very low115 Ų11579.7 Ų79.754%0.53743%0.43SS..G310 helixtrans-65-26.5176.6-62.5165.8-17.800115P2554 L2558 N2559P2554-Q2556 HydrophobicContact CB-CB 4.22Å; P2554-Q2556 PolarHBondContact O-N 2.88Å; Q2556-L2558 VanDerWaalsContact C-N 3.3Å; Q2556-L2558 PolarHBondContact O-N 3.14Å; Q2556-N2559 VanDerWaalsContact O-CB 3.28Å; Q2556-N2559 WeakPolarHBondContact O-CB 3.45Å; Q2556-N2559 PolarHBondContact O-N 3.02Å
2557L32.8Very low39.7Very low105 Ų10582.7 Ų82.755%0.5546%0.461SS..G310 helixtrans-73.2-23.4-178.2-120.3156.9000112.4P2554 L2555 N2559 S2560P2554-L2557 HydrophobicContact CG-CD1 4.34Å; P2554-L2557 PolarHBondContact O-N 2.89Å; L2555-L2557 PolarHBondContact O-N 3.43Å; L2557-N2559 PolarHBondContact O-N 2.66Å; L2557-S2560 PolarHBondContact O-N 3.47Å; L2557-S2560 PolarHBondContact O-OG 3.46Å
2558L33.9Very low39.4Very low52 Ų5291 Ų9127%0.27250%0.496SS..G310 helixtrans-72.8-7.4169.2-74165.1000112.8Q2556 Q2583Q2556-L2558 VanDerWaalsContact C-N 3.3Å; Q2556-L2558 PolarHBondContact O-N 3.14Å; L2558-Q2583 HydrophobicContact CB-CG 4.43Å; L2558-Q2583 HydrophobicContact CD1-CG 4.17Å
2559N36.8Very low38.9Very low86 Ų8697 Ų9746%0.4652%0.52SS..G310 helixtrans-90.4-4.5175.4-67-18.2000113.7Q2556 L2557 V2561 Q2583Q2556-N2559 VanDerWaalsContact O-CB 3.28Å; Q2556-N2559 WeakPolarHBondContact O-CB 3.45Å; Q2556-N2559 PolarHBondContact O-N 3.02Å; L2557-N2559 PolarHBondContact O-N 2.66Å; N2559-V2561 PolarHBondContact O-N 2.83Å; N2559-Q2583 PolarHBondContact OD1-NE2 3.06Å
2560S33.3Very low38.4Very low87 Ų87101 Ų10161%0.60854%0.542SS*.  trans-76.994.3-174.468.20000111.6L2557 D2562L2557-S2560 PolarHBondContact O-N 3.47Å; L2557-S2560 PolarHBondContact O-OG 3.46Å; S2560-D2562 PolarHBondContact O-N 3.16Å
2561V36.1Very low38.2Very low60 Ų60104 Ų10436%0.36456%0.555SS.*  trans-78.714.1-178.9173.50000113.8N1833 N2559 R2563N1833-V2561 HydrophobicContact CB-CG1 4.39Å; N1833-V2561 WeakPolarHBondContact OD1-CB 3.36Å; N1833-V2561 VanDerWaalsContact OD1-CG1 3.24Å; N1833-V2561 WeakPolarHBondContact OD1-CG1 3.43Å; N1833-V2561 VanDerWaalsContact OD1-CG2 3.22Å; N1833-V2561 WeakPolarHBondContact OD1-CG2 3.43Å; N2559-V2561 PolarHBondContact O-N 2.83Å; V2561-R2563 PolarHBondContact O-N 2.86Å
2562D29Very low38.1Very low147 Ų147106 Ų10679%0.78657%0.568SS**  trans-70.411.7-175-78.9-10.3000115.7S2560S2560-D2562 PolarHBondContact O-N 3.16Å
2563R31.6Very low37.8Very low174 Ų174101.1 Ų101.166%0.65756%0.559SS**SBendtrans-13888.5174.9-58.8-172.6-168.5-174.19.8110.2S2495 V2561S2495-R2563 PolarHBondContact O-NH1 2.59Å; V2561-R2563 PolarHBondContact O-N 2.86Å
2564I36.4Very low37.7Very low141 Ų141106 Ų10672%0.72358%0.579SS**  trans175.797.1133.8-81.1145.3000105.8
2565T30.9Very low37.9Very low117 Ų117106.7 Ų106.772%0.71858%0.579SS**  trans-65.1140.1168.645.20000111.2R2514R2514-T2565 PolarHBondContact NH2-O 2.63Å; R2514-T2565 VanDerWaalsContact NH2-O 3.16Å
2566A33.3Very low38.1Very low83 Ų83106.5 Ų106.569%0.68658%0.576SS**  trans75.3104.5159.900000119.2
2567G36.9Very low38.1Very low66 Ų66103.4 Ų103.468%0.6856%0.562SS**  trans119.6117.913300000117.8
2568K40.5Very low38.8Very low182 Ų182100.8 Ų100.879%0.79155%0.548SS*.  trans79.9105.1165.9-66.8-177.5175.7178.90118N2570 Q2571K2568-N2570 VanDerWaalsContact C-N 3.31Å; K2568-N2570 PolarHBondContact O-N 2.79Å; K2568-Q2571 PolarHBondContact O-N 3.23Å
2569E40.5Very low39.6Very low168 Ų168100.7 Ų100.779%0.78555%0.546SS*.THydrogen-bonded Turntrans-58.4-24.2-173.3-65.2170.2165.100116Q2571 N2572E2569-Q2571 VanDerWaalsContact C-N 3.33Å; E2569-Q2571 PolarHBondContact O-N 3.2Å; E2569-N2572 WeakPolarHBondContact O-CB 3.43Å; E2569-N2572 PolarHBondContact O-N 3.44Å
2570N41Very low40.1Very low147 Ų147103.8 Ų103.879%0.78655%0.551SS**Hα-helixtrans-71.1-24.3-179.6-74.56000113.9K2568 N2572K2568-N2570 VanDerWaalsContact C-N 3.31Å; K2568-N2570 PolarHBondContact O-N 2.79Å; N2570-N2572 PolarHBondContact O-N 3.17Å
2571Q42.2Very low41Very low84 Ų84100.2 Ų100.239%0.39353%0.525SS..Hα-helixtrans-75.2-16.1176.9-68.6-176-20.100112.2K2568 E2569 I2575K2568-Q2571 PolarHBondContact O-N 3.23Å; E2569-Q2571 VanDerWaalsContact C-N 3.33Å; E2569-Q2571 PolarHBondContact O-N 3.2Å; Q2571-I2575 HydrophobicContact CB-CD1 4.47Å; Q2571-I2575 VanDerWaalsContact O-CD1 3.32Å; Q2571-I2575 WeakPolarHBondContact O-CD1 3.42Å; Q2571-I2575 WeakPolarHBondContact O-CG1 3.3Å; Q2571-I2575 PolarHBondContact O-N 3.45Å
2572N46.6Very low42Very low82 Ų8297.9 Ų97.944%0.43951%0.511SS..Hα-helixtrans-72.4-34.5-176.4-71.1-16.5000113E2569 N2570 Q2576E2569-N2572 WeakPolarHBondContact O-CB 3.43Å; E2569-N2572 PolarHBondContact O-N 3.44Å; N2570-N2572 PolarHBondContact O-N 3.17Å; N2572-Q2576 WeakPolarHBondContact O-CB 3.41Å; N2572-Q2576 VanDerWaalsContact O-CG 3.25Å; N2572-Q2576 WeakPolarHBondContact O-CG 3.42Å; N2572-Q2576 PolarHBondContact O-N 3.23Å
2573A42.6Very low43.4Very low67 Ų6792.5 Ų92.555%0.55448%0.481SS*.Hα-helixtrans-68.7-44.8-179.300000111.7Q2576 M2577A2573-Q2576 PolarHBondContact O-N 2.93Å; A2573-M2577 WeakPolarHBondContact O-CB 3.41Å; A2573-M2577 PolarHBondContact O-N 3.35Å
2574E40.6Very low44.6Very low127 Ų12786.9 Ų86.959%0.59346%0.464SS*.Hα-helixtrans-61.6-44.3174.8-71177.9178.700111.5M2577 M2578E2574-M2577 PolarHBondContact O-N 3.43Å; E2574-M2578 WeakPolarHBondContact O-CB 3.46Å; E2574-M2578 VanDerWaalsContact O-CG 3.26Å; E2574-M2578 WeakPolarHBondContact O-CG 3.36Å; E2574-M2578 PolarHBondContact O-N 2.85Å
2575I47.5Very low46Very low75 Ų7580.7 Ų80.739%0.38544%0.435SS..Hα-helixtrans-62.9-44.6177.1-67.5166.9000110.7Q2571 M2578 Q2579Q2571-I2575 HydrophobicContact CB-CD1 4.47Å; Q2571-I2575 VanDerWaalsContact O-CD1 3.32Å; Q2571-I2575 WeakPolarHBondContact O-CD1 3.42Å; Q2571-I2575 WeakPolarHBondContact O-CG1 3.3Å; Q2571-I2575 PolarHBondContact O-N 3.45Å; I2575-M2578 PolarHBondContact O-N 3.32Å; I2575-Q2579 HydrophobicContact CG2-CG 4.48Å; I2575-Q2579 WeakPolarHBondContact O-CB 3.31Å; I2575-Q2579 VanDerWaalsContact O-CG 3.23Å; I2575-Q2579 WeakPolarHBondContact O-CG 3.46Å; I2575-Q2579 PolarHBondContact O-N 2.92Å
2576Q46Very low47.7Very low71 Ų7176.7 Ų76.733%0.33241%0.41SS..Hα-helixtrans-64.2-39.6176.5-77.1-179.64.700112.3N2572 A2573 Q2579 R2580N2572-Q2576 WeakPolarHBondContact O-CB 3.41Å; N2572-Q2576 VanDerWaalsContact O-CG 3.25Å; N2572-Q2576 WeakPolarHBondContact O-CG 3.42Å; N2572-Q2576 PolarHBondContact O-N 3.23Å; A2573-Q2576 PolarHBondContact O-N 2.93Å; Q2576-Q2579 PolarHBondContact O-N 3.39Å; Q2576-R2580 WeakPolarHBondContact O-CG 3.42Å; Q2576-R2580 PolarHBondContact O-N 2.94Å
2577M42.1Very low49.3Very low50 Ų5074.8 Ų74.825%0.24639%0.392CS..Hα-helixtrans-63.4-47.5176.3-174.9180-178.400110.8Y2169 A2573 E2574 Q2579 R2580 L2581Y2169-M2577 VanDerWaalsContact CB-CE 3.45Å; Y2169-M2577 HydrophobicContact CG-CE 4.1Å; A2573-M2577 WeakPolarHBondContact O-CB 3.41Å; A2573-M2577 PolarHBondContact O-N 3.35Å; E2574-M2577 PolarHBondContact O-N 3.43Å; M2577-Q2579 VanDerWaalsContact C-N 3.3Å; M2577-Q2579 PolarHBondContact O-N 2.94Å; M2577-R2580 PolarHBondContact O-N 3.17Å; M2577-L2581 HydrophobicContact CE-CD1 4.33Å; M2577-L2581 HydrophobicContact CG-CD1 4.21Å; M2577-L2581 WeakPolarHBondContact O-CB 3.36Å; M2577-L2581 WeakPolarHBondContact O-CG 3.03Å; M2577-L2581 PolarHBondContact O-N 3.43Å
2578M46.4Very low51Low51 Ų5172.1 Ų72.125%0.25136%0.363SS..Hα-helixtrans-64.6-34.4176.9-68.8-67-92.200112F2521 I2525 E2574 I2575 T2582F2521-M2578 HydrophobicContact CE1-CB 3.93Å; I2525-M2578 HydrophobicContact CB-CE 3.98Å; I2525-M2578 HydrophobicContact CD1-CB 4.05Å; I2525-M2578 HydrophobicContact CD1-CE 3.23Å; I2525-M2578 HydrophobicContact CD1-CG 4.5Å; I2525-M2578 HydrophobicContact CD1-SD 4.03Å; I2525-M2578 HydrophobicContact CG1-CE 4.16Å; I2525-M2578 HydrophobicContact CG2-CE 4.09Å; E2574-M2578 WeakPolarHBondContact O-CB 3.46Å; E2574-M2578 VanDerWaalsContact O-CG 3.26Å; E2574-M2578 WeakPolarHBondContact O-CG 3.36Å; E2574-M2578 PolarHBondContact O-N 2.85Å; I2575-M2578 PolarHBondContact O-N 3.32Å; M2578-T2582 WeakPolarHBondContact O-CB 3.33Å; M2578-T2582 VanDerWaalsContact O-CG2 3.28Å; M2578-T2582 WeakPolarHBondContact O-CG2 3.27Å; M2578-T2582 PolarHBondContact O-N 3.4Å; M2578-T2582 PolarHBondContact O-OG1 2.97Å
2579Q51Low52.6Low49 Ų4964.2 Ų64.223%0.22933%0.329CS..Hα-helixtrans-65.4-41.1171.8-77.1172.9-7.100112.6I2575 Q2576 M2577 T2582 Q2583I2575-Q2579 HydrophobicContact CG2-CG 4.48Å; I2575-Q2579 WeakPolarHBondContact O-CB 3.31Å; I2575-Q2579 VanDerWaalsContact O-CG 3.23Å; I2575-Q2579 WeakPolarHBondContact O-CG 3.46Å; I2575-Q2579 PolarHBondContact O-N 2.92Å; Q2576-Q2579 PolarHBondContact O-N 3.39Å; M2577-Q2579 VanDerWaalsContact C-N 3.3Å; M2577-Q2579 PolarHBondContact O-N 2.94Å; Q2579-T2582 VanDerWaalsContact CA-OG1 3.27Å; Q2579-T2582 WeakPolarHBondContact CA-OG1 3.49Å; Q2579-T2582 PolarHBondContact O-OG1 2.89Å; Q2579-Q2583 WeakPolarHBondContact O-CB 3.39Å; Q2579-Q2583 WeakPolarHBondContact O-CG 3.16Å; Q2579-Q2583 PolarHBondContact O-N 2.82Å
2580R47.9Very low54.2Low151 Ų15157.8 Ų57.857%0.5730%0.298SS*.Hα-helixtrans-69.9-41.8176.9-72.8-179.7-176-177.23.3112.3Q2576 M2577 T2582 Q2583 L2584Q2576-R2580 WeakPolarHBondContact O-CG 3.42Å; Q2576-R2580 PolarHBondContact O-N 2.94Å; M2577-R2580 PolarHBondContact O-N 3.17Å; R2580-T2582 VanDerWaalsContact C-N 3.34Å; R2580-Q2583 WeakPolarHBondContact O-CB 3.39Å; R2580-Q2583 PolarHBondContact O-N 3.2Å; R2580-L2584 WeakPolarHBondContact O-CB 2.94Å; R2580-L2584 PolarHBondContact O-N 3.24Å
2581L51.4Low55.9Low13 Ų1353.6 Ų53.67%0.06828%0.277CS..Hα-helixtrans-63.2-41.3176.2-75.8175.2000111.4I2173 F2389 M2577 L2584 G2585I2173-L2581 HydrophobicContact CD1-CD2 4.19Å; F2389-L2581 HydrophobicContact CE1-CB 4.46Å; F2389-L2581 HydrophobicContact CE1-CD2 4.06Å; F2389-L2581 HydrophobicContact CE2-CD2 4.1Å; F2389-L2581 HydrophobicContact CZ-CB 3.83Å; F2389-L2581 HydrophobicContact CZ-CD2 3.78Å; F2389-L2581 HydrophobicContact CZ-CG 4.27Å; M2577-L2581 HydrophobicContact CE-CD1 4.33Å; M2577-L2581 HydrophobicContact CG-CD1 4.21Å; M2577-L2581 WeakPolarHBondContact O-CB 3.36Å; M2577-L2581 WeakPolarHBondContact O-CG 3.03Å; M2577-L2581 PolarHBondContact O-N 3.43Å; L2581-L2584 PolarHBondContact O-N 3.3Å; L2581-G2585 PolarHBondContact O-N 3.29Å
2582T57.1Low57.8Low10 Ų1049.7 Ų49.76%0.06126%0.259CS..Hα-helixtrans-65.6-39.6172.646.70000112.2F2492 I2525 M2578 Q2579 R2580 L2584 G2585 V2586F2492-T2582 HydrophobicContact CZ-CG2 4.08Å; I2525-T2582 HydrophobicContact CD1-CG2 3.44Å; I2525-T2582 VanDerWaalsContact CD1-CG2 3.44Å; I2525-T2582 HydrophobicContact CG1-CG2 3.55Å; M2578-T2582 WeakPolarHBondContact O-CB 3.33Å; M2578-T2582 VanDerWaalsContact O-CG2 3.28Å; M2578-T2582 WeakPolarHBondContact O-CG2 3.27Å; M2578-T2582 PolarHBondContact O-N 3.4Å; M2578-T2582 PolarHBondContact O-OG1 2.97Å; Q2579-T2582 VanDerWaalsContact CA-OG1 3.27Å; Q2579-T2582 WeakPolarHBondContact CA-OG1 3.49Å; Q2579-T2582 PolarHBondContact O-OG1 2.89Å; R2580-T2582 VanDerWaalsContact C-N 3.34Å; T2582-L2584 PolarHBondContact O-N 2.95Å; T2582-G2585 PolarHBondContact O-N 2.85Å; T2582-V2586 WeakPolarHBondContact O-CB 3.46Å; T2582-V2586 WeakPolarHBondContact O-CG2 3.44Å; T2582-V2586 PolarHBondContact O-N 3.28Å
2583Q58.1Low59.5Low34 Ų3446 Ų4616%0.15924%0.24CC..Hα-helixtrans-60.5-43.7173-76170.38.300112.1L2558 N2559 Q2579 R2580 V2586 S2587L2558-Q2583 HydrophobicContact CB-CG 4.43Å; L2558-Q2583 HydrophobicContact CD1-CG 4.17Å; N2559-Q2583 PolarHBondContact OD1-NE2 3.06Å; Q2579-Q2583 WeakPolarHBondContact O-CB 3.39Å; Q2579-Q2583 WeakPolarHBondContact O-CG 3.16Å; Q2579-Q2583 PolarHBondContact O-N 2.82Å; R2580-Q2583 WeakPolarHBondContact O-CB 3.39Å; R2580-Q2583 PolarHBondContact O-N 3.2Å; Q2583-V2586 PolarHBondContact O-N 3.43Å; Q2583-S2587 VanDerWaalsContact O-CB 3.27Å; Q2583-S2587 WeakPolarHBondContact O-CB 3.4Å; Q2583-S2587 PolarHBondContact O-N 2.77Å; Q2583-S2587 PolarHBondContact O-OG 3.39Å
2584L58.2Low61.4Low57 Ų5749.3 Ų49.330%0.29824%0.238SC..Hα-helixtrans-64.7-48.7178.4-167.7138.5000110.6F2389 R2580 L2581 T2582 V2586 S2587 C2588F2389-L2584 HydrophobicContact CD1-CD2 4.12Å; F2389-L2584 HydrophobicContact CE1-CD2 4.25Å; R2580-L2584 WeakPolarHBondContact O-CB 2.94Å; R2580-L2584 PolarHBondContact O-N 3.24Å; L2581-L2584 PolarHBondContact O-N 3.3Å; T2582-L2584 PolarHBondContact O-N 2.95Å; L2584-V2586 PolarHBondContact O-N 2.95Å; L2584-S2587 WeakPolarHBondContact CA-OG 3.47Å; L2584-S2587 WeakPolarHBondContact O-CB 3.42Å; L2584-S2587 PolarHBondContact O-N 3.2Å; L2584-S2587 VanDerWaalsContact O-N 3.1Å; L2584-S2587 PolarHBondContact O-OG 3.41Å; L2584-C2588 PolarHBondContact O-N 3Å; L2584-C2588 PolarHBondContact O-SG 2.87Å; L2584-C2588 VanDerWaalsContact O-SG 3.4Å
2585G65.2Low63.5Low11 Ų1143.4 Ų43.411%0.11321%0.211CC..Hα-helixtrans-57.9-45.617500000113.2L2581 T2582 S2587 C2588 L2589L2581-G2585 PolarHBondContact O-N 3.29Å; T2582-G2585 PolarHBondContact O-N 2.85Å; G2585-S2587 VanDerWaalsContact C-N 3.3Å; G2585-S2587 PolarHBondContact O-N 2.88Å; G2585-C2588 PolarHBondContact O-N 3.38Å; G2585-L2589 WeakPolarHBondContact O-CB 3.08Å; G2585-L2589 PolarHBondContact O-N 3.27Å
2586V67.6Low65.4Low33 Ų3339.9 Ų39.920%0.219%0.193CC..Hα-helixtrans-64.2-35.8175.5171.10000111.5T2582 Q2583 L2584 R2590T2582-V2586 WeakPolarHBondContact O-CB 3.46Å; T2582-V2586 WeakPolarHBondContact O-CG2 3.44Å; T2582-V2586 PolarHBondContact O-N 3.28Å; Q2583-V2586 PolarHBondContact O-N 3.43Å; L2584-V2586 PolarHBondContact O-N 2.95Å; V2586-R2590 VanDerWaalsContact O-CB 3.29Å; V2586-R2590 WeakPolarHBondContact O-CB 3.47Å; V2586-R2590 PolarHBondContact O-N 3.48Å
2587S66.7Low67.2Low42 Ų4236.7 Ų36.729%0.29418%0.178SC..Hα-helixtrans-68.6-43.8177.178.50000112Q2583 L2584 G2585 R2590 V2591Q2583-S2587 VanDerWaalsContact O-CB 3.27Å; Q2583-S2587 WeakPolarHBondContact O-CB 3.4Å; Q2583-S2587 PolarHBondContact O-N 2.77Å; Q2583-S2587 PolarHBondContact O-OG 3.39Å; L2584-S2587 WeakPolarHBondContact CA-OG 3.47Å; L2584-S2587 WeakPolarHBondContact O-CB 3.42Å; L2584-S2587 PolarHBondContact O-N 3.2Å; L2584-S2587 VanDerWaalsContact O-N 3.1Å; L2584-S2587 PolarHBondContact O-OG 3.41Å; G2585-S2587 VanDerWaalsContact C-N 3.3Å; G2585-S2587 PolarHBondContact O-N 2.88Å; S2587-R2590 PolarHBondContact O-N 3.05Å; S2587-V2591 WeakPolarHBondContact O-CG2 3.46Å; S2587-V2591 PolarHBondContact O-N 3.26Å
2588C71.1Confident69.3Low11 Ų1134.5 Ų34.57%0.07417%0.168CC..Hα-helixtrans-58.4-52.5173-700000109.8L2584 G2585 R2590 V2591 Q2592L2584-C2588 PolarHBondContact O-N 3Å; L2584-C2588 PolarHBondContact O-SG 2.87Å; L2584-C2588 VanDerWaalsContact O-SG 3.4Å; G2585-C2588 PolarHBondContact O-N 3.38Å; C2588-R2590 VanDerWaalsContact C-N 3.28Å; C2588-R2590 PolarHBondContact O-N 2.8Å; C2588-V2591 CarbonylContact O-C 3.57Å; C2588-V2591 WeakPolarHBondContact O-CA 3.38Å; C2588-V2591 PolarHBondContact O-N 3.25Å; C2588-Q2592 WeakPolarHBondContact O-CG 3.14Å; C2588-Q2592 PolarHBondContact O-N 3.35Å
2589L74.2Confident71.2Confident16 Ų1632.1 Ų32.18%0.08416%0.156CC..Hα-helixtrans-56.4-41.6178.3-169.4154.5000111.9I2483 L2487 I2550 G2585 V2591 Q2592 L2593I2483-L2589 HydrophobicContact CG2-CD1 4.02Å; L2487-L2589 HydrophobicContact CD1-CD1 4.17Å; I2550-L2589 HydrophobicContact CG2-CD2 4.25Å; G2585-L2589 WeakPolarHBondContact O-CB 3.08Å; G2585-L2589 PolarHBondContact O-N 3.27Å; L2589-V2591 PolarHBondContact O-N 2.93Å; L2589-Q2592 PolarHBondContact O-N 2.91Å; L2589-L2593 HydrophobicContact CD2-CD1 3.51Å; L2589-L2593 HydrophobicContact CD2-CG 4.02Å; L2589-L2593 WeakPolarHBondContact O-CG 3.31Å; L2589-L2593 PolarHBondContact O-N 3.3Å
2590R75.2Confident72.9Confident32 Ų3229.8 Ų29.812%0.12115%0.145CC..Hα-helixtrans-63.9-40.5176-177.9-174-71.7177.9-4.6112.4I2550 C2553 V2586 S2587 C2588 R2594I2550-R2590 PolarHBondContact O-NE 3.48Å; I2550-R2590 PolarHBondContact O-NH2 3.45Å; C2553-R2590 PolarHBondContact O-NH2 2.97Å; V2586-R2590 VanDerWaalsContact O-CB 3.29Å; V2586-R2590 WeakPolarHBondContact O-CB 3.47Å; V2586-R2590 PolarHBondContact O-N 3.48Å; S2587-R2590 PolarHBondContact O-N 3.05Å; C2588-R2590 VanDerWaalsContact C-N 3.28Å; C2588-R2590 PolarHBondContact O-N 2.8Å; R2590-R2594 WeakPolarHBondContact O-CB 3.34Å; R2590-R2594 VanDerWaalsContact O-CG 3.32Å; R2590-R2594 WeakPolarHBondContact O-CG 3.42Å; R2590-R2594 PolarHBondContact O-N 3.45Å; R2590-R2594 VanDerWaalsContact O-N 3.11Å
2591V76.8Confident74.8Confident59 Ų5924.5 Ų24.536%0.35813%0.127SC..Hα-helixtrans-67.4-45.3176.1173.90000110.2T2396 S2587 C2588 L2589 L2593 R2594 G2595T2396-V2591 HydrophobicContact CG2-CB 3.86Å; T2396-V2591 HydrophobicContact CG2-CG1 3.61Å; S2587-V2591 WeakPolarHBondContact O-CG2 3.46Å; S2587-V2591 PolarHBondContact O-N 3.26Å; C2588-V2591 CarbonylContact O-C 3.57Å; C2588-V2591 WeakPolarHBondContact O-CA 3.38Å; C2588-V2591 PolarHBondContact O-N 3.25Å; L2589-V2591 PolarHBondContact O-N 2.93Å; V2591-L2593 PolarHBondContact O-N 2.69Å; V2591-R2594 PolarHBondContact O-N 3.06Å; V2591-G2595 PolarHBondContact O-N 2.85Å
2592Q82.1Confident76.4Confident3 Ų324.8 Ų24.81%0.01413%0.128CC..Hα-helixtrans-54.9-51.7175.1-68.1-175.6-12.700111.5S2392 E2395 T2396 I2399 C2588 L2589 R2594 G2595 L2596S2392-Q2592 PolarHBondContact O-NE2 3.35Å; E2395-Q2592 PolarHBondContact OE2-NE2 2.92Å; T2396-Q2592 HydrophobicContact CG2-CG 4.1Å; T2396-Q2592 WeakPolarHBondContact OG1-CG 3.22Å; T2396-Q2592 PolarHBondContact OG1-NE2 3.21Å; T2396-Q2592 VanDerWaalsContact OG1-NE2 3.09Å; I2399-Q2592 HydrophobicContact CD1-CB 3.92Å; I2399-Q2592 HydrophobicContact CD1-CG 3.86Å; C2588-Q2592 WeakPolarHBondContact O-CG 3.14Å; C2588-Q2592 PolarHBondContact O-N 3.35Å; L2589-Q2592 PolarHBondContact O-N 2.91Å; Q2592-R2594 PolarHBondContact O-N 2.91Å; Q2592-G2595 PolarHBondContact O-N 2.94Å; Q2592-L2596 WeakPolarHBondContact O-CB 3.44Å; Q2592-L2596 WeakPolarHBondContact O-CG 3.33Å; Q2592-L2596 PolarHBondContact O-N 2.73Å
2593L82.4Confident77.9Confident5 Ų524.3 Ų24.33%0.02613%0.125CC..Hα-helixtrans-61.5-43179-71.6176.3000112.3L2477 K2480 F2551 L2589 V2591 L2596 I2597L2477-L2593 HydrophobicContact CD1-CD2 3.7Å; K2480-L2593 HydrophobicContact CB-CD2 3.73Å; F2551-L2593 HydrophobicContact CE1-CB 4.26Å; F2551-L2593 HydrophobicContact CE2-CD1 3.93Å; F2551-L2593 HydrophobicContact CZ-CB 3.74Å; F2551-L2593 HydrophobicContact CZ-CD1 3.66Å; F2551-L2593 HydrophobicContact CZ-CG 4.35Å; L2589-L2593 HydrophobicContact CD2-CD1 3.51Å; L2589-L2593 HydrophobicContact CD2-CG 4.02Å; L2589-L2593 WeakPolarHBondContact O-CG 3.31Å; L2589-L2593 PolarHBondContact O-N 3.3Å; V2591-L2593 PolarHBondContact O-N 2.69Å; L2593-L2596 PolarHBondContact O-N 2.99Å; L2593-I2597 VanDerWaalsContact O-CD1 3.3Å; L2593-I2597 WeakPolarHBondContact O-CD1 3.34Å; L2593-I2597 WeakPolarHBondContact O-CG1 3.49Å; L2593-I2597 PolarHBondContact O-N 3.19Å
2594R81.8Confident79.2Confident136 Ų13622.8 Ų22.851%0.51312%0.118SC..Hα-helixtrans-64.2-41.6177-75.7177.9-178167.80.6111.9F2551 R2590 V2591 Q2592 G2598F2551-R2594 HydrophobicContact CE1-CG 4.15Å; R2590-R2594 WeakPolarHBondContact O-CB 3.34Å; R2590-R2594 VanDerWaalsContact O-CG 3.32Å; R2590-R2594 WeakPolarHBondContact O-CG 3.42Å; R2590-R2594 PolarHBondContact O-N 3.45Å; R2590-R2594 VanDerWaalsContact O-N 3.11Å; V2591-R2594 PolarHBondContact O-N 3.06Å; Q2592-R2594 PolarHBondContact O-N 2.91Å; R2594-G2598 PolarHBondContact O-N 3Å
2595G85Confident80.4Confident3 Ų322 Ų223%0.03111%0.113CC..Hα-helixtrans-60.6-49.5175.400000111.5V2591 Q2592 I2597 G2598 I2599V2591-G2595 PolarHBondContact O-N 2.85Å; Q2592-G2595 PolarHBondContact O-N 2.94Å; G2595-I2597 PolarHBondContact O-N 3.27Å; G2595-G2598 CarbonylContact O-C 3.52Å; G2595-G2598 WeakPolarHBondContact O-CA 3.5Å; G2595-G2598 PolarHBondContact O-N 3Å; G2595-G2598 VanDerWaalsContact O-N 3.14Å; G2595-I2599 VanDerWaalsContact O-CG1 3.28Å; G2595-I2599 WeakPolarHBondContact O-CG1 3.21Å; G2595-I2599 PolarHBondContact O-N 2.83Å
2596L86.6Confident81.3Confident0 Ų021.6 Ų21.60%011%0.108CC..Hα-helixtrans-60.6-44.6177.9-72.9170.2000112.7I2399 W2472 C2476 L2477 K2480 Q2592 L2593 G2598 I2599 I2600I2399-L2596 HydrophobicContact CD1-CD1 4.45Å; I2399-L2596 HydrophobicContact CD1-CG 4.33Å; I2399-L2596 HydrophobicContact CG2-CG 4.27Å; W2472-L2596 HydrophobicContact CH2-CD2 4.37Å; W2472-L2596 HydrophobicContact CZ3-CD2 4.43Å; C2476-L2596 HydrophobicContact CB-CD1 4.15Å; C2476-L2596 HydrophobicContact CB-CD2 3.87Å; L2477-L2596 HydrophobicContact CD1-CB 4.41Å; K2480-L2596 HydrophobicContact CG-CD1 4.16Å; Q2592-L2596 WeakPolarHBondContact O-CB 3.44Å; Q2592-L2596 WeakPolarHBondContact O-CG 3.33Å; Q2592-L2596 PolarHBondContact O-N 2.73Å; L2593-L2596 PolarHBondContact O-N 2.99Å; L2596-G2598 VanDerWaalsContact C-N 3.3Å; L2596-G2598 PolarHBondContact O-N 2.69Å; L2596-I2599 WeakPolarHBondContact O-CB 3.41Å; L2596-I2599 PolarHBondContact O-N 3.37Å; L2596-I2600 WeakPolarHBondContact O-CG1 3.34Å; L2596-I2600 PolarHBondContact O-N 3.42Å
2597I85.3Confident82Confident5 Ų520.2 Ų20.23%0.02610%0.099CC..Hα-helixtrans-59.6-44.5174.8-66.9159000110.2F2551 L2593 G2595 I2599 I2600 E2601 Y2716 L2717F2551-I2597 HydrophobicContact CZ-CD1 4.25Å; L2593-I2597 VanDerWaalsContact O-CD1 3.3Å; L2593-I2597 WeakPolarHBondContact O-CD1 3.34Å; L2593-I2597 WeakPolarHBondContact O-CG1 3.49Å; L2593-I2597 PolarHBondContact O-N 3.19Å; G2595-I2597 PolarHBondContact O-N 3.27Å; I2597-I2599 VanDerWaalsContact C-N 3.35Å; I2597-I2599 PolarHBondContact O-N 3.39Å; I2597-I2600 PolarHBondContact O-N 3.28Å; I2597-E2601 WeakPolarHBondContact O-CG 3.06Å; I2597-E2601 PolarHBondContact O-N 2.92Å; I2597-Y2716 HydrophobicContact CD1-CD2 4.07Å; I2597-Y2716 HydrophobicContact CD1-CE2 3.84Å; I2597-Y2716 HydrophobicContact CG1-CE2 4.37Å; I2597-L2717 HydrophobicContact CB-CD2 4.4Å; I2597-L2717 HydrophobicContact CD1-CD2 3.78Å; I2597-L2717 HydrophobicContact CG1-CD2 3.89Å; I2597-L2717 HydrophobicContact CG2-CD2 3.56Å
2598G85.4Confident82.7Confident4 Ų419.8 Ų19.84%0.0419%0.091CC..Hα-helixtrans-62.5-39176.400000113.3R2594 G2595 L2596 E2601 Q2602R2594-G2598 PolarHBondContact O-N 3Å; G2595-G2598 CarbonylContact O-C 3.52Å; G2595-G2598 WeakPolarHBondContact O-CA 3.5Å; G2595-G2598 PolarHBondContact O-N 3Å; G2595-G2598 VanDerWaalsContact O-N 3.14Å; L2596-G2598 VanDerWaalsContact C-N 3.3Å; L2596-G2598 PolarHBondContact O-N 2.69Å; G2598-E2601 PolarHBondContact O-N 3.42Å; G2598-Q2602 WeakPolarHBondContact O-CB 3.39Å; G2598-Q2602 VanDerWaalsContact O-CG 3.27Å; G2598-Q2602 WeakPolarHBondContact O-CG 3.37Å; G2598-Q2602 PolarHBondContact O-N 2.98Å
2599I86.7Confident83Confident0 Ų022 Ų220%010%0.1CC..Hα-helixtrans-62.3-43174.3-71.5165.5000110.7I2399 I2402 Y2403 L2406 L2469 W2472 G2595 L2596 I2597 Q2602 S2603I2399-I2599 HydrophobicContact CG2-CD1 4.04Å; I2402-I2599 HydrophobicContact CB-CD1 4.1Å; I2402-I2599 HydrophobicContact CG2-CD1 3.8Å; I2402-I2599 HydrophobicContact CG2-CG1 4.19Å; Y2403-I2599 HydrophobicContact CD2-CG1 4.25Å; L2406-I2599 HydrophobicContact CD1-CB 4.03Å; L2406-I2599 HydrophobicContact CD1-CG1 3.95Å; L2406-I2599 HydrophobicContact CD1-CG2 3.67Å; L2469-I2599 HydrophobicContact CD2-CG2 3.68Å; W2472-I2599 HydrophobicContact CZ3-CD1 4.33Å; G2595-I2599 VanDerWaalsContact O-CG1 3.28Å; G2595-I2599 WeakPolarHBondContact O-CG1 3.21Å; G2595-I2599 PolarHBondContact O-N 2.83Å; L2596-I2599 WeakPolarHBondContact O-CB 3.41Å; L2596-I2599 PolarHBondContact O-N 3.37Å; I2597-I2599 VanDerWaalsContact C-N 3.35Å; I2597-I2599 PolarHBondContact O-N 3.39Å; I2599-Q2602 PolarHBondContact O-N 3.33Å; I2599-S2603 WeakPolarHBondContact O-CB 3.49Å; I2599-S2603 PolarHBondContact O-N 3.48Å; I2599-S2603 PolarHBondContact O-OG 3.46Å
2600I86.6Confident83Confident0 Ų021.4 Ų21.40%010%0.096CC..Hα-helixtrans-64.9-45.8177-67161000110.7S2473 L2474 L2477 L2596 I2597 Q2602 S2603 T2604 L2708 L2711S2473-I2600 VanDerWaalsContact OG-CG1 3.23Å; S2473-I2600 WeakPolarHBondContact OG-CG1 3.21Å; L2474-I2600 HydrophobicContact CD2-CD1 3.87Å; L2474-I2600 HydrophobicContact CD2-CG1 4.3Å; L2474-I2600 HydrophobicContact CG-CD1 4.49Å; L2477-I2600 HydrophobicContact CB-CD1 4.37Å; L2477-I2600 HydrophobicContact CD2-CD1 3.63Å; L2596-I2600 WeakPolarHBondContact O-CG1 3.34Å; L2596-I2600 PolarHBondContact O-N 3.42Å; I2597-I2600 PolarHBondContact O-N 3.28Å; I2600-Q2602 VanDerWaalsContact C-N 3.34Å; I2600-Q2602 PolarHBondContact O-N 2.91Å; I2600-S2603 WeakPolarHBondContact CA-OG 3.28Å; I2600-S2603 PolarHBondContact O-OG 2.85Å; I2600-S2603 VanDerWaalsContact O-OG 3.14Å; I2600-T2604 HydrophobicContact CG2-CG2 4.21Å; I2600-T2604 WeakPolarHBondContact O-CB 3.3Å; I2600-T2604 WeakPolarHBondContact O-CG2 3.35Å; I2600-T2604 PolarHBondContact O-N 3.14Å; I2600-T2604 PolarHBondContact O-OG1 3Å; I2600-L2708 HydrophobicContact CG2-CD2 3.99Å; I2600-L2711 HydrophobicContact CD1-CD1 3.99Å
2601E86.4Confident83Confident41 Ų4120.2 Ų20.219%0.1929%0.092CC..Hα-helixtrans-59.3-45.2177.1-73.2175178.700111.5I2597 G2598 T2604 F2605 Q2721 F2724 I2725I2597-E2601 WeakPolarHBondContact O-CG 3.06Å; I2597-E2601 PolarHBondContact O-N 2.92Å; G2598-E2601 PolarHBondContact O-N 3.42Å; E2601-T2604 PolarHBondContact O-OG1 3.39Å; E2601-F2605 WeakPolarHBondContact O-CB 3.48Å; E2601-F2605 PolarHBondContact O-N 3.29Å; E2601-F2605 VanDerWaalsContact O-N 3.16Å; E2601-Q2721 VanDerWaalsContact OE1-CB 3.22Å; E2601-Q2721 WeakPolarHBondContact OE1-CB 3.47Å; E2601-Q2721 WeakPolarHBondContact OE1-CG 3.45Å; E2601-Q2721 PolarHBondContact OE1-NE2 3.46Å; E2601-Q2721 VanDerWaalsContact OE1-NE2 3.09Å; E2601-F2724 HydrophobicContact CB-CD1 4.16Å; E2601-F2724 HydrophobicContact CB-CE1 3.88Å; E2601-F2724 HydrophobicContact CG-CD1 3.95Å; E2601-F2724 HydrophobicContact CG-CE1 4.2Å; E2601-F2724 WeakPolarHBondContact O-CE1 3.27Å; E2601-I2725 HydrophobicContact CG-CD1 4.15Å; E2601-I2725 HydrophobicContact CG-CG1 4.17Å
2602Q86.7Confident82.8Confident18 Ų1820 Ų208%0.0849%0.089CC..Hα-helixtrans-72-43.3-179.1-68.9-179.419.500112.3Y2403 L2406 T2410 G2598 I2599 I2600 F2605 L2606Y2403-Q2602 PolarHBondContact O-OE1 3.44Å; L2406-Q2602 HydrophobicContact CB-CB 4.17Å; L2406-Q2602 PolarHBondContact O-OE1 3.12Å; T2410-Q2602 HydrophobicContact CG2-CB 3.73Å; T2410-Q2602 HydrophobicContact CG2-CG 3.93Å; G2598-Q2602 WeakPolarHBondContact O-CB 3.39Å; G2598-Q2602 VanDerWaalsContact O-CG 3.27Å; G2598-Q2602 WeakPolarHBondContact O-CG 3.37Å; G2598-Q2602 PolarHBondContact O-N 2.98Å; I2599-Q2602 PolarHBondContact O-N 3.33Å; I2600-Q2602 VanDerWaalsContact C-N 3.34Å; I2600-Q2602 PolarHBondContact O-N 2.91Å; Q2602-F2605 WeakPolarHBondContact O-CB 3.17Å; Q2602-F2605 PolarHBondContact O-N 2.93Å; Q2602-L2606 WeakPolarHBondContact O-CB 3.49Å; Q2602-L2606 WeakPolarHBondContact O-CG 3.29Å; Q2602-L2606 PolarHBondContact O-N 2.88Å
2603S87.2Confident82.1Confident1 Ų120.7 Ų20.71%0.0079%0.094CC..Hα-helixtrans-67.1-41.2179.459.60000113.1I2599 I2600 F2605 L2606 L2607I2599-S2603 WeakPolarHBondContact O-CB 3.49Å; I2599-S2603 PolarHBondContact O-N 3.48Å; I2599-S2603 PolarHBondContact O-OG 3.46Å; I2600-S2603 WeakPolarHBondContact CA-OG 3.28Å; I2600-S2603 PolarHBondContact O-OG 2.85Å; I2600-S2603 VanDerWaalsContact O-OG 3.14Å; S2603-F2605 VanDerWaalsContact C-N 3.31Å; S2603-F2605 PolarHBondContact O-N 3.49Å; S2603-L2606 PolarHBondContact O-N 3.24Å; S2603-L2607 WeakPolarHBondContact O-CB 3.38Å; S2603-L2607 PolarHBondContact O-N 3.37Å
2604T85.1Confident81.4Confident1 Ų121 Ų211%0.00610%0.096CC..Hα-helixtrans-62.3-39.817352.20000111.6L2470 I2600 E2601 W2608 L2708 M2728L2470-T2604 HydrophobicContact CD1-CG2 3.47Å; L2470-T2604 VanDerWaalsContact CD1-CG2 3.47Å; I2600-T2604 HydrophobicContact CG2-CG2 4.21Å; I2600-T2604 WeakPolarHBondContact O-CB 3.3Å; I2600-T2604 WeakPolarHBondContact O-CG2 3.35Å; I2600-T2604 PolarHBondContact O-N 3.14Å; I2600-T2604 PolarHBondContact O-OG1 3Å; E2601-T2604 PolarHBondContact O-OG1 3.39Å; T2604-W2608 WeakPolarHBondContact O-CB 3.26Å; T2604-W2608 PolarHBondContact O-N 3.31Å; T2604-L2708 HydrophobicContact CG2-CD1 4.02Å; T2604-L2708 HydrophobicContact CG2-CD2 3.63Å; T2604-L2708 HydrophobicContact CG2-CG 4.5Å; T2604-M2728 WeakPolarHBondContact O-CE 3.32Å
2605F84.2Confident80.6Confident42 Ų4216.5 Ų16.518%0.1848%0.082CC..Hα-helixtrans-62.8-47.2174.3177.7-100.8000112.6T2410 I2413 E2601 Q2602 S2603 W2608 K2609 F2724 M2728T2410-F2605 HydrophobicContact CG2-CD1 4.09Å; I2413-F2605 HydrophobicContact CG2-CE1 4.19Å; E2601-F2605 WeakPolarHBondContact O-CB 3.48Å; E2601-F2605 PolarHBondContact O-N 3.29Å; E2601-F2605 VanDerWaalsContact O-N 3.16Å; Q2602-F2605 WeakPolarHBondContact O-CB 3.17Å; Q2602-F2605 PolarHBondContact O-N 2.93Å; S2603-F2605 VanDerWaalsContact C-N 3.31Å; S2603-F2605 PolarHBondContact O-N 3.49Å; F2605-W2608 HydrophobicContact CD2-CE3 4.1Å; F2605-W2608 HydrophobicContact CD2-CZ3 4.28Å; F2605-W2608 HydrophobicContact CE2-CE3 4.13Å; F2605-W2608 AromaticContact CE2-CZ3 3.88Å; F2605-W2608 HydrophobicContact CE2-CZ3 3.88Å; F2605-W2608 PolarHBondContact O-N 3.05Å; F2605-K2609 HydrophobicContact CE1-CD 4.42Å; F2605-K2609 HydrophobicContact CZ-CD 4.07Å; F2605-K2609 WeakPolarHBondContact O-CB 3.38Å; F2605-K2609 PolarHBondContact O-N 3.49Å; F2605-F2724 HydrophobicContact CB-CZ 4.13Å; F2605-F2724 HydrophobicContact CD2-CZ 4.39Å; F2605-M2728 HydrophobicContact CB-CE 4.45Å; F2605-M2728 HydrophobicContact CD2-CE 4.47Å
2606L83.6Confident79.6Confident1 Ų120.7 Ų20.71%0.00510%0.103CC..Hα-helixtrans-59.4-50.2176.4-69.8171000110.5L2406 L2409 T2410 I2413 L2437 I2466 Q2602 S2603 W2608 K2609 H2610L2406-L2606 HydrophobicContact CD2-CD1 3.85Å; L2409-L2606 HydrophobicContact CB-CD1 3.96Å; L2409-L2606 HydrophobicContact CB-CD2 4.08Å; L2409-L2606 HydrophobicContact CD1-CD1 4.25Å; T2410-L2606 HydrophobicContact CG2-CD1 4.12Å; T2410-L2606 HydrophobicContact CG2-CD2 3.92Å; T2410-L2606 HydrophobicContact CG2-CG 3.83Å; I2413-L2606 HydrophobicContact CD1-CD2 3.31Å; I2413-L2606 HydrophobicContact CG1-CD2 4.48Å; L2437-L2606 HydrophobicContact CD1-CD2 4.42Å; I2466-L2606 HydrophobicContact CD1-CB 4.23Å; I2466-L2606 HydrophobicContact CG2-CB 4.44Å; Q2602-L2606 WeakPolarHBondContact O-CB 3.49Å; Q2602-L2606 WeakPolarHBondContact O-CG 3.29Å; Q2602-L2606 PolarHBondContact O-N 2.88Å; S2603-L2606 PolarHBondContact O-N 3.24Å; L2606-W2608 PolarHBondContact O-N 3.39Å; L2606-K2609 PolarHBondContact O-N 2.83Å; L2606-H2610 WeakPolarHBondContact O-CB 3.27Å; L2606-H2610 PolarHBondContact O-CD2 3.19Å; L2606-H2610 PolarHBondContact O-N 3.1Å
2607L82.8Confident78.2Confident4 Ų423.6 Ų23.62%0.02112%0.119CC..Hα-helixtrans-55.6-52.2179.1-17665.5000111.5L2463 I2466 V2467 L2470 S2603 K2609 H2610 L2611 L2732L2463-L2607 HydrophobicContact CD2-CD1 4.09Å; I2466-L2607 HydrophobicContact CG2-CB 3.81Å; I2466-L2607 HydrophobicContact CG2-CD1 4.21Å; V2467-L2607 HydrophobicContact CG2-CD1 3.93Å; L2470-L2607 HydrophobicContact CD1-CD2 4.39Å; S2603-L2607 WeakPolarHBondContact O-CB 3.38Å; S2603-L2607 PolarHBondContact O-N 3.37Å; L2607-K2609 VanDerWaalsContact C-N 3.34Å; L2607-K2609 PolarHBondContact O-N 3.39Å; L2607-H2610 PolarHBondContact O-N 2.98Å; L2607-L2611 HydrophobicContact CD1-CD1 4.22Å; L2607-L2611 HydrophobicContact CD1-CG 4.48Å; L2607-L2611 HydrophobicContact CG-CD1 4.08Å; L2607-L2611 WeakPolarHBondContact O-CG 3.5Å; L2607-L2611 PolarHBondContact O-N 3.19Å; L2607-L2732 HydrophobicContact CD2-CD1 4.18Å; L2607-L2732 HydrophobicContact CD2-CD2 4.06Å; L2607-L2732 HydrophobicContact CG-CD2 4.04Å
2608W81.5Confident76.6Confident33 Ų3325.5 Ų25.513%0.12513%0.132CC..Hα-helixtrans-58.6-46178.4166.466.6000112T2604 F2605 L2606 H2610 L2611 N2612 M2728 R2731 L2732T2604-W2608 WeakPolarHBondContact O-CB 3.26Å; T2604-W2608 PolarHBondContact O-N 3.31Å; F2605-W2608 HydrophobicContact CD2-CE3 4.1Å; F2605-W2608 HydrophobicContact CD2-CZ3 4.28Å; F2605-W2608 HydrophobicContact CE2-CE3 4.13Å; F2605-W2608 AromaticContact CE2-CZ3 3.88Å; F2605-W2608 HydrophobicContact CE2-CZ3 3.88Å; F2605-W2608 PolarHBondContact O-N 3.05Å; L2606-W2608 PolarHBondContact O-N 3.39Å; W2608-H2610 VanDerWaalsContact C-N 3.34Å; W2608-H2610 PolarHBondContact O-N 3.3Å; W2608-L2611 PolarHBondContact O-N 2.95Å; W2608-N2612 WeakPolarHBondContact O-CB 3.43Å; W2608-N2612 PolarHBondContact O-N 2.88Å; W2608-M2728 HydrophobicContact CB-CE 3.17Å; W2608-M2728 HydrophobicContact CD2-CE 3.71Å; W2608-M2728 HydrophobicContact CE3-CE 3.75Å; W2608-M2728 HydrophobicContact CE3-SD 4.44Å; W2608-M2728 HydrophobicContact CG-CE 3.46Å; W2608-M2728 VanDerWaalsContact CG-CE 3.46Å; W2608-R2731 HydrophobicContact CG-CB 4.27Å; W2608-L2732 HydrophobicContact CB-CD2 3.93Å; W2608-L2732 HydrophobicContact CB-CG 4.34Å
2609K78Confident74.9Confident58 Ų5831.1 Ų31.125%0.25216%0.161SC..Hα-helixtrans-66.6-38.7-177-173.8134.4173.7-162.30111.8I2413 F2605 L2606 L2607 S2613I2413-K2609 HydrophobicContact CG2-CB 4.21Å; I2413-K2609 HydrophobicContact CG2-CD 3.15Å; I2413-K2609 HydrophobicContact CG2-CG 3.55Å; I2413-K2609 VanDerWaalsContact CG2-NZ 3.3Å; I2413-K2609 PolarHBondContact O-NZ 3.12Å; F2605-K2609 HydrophobicContact CE1-CD 4.42Å; F2605-K2609 HydrophobicContact CZ-CD 4.07Å; F2605-K2609 WeakPolarHBondContact O-CB 3.38Å; F2605-K2609 PolarHBondContact O-N 3.49Å; L2606-K2609 PolarHBondContact O-N 2.83Å; L2607-K2609 VanDerWaalsContact C-N 3.34Å; L2607-K2609 PolarHBondContact O-N 3.39Å; K2609-S2613 WeakPolarHBondContact O-CB 3.31Å; K2609-S2613 PolarHBondContact O-N 2.91Å
2610H74.7Confident73.1Confident4 Ų434.1 Ų34.12%0.01918%0.176CC..Hα-helixtrans-61.7-51.5173.5-88.8-78.5000112.1L2437 F2438 L2463 L2606 L2607 W2608 N2612 S2613 L2614L2437-H2610 VanDerWaalsContact CD1-NE2 3.27Å; L2437-H2610 WeakPolarHBondContact CD1-NE2 3.41Å; L2437-H2610 WeakPolarHBondContact CG-NE2 2.74Å; L2437-H2610 PolarHBondContact N-CE1 3.09Å; F2438-H2610 AromaticContact CE1-CE1 3.85Å; F2438-H2610 AromaticContact CE1-ND1 3.33Å; F2438-H2610 VanDerWaalsContact CE1-ND1 3.33Å; F2438-H2610 WeakPolarHBondContact CE1-ND1 3.17Å; F2438-H2610 AromaticContact CZ-ND1 3.35Å; F2438-H2610 VanDerWaalsContact CZ-ND1 3.35Å; F2438-H2610 WeakPolarHBondContact CZ-ND1 3.28Å; L2463-H2610 HydrophobicContact CD2-CB 4.08Å; L2606-H2610 WeakPolarHBondContact O-CB 3.27Å; L2606-H2610 PolarHBondContact O-CD2 3.19Å; L2606-H2610 PolarHBondContact O-N 3.1Å; L2607-H2610 PolarHBondContact O-N 2.98Å; W2608-H2610 VanDerWaalsContact C-N 3.34Å; W2608-H2610 PolarHBondContact O-N 3.3Å; H2610-N2612 VanDerWaalsContact C-N 3.35Å; H2610-N2612 PolarHBondContact O-N 2.78Å; H2610-S2613 PolarHBondContact O-N 3.47Å; H2610-L2614 WeakPolarHBondContact O-CG 3.49Å; H2610-L2614 PolarHBondContact O-N 3.28Å
2611L74.3Confident71.2Confident7 Ų735.2 Ų35.24%0.03718%0.182CC..Hα-helixtrans-61.9-42.9178.3-68.6174.8000111.7L2463 L2607 W2608 S2613 L2614 I2615 L2732 I2735L2463-L2611 HydrophobicContact CD2-CD2 4.11Å; L2463-L2611 HydrophobicContact CD2-CG 4.42Å; L2607-L2611 HydrophobicContact CD1-CD1 4.22Å; L2607-L2611 HydrophobicContact CD1-CG 4.48Å; L2607-L2611 HydrophobicContact CG-CD1 4.08Å; L2607-L2611 WeakPolarHBondContact O-CG 3.5Å; L2607-L2611 PolarHBondContact O-N 3.19Å; W2608-L2611 PolarHBondContact O-N 2.95Å; L2611-S2613 VanDerWaalsContact C-N 3.32Å; L2611-S2613 PolarHBondContact O-N 2.95Å; L2611-L2614 PolarHBondContact O-N 3.28Å; L2611-I2615 WeakPolarHBondContact O-CD1 3.42Å; L2611-I2615 WeakPolarHBondContact O-CG1 3.41Å; L2611-I2615 PolarHBondContact O-N 2.85Å; L2611-L2732 HydrophobicContact CD1-CD2 3.88Å; L2611-I2735 HydrophobicContact CB-CD1 4.09Å; L2611-I2735 HydrophobicContact CB-CG2 4.18Å; L2611-I2735 HydrophobicContact CD1-CG2 4.41Å
2612N72.9Confident69Low53 Ų5335.8 Ų35.828%0.28319%0.186SC..Hα-helixtrans-64.2-36.6178-169.352.5000112.3W2608 H2610 N2616 I2735W2608-N2612 WeakPolarHBondContact O-CB 3.43Å; W2608-N2612 PolarHBondContact O-N 2.88Å; H2610-N2612 VanDerWaalsContact C-N 3.35Å; H2610-N2612 PolarHBondContact O-N 2.78Å; N2612-N2616 VanDerWaalsContact CG-ND2 3.34Å; N2612-N2616 PolarHBondContact ND2-ND2 2.88Å; N2612-N2616 WeakPolarHBondContact O-CB 3.36Å; N2612-N2616 PolarHBondContact O-N 3.49Å; N2612-N2616 VanDerWaalsContact O-N 3.15Å; N2612-N2616 PolarHBondContact O-ND2 3.4Å; N2612-N2616 PolarHBondContact OD1-ND2 3.37Å; N2612-I2735 HydrophobicContact CB-CD1 4.15Å
2613S67Low66.8Low18 Ų1838 Ų3813%0.12621%0.213CC..Hα-helixtrans-67.2-40.4175.4-174.10000112.2A2434 K2609 H2610 L2611 I2615 N2617A2434-S2613 WeakPolarHBondContact CB-OG 3.23Å; K2609-S2613 WeakPolarHBondContact O-CB 3.31Å; K2609-S2613 PolarHBondContact O-N 2.91Å; H2610-S2613 PolarHBondContact O-N 3.47Å; L2611-S2613 VanDerWaalsContact C-N 3.32Å; L2611-S2613 PolarHBondContact O-N 2.95Å; S2613-I2615 VanDerWaalsContact C-N 3.34Å; S2613-N2617 PolarHBondContact O-N 3.42Å
2614L66.6Low64.2Low12 Ų1243.6 Ų43.66%0.06324%0.239CC..Hα-helixtrans-66.1-38.1178.3-72167.7000111.9F2438 I2459 L2463 H2610 L2611 L2692F2438-L2614 HydrophobicContact CE2-CD2 3.69Å; F2438-L2614 HydrophobicContact CE2-CG 4.17Å; F2438-L2614 HydrophobicContact CZ-CD1 3.94Å; F2438-L2614 HydrophobicContact CZ-CD2 3.79Å; F2438-L2614 HydrophobicContact CZ-CG 3.89Å; I2459-L2614 HydrophobicContact CD1-CD2 3.85Å; I2459-L2614 HydrophobicContact CG1-CD2 4.39Å; I2459-L2614 HydrophobicContact CG2-CD1 3.72Å; I2459-L2614 HydrophobicContact CG2-CD2 3.88Å; I2459-L2614 HydrophobicContact CG2-CG 4.45Å; L2463-L2614 HydrophobicContact CD1-CD1 3.94Å; H2610-L2614 WeakPolarHBondContact O-CG 3.49Å; H2610-L2614 PolarHBondContact O-N 3.28Å; L2611-L2614 PolarHBondContact O-N 3.28Å; L2614-L2692 HydrophobicContact CD1-CD2 4.19Å
2615I66.1Low61.8Low41 Ų4150.2 Ų50.221%0.2127%0.274CS..Hα-helixtrans-75.8-40-176.3-66.4170.3000112.2L2611 S2613 I2735 Q2739L2611-I2615 WeakPolarHBondContact O-CD1 3.42Å; L2611-I2615 WeakPolarHBondContact O-CG1 3.41Å; L2611-I2615 PolarHBondContact O-N 2.85Å; S2613-I2615 VanDerWaalsContact C-N 3.34Å; I2615-I2735 HydrophobicContact CD1-CB 4.2Å; I2615-I2735 HydrophobicContact CD1-CG1 4.18Å; I2615-I2735 HydrophobicContact CD1-CG2 3.29Å; I2615-Q2739 HydrophobicContact CD1-CG 4.3Å
2616N63.6Low59.3Low91 Ų9155.6 Ų55.649%0.48731%0.305SS..Hα-helixtrans-84.9-18.7-174.3-63.3-34.5000113.7N2612 P2618N2612-N2616 VanDerWaalsContact CG-ND2 3.34Å; N2612-N2616 PolarHBondContact ND2-ND2 2.88Å; N2612-N2616 WeakPolarHBondContact O-CB 3.36Å; N2612-N2616 PolarHBondContact O-N 3.49Å; N2612-N2616 VanDerWaalsContact O-N 3.15Å; N2612-N2616 PolarHBondContact O-ND2 3.4Å; N2612-N2616 PolarHBondContact OD1-ND2 3.37Å; N2616-P2618 VanDerWaalsContact C-CD 3.49Å; N2616-P2618 WeakPolarHBondContact O-CD 3.48Å
2617N58.6Low56.9Low62 Ų6262.9 Ų62.933%0.33234%0.337SS..  trans-123.767.9-177.9-73.3-24.3000112.4S2613 N2619 I2620S2613-N2617 PolarHBondContact O-N 3.42Å; N2617-N2619 PolarHBondContact O-N 2.97Å; N2617-I2620 HydrophobicContact CB-CD1 3.67Å; N2617-I2620 HydrophobicContact CB-CG1 4.1Å; N2617-I2620 PolarHBondContact O-N 2.94Å
2618P51.2Low54.2Low45 Ų4572 Ų7229%0.29238%0.379SS..G310 helixtrans-62.7-26.1-179.525.7-34.1000113N2616 I2620 I2621 L2685N2616-P2618 VanDerWaalsContact C-CD 3.49Å; N2616-P2618 WeakPolarHBondContact O-CD 3.48Å; P2618-I2620 PolarHBondContact O-N 2.79Å; P2618-I2620 VanDerWaalsContact O-N 3.15Å; P2618-I2621 WeakPolarHBondContact O-CB 3.29Å; P2618-I2621 PolarHBondContact O-N 2.86Å; P2618-L2685 HydrophobicContact CB-CD2 4.07Å
2619N48.5Very low51.7Low121 Ų12175.2 Ų75.265%0.64740%0.402SS*.G310 helixtrans-63.4-20.5-178.8-66-8.4000113.8N2617 I2621 I2622N2617-N2619 PolarHBondContact O-N 2.97Å; N2619-I2621 PolarHBondContact O-N 3.14Å; N2619-I2622 PolarHBondContact O-N 2.9Å
2620I48.7Very low49.6Very low64 Ų6478.6 Ų78.633%0.32843%0.43SS..G310 helixtrans-67.7-21.3176.5-62.3174.8000111.1F2455 N2617 P2618F2455-I2620 HydrophobicContact CE1-CG2 3.82Å; F2455-I2620 HydrophobicContact CZ-CG2 3.62Å; N2617-I2620 HydrophobicContact CB-CD1 3.67Å; N2617-I2620 HydrophobicContact CB-CG1 4.1Å; N2617-I2620 PolarHBondContact O-N 2.94Å; P2618-I2620 PolarHBondContact O-N 2.79Å; P2618-I2620 VanDerWaalsContact O-N 3.15Å
2621I46.7Very low47.3Very low22 Ų2285.9 Ų85.911%0.11347%0.469CS..G310 helixtrans-81.8-22.9-179.1-54.1172.6000111.3P2618 N2619 G2623 N2688 L2692P2618-I2621 WeakPolarHBondContact O-CB 3.29Å; P2618-I2621 PolarHBondContact O-N 2.86Å; N2619-I2621 PolarHBondContact O-N 3.14Å; I2621-G2623 PolarHBondContact O-N 3.48Å; I2621-N2688 HydrophobicContact CG2-CB 4Å; I2621-N2688 VanDerWaalsContact CG2-ND2 3.27Å; I2621-N2688 WeakPolarHBondContact CG2-ND2 3.24Å; I2621-L2692 HydrophobicContact CD1-CD1 3.81Å
2622I41.9Very low44.9Very low54 Ų5494.3 Ų94.328%0.27751%0.507SS..SBendtrans-90.992.1179.6-49.5173.6000107.8N2619 E2624 L2685N2619-I2622 PolarHBondContact O-N 2.9Å; I2622-E2624 PolarHBondContact O-N 2.8Å; I2622-L2685 HydrophobicContact CD1-CD1 3.78Å; I2622-L2685 HydrophobicContact CD1-CD2 4.09Å; I2622-L2685 HydrophobicContact CD1-CG 3.79Å; I2622-L2685 HydrophobicContact CG1-CD2 4.4Å; I2622-L2685 HydrophobicContact CG1-CG 4.32Å
2623G40.8Very low42.5Very low63 Ų63101 Ų10165%0.64954%0.536SS*.  trans-56.2113.1171.600000110.3I2621 N2625I2621-G2623 PolarHBondContact O-N 3.48Å; G2623-N2625 PolarHBondContact O-N 2.71Å
2624E32.4Very low40.4Very low119 Ų119108.4 Ų108.456%0.55657%0.569SS**  trans-68.972170.3-76.8-166.3139.100110.4I2622 K2627I2622-E2624 PolarHBondContact O-N 2.8Å; E2624-K2627 IonicContact OE1-NZ 3.35Å; E2624-K2627 PolarHBondContact OE1-NZ 3.32Å
2625N33.4Very low38.3Very low141 Ų141113.1 Ų113.175%0.75460%0.603SS**  trans-96.9119.4147.8-69.9-13.1000105G2623G2623-N2625 PolarHBondContact O-N 2.71Å
2626N31.5Very low36.3Very low154 Ų154119.4 Ų119.482%0.82464%0.636SS**  trans117.736.8167.5-50.6-16.5000117.6
2627K33.2Very low34.4Very low155 Ų155124.3 Ų124.367%0.67466%0.656SS**  trans-108.381.9154.7-74.2-178.5-171.5154.30110.4E2624 T2629E2624-K2627 IonicContact OE1-NZ 3.35Å; E2624-K2627 PolarHBondContact OE1-NZ 3.32Å; K2627-T2629 VanDerWaalsContact C-N 3.27Å; K2627-T2629 PolarHBondContact O-N 3.41Å
2628E27.5Very low32.7Very low196 Ų196126.6 Ų126.692%0.91668%0.677SS**  trans-68.387.5159.9-71-176.9163.600108.5
2629T28.6Very low31.4Very low100 Ų100129 Ų12961%0.61370%0.695SS**  trans-83.4123.8163.445.30000108.7K2627 L2631K2627-T2629 VanDerWaalsContact C-N 3.27Å; K2627-T2629 PolarHBondContact O-N 3.41Å; T2629-L2631 PolarHBondContact O-N 3.09Å
2630P32.6Very low30.3Very low129 Ų129131.8 Ų131.884%0.83870%0.703SS**  trans-7892-177.232-31.1000108.5
2631L26.7Very low29.2Very low157 Ų157132.3 Ų132.382%0.82273%0.725SS**  trans-94118.8171.7-77.4169.3000109.4T2629T2629-L2631 PolarHBondContact O-N 3.09Å
2632H24.1Very low28.3Very low184 Ų184137.6 Ų137.685%0.85276%0.758SS**  trans-35.7131.6174.1-95.4-96.9000113.7Q2634H2632-Q2634 PolarHBondContact O-N 3.09Å
2633H22.4Very low27.4Very low192 Ų192145.7 Ų145.789%0.88979%0.785SS**  trans-45.4103.2164.6-78.5-74.6000112.5
2634Q23.5Very low26.7Very low175 Ų175149.8 Ų149.882%0.81879%0.792SS**  trans-134.992.8145.2-76.7-169.7-1400108.7H2632 L2636H2632-Q2634 PolarHBondContact O-N 3.09Å; Q2634-L2636 PolarHBondContact O-N 2.94Å
2635S22.5Very low26.3Very low110 Ų110151.9 Ų151.977%0.76981%0.806SS**  trans10.392.8150.857.70000117.5
2636L23Very low25.9Very low174 Ų174149.7 Ų149.791%0.91180%0.802SS**  trans-131.1107.1144.1-82.1170.7000107.5Q2634 S2638Q2634-L2636 PolarHBondContact O-N 2.94Å; L2636-S2638 PolarHBondContact O-N 3.48Å
2637Q23.7Very low25.6Very low193 Ų193148.3 Ų148.390%0.90280%0.799SS**  trans-57.3127.8179.5-74.3171.2-29.300110.4
2638S23.3Very low25.2Very low110 Ų110147.8 Ų147.877%0.76981%0.809SS**  trans-48.8134.8162.753.30000112.6L2636L2636-S2638 PolarHBondContact O-N 3.48Å
2639S24.2Very low25.1Very low95 Ų95145.2 Ų145.266%0.66480%0.802SS**  -179123.4121.951.80000109.6
2640H24.7Very low24.8Very low180 Ų180146.7 Ų146.783%0.83381%0.814SS**  trans177.568137.1-82.2-45.1000107.5V2642H2640-V2642 PolarHBondContact O-N 3.23Å
2641G27.4Very low24.4Very low75 Ų75148.2 Ų148.277%0.77381%0.814SS**  trans-62.8118.8154.800000107.6R2643G2641-R2643 PolarHBondContact O-N 3.17Å; G2641-R2643 VanDerWaalsContact O-N 3.13Å
2642V26.3Very low24.3Very low134 Ų134147.3 Ų147.381%0.81282%0.815SS**  trans-56.6112.8176.8175.80000108.1H2640 N2644H2640-V2642 PolarHBondContact O-N 3.23Å; V2642-N2644 PolarHBondContact O-N 2.9Å
2643R23.6Very low24.3Very low224 Ų224143.9 Ų143.985%0.84581%0.812SS**  trans-63.8112.6173.8-80.9176.9172.6158.7-2.8108.3G2641 L2645G2641-R2643 PolarHBondContact O-N 3.17Å; G2641-R2643 VanDerWaalsContact O-N 3.13Å; R2643-L2645 VanDerWaalsContact C-N 3.35Å; R2643-L2645 PolarHBondContact O-N 2.95Å
2644N25.8Very low24.8Very low148 Ų148140.6 Ų140.679%0.79181%0.807SS**  trans-59.796.7161.6-79.4-12.2000108.8V2642 S2646V2642-N2644 PolarHBondContact O-N 2.9Å; N2644-S2646 PolarHBondContact O-N 3.44Å
2645L24Very low24.8Very low163 Ų163141.2 Ų141.285%0.85381%0.813SS**  trans-8973.7170.5-78.5161.1000108.5R2643R2643-L2645 VanDerWaalsContact C-N 3.35Å; R2643-L2645 PolarHBondContact O-N 2.95Å
2646S25.1Very low24.9Very low96 Ų96145 Ų14567%0.67182%0.82SS**  trans-161.556.7171.665.80000112.5N2644N2644-S2646 PolarHBondContact O-N 3.44Å
2647T25.7Very low25Very low124 Ų124146.9 Ų146.976%0.76182%0.821SS**  trans-145.171.2161.648.80000109.9N2649T2647-N2649 PolarHBondContact O-N 3.43Å
2648T25.1Very low25Very low144 Ų144142.7 Ų142.788%0.88381%0.813SS**  trans-68109.4156.837.40000107.9C2650T2648-C2650 PolarHBondContact O-N 3.44Å
2649N24.4Very low25Very low143 Ų143142.4 Ų142.477%0.76581%0.811SS**  trans-45.9115.1-178.7-64.4-39.9000113.9T2647T2647-N2649 PolarHBondContact O-N 3.43Å
2650C23.6Very low25.1Very low130 Ų130146.5 Ų146.588%0.87883%0.825SS**  trans-110.6111.8149.5-76.80000107.8T2648 T2652T2648-C2650 PolarHBondContact O-N 3.44Å; C2650-T2652 PolarHBondContact O-N 3Å
2651I22.5Very low25.2Very low161 Ų161147.5 Ų147.583%0.82683%0.827SS**  trans-75113.5-176.8-64.7160.6000108.4
2652T26.1Very low25.6Very low138 Ų138149.1 Ų149.185%0.84782%0.824SS**  trans-132140.7151.753.80000109.6C2650C2650-T2652 PolarHBondContact O-N 3Å
2653S24.1Very low25.4Very low112 Ų112150.1 Ų150.178%0.78382%0.824SS**PPolyproline II helixtrans-77164.4-152.241.30000115.9
2654P32.5Very low25.6Very low123 Ų123146.1 Ų146.180%0.79982%0.819SS**PPolyproline II helixtrans-90.8135.3-160.334.7-30.4000112.8
2655M23.6Very low25.6Very low188 Ų188144.7 Ų144.793%0.92682%0.815SS**PPolyproline II helixtrans-100.9132.6158.4-92.8-175.982.800110.7
2656M24Very low26Very low190 Ų190143.1 Ų143.194%0.93682%0.815SS**PPolyproline II helixtrans-54123.8-168.5-69.4179159.500114.3
2657K24.4Very low26.1Very low213 Ų213145.2 Ų145.293%0.92682%0.823SS**  trans-89.1111.8159-79.7-179.1176177.10109.5
2658S23.7Very low26.1Very low105 Ų105149 Ų14973%0.73483%0.829SS**  trans-84.1109.7169.1440000111
2659S23.1Very low26.1Very low104 Ų104153.8 Ų153.873%0.72783%0.831SS**  trans31.6103.1135.563.60000119.3
2660L27.4Very low26.2Very low182 Ų182154.3 Ų154.395%0.95383%0.834SS**  trans-117.3121.1146.5-83.1165.4000108.9
2661K26.8Very low26.5Very low200 Ų200154.4 Ų154.487%0.8783%0.831SS**  trans-73.5153.3-174.2-82.6174.5173.4174.70112.3
2662P35.2Very low26.8Very low110 Ų110154.1 Ų154.171%0.71483%0.83SS**  trans-87.5151.7174.636.4-31.6000110.7
2663L23.2Very low27Very low154 Ų154153.4 Ų153.481%0.80682%0.819SS**  trans-170.5143.8143.3-130.179.1000113
2664L28.1Very low27.4Very low141 Ų141155.4 Ų155.474%0.73882%0.821SS**  trans10280.9150.1-61.9154.7000119
2665T24.9Very low27.6Very low118 Ų118154.3 Ų154.372%0.72481%0.812SS**  19.6136.7125.653.60000121
2666P32.1Very low28.3Very low130 Ų130147.8 Ų147.884%0.84479%0.788SS**  trans-92.1133-169.636.9-32000112.9
2667T27.9Very low28.9Very low139 Ų139143.4 Ų143.485%0.85376%0.764SS**  trans-113.7112.1169.741.10000111
2668K25.4Very low29.6Very low203 Ų203136.2 Ų136.288%0.88374%0.74SS**  trans-11.7124.6157.1-65.3170.9175.6176.50115.8
2669R25.8Very low30.5Very low246 Ų246138 Ų13893%0.92874%0.737SS**  -175.4111.8111.3-104.5170.8176.2151.5-1.9111.5
2670N26.2Very low31.5Very low153 Ų153138.6 Ų138.682%0.81873%0.728SS**  trans-57.7161.7157.5-78.9-21.7000111
2671T28.7Very low32.1Very low132 Ų132133.8 Ų133.881%0.8170%0.703SS**SBendtrans90.758.4171.977.60000116.7
2672L28.7Very low33Very low155 Ų155128.9 Ų128.981%0.81269%0.687SS**SBendtrans-163.732.7149.2-112.5154.2000113.2
2673M30.9Very low33.8Very low123 Ų123126.5 Ų126.561%0.60667%0.673SS**  trans-117.928.1-166-135176.9-175.400115.5F2677M2673-F2677 HydrophobicContact CB-CD2 4.49Å; M2673-F2677 HydrophobicContact CB-CE2 4.4Å; M2673-F2677 HydrophobicContact CE-CD2 4.39Å; M2673-F2677 HydrophobicContact CE-CE1 4.47Å; M2673-F2677 HydrophobicContact CE-CE2 3.41Å; M2673-F2677 VanDerWaalsContact CE-CE2 3.41Å; M2673-F2677 HydrophobicContact CE-CZ 3.45Å; M2673-F2677 VanDerWaalsContact CE-CZ 3.45Å; M2673-F2677 HydrophobicContact CG-CD2 3.78Å; M2673-F2677 HydrophobicContact CG-CE2 3.48Å; M2673-F2677 VanDerWaalsContact CG-CE2 3.48Å; M2673-F2677 HydrophobicContact CG-CZ 4.46Å; M2673-F2677 VanDerWaalsContact O-CD2 3.31Å; M2673-F2677 WeakPolarHBondContact O-CD2 3.18Å; M2673-F2677 HydrophobicContact SD-CD2 4.31Å; M2673-F2677 HydrophobicContact SD-CE2 3.41Å; M2673-F2677 WeakPolarHBondContact SD-CE2 3.39Å; M2673-F2677 HydrophobicContact SD-CZ 4.03Å
2674N33.5Very low35Very low155 Ų155123.2 Ų123.283%0.82966%0.655SS**SBendtrans-106.6-12.5171.9-83.92.8000114.7
2675T36.5Very low36Very low100 Ų100118.3 Ų118.361%0.61363%0.63SS**SBendtrans-95.9-35.3177.348.30000112.7S2678T2675-S2678 PolarHBondContact O-OG 3.42Å
2676A38.6Very low37.3Very low51 Ų51119.4 Ų119.442%0.42163%0.626SS.*Hα-helixtrans-69-39.9179.200000113.6S2678 Q2679 E2680A2676-S2678 VanDerWaalsContact C-N 3.31Å; A2676-S2678 PolarHBondContact O-N 2.92Å; A2676-Q2679 PolarHBondContact O-N 2.96Å; A2676-Q2679 VanDerWaalsContact O-N 3.12Å; A2676-E2680 PolarHBondContact O-N 3.48Å
2677F35.3Very low38.3Very low98 Ų98119.9 Ų119.943%0.4362%0.619SS.*Hα-helixtrans-67-28.6-179.6-84.8-60.2000114.1M2673 Q2679 N2681M2673-F2677 HydrophobicContact CB-CD2 4.49Å; M2673-F2677 HydrophobicContact CB-CE2 4.4Å; M2673-F2677 HydrophobicContact CE-CD2 4.39Å; M2673-F2677 HydrophobicContact CE-CE1 4.47Å; M2673-F2677 HydrophobicContact CE-CE2 3.41Å; M2673-F2677 VanDerWaalsContact CE-CE2 3.41Å; M2673-F2677 HydrophobicContact CE-CZ 3.45Å; M2673-F2677 VanDerWaalsContact CE-CZ 3.45Å; M2673-F2677 HydrophobicContact CG-CD2 3.78Å; M2673-F2677 HydrophobicContact CG-CE2 3.48Å; M2673-F2677 VanDerWaalsContact CG-CE2 3.48Å; M2673-F2677 HydrophobicContact CG-CZ 4.46Å; M2673-F2677 VanDerWaalsContact O-CD2 3.31Å; M2673-F2677 WeakPolarHBondContact O-CD2 3.18Å; M2673-F2677 HydrophobicContact SD-CD2 4.31Å; M2673-F2677 HydrophobicContact SD-CE2 3.41Å; M2673-F2677 WeakPolarHBondContact SD-CE2 3.39Å; M2673-F2677 HydrophobicContact SD-CZ 4.03Å; F2677-Q2679 VanDerWaalsContact C-N 3.31Å; F2677-N2681 PolarHBondContact O-N 3.15Å
2678S39.9Very low39.5Very low62 Ų62114.3 Ų114.343%0.43458%0.584SS.*Hα-helixtrans-70.6-29.5174.771.50000112.5T2675 A2676 N2682T2675-S2678 PolarHBondContact O-OG 3.42Å; A2676-S2678 VanDerWaalsContact C-N 3.31Å; A2676-S2678 PolarHBondContact O-N 2.92Å; S2678-N2682 WeakPolarHBondContact O-CB 3.5Å; S2678-N2682 PolarHBondContact O-N 3.26Å; S2678-N2682 PolarHBondContact O-ND2 3.11Å
2679Q42.5Very low40.8Very low143 Ų143107.7 Ų107.767%0.66856%0.557SS**Hα-helixtrans-78.5-37.8178.8-73.3-174.8-21.400112.1A2676 F2677 N2682 S2683A2676-Q2679 PolarHBondContact O-N 2.96Å; A2676-Q2679 VanDerWaalsContact O-N 3.12Å; F2677-Q2679 VanDerWaalsContact C-N 3.31Å; Q2679-N2682 PolarHBondContact O-N 3.19Å; Q2679-S2683 WeakPolarHBondContact O-CB 3.22Å; Q2679-S2683 PolarHBondContact O-N 3.27Å; Q2679-S2683 PolarHBondContact O-OG 3.4Å
2680E44.8Very low42.3Very low116 Ų11698.6 Ų98.654%0.54253%0.531SS..Hα-helixtrans-67.2-40.1175.2-81.1-175.3156.100112.8A2676 N2682 S2683 I2684A2676-E2680 PolarHBondContact O-N 3.48Å; E2680-N2682 VanDerWaalsContact C-N 3.34Å; E2680-N2682 PolarHBondContact O-N 2.69Å; E2680-S2683 PolarHBondContact O-N 3.4Å; E2680-S2683 PolarHBondContact O-OG 2.93Å; E2680-I2684 WeakPolarHBondContact O-CD1 3.3Å; E2680-I2684 VanDerWaalsContact O-CG1 3.29Å; E2680-I2684 WeakPolarHBondContact O-CG1 3.13Å; E2680-I2684 PolarHBondContact O-N 3.48Å
2681N39.8Very low44Very low80 Ų8095.3 Ų95.343%0.42851%0.508SS..Hα-helixtrans-68-35.9176.8-76.6-17.4000112.3F2677 L2685F2677-N2681 PolarHBondContact O-N 3.15Å; N2681-L2685 WeakPolarHBondContact O-CB 3.27Å; N2681-L2685 PolarHBondContact O-N 2.85Å
2682N45.4Very low45.4Very low97 Ų9789.8 Ų89.852%0.51947%0.473SS..Hα-helixtrans-70.6-35.6175.1-79.6-16.9000112.4S2678 Q2679 E2680 L2685 Q2686S2678-N2682 WeakPolarHBondContact O-CB 3.5Å; S2678-N2682 PolarHBondContact O-N 3.26Å; S2678-N2682 PolarHBondContact O-ND2 3.11Å; Q2679-N2682 PolarHBondContact O-N 3.19Å; E2680-N2682 VanDerWaalsContact C-N 3.34Å; E2680-N2682 PolarHBondContact O-N 2.69Å; N2682-L2685 PolarHBondContact O-N 3.28Å; N2682-Q2686 WeakPolarHBondContact O-CB 3.43Å; N2682-Q2686 WeakPolarHBondContact O-CG 3.46Å; N2682-Q2686 PolarHBondContact O-N 2.93Å
2683S51.2Low46.7Very low61 Ų6184.8 Ų84.843%0.42744%0.443SS..Hα-helixtrans-69.2-39.517769.50000111.7Q2679 E2680 Q2686 M2687Q2679-S2683 WeakPolarHBondContact O-CB 3.22Å; Q2679-S2683 PolarHBondContact O-N 3.27Å; Q2679-S2683 PolarHBondContact O-OG 3.4Å; E2680-S2683 PolarHBondContact O-N 3.4Å; E2680-S2683 PolarHBondContact O-OG 2.93Å; S2683-Q2686 PolarHBondContact O-N 3.09Å; S2683-M2687 VanDerWaalsContact O-CB 3.24Å; S2683-M2687 WeakPolarHBondContact O-CB 3.35Å; S2683-M2687 PolarHBondContact O-N 3.37Å
2684I48.9Very low48.1Very low84 Ų8483.7 Ų83.743%0.43144%0.44SS..Hα-helixtrans-65.7-42.2174.8-65.8164.5000110.9E2680 M2687 N2688E2680-I2684 WeakPolarHBondContact O-CD1 3.3Å; E2680-I2684 VanDerWaalsContact O-CG1 3.29Å; E2680-I2684 WeakPolarHBondContact O-CG1 3.13Å; E2680-I2684 PolarHBondContact O-N 3.48Å; I2684-M2687 PolarHBondContact O-N 2.91Å; I2684-N2688 WeakPolarHBondContact CG2-ND2 3.3Å; I2684-N2688 WeakPolarHBondContact O-CB 3.3Å; I2684-N2688 PolarHBondContact O-N 3.34Å; I2684-N2688 PolarHBondContact O-ND2 2.93Å; I2684-N2688 VanDerWaalsContact O-ND2 3.15Å
2685L48.6Very low49.3Very low39 Ų3978 Ų7820%0.20441%0.408CS..Hα-helixtrans-61.5-46.5173.9-94.6167.8000112.1P2618 I2622 N2681 N2682 M2687 N2688 M2689P2618-L2685 HydrophobicContact CB-CD2 4.07Å; I2622-L2685 HydrophobicContact CD1-CD1 3.78Å; I2622-L2685 HydrophobicContact CD1-CD2 4.09Å; I2622-L2685 HydrophobicContact CD1-CG 3.79Å; I2622-L2685 HydrophobicContact CG1-CD2 4.4Å; I2622-L2685 HydrophobicContact CG1-CG 4.32Å; N2681-L2685 WeakPolarHBondContact O-CB 3.27Å; N2681-L2685 PolarHBondContact O-N 2.85Å; N2682-L2685 PolarHBondContact O-N 3.28Å; L2685-M2687 VanDerWaalsContact C-N 3.35Å; L2685-N2688 PolarHBondContact O-N 3.12Å; L2685-M2689 WeakPolarHBondContact O-CB 3.34Å; L2685-M2689 VanDerWaalsContact O-CG 3.24Å; L2685-M2689 WeakPolarHBondContact O-CG 3.26Å; L2685-M2689 PolarHBondContact O-N 2.96Å
2686Q52.5Low50.4Low140 Ų14074.1 Ų74.165%0.65439%0.385SS*.Hα-helixtrans-63.5-41.1176.6-81.5-177.1-20.100111.7N2682 S2683 M2689 S2690N2682-Q2686 WeakPolarHBondContact O-CB 3.43Å; N2682-Q2686 WeakPolarHBondContact O-CG 3.46Å; N2682-Q2686 PolarHBondContact O-N 2.93Å; S2683-Q2686 PolarHBondContact O-N 3.09Å; Q2686-M2689 PolarHBondContact O-N 2.85Å; Q2686-S2690 VanDerWaalsContact O-CB 3.26Å; Q2686-S2690 WeakPolarHBondContact O-CB 3.4Å; Q2686-S2690 PolarHBondContact O-N 3.39Å; Q2686-S2690 PolarHBondContact O-OG 2.91Å
2687M53.7Low51.5Low140 Ų14076.1 Ų76.169%0.6939%0.385SS*.Hα-helixtrans-64.6-44.7177.9-164.9172.9177.900111.1S2683 I2684 L2685 S2690 W2691S2683-M2687 VanDerWaalsContact O-CB 3.24Å; S2683-M2687 WeakPolarHBondContact O-CB 3.35Å; S2683-M2687 PolarHBondContact O-N 3.37Å; I2684-M2687 PolarHBondContact O-N 2.91Å; L2685-M2687 VanDerWaalsContact C-N 3.35Å; M2687-S2690 WeakPolarHBondContact CA-OG 3.45Å; M2687-S2690 PolarHBondContact O-N 3.48Å; M2687-S2690 PolarHBondContact O-OG 3.49Å; M2687-W2691 VanDerWaalsContact O-CB 3.32Å; M2687-W2691 WeakPolarHBondContact O-CB 3.28Å; M2687-W2691 PolarHBondContact O-N 2.94Å
2688N51.8Low52.7Low22 Ų2278.1 Ų78.112%0.11840%0.396CS..Hα-helixtrans-66.2-39.4175.6-74.5-36.6000113N2456 I2621 I2684 L2685 W2691 L2692N2456-N2688 PolarHBondContact ND2-OD1 3.46Å; I2621-N2688 HydrophobicContact CG2-CB 4Å; I2621-N2688 VanDerWaalsContact CG2-ND2 3.27Å; I2621-N2688 WeakPolarHBondContact CG2-ND2 3.24Å; I2684-N2688 WeakPolarHBondContact CG2-ND2 3.3Å; I2684-N2688 WeakPolarHBondContact O-CB 3.3Å; I2684-N2688 PolarHBondContact O-N 3.34Å; I2684-N2688 PolarHBondContact O-ND2 2.93Å; I2684-N2688 VanDerWaalsContact O-ND2 3.15Å; L2685-N2688 PolarHBondContact O-N 3.12Å; N2688-W2691 PolarHBondContact O-N 2.73Å; N2688-L2692 WeakPolarHBondContact O-CB 3.42Å; N2688-L2692 PolarHBondContact O-N 3.25Å
2689M53.8Low53.6Low64 Ų6476.2 Ų76.232%0.31538%0.381SS..Hα-helixtrans-67.9-40.4175.1-74-71.2-78.100111.4L2685 Q2686 W2691 L2692 R2693L2685-M2689 WeakPolarHBondContact O-CB 3.34Å; L2685-M2689 VanDerWaalsContact O-CG 3.24Å; L2685-M2689 WeakPolarHBondContact O-CG 3.26Å; L2685-M2689 PolarHBondContact O-N 2.96Å; Q2686-M2689 PolarHBondContact O-N 2.85Å; M2689-W2691 VanDerWaalsContact C-N 3.35Å; M2689-L2692 PolarHBondContact O-N 3.09Å; M2689-R2693 VanDerWaalsContact O-CB 3.22Å; M2689-R2693 WeakPolarHBondContact O-CB 3.35Å; M2689-R2693 PolarHBondContact O-N 2.95Å
2690S57.7Low54.6Low56 Ų5669.9 Ų69.939%0.39235%0.352SS..Hα-helixtrans-65.3-38.417574.10000111.9Q2686 M2687 R2693 N2694Q2686-S2690 VanDerWaalsContact O-CB 3.26Å; Q2686-S2690 WeakPolarHBondContact O-CB 3.4Å; Q2686-S2690 PolarHBondContact O-N 3.39Å; Q2686-S2690 PolarHBondContact O-OG 2.91Å; M2687-S2690 WeakPolarHBondContact CA-OG 3.45Å; M2687-S2690 PolarHBondContact O-N 3.48Å; M2687-S2690 PolarHBondContact O-OG 3.49Å; S2690-R2693 PolarHBondContact O-N 2.97Å; S2690-N2694 PolarHBondContact O-N 3.45Å
2691W62.2Low55.5Low84 Ų8468.6 Ų68.632%0.31835%0.346SS..Hα-helixtrans-66.6-47.7174.6-179.987000111.9N2456 Q2460 M2687 N2688 M2689 R2693 N2694 H2695N2456-W2691 HydrophobicContact CB-CH2 4.2Å; N2456-W2691 HydrophobicContact CB-CZ3 4.29Å; Q2460-W2691 HydrophobicContact CB-CH2 4.06Å; Q2460-W2691 HydrophobicContact CB-CZ2 4.41Å; M2687-W2691 VanDerWaalsContact O-CB 3.32Å; M2687-W2691 WeakPolarHBondContact O-CB 3.28Å; M2687-W2691 PolarHBondContact O-N 2.94Å; N2688-W2691 PolarHBondContact O-N 2.73Å; M2689-W2691 VanDerWaalsContact C-N 3.35Å; W2691-R2693 VanDerWaalsContact C-N 3.27Å; W2691-R2693 PolarHBondContact O-N 3.15Å; W2691-N2694 PolarHBondContact O-N 3.2Å; W2691-H2695 VanDerWaalsContact O-CB 3.23Å; W2691-H2695 WeakPolarHBondContact O-CB 3.48Å; W2691-H2695 PolarHBondContact O-N 2.68Å
2692L57.2Low56.8Low15 Ų1571.5 Ų71.58%0.07936%0.361CS..Hα-helixtrans-58.8-38.8173.1-89.5162.9000111.5L2614 I2621 N2688 M2689 H2695 C2696L2614-L2692 HydrophobicContact CD1-CD2 4.19Å; I2621-L2692 HydrophobicContact CD1-CD1 3.81Å; N2688-L2692 WeakPolarHBondContact O-CB 3.42Å; N2688-L2692 PolarHBondContact O-N 3.25Å; M2689-L2692 PolarHBondContact O-N 3.09Å; L2692-H2695 PolarHBondContact O-N 2.93Å; L2692-C2696 VanDerWaalsContact O-CB 3.24Å; L2692-C2696 WeakPolarHBondContact O-CB 3.32Å; L2692-C2696 PolarHBondContact O-N 3.45Å; L2692-C2696 PolarHBondContact O-SG 3.29Å
2693R57.1Low58Low50 Ų5072.3 Ų72.319%0.18936%0.362CS..Hα-helixtrans-64-53.1178.6-171.6-176.8-85.6167.3-3.1111.3M2689 S2690 W2691 H2695 C2696 E2697 Q2739 S2742 N2743M2689-R2693 VanDerWaalsContact O-CB 3.22Å; M2689-R2693 WeakPolarHBondContact O-CB 3.35Å; M2689-R2693 PolarHBondContact O-N 2.95Å; S2690-R2693 PolarHBondContact O-N 2.97Å; W2691-R2693 VanDerWaalsContact C-N 3.27Å; W2691-R2693 PolarHBondContact O-N 3.15Å; R2693-H2695 VanDerWaalsContact C-N 3.29Å; R2693-H2695 PolarHBondContact O-N 2.94Å; R2693-C2696 PolarHBondContact O-N 3.33Å; R2693-E2697 PolarHBondContact O-N 2.8Å; R2693-Q2739 PolarHBondContact NE-O 3.46Å; R2693-Q2739 PolarHBondContact NH2-O 2.67Å; R2693-S2742 PolarHBondContact NH2-O 2.83Å; R2693-S2742 VanDerWaalsContact NH2-O 3.08Å; R2693-S2742 PolarHBondContact NH2-OG 3Å; R2693-N2743 PolarHBondContact NH1-OD1 3.34Å
2694N59.9Low59.2Low100 Ų10069.6 Ų69.654%0.53534%0.343SS..Hα-helixtrans-62.3-37176.9-70.5-4000111.9S2690 W2691 H2698S2690-N2694 PolarHBondContact O-N 3.45Å; W2691-N2694 PolarHBondContact O-N 3.2Å; N2694-H2698 PolarHBondContact O-CD2 3.43Å; N2694-H2698 PolarHBondContact O-N 2.83Å
2695H58.2Low60.6Low37 Ų3766.7 Ų66.717%0.17133%0.327CS..Hα-helixtrans-77.7-35.9-177.5-154.946.9000112.8Q2460 W2691 L2692 R2693 H2698 L2699Q2460-H2695 VanDerWaalsContact CG-NE2 3.35Å; Q2460-H2695 WeakPolarHBondContact CG-NE2 3.43Å; Q2460-H2695 PolarHBondContact NE2-CE1 3.08Å; Q2460-H2695 VanDerWaalsContact NE2-CE1 3.26Å; Q2460-H2695 PolarHBondContact NE2-NE2 3.04Å; Q2460-H2695 VanDerWaalsContact NE2-NE2 3.19Å; W2691-H2695 VanDerWaalsContact O-CB 3.23Å; W2691-H2695 WeakPolarHBondContact O-CB 3.48Å; W2691-H2695 PolarHBondContact O-N 2.68Å; L2692-H2695 PolarHBondContact O-N 2.93Å; R2693-H2695 VanDerWaalsContact C-N 3.29Å; R2693-H2695 PolarHBondContact O-N 2.94Å; H2695-H2698 PolarHBondContact O-N 3.24Å; H2695-L2699 WeakPolarHBondContact CD2-CD1 3.19Å; H2695-L2699 WeakPolarHBondContact NE2-CD1 3.41Å; H2695-L2699 WeakPolarHBondContact O-CB 3.5Å; H2695-L2699 WeakPolarHBondContact O-CG 3.45Å; H2695-L2699 PolarHBondContact O-N 2.89Å
2696C59.5Low62.1Low18 Ų1870.7 Ų70.712%0.12235%0.345CS..Hα-helixtrans-65.9-39.9175.5-72.40000112.3L2692 R2693 L2699 V2700L2692-C2696 VanDerWaalsContact O-CB 3.24Å; L2692-C2696 WeakPolarHBondContact O-CB 3.32Å; L2692-C2696 PolarHBondContact O-N 3.45Å; L2692-C2696 PolarHBondContact O-SG 3.29Å; R2693-C2696 PolarHBondContact O-N 3.33Å; C2696-L2699 PolarHBondContact O-N 3.48Å; C2696-V2700 PolarHBondContact O-N 3.44Å; C2696-V2700 VanDerWaalsContact O-N 3.11Å
2697E60.9Low63.3Low92 Ų9265.7 Ų65.743%0.4332%0.322SS..Hα-helixtrans-61.5-43.1173.9-80.2-179.1178.100111.7R2693 L2740R2693-E2697 PolarHBondContact O-N 2.8Å; E2697-L2740 WeakPolarHBondContact OE1-CD2 3.45Å
2698H62.1Low64.6Low141 Ų14159.1 Ų59.165%0.65329%0.29SS*.Hα-helixtrans-74.9-32.3178.6-76.9-49.7000114.2N2694 H2695 Q2701N2694-H2698 PolarHBondContact O-CD2 3.43Å; N2694-H2698 PolarHBondContact O-N 2.83Å; H2695-H2698 PolarHBondContact O-N 3.24Å; H2698-Q2701 WeakPolarHBondContact O-CG 3.45Å
2699L58.7Low66.1Low22 Ų2261.1 Ų61.112%0.11530%0.301CS..Hα-helixtrans-75.9-46-177.4-81.9170.6000112.6L2463 T2464 V2467 H2695 C2696 Q2701L2463-L2699 HydrophobicContact CB-CD1 4.14Å; L2463-L2699 HydrophobicContact CD1-CD1 4.43Å; T2464-L2699 HydrophobicContact CG2-CD2 3.71Å; V2467-L2699 WeakPolarHBondContact CG1-O 3.47Å; H2695-L2699 WeakPolarHBondContact CD2-CD1 3.19Å; H2695-L2699 WeakPolarHBondContact NE2-CD1 3.41Å; H2695-L2699 WeakPolarHBondContact O-CB 3.5Å; H2695-L2699 WeakPolarHBondContact O-CG 3.45Å; H2695-L2699 PolarHBondContact O-N 2.89Å; C2696-L2699 PolarHBondContact O-N 3.48Å; L2699-Q2701 PolarHBondContact O-N 3.38Å; L2699-Q2701 VanDerWaalsContact O-N 3.11Å
2700V63Low67.3Low9 Ų963.3 Ų63.36%0.05531%0.31CS..SBendtrans-89.471.5176-169.40000107.7C2696 I2704 M2705 I2736C2696-V2700 PolarHBondContact O-N 3.44Å; C2696-V2700 VanDerWaalsContact O-N 3.11Å; V2700-I2704 HydrophobicContact CG1-CG2 4.46Å; V2700-M2705 HydrophobicContact CG1-CG 3.77Å; V2700-M2705 HydrophobicContact CG1-SD 3.98Å; V2700-I2736 HydrophobicContact CB-CD1 4.17Å; V2700-I2736 HydrophobicContact CG1-CD1 3.92Å
2701Q63.8Low68.4Low90 Ų9061.1 Ų61.142%0.42129%0.294SS..  trans-52.1143.8177-65.6178-21.800110.4H2698 L2699 E2703 I2704H2698-Q2701 WeakPolarHBondContact O-CG 3.45Å; L2699-Q2701 PolarHBondContact O-N 3.38Å; L2699-Q2701 VanDerWaalsContact O-N 3.11Å; Q2701-E2703 PolarHBondContact O-N 3.41Å; Q2701-I2704 PolarHBondContact O-N 3.21Å
2702D66.1Low69.1Low140 Ų14058.3 Ų58.375%0.74929%0.286SS*.Hα-helixtrans-49.7-32.7177.2-72.7-32.8000112I2704 M2705 E2706D2702-I2704 PolarHBondContact O-N 3.12Å; D2702-M2705 PolarHBondContact O-N 2.63Å; D2702-E2706 WeakPolarHBondContact O-CB 3.33Å; D2702-E2706 PolarHBondContact O-N 3.13Å
2703E70.5Confident70.1Confident114 Ų11464 Ų6453%0.53331%0.31SS..Hα-helixtrans-54.9-44.1174.2-64.4-172.8178.500113.6Q2701 E2706 M2707Q2701-E2703 PolarHBondContact O-N 3.41Å; E2703-E2706 PolarHBondContact O-N 3.47Å; E2703-M2707 VanDerWaalsContact O-CB 3.28Å; E2703-M2707 WeakPolarHBondContact O-CB 3.45Å; E2703-M2707 WeakPolarHBondContact O-CG 3.38Å; E2703-M2707 PolarHBondContact O-N 2.98Å
2704I76.5Confident70.9Confident5 Ų562.3 Ų62.33%0.02631%0.307CS..Hα-helixtrans-66.3-43.9-178.7-74.2171.7000110.1V2467 L2470 V2700 Q2701 D2702 M2707 L2708V2467-I2704 HydrophobicContact CG1-CD1 3.71Å; L2470-I2704 HydrophobicContact CD2-CB 4.28Å; L2470-I2704 HydrophobicContact CD2-CD1 4.17Å; L2470-I2704 HydrophobicContact CD2-CG1 4.04Å; L2470-I2704 HydrophobicContact CD2-CG2 3.37Å; V2700-I2704 HydrophobicContact CG1-CG2 4.46Å; Q2701-I2704 PolarHBondContact O-N 3.21Å; D2702-I2704 PolarHBondContact O-N 3.12Å; I2704-M2707 PolarHBondContact O-N 2.95Å; I2704-L2708 HydrophobicContact CG2-CD1 3.96Å; I2704-L2708 HydrophobicContact CG2-CG 4.49Å; I2704-L2708 WeakPolarHBondContact O-CB 3.44Å; I2704-L2708 VanDerWaalsContact O-CG 3.31Å; I2704-L2708 WeakPolarHBondContact O-CG 3.47Å; I2704-L2708 PolarHBondContact O-N 3.18Å
2705M79.2Confident71.4Confident22 Ų2258.8 Ų58.811%0.10829%0.291CS..Hα-helixtrans-67.8-41.2179.8-69.5-60-69.500111V2700 D2702 L2708 N2709 H2729 L2732 E2733 I2736V2700-M2705 HydrophobicContact CG1-CG 3.77Å; V2700-M2705 HydrophobicContact CG1-SD 3.98Å; D2702-M2705 PolarHBondContact O-N 2.63Å; M2705-L2708 PolarHBondContact O-N 3.08Å; M2705-N2709 VanDerWaalsContact O-CB 3.25Å; M2705-N2709 WeakPolarHBondContact O-CB 3.16Å; M2705-N2709 PolarHBondContact O-N 2.69Å; M2705-H2729 WeakPolarHBondContact CE-NE2 3.39Å; M2705-L2732 HydrophobicContact CE-CB 4.48Å; M2705-L2732 HydrophobicContact SD-CB 4.32Å; M2705-E2733 HydrophobicContact CE-CB 3.8Å; M2705-E2733 HydrophobicContact CE-CG 4.41Å; M2705-I2736 HydrophobicContact SD-CD1 4.49Å
2706E78.8Confident72.1Confident123 Ų12358.1 Ų58.158%0.57529%0.287SS*.Hα-helixtrans-60.3-48172.7-80.9-166147.500112.1D2702 E2703 L2708 N2709 Q2710D2702-E2706 WeakPolarHBondContact O-CB 3.33Å; D2702-E2706 PolarHBondContact O-N 3.13Å; E2703-E2706 PolarHBondContact O-N 3.47Å; E2706-L2708 PolarHBondContact O-N 3.49Å; E2706-N2709 WeakPolarHBondContact O-CB 3.29Å; E2706-N2709 PolarHBondContact O-N 3.5Å; E2706-Q2710 WeakPolarHBondContact O-CG 3.48Å; E2706-Q2710 PolarHBondContact O-N 3.34Å
2707M78.7Confident72.8Confident36 Ų3657.3 Ų57.318%0.17728%0.282CS..Hα-helixtrans-63.2-42.5179.4-73.4-67-60.300111.8L2474 R2478 E2703 I2704 N2709 Q2710 L2711L2474-M2707 HydrophobicContact CB-CE 4.28Å; L2474-M2707 HydrophobicContact CD1-CB 3.8Å; L2474-M2707 HydrophobicContact CD2-CB 4.3Å; L2474-M2707 HydrophobicContact CG-CB 4.5Å; R2478-M2707 HydrophobicContact CB-CE 4.27Å; E2703-M2707 VanDerWaalsContact O-CB 3.28Å; E2703-M2707 WeakPolarHBondContact O-CB 3.45Å; E2703-M2707 WeakPolarHBondContact O-CG 3.38Å; E2703-M2707 PolarHBondContact O-N 2.98Å; I2704-M2707 PolarHBondContact O-N 2.95Å; M2707-N2709 VanDerWaalsContact C-N 3.35Å; M2707-N2709 PolarHBondContact O-N 3.06Å; M2707-Q2710 PolarHBondContact O-N 2.9Å; M2707-L2711 WeakPolarHBondContact O-CB 3.47Å; M2707-L2711 PolarHBondContact O-N 3.35Å
2708L81.6Confident73.6Confident1 Ų160.2 Ų60.21%0.00529%0.293CS..Hα-helixtrans-62.7-41.7173.8-75.4172.2000111.5I2600 T2604 I2704 M2705 E2706 L2711 T2712 I2725 L2732I2600-L2708 HydrophobicContact CG2-CD2 3.99Å; T2604-L2708 HydrophobicContact CG2-CD1 4.02Å; T2604-L2708 HydrophobicContact CG2-CD2 3.63Å; T2604-L2708 HydrophobicContact CG2-CG 4.5Å; I2704-L2708 HydrophobicContact CG2-CD1 3.96Å; I2704-L2708 HydrophobicContact CG2-CG 4.49Å; I2704-L2708 WeakPolarHBondContact O-CB 3.44Å; I2704-L2708 VanDerWaalsContact O-CG 3.31Å; I2704-L2708 WeakPolarHBondContact O-CG 3.47Å; I2704-L2708 PolarHBondContact O-N 3.18Å; M2705-L2708 PolarHBondContact O-N 3.08Å; E2706-L2708 PolarHBondContact O-N 3.49Å; L2708-L2711 WeakPolarHBondContact O-CB 3.39Å; L2708-L2711 PolarHBondContact O-N 2.96Å; L2708-T2712 WeakPolarHBondContact O-CG2 3.3Å; L2708-T2712 PolarHBondContact O-N 2.89Å; L2708-I2725 HydrophobicContact CD2-CG2 4.27Å; L2708-L2732 HydrophobicContact CD1-CD1 4.4Å
2709N82.2Confident74.3Confident65 Ų6560.6 Ų60.635%0.34830%0.295SS..Hα-helixtrans-63.7-42.8176.8-172.68.1000111.6M2705 E2706 M2707 L2711 T2712M2705-N2709 VanDerWaalsContact O-CB 3.25Å; M2705-N2709 WeakPolarHBondContact O-CB 3.16Å; M2705-N2709 PolarHBondContact O-N 2.69Å; E2706-N2709 WeakPolarHBondContact O-CB 3.29Å; E2706-N2709 PolarHBondContact O-N 3.5Å; M2707-N2709 VanDerWaalsContact C-N 3.35Å; M2707-N2709 PolarHBondContact O-N 3.06Å; N2709-L2711 VanDerWaalsContact C-N 3.26Å; N2709-L2711 PolarHBondContact O-N 3.43Å; N2709-T2712 PolarHBondContact O-N 3.18Å; N2709-T2712 PolarHBondContact O-OG1 3.07Å
2710Q80.2Confident75.3Confident109 Ų10965.7 Ų65.751%0.50932%0.323SS..Hα-helixtrans-58.3-41.9172.6-71.7176.712.600111.1E2706 M2707 T2712 K2713 A2714E2706-Q2710 WeakPolarHBondContact O-CG 3.48Å; E2706-Q2710 PolarHBondContact O-N 3.34Å; M2707-Q2710 PolarHBondContact O-N 2.9Å; Q2710-T2712 PolarHBondContact O-N 3.4Å; Q2710-K2713 WeakPolarHBondContact O-CB 3.35Å; Q2710-K2713 PolarHBondContact O-N 2.69Å; Q2710-A2714 PolarHBondContact O-N 2.91Å
2711L79.5Confident76.1Confident10 Ų1067.5 Ų67.55%0.05233%0.33CS..Hα-helixtrans-66.8-32.8179.8-161.1139.6000112.6L2474 L2477 I2600 M2707 L2708 N2709 K2713 A2714 L2717 I2725L2474-L2711 HydrophobicContact CD2-CD1 4.05Å; L2477-L2711 HydrophobicContact CD2-CD1 3.27Å; I2600-L2711 HydrophobicContact CD1-CD1 3.99Å; M2707-L2711 WeakPolarHBondContact O-CB 3.47Å; M2707-L2711 PolarHBondContact O-N 3.35Å; L2708-L2711 WeakPolarHBondContact O-CB 3.39Å; L2708-L2711 PolarHBondContact O-N 2.96Å; N2709-L2711 VanDerWaalsContact C-N 3.26Å; N2709-L2711 PolarHBondContact O-N 3.43Å; L2711-K2713 PolarHBondContact O-N 3.28Å; L2711-K2713 VanDerWaalsContact O-N 3.17Å; L2711-A2714 WeakPolarHBondContact O-CB 3.47Å; L2711-A2714 PolarHBondContact O-N 3.29Å; L2711-L2717 HydrophobicContact CD2-CD1 3.43Å; L2711-L2717 VanDerWaalsContact CD2-CD1 3.43Å; L2711-L2717 HydrophobicContact CG-CD1 4Å; L2711-L2717 WeakPolarHBondContact O-CD1 3.37Å; L2711-I2725 HydrophobicContact CD2-CB 4.42Å; L2711-I2725 HydrophobicContact CD2-CD1 3.16Å; L2711-I2725 HydrophobicContact CD2-CG1 4.25Å; L2711-I2725 HydrophobicContact CD2-CG2 3.85Å
2712T78.4Confident76.9Confident26 Ų2667.1 Ų67.116%0.1633%0.325CS..Hα-helixtrans-59.9-27.3171.869.50000113.1L2708 N2709 Q2710 I2725 Q2726L2708-T2712 WeakPolarHBondContact O-CG2 3.3Å; L2708-T2712 PolarHBondContact O-N 2.89Å; N2709-T2712 PolarHBondContact O-N 3.18Å; N2709-T2712 PolarHBondContact O-OG1 3.07Å; Q2710-T2712 PolarHBondContact O-N 3.4Å; T2712-I2725 HydrophobicContact CG2-CG2 4.04Å; T2712-Q2726 HydrophobicContact CG2-CB 3.94Å; T2712-Q2726 HydrophobicContact CG2-CG 4.49Å
2713K78.2Confident77.7Confident135 Ų13564.4 Ų64.459%0.58731%0.31SS*.THydrogen-bonded Turntrans-87.5-8.5178.8-59.2173.1-174171.50112.5Q2710 L2711 A2715Q2710-K2713 WeakPolarHBondContact O-CB 3.35Å; Q2710-K2713 PolarHBondContact O-N 2.69Å; L2711-K2713 PolarHBondContact O-N 3.28Å; L2711-K2713 VanDerWaalsContact O-N 3.17Å; K2713-A2715 PolarHBondContact O-N 3.49Å
2714A73.3Confident78.5Confident14 Ų1462.5 Ų62.512%0.11630%0.3CS..  trans-68.3126.8-177.500000112.1Q2710 L2711 Y2716 L2717 R2722Q2710-A2714 PolarHBondContact O-N 2.91Å; L2711-A2714 WeakPolarHBondContact O-CB 3.47Å; L2711-A2714 PolarHBondContact O-N 3.29Å; A2714-Y2716 HydrophobicContact CB-CD1 4.17Å; A2714-Y2716 HydrophobicContact CB-CE1 3.65Å; A2714-Y2716 HydrophobicContact CB-CE2 4.42Å; A2714-L2717 HydrophobicContact CB-CD1 4.06Å; A2714-L2717 HydrophobicContact CB-CG 4.37Å; A2714-R2722 WeakPolarHBondContact O-CD 3.42Å; A2714-R2722 PolarHBondContact O-NE 3.41Å
2715A69.7Low78.8Confident25 Ų2562.3 Ų62.321%0.20730%0.3CS..THydrogen-bonded Turntrans-84.3-9.7-171.200000115.7K2544 K2713 R2722K2544-A2715 HydrophobicContact CB-CB 3.64Å; K2544-A2715 HydrophobicContact CD-CB 3.41Å; K2544-A2715 VanDerWaalsContact CD-CB 3.41Å; K2544-A2715 HydrophobicContact CG-CB 3.25Å; K2713-A2715 PolarHBondContact O-N 3.49Å; A2715-R2722 PolarHBondContact O-NH2 3.37Å
2716Y72.8Confident79.1Confident23 Ų2365.7 Ų65.79%0.0932%0.315CS..THydrogen-bonded Turntrans-82.7-21.5177.252.7-96.7000114.1E2481 L2543 S2547 F2551 I2597 A2714E2481-Y2716 WeakPolarHBondContact OE1-CE1 3.31Å; E2481-Y2716 PolarHBondContact OE1-OH 2.96Å; L2543-Y2716 HydrophobicContact CD2-CD1 4.41Å; L2543-Y2716 HydrophobicContact CD2-CE1 4.34Å; S2547-Y2716 WeakPolarHBondContact OG-CB 3.39Å; F2551-Y2716 VanDerWaalsContact CD2-CB 3.49Å; F2551-Y2716 HydrophobicContact CD2-CG 4.26Å; F2551-Y2716 AromaticContact CE2-CD2 3.74Å; F2551-Y2716 HydrophobicContact CE2-CD2 3.74Å; F2551-Y2716 AromaticContact CE2-CG 3.77Å; F2551-Y2716 HydrophobicContact CE2-CG 3.77Å; F2551-Y2716 HydrophobicContact CZ-CD2 4.16Å; I2597-Y2716 HydrophobicContact CD1-CD2 4.07Å; I2597-Y2716 HydrophobicContact CD1-CE2 3.84Å; I2597-Y2716 HydrophobicContact CG1-CE2 4.37Å; A2714-Y2716 HydrophobicContact CB-CD1 4.17Å; A2714-Y2716 HydrophobicContact CB-CE1 3.65Å; A2714-Y2716 HydrophobicContact CB-CE2 4.42Å
2717L73.6Confident79.4Confident2 Ų262.9 Ų62.91%0.0131%0.306CS..SBendtrans-64.3138.7174.5-65.9172.2000109.6I2597 L2711 A2714 Q2721 R2722 I2725I2597-L2717 HydrophobicContact CB-CD2 4.4Å; I2597-L2717 HydrophobicContact CD1-CD2 3.78Å; I2597-L2717 HydrophobicContact CG1-CD2 3.89Å; I2597-L2717 HydrophobicContact CG2-CD2 3.56Å; L2711-L2717 HydrophobicContact CD2-CD1 3.43Å; L2711-L2717 VanDerWaalsContact CD2-CD1 3.43Å; L2711-L2717 HydrophobicContact CG-CD1 4Å; L2711-L2717 WeakPolarHBondContact O-CD1 3.37Å; A2714-L2717 HydrophobicContact CB-CD1 4.06Å; A2714-L2717 HydrophobicContact CB-CG 4.37Å; L2717-Q2721 HydrophobicContact CB-CB 4.27Å; L2717-Q2721 HydrophobicContact CD2-CB 4.37Å; L2717-R2722 HydrophobicContact CB-CG 3.43Å; L2717-R2722 VanDerWaalsContact CB-CG 3.43Å; L2717-R2722 HydrophobicContact CD1-CG 4Å; L2717-R2722 HydrophobicContact CG-CG 4.38Å; L2717-R2722 VanDerWaalsContact O-CZ 3.28Å; L2717-R2722 PolarHBondContact O-NE 3.25Å; L2717-R2722 PolarHBondContact O-NH2 3.14Å; L2717-I2725 HydrophobicContact CD1-CD1 4.12Å
2718K77.6Confident79.7Confident152 Ų15261.2 Ų61.266%0.66130%0.298SS*.  trans-62.8154170.3-63.7176.5179.2176.70109.2N2720 Q2721 R2722K2718-N2720 PolarHBondContact O-N 3.33Å; K2718-Q2721 HydrophobicContact CB-CG 4.08Å; K2718-Q2721 WeakPolarHBondContact O-CB 3.38Å; K2718-Q2721 PolarHBondContact O-N 3.2Å; K2718-R2722 PolarHBondContact O-N 3.43Å
2719Q76.9Confident79.8Confident149 Ų14962.1 Ų62.170%0.69630%0.302SS*.Hα-helixtrans-54.5-41-178.6-173167.80.300112.3Q2721 R2722 L2723Q2719-Q2721 VanDerWaalsContact C-N 3.33Å; Q2719-Q2721 PolarHBondContact O-N 3.37Å; Q2719-R2722 PolarHBondContact O-N 2.91Å; Q2719-L2723 HydrophobicContact CG-CD1 4.09Å; Q2719-L2723 WeakPolarHBondContact O-CB 3.42Å; Q2719-L2723 VanDerWaalsContact O-CG 3.27Å; Q2719-L2723 WeakPolarHBondContact O-CG 3.33Å; Q2719-L2723 PolarHBondContact O-N 3.01Å
2720N80Confident79.9Confident130 Ų13061.8 Ų61.870%0.69530%0.3SS*.Hα-helixtrans-63.4-36.9176.6-63.7-0.8000112.8K2718 F2724K2718-N2720 PolarHBondContact O-N 3.33Å; N2720-F2724 VanDerWaalsContact O-CB 3.31Å; N2720-F2724 WeakPolarHBondContact O-CB 3.36Å; N2720-F2724 PolarHBondContact O-N 2.93Å
2721Q80.8Confident80.1Confident46 Ų4661.2 Ų61.222%0.21529%0.293CS..Hα-helixtrans-70.7-44179.1-61.1-176.4-67.500110.8E2601 L2717 K2718 Q2719 L2723 F2724 I2725E2601-Q2721 VanDerWaalsContact OE1-CB 3.22Å; E2601-Q2721 WeakPolarHBondContact OE1-CB 3.47Å; E2601-Q2721 WeakPolarHBondContact OE1-CG 3.45Å; E2601-Q2721 PolarHBondContact OE1-NE2 3.46Å; E2601-Q2721 VanDerWaalsContact OE1-NE2 3.09Å; L2717-Q2721 HydrophobicContact CB-CB 4.27Å; L2717-Q2721 HydrophobicContact CD2-CB 4.37Å; K2718-Q2721 HydrophobicContact CB-CG 4.08Å; K2718-Q2721 WeakPolarHBondContact O-CB 3.38Å; K2718-Q2721 PolarHBondContact O-N 3.2Å; Q2719-Q2721 VanDerWaalsContact C-N 3.33Å; Q2719-Q2721 PolarHBondContact O-N 3.37Å; Q2721-L2723 PolarHBondContact O-N 3.39Å; Q2721-F2724 PolarHBondContact O-N 3.44Å; Q2721-I2725 VanDerWaalsContact O-CG1 3.27Å; Q2721-I2725 WeakPolarHBondContact O-CG1 3.43Å; Q2721-I2725 PolarHBondContact O-N 3.08Å
2722R80.4Confident80.2Confident82 Ų8260.8 Ų60.831%0.30929%0.291SS..Hα-helixtrans-60.6-46.3174.4-65.4-173.1-137.4175.73.2111.7A2714 A2715 L2717 K2718 Q2719 F2724 I2725 Q2726A2714-R2722 WeakPolarHBondContact O-CD 3.42Å; A2714-R2722 PolarHBondContact O-NE 3.41Å; A2715-R2722 PolarHBondContact O-NH2 3.37Å; L2717-R2722 HydrophobicContact CB-CG 3.43Å; L2717-R2722 VanDerWaalsContact CB-CG 3.43Å; L2717-R2722 HydrophobicContact CD1-CG 4Å; L2717-R2722 HydrophobicContact CG-CG 4.38Å; L2717-R2722 VanDerWaalsContact O-CZ 3.28Å; L2717-R2722 PolarHBondContact O-NE 3.25Å; L2717-R2722 PolarHBondContact O-NH2 3.14Å; K2718-R2722 PolarHBondContact O-N 3.43Å; Q2719-R2722 PolarHBondContact O-N 2.91Å; R2722-F2724 VanDerWaalsContact C-N 3.32Å; R2722-F2724 PolarHBondContact O-N 3.29Å; R2722-I2725 PolarHBondContact O-N 3.33Å; R2722-Q2726 WeakPolarHBondContact O-CB 3.44Å; R2722-Q2726 PolarHBondContact O-N 3.4Å
2723L83.9Confident80.3Confident83 Ų8363 Ų6344%0.43530%0.3SS..Hα-helixtrans-60.3-43.8176.6-74.8169.9000111Q2719 Q2721 Q2726 V2727Q2719-L2723 HydrophobicContact CG-CD1 4.09Å; Q2719-L2723 WeakPolarHBondContact O-CB 3.42Å; Q2719-L2723 VanDerWaalsContact O-CG 3.27Å; Q2719-L2723 WeakPolarHBondContact O-CG 3.33Å; Q2719-L2723 PolarHBondContact O-N 3.01Å; Q2721-L2723 PolarHBondContact O-N 3.39Å; L2723-Q2726 PolarHBondContact O-N 3.44Å; L2723-V2727 WeakPolarHBondContact O-CB 3.36Å; L2723-V2727 WeakPolarHBondContact O-CG2 2.83Å; L2723-V2727 PolarHBondContact O-N 3.09Å
2724F85.5Confident80.4Confident75 Ų7564.2 Ų64.233%0.32930%0.301SS..Hα-helixtrans-59.5-52.4176.6-178.2-92.8000111.4E2601 F2605 N2720 Q2721 R2722 Q2726 V2727 M2728E2601-F2724 HydrophobicContact CB-CD1 4.16Å; E2601-F2724 HydrophobicContact CB-CE1 3.88Å; E2601-F2724 HydrophobicContact CG-CD1 3.95Å; E2601-F2724 HydrophobicContact CG-CE1 4.2Å; E2601-F2724 WeakPolarHBondContact O-CE1 3.27Å; F2605-F2724 HydrophobicContact CB-CZ 4.13Å; F2605-F2724 HydrophobicContact CD2-CZ 4.39Å; N2720-F2724 VanDerWaalsContact O-CB 3.31Å; N2720-F2724 WeakPolarHBondContact O-CB 3.36Å; N2720-F2724 PolarHBondContact O-N 2.93Å; Q2721-F2724 PolarHBondContact O-N 3.44Å; R2722-F2724 VanDerWaalsContact C-N 3.32Å; R2722-F2724 PolarHBondContact O-N 3.29Å; F2724-Q2726 VanDerWaalsContact C-N 3.32Å; F2724-Q2726 PolarHBondContact O-N 2.9Å; F2724-V2727 WeakPolarHBondContact O-CB 3.45Å; F2724-V2727 PolarHBondContact O-N 3.16Å; F2724-V2727 VanDerWaalsContact O-N 3.13Å; F2724-M2728 HydrophobicContact CD1-CG 3.94Å; F2724-M2728 HydrophobicContact CE1-CG 3.57Å; F2724-M2728 HydrophobicContact CE1-SD 4.5Å; F2724-M2728 HydrophobicContact CE2-CG 4.3Å; F2724-M2728 HydrophobicContact CE2-SD 4.38Å; F2724-M2728 HydrophobicContact CG-CG 4.46Å; F2724-M2728 HydrophobicContact CZ-CG 3.79Å; F2724-M2728 HydrophobicContact CZ-SD 4.12Å; F2724-M2728 VanDerWaalsContact O-CG 3.29Å; F2724-M2728 WeakPolarHBondContact O-CG 3.2Å; F2724-M2728 PolarHBondContact O-N 3.07Å
2725I83.6Confident80.4Confident1 Ų164.1 Ų64.11%0.00530%0.298CS..Hα-helixtrans-64.9-38.9-177.5-63.9169.1000110.9E2601 L2708 L2711 T2712 L2717 Q2721 R2722 M2728 H2729E2601-I2725 HydrophobicContact CG-CD1 4.15Å; E2601-I2725 HydrophobicContact CG-CG1 4.17Å; L2708-I2725 HydrophobicContact CD2-CG2 4.27Å; L2711-I2725 HydrophobicContact CD2-CB 4.42Å; L2711-I2725 HydrophobicContact CD2-CD1 3.16Å; L2711-I2725 HydrophobicContact CD2-CG1 4.25Å; L2711-I2725 HydrophobicContact CD2-CG2 3.85Å; T2712-I2725 HydrophobicContact CG2-CG2 4.04Å; L2717-I2725 HydrophobicContact CD1-CD1 4.12Å; Q2721-I2725 VanDerWaalsContact O-CG1 3.27Å; Q2721-I2725 WeakPolarHBondContact O-CG1 3.43Å; Q2721-I2725 PolarHBondContact O-N 3.08Å; R2722-I2725 PolarHBondContact O-N 3.33Å; I2725-M2728 PolarHBondContact O-N 3.35Å; I2725-H2729 VanDerWaalsContact O-CB 3.28Å; I2725-H2729 WeakPolarHBondContact O-CB 3.42Å; I2725-H2729 PolarHBondContact O-N 3.01Å
2726Q85.2Confident80.5Confident92 Ų9265 Ų6543%0.4330%0.299SS..Hα-helixtrans-63.2-42.8173.5-173.5-176.99.100111.8T2712 R2722 L2723 F2724 M2728 N2730T2712-Q2726 HydrophobicContact CG2-CB 3.94Å; T2712-Q2726 HydrophobicContact CG2-CG 4.49Å; R2722-Q2726 WeakPolarHBondContact O-CB 3.44Å; R2722-Q2726 PolarHBondContact O-N 3.4Å; L2723-Q2726 PolarHBondContact O-N 3.44Å; F2724-Q2726 VanDerWaalsContact C-N 3.32Å; F2724-Q2726 PolarHBondContact O-N 2.9Å; Q2726-M2728 VanDerWaalsContact C-N 3.34Å; Q2726-N2730 WeakPolarHBondContact O-CB 3.43Å; Q2726-N2730 PolarHBondContact O-N 3.4Å; Q2726-N2730 PolarHBondContact O-ND2 2.77Å; Q2726-N2730 PolarHBondContact O-OD1 2.76Å
2727V85.6Confident80.5Confident65 Ų6567.8 Ų67.839%0.39431%0.313SS..Hα-helixtrans-63.6-42.2175.5167.60000110.7L2723 F2724 N2730 R2731L2723-V2727 WeakPolarHBondContact O-CB 3.36Å; L2723-V2727 WeakPolarHBondContact O-CG2 2.83Å; L2723-V2727 PolarHBondContact O-N 3.09Å; F2724-V2727 WeakPolarHBondContact O-CB 3.45Å; F2724-V2727 PolarHBondContact O-N 3.16Å; F2724-V2727 VanDerWaalsContact O-N 3.13Å; V2727-N2730 PolarHBondContact O-N 3.22Å; V2727-R2731 HydrophobicContact CG1-CG 4.42Å; V2727-R2731 VanDerWaalsContact O-CB 3.31Å; V2727-R2731 WeakPolarHBondContact O-CB 3.02Å; V2727-R2731 WeakPolarHBondContact O-CG 3.11Å; V2727-R2731 PolarHBondContact O-N 3.36Å
2728M84.3Confident80.2Confident1 Ų174.4 Ų74.41%0.00534%0.342CS..Hα-helixtrans-67.7-44.1178.5-66.6-47.4-57.400112.1T2604 F2605 W2608 F2724 I2725 Q2726 R2731 L2732T2604-M2728 WeakPolarHBondContact O-CE 3.32Å; F2605-M2728 HydrophobicContact CB-CE 4.45Å; F2605-M2728 HydrophobicContact CD2-CE 4.47Å; W2608-M2728 HydrophobicContact CB-CE 3.17Å; W2608-M2728 HydrophobicContact CD2-CE 3.71Å; W2608-M2728 HydrophobicContact CE3-CE 3.75Å; W2608-M2728 HydrophobicContact CE3-SD 4.44Å; W2608-M2728 HydrophobicContact CG-CE 3.46Å; W2608-M2728 VanDerWaalsContact CG-CE 3.46Å; F2724-M2728 HydrophobicContact CD1-CG 3.94Å; F2724-M2728 HydrophobicContact CE1-CG 3.57Å; F2724-M2728 HydrophobicContact CE1-SD 4.5Å; F2724-M2728 HydrophobicContact CE2-CG 4.3Å; F2724-M2728 HydrophobicContact CE2-SD 4.38Å; F2724-M2728 HydrophobicContact CG-CG 4.46Å; F2724-M2728 HydrophobicContact CZ-CG 3.79Å; F2724-M2728 HydrophobicContact CZ-SD 4.12Å; F2724-M2728 VanDerWaalsContact O-CG 3.29Å; F2724-M2728 WeakPolarHBondContact O-CG 3.2Å; F2724-M2728 PolarHBondContact O-N 3.07Å; I2725-M2728 PolarHBondContact O-N 3.35Å; Q2726-M2728 VanDerWaalsContact C-N 3.34Å; M2728-R2731 WeakPolarHBondContact O-CB 3.49Å; M2728-R2731 PolarHBondContact O-N 2.89Å; M2728-L2732 WeakPolarHBondContact O-CG 3.25Å; M2728-L2732 PolarHBondContact O-N 2.9Å
2729H85.1Confident79.5Confident19 Ų1968 Ų689%0.08831%0.314CS..Hα-helixtrans-54.3-54.2171.7174.7-78.2000110.7M2705 I2725 R2731 L2732 E2733M2705-H2729 WeakPolarHBondContact CE-NE2 3.39Å; I2725-H2729 VanDerWaalsContact O-CB 3.28Å; I2725-H2729 WeakPolarHBondContact O-CB 3.42Å; I2725-H2729 PolarHBondContact O-N 3.01Å; H2729-R2731 PolarHBondContact O-N 3.26Å; H2729-L2732 PolarHBondContact O-N 3.34Å; H2729-L2732 VanDerWaalsContact O-N 3.17Å; H2729-E2733 IonicContact CE1-OE2 2.82Å; H2729-E2733 PolarHBondContact CE1-OE2 2.93Å; H2729-E2733 IonicContact ND1-OE2 2.95Å; H2729-E2733 WeakPolarHBondContact O-CB 3.39Å; H2729-E2733 PolarHBondContact O-N 3.39Å
2730N84.5Confident78.5Confident59 Ų5964 Ų6432%0.31630%0.297SS..Hα-helixtrans-61.8-33179.6-68.5-8.7000112.5Q2726 V2727 R2734Q2726-N2730 WeakPolarHBondContact O-CB 3.43Å; Q2726-N2730 PolarHBondContact O-N 3.4Å; Q2726-N2730 PolarHBondContact O-ND2 2.77Å; Q2726-N2730 PolarHBondContact O-OD1 2.76Å; V2727-N2730 PolarHBondContact O-N 3.22Å; N2730-R2734 VanDerWaalsContact O-CB 3.31Å; N2730-R2734 WeakPolarHBondContact O-CB 3.39Å; N2730-R2734 WeakPolarHBondContact O-CD 3.48Å; N2730-R2734 WeakPolarHBondContact O-CG 3.43Å; N2730-R2734 PolarHBondContact O-N 3.27Å
2731R82.9Confident77.2Confident96 Ų9662.6 Ų62.636%0.36229%0.29SS..Hα-helixtrans-70.8-41.9176.5-80.9173.6173.4-169.70.7112.1W2608 V2727 M2728 H2729 I2735W2608-R2731 HydrophobicContact CG-CB 4.27Å; V2727-R2731 HydrophobicContact CG1-CG 4.42Å; V2727-R2731 VanDerWaalsContact O-CB 3.31Å; V2727-R2731 WeakPolarHBondContact O-CB 3.02Å; V2727-R2731 WeakPolarHBondContact O-CG 3.11Å; V2727-R2731 PolarHBondContact O-N 3.36Å; M2728-R2731 WeakPolarHBondContact O-CB 3.49Å; M2728-R2731 PolarHBondContact O-N 2.89Å; H2729-R2731 PolarHBondContact O-N 3.26Å; R2731-I2735 WeakPolarHBondContact O-CG1 3.42Å; R2731-I2735 PolarHBondContact O-N 3.46Å; R2731-I2735 VanDerWaalsContact O-N 3.12Å
2732L81.4Confident75.9Confident1 Ų162 Ų621%0.00529%0.29CS..Hα-helixtrans-65.5-46174.5-71.8169.6000110.7L2607 W2608 L2611 M2705 L2708 M2728 H2729 R2734 I2735 I2736L2607-L2732 HydrophobicContact CD2-CD1 4.18Å; L2607-L2732 HydrophobicContact CD2-CD2 4.06Å; L2607-L2732 HydrophobicContact CG-CD2 4.04Å; W2608-L2732 HydrophobicContact CB-CD2 3.93Å; W2608-L2732 HydrophobicContact CB-CG 4.34Å; L2611-L2732 HydrophobicContact CD1-CD2 3.88Å; M2705-L2732 HydrophobicContact CE-CB 4.48Å; M2705-L2732 HydrophobicContact SD-CB 4.32Å; L2708-L2732 HydrophobicContact CD1-CD1 4.4Å; M2728-L2732 WeakPolarHBondContact O-CG 3.25Å; M2728-L2732 PolarHBondContact O-N 2.9Å; H2729-L2732 PolarHBondContact O-N 3.34Å; H2729-L2732 VanDerWaalsContact O-N 3.17Å; L2732-R2734 PolarHBondContact O-N 2.83Å; L2732-I2735 WeakPolarHBondContact O-CB 3.27Å; L2732-I2735 PolarHBondContact O-N 3.4Å; L2732-I2736 WeakPolarHBondContact O-CG1 3.45Å; L2732-I2736 PolarHBondContact O-N 2.77Å
2733E81.2Confident74.3Confident72 Ų7261.8 Ų61.834%0.33630%0.295SS..Hα-helixtrans-59.1-44.8176.4-168.1-175.8170.700111.7M2705 H2729 I2735 I2736 Q2737M2705-E2733 HydrophobicContact CE-CB 3.8Å; M2705-E2733 HydrophobicContact CE-CG 4.41Å; H2729-E2733 IonicContact CE1-OE2 2.82Å; H2729-E2733 PolarHBondContact CE1-OE2 2.93Å; H2729-E2733 IonicContact ND1-OE2 2.95Å; H2729-E2733 WeakPolarHBondContact O-CB 3.39Å; H2729-E2733 PolarHBondContact O-N 3.39Å; E2733-I2735 VanDerWaalsContact C-N 3.28Å; E2733-I2735 PolarHBondContact O-N 3.43Å; E2733-I2736 PolarHBondContact O-N 2.69Å; E2733-Q2737 WeakPolarHBondContact O-CB 3.38Å; E2733-Q2737 WeakPolarHBondContact O-CG 2.97Å; E2733-Q2737 PolarHBondContact O-N 3.15Å; E2733-Q2737 PolarHBondContact OE1-NE2 2.9Å
2734R80Confident72.6Confident161 Ų16165.1 Ų65.161%0.60831%0.313SS*.Hα-helixtrans-61.9-34.6174.7-78.2171.8-175.2-179.82.3113.1N2730 L2732 K2738N2730-R2734 VanDerWaalsContact O-CB 3.31Å; N2730-R2734 WeakPolarHBondContact O-CB 3.39Å; N2730-R2734 WeakPolarHBondContact O-CD 3.48Å; N2730-R2734 WeakPolarHBondContact O-CG 3.43Å; N2730-R2734 PolarHBondContact O-N 3.27Å; L2732-R2734 PolarHBondContact O-N 2.83Å; R2734-K2738 WeakPolarHBondContact O-CB 3Å; R2734-K2738 VanDerWaalsContact O-CG 3.29Å; R2734-K2738 WeakPolarHBondContact O-CG 3.36Å; R2734-K2738 PolarHBondContact O-N 3.48Å
2735I73.8Confident70.5Confident13 Ų1366.4 Ų66.47%0.06733%0.331CS..Hα-helixtrans-66-47.3175.9-80.7171.1000109.8L2611 N2612 I2615 R2731 L2732 E2733 K2738 Q2739L2611-I2735 HydrophobicContact CB-CD1 4.09Å; L2611-I2735 HydrophobicContact CB-CG2 4.18Å; L2611-I2735 HydrophobicContact CD1-CG2 4.41Å; N2612-I2735 HydrophobicContact CB-CD1 4.15Å; I2615-I2735 HydrophobicContact CD1-CB 4.2Å; I2615-I2735 HydrophobicContact CD1-CG1 4.18Å; I2615-I2735 HydrophobicContact CD1-CG2 3.29Å; R2731-I2735 WeakPolarHBondContact O-CG1 3.42Å; R2731-I2735 PolarHBondContact O-N 3.46Å; R2731-I2735 VanDerWaalsContact O-N 3.12Å; L2732-I2735 WeakPolarHBondContact O-CB 3.27Å; L2732-I2735 PolarHBondContact O-N 3.4Å; E2733-I2735 VanDerWaalsContact C-N 3.28Å; E2733-I2735 PolarHBondContact O-N 3.43Å; I2735-K2738 PolarHBondContact O-N 2.93Å; I2735-Q2739 WeakPolarHBondContact O-CG 3.27Å; I2735-Q2739 PolarHBondContact O-N 3.11Å; I2735-Q2739 VanDerWaalsContact O-N 3.1Å
2736I72.3Confident68.3Low42 Ų4273.6 Ų73.622%0.21538%0.375CS..Hα-helixtrans-61.3-46.8177.2-63.1163.9000109.9V2700 M2705 L2732 E2733 K2738 Q2739 L2740V2700-I2736 HydrophobicContact CB-CD1 4.17Å; V2700-I2736 HydrophobicContact CG1-CD1 3.92Å; M2705-I2736 HydrophobicContact SD-CD1 4.49Å; L2732-I2736 WeakPolarHBondContact O-CG1 3.45Å; L2732-I2736 PolarHBondContact O-N 2.77Å; E2733-I2736 PolarHBondContact O-N 2.69Å; I2736-K2738 PolarHBondContact O-N 3.5Å; I2736-Q2739 WeakPolarHBondContact O-CB 3.45Å; I2736-Q2739 PolarHBondContact O-N 2.92Å; I2736-Q2739 VanDerWaalsContact O-N 3.16Å; I2736-L2740 HydrophobicContact CG2-CD1 4Å; I2736-L2740 WeakPolarHBondContact O-CG 3.47Å; I2736-L2740 PolarHBondContact O-N 3.17Å
2737Q72.7Confident67.4Low83 Ų8372.7 Ų72.739%0.38837%0.373SS..Hα-helixtrans-63.6-37.4177-73.6175.8-0.100113.5E2733 Q2739 L2740 N2741E2733-Q2737 WeakPolarHBondContact O-CB 3.38Å; E2733-Q2737 WeakPolarHBondContact O-CG 2.97Å; E2733-Q2737 PolarHBondContact O-N 3.15Å; E2733-Q2737 PolarHBondContact OE1-NE2 2.9Å; Q2737-Q2739 VanDerWaalsContact C-N 3.3Å; Q2737-Q2739 PolarHBondContact O-N 2.97Å; Q2737-L2740 PolarHBondContact O-N 3.1Å; Q2737-N2741 VanDerWaalsContact O-CB 3.28Å; Q2737-N2741 WeakPolarHBondContact O-CB 3.29Å; Q2737-N2741 VanDerWaalsContact O-CG 3.27Å; Q2737-N2741 PolarHBondContact O-N 3.21Å
2738K67.8Low66.5Low141 Ų14173.1 Ų73.161%0.61337%0.371SS*.Hα-helixtrans-64.4-36.9174.2-82.5-178.6176-170.30111.7R2734 I2735 I2736 S2742R2734-K2738 WeakPolarHBondContact O-CB 3Å; R2734-K2738 VanDerWaalsContact O-CG 3.29Å; R2734-K2738 WeakPolarHBondContact O-CG 3.36Å; R2734-K2738 PolarHBondContact O-N 3.48Å; I2735-K2738 PolarHBondContact O-N 2.93Å; I2736-K2738 PolarHBondContact O-N 3.5Å; K2738-S2742 PolarHBondContact O-N 2.77Å; K2738-S2742 PolarHBondContact O-OG 3.25Å
2739Q62.7Low65.5Low17 Ų1777.1 Ų77.18%0.07939%0.392CS..Hα-helixtrans-70.3-36.7175.1-71.4-66-21.100111.9I2615 R2693 I2735 I2736 Q2737 S2742I2615-Q2739 HydrophobicContact CD1-CG 4.3Å; R2693-Q2739 PolarHBondContact NE-O 3.46Å; R2693-Q2739 PolarHBondContact NH2-O 2.67Å; I2735-Q2739 WeakPolarHBondContact O-CG 3.27Å; I2735-Q2739 PolarHBondContact O-N 3.11Å; I2735-Q2739 VanDerWaalsContact O-N 3.1Å; I2736-Q2739 WeakPolarHBondContact O-CB 3.45Å; I2736-Q2739 PolarHBondContact O-N 2.92Å; I2736-Q2739 VanDerWaalsContact O-N 3.16Å; Q2737-Q2739 VanDerWaalsContact C-N 3.3Å; Q2737-Q2739 PolarHBondContact O-N 2.97Å; Q2739-S2742 PolarHBondContact O-OG 3.31Å
2740L55.2Low64.3Low64 Ų6480.5 Ų80.534%0.33541%0.41SS..Hα-helixtrans-70.3-45.1173.7-75.1168.7000113E2697 I2736 Q2737 S2742 N2743E2697-L2740 WeakPolarHBondContact OE1-CD2 3.45Å; I2736-L2740 HydrophobicContact CG2-CD1 4Å; I2736-L2740 WeakPolarHBondContact O-CG 3.47Å; I2736-L2740 PolarHBondContact O-N 3.17Å; Q2737-L2740 PolarHBondContact O-N 3.1Å; L2740-S2742 VanDerWaalsContact C-N 3.27Å; L2740-S2742 PolarHBondContact O-N 3.24Å; L2740-N2743 WeakPolarHBondContact O-CA 3.25Å; L2740-N2743 WeakPolarHBondContact O-CB 3.44Å; L2740-N2743 VanDerWaalsContact O-CG 3.29Å; L2740-N2743 PolarHBondContact O-N 2.89Å; L2740-N2743 PolarHBondContact O-ND2 3.07Å
2741N53.1Low63.1Low102 Ų10281.9 Ų81.955%0.54542%0.416SS..Hα-helixtrans-71.4-22.8-176.1-74.5-13.5000112.9Q2737 N2743 L2744Q2737-N2741 VanDerWaalsContact O-CB 3.28Å; Q2737-N2741 WeakPolarHBondContact O-CB 3.29Å; Q2737-N2741 VanDerWaalsContact O-CG 3.27Å; Q2737-N2741 PolarHBondContact O-N 3.21Å; N2741-N2743 PolarHBondContact O-N 3.23Å; N2741-L2744 PolarHBondContact O-N 3.23Å
2742S53.3Low61.7Low33 Ų3380.9 Ų80.923%0.23142%0.419CS..THydrogen-bonded Turntrans-69.80.4167.246.50000113R2693 K2738 Q2739 L2740 T2746R2693-S2742 PolarHBondContact NH2-O 2.83Å; R2693-S2742 VanDerWaalsContact NH2-O 3.08Å; R2693-S2742 PolarHBondContact NH2-OG 3Å; K2738-S2742 PolarHBondContact O-N 2.77Å; K2738-S2742 PolarHBondContact O-OG 3.25Å; Q2739-S2742 PolarHBondContact O-OG 3.31Å; L2740-S2742 VanDerWaalsContact C-N 3.27Å; L2740-S2742 PolarHBondContact O-N 3.24Å; S2742-T2746 PolarHBondContact O-OG1 2.8Å
2743N46.4Very low60.3Low77 Ų7786.6 Ų86.641%0.41245%0.449SS..THydrogen-bonded Turntrans-77.1-18.9161.4-68.2-34.3000113.2R2693 L2740 N2741R2693-N2743 PolarHBondContact NH1-OD1 3.34Å; L2740-N2743 WeakPolarHBondContact O-CA 3.25Å; L2740-N2743 WeakPolarHBondContact O-CB 3.44Å; L2740-N2743 VanDerWaalsContact O-CG 3.29Å; L2740-N2743 PolarHBondContact O-N 2.89Å; L2740-N2743 PolarHBondContact O-ND2 3.07Å; N2741-N2743 PolarHBondContact O-N 3.23Å
2744L47.3Very low58.7Low153 Ų15387.8 Ų87.880%0.80146%0.457SS*.THydrogen-bonded Turntrans-98-16.4-174.7-77163.3000113.6N2741N2741-L2744 PolarHBondContact O-N 3.23Å
2745S43.3Very low57Low102 Ų10281.7 Ų81.771%0.71345%0.445SS*.  trans-102.3-3179.665.90000114.5
2746T35.6Very low55.4Low153 Ų15387.9 Ų87.994%0.93948%0.479SS*.  trans-112.50170.556.20000108.5S2742S2742-T2746 PolarHBondContact O-OG1 2.8Å

Retrieved 2,746 of 2,746 residues in 7719.6 ms (Link to these results)

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