A0A5K4FB58_SCHMA Loading...

Inositol 1,4,5-trisphosphate receptor AlphaSync Fragmented

Receptor for inositol 1,4,5-trisphosphate, a second messenger that mediates the release of intracellular calcium.

AlphaFold DB , UniProt , Accession A0A5K4FB58, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 2,890 aa.

>A0A5K4FB58_SCHMA|A0A5K4FB58
MLMIFGAEIENKVELLHFGDQVTFYSNDEDGGLLCMEGQISNKPNVTRLNSVGNFTSSLTRDCRFFILAMQKYLNENCLENETRFRPDKLIEESGCDNEQNSKMQRRLQESLVYYGNIIQLLHVKSNKILRAKKELSPEFKDASVRFTLEEYQGDESWFIIQPSYKHKQIGDPVVIGDKVTLFACRAGCALNIKQLNSNPKQHKLMSDTDPHGINNNNNSDNNNNTSWQINLYLSYQDNLEHILKGGDVIRLFHSEAEKFLTCDEYENELYVFLRTTFRAATTTAKSSKALWEVEVIHSDCRRTGAGHWNSLFRLKHLITGLYLCPKIIKINNKSGEQGAFSKQEQDDGCIESFLTLSKEPTYETVFEMDSTSHYKESDGFIPNNAFVRICHTASRMWIKASEILIDTDADKPIMYKLHLTSFKDNKEVFAILPVPANVVRDLDFASDSFKALRAILCMLNDHGKLTETQMRSLIFILSELVMFLNGNTRLTFESTNPTIQNEIGLRDRQKLLREHNIIAQIIKILNSKMISNLPKQSTSIVNNHLINSNILIWKPDISLLSILHETQSNTMDTQQQNVYLDEKNEILAWQTVGNLCYRILTLSQHGYRKNQEYLAQYLNLMQTHIGLGIRASETITALLHNNRQLLEKRVGEQEVSAFVSLVRDNIEARFLNYLSALCSSCGVAIPVTQELICHQLLSENNEDLLVETCNKTFIDSDSNYSTDIITLIWKQTCLIDDDFWKNLNSNLILNQSEFNQTQKYLQFNLNVLNDIINQSKQELNEKSKQITLYCLILDYYQAQIDLFALLCQERQYIAINYLSLKLSIYLLLKCMRNERLRPSLRASFTRLLLNLHVDRDPQELHQPIQYARLWSTLGTKSDVFNYEKANSSTNEQGNFTTDFMEIKNFVNDYLDNMLSSGCYLSEPGYINLTNEVIILSKNLVFFGLYNIKELLLLGQKLVFMLNQLGSTNDFNSNIYKMKEMNTSSTLLTSSNDDKLFDLKLKTLDVIEYILDVRVDYQIFCLLTTLRSVKQPEACSNNLELEDLEKEQTLELSNEVRNQLLTLFPLNNLSQNLEMNDSPKYNSTEDKLTILNVDGYHGQLLIGVLARLCISTNVELKLKSLQLLFRHFSQQEELINKLKQVQLLVSDTGIKIYRQLKQHLDTLRGLIEKSELWMHDKSCMVMSNNNNNNNINNIQILCHIISLCQLEHNDLLTSTIEQKSTNVIDVLSIEISTQINNRILRTMDKSLSSSFPFEQIQQLLRHLGVHTILKELLNIRFKCTDVVFNEIVHLTKYILCLFCYNNEINQKLLYPYLDKFITNETDDAEVCLWMLKDNTELCMMVDRSTIRKLCFFLQKSRPYVHWLEVLITVVKPNDEVLGPVREMISNELCSMFDDTLFLMNSFSRVRNILDSLLLTITYSNSSAWSVIKFSDNTSKQDLLFNLKFFHLLNILLTEENDILVKKYRKWFKLSELIKVIIHPVTKCHNLCYLRNVYMENLANFCSSTDFKNNFVIQYSESLSFLWRDITEELDKILLNKLSSNDYKIFLRDSIIPCVTKIFANIQLLEHQQPRFHLDASCYLMHKLMQINNDPLLGPASIECSQMIMCTIPSESLSVLPEFSYRQDIFMTNSYADLRKTLEDKNTSTSGITSDDLIDSGLQDENSLDSNMFETVSVKTVQKCHMSNNLSEIQMSQPMDDTNRSLSQNFAKNIEKQFNNMIKEIELQLSTSIHKEYDSLIRLVQHAYDLIELGFESQFVKLLQVFTSLSKAPMMESVPLEMKWSLDGLSNTGQNSIHYFLCSNGICDLIIRCIENPNTSETIFVMANELAINLLKHSNKYVQECFYIILSKPKQHEDFFSSMFQRFHNAYSQMDNLTKNRFFSKEEFTKTTNYLDCFNSLIPGKNVSVQISLQFLKTLCHRSNLRLQELLRVQPNNVTNFNLIEEIKSLFINLWKINDRLINAVTTNSNNDNSCSNDSNNNNDTLSYSDVNHKTLQSKQQCFSSTNVENLPRFTENSTLKIVQNNMNIMEPTTICQRKFDKSSFLEVSHNQQSVQIQKNSNNSVHFIQPEIIILILTCLIEFCQGPCVSNQNDILFGSPNILGLLVNLVLSTPKWIGNHKLENITCSLAEISCLSIKLLLAVLEGRHEDKVYQQLIELCPLDKLISSIRYYHILSEDSDFTANHPRESFHKCGHLLFILTQYLYRCFPSIFKHMKISENHNNNDQLLRVKWSEPNSYNTTEGQNCFYEMKCTDHNSIPFNGTGKLDLNNTIIKRLIKSKSDNILSLQHYTMNTAQIEIVRADNRIERIVYPIPKICHYLTDSKKYQLLAINNMDNDYSKIPSLFKIIEEIYAEMLCAEHMLIHPWIHWFSLRSQWISDASFYRSLCLNCLLIGFYPFRGESLSYDFYNLETQITVIPIAIFAVVLCLVSSNQLLVQIYIGLETLYLLFACGTENVILVLGLTNFIFRFANLLIIYKQYLLIKNYKNCLFSNEININETNWKYFEYINNKEKRKLVNAKNRISYLHSSSTLSSSSWWNNIFFTVHGLLRYFQGSLFNLKIPNINQLYYKLIHNFILIIFTGFGIFIHPFFYSLVLLDVVTREETLLNVVRSVTKNGRSIFLTGILALIIIYLYSIIGYAYFQNDFTIEIDVTNDNETVGSTERRCDSLRMCILTTLREGLLNGGGIGDVLKRPSNKDNLFFFRTIYDLSFFVIVIVIILNLIFGVIVDTFAALRQEKQNTEELNKNHCCVCGLHRSAFDHSNTSFDDHVNVDHNVWHYIYFIIYLKTKLTDDLTGLEIYIDKLIKKNEFKWIPRRRAMTLDNIENGPTEKSEEITALANSLNKTVKAMDKLNESFQKLSKLISKQFMEKSKEQLLSSIFNSVTNKKNEDGNKKKL

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

 

Download 9 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
1M29.7Very low37.2Very low155 Ų155139.5 Ų139.576%0.76474%0.744SS**  0-26.10-144.2-171.7-82.400113.1M3 I4M1-M3 PolarHBondContact O-N 3.26Å; M1-I4 HydrophobicContact CG-CD1 4.21Å; M1-I4 PolarHBondContact O-N 2.74Å
2L31.4Very low38.8Very low153 Ų153140.9 Ų140.980%0.80174%0.739SS**THydrogen-bonded Turntrans-54.7-20.4173.8-81157000115.3I4L2-I4 VanDerWaalsContact C-N 3.34Å; L2-I4 PolarHBondContact O-N 2.78Å
3M34Very low41.1Very low186 Ų186138.1 Ų138.192%0.91673%0.731SS**THydrogen-bonded Turntrans-76.4-12.4175.9-72.4-115.6-129.900114.9M1M1-M3 PolarHBondContact O-N 3.26Å
4I40.2Very low43.8Very low135 Ų135134.4 Ų134.469%0.69271%0.707SS**SBendtrans-83.8-21.5-176.5-60.6176.5000111.6M1 L2 G6M1-I4 HydrophobicContact CG-CD1 4.21Å; M1-I4 PolarHBondContact O-N 2.74Å; L2-I4 VanDerWaalsContact C-N 3.34Å; L2-I4 PolarHBondContact O-N 2.78Å; I4-G6 PolarHBondContact O-N 2.91Å
5F37.7Very low46.7Very low162 Ų162128.9 Ų128.971%0.71168%0.679SS**  trans-84.858.8169.6-65.6-76.1000110.6A7F5-A7 PolarHBondContact O-N 3.44Å; F5-A7 VanDerWaalsContact O-N 3.09Å
6G32.8Very low49.3Very low69 Ų69120.9 Ų120.971%0.71164%0.636SS**  trans-78.741.6169.300000112.1I4 E8I4-G6 PolarHBondContact O-N 2.91Å; G6-E8 PolarHBondContact O-N 2.89Å
7A37.3Very low51.5Low80 Ų80116 Ų11666%0.66161%0.609SS**  trans-71.2118162.900000106F5 I9F5-A7 PolarHBondContact O-N 3.44Å; F5-A7 VanDerWaalsContact O-N 3.09Å; A7-I9 VanDerWaalsContact C-N 3.34Å; A7-I9 PolarHBondContact O-N 3.46Å
8E36.1Very low53.3Low187 Ų187110.1 Ų110.187%0.87458%0.578SS**  trans-47.1102.6168.8-70.9173.7150.900107.7G6 E10G6-E8 PolarHBondContact O-N 2.89Å; E8-E10 PolarHBondContact O-N 2.87Å
9I41.7Very low54.7Low125 Ų125104.4 Ų104.464%0.64155%0.548SS*.  trans-68.589.7166.4-58.8170.3000103A7 N11A7-I9 VanDerWaalsContact C-N 3.34Å; A7-I9 PolarHBondContact O-N 3.46Å; I9-N11 VanDerWaalsContact C-N 3.27Å; I9-N11 PolarHBondContact O-N 3.13Å
10E40.3Very low56.4Low138 Ų13899.2 Ų99.265%0.64552%0.521SS*.  trans-48.4109152.2-77.6-172.3158.100104.1E8 K12E8-E10 PolarHBondContact O-N 2.87Å; E10-K12 HydrophobicContact CB-CG 4.44Å; E10-K12 PolarHBondContact O-N 2.64Å; E10-K12 VanDerWaalsContact OE2-CE 3.25Å; E10-K12 WeakPolarHBondContact OE2-CE 3.24Å; E10-K12 IonicContact OE2-NZ 3.12Å
11N48.7Very low58Low144 Ų14495 Ų9577%0.7750%0.498SS*.  trans-65.464.3174.7-78.9-29.8000108.3I9 V13I9-N11 VanDerWaalsContact C-N 3.27Å; I9-N11 PolarHBondContact O-N 3.13Å; N11-V13 PolarHBondContact O-N 3.48Å
12K55.6Low60.8Low157 Ų15787.6 Ų87.668%0.68346%0.462SS*.  trans-61.5111.8165.7-79.2-179.5-178.8164.50104.5E10 E14E10-K12 HydrophobicContact CB-CG 4.44Å; E10-K12 PolarHBondContact O-N 2.64Å; E10-K12 VanDerWaalsContact OE2-CE 3.25Å; E10-K12 WeakPolarHBondContact OE2-CE 3.24Å; E10-K12 IonicContact OE2-NZ 3.12Å; K12-E14 PolarHBondContact O-N 2.98Å
13V68.3Low63.4Low104 Ų10480.4 Ų80.463%0.6342%0.424SS*.  trans-59.7107.2173.8178.80000106.5N11 V175N11-V13 PolarHBondContact O-N 3.48Å; V13-V175 HydrophobicContact CG1-CB 4.18Å; V13-V175 HydrophobicContact CG1-CG1 3.31Å; V13-V175 HydrophobicContact CG1-CG2 3.76Å
14E79Confident66Low86 Ų8671.5 Ų71.540%0.40238%0.381SS..PPolyproline II helixtrans-80.1136.4179.8-66.4177.2172.800110.5K12 I176 R303K12-E14 PolarHBondContact O-N 2.98Å; E14-I176 HydrophobicContact CB-CD1 3.72Å; E14-I176 PolarHBondContact O-N 3.33Å; E14-R303 VanDerWaalsContact CD-NH1 3.29Å; E14-R303 IonicContact OE1-NH1 2.72Å; E14-R303 PolarHBondContact OE1-NH1 2.9Å; E14-R303 IonicContact OE2-CZ 2.84Å; E14-R303 IonicContact OE2-NH1 2.89Å; E14-R303 PolarHBondContact OE2-NH1 2.84Å; E14-R303 IonicContact OE2-NH2 3.29Å; E14-R303 PolarHBondContact OE2-NH2 3.28Å
15L87.8Confident68.1Low53 Ų5367.3 Ų67.328%0.27736%0.356SS..BIsolated β-bridgetrans-100.6149.4-178.9-56.1177.7000110.4H17 L112 P173 V175L15-H17 PolarHBondContact O-CE1 2.92Å; L15-H17 VanDerWaalsContact O-CE1 3.28Å; L15-H17 PolarHBondContact O-ND1 2.84Å; L15-L112 HydrophobicContact CB-CD2 3.45Å; L15-L112 VanDerWaalsContact CB-CD2 3.45Å; L15-L112 HydrophobicContact CD1-CD1 4.23Å; L15-L112 HydrophobicContact CD1-CD2 3.77Å; L15-L112 HydrophobicContact CG-CD2 4.26Å; L15-P173 HydrophobicContact CD1-CB 4.27Å; L15-P173 HydrophobicContact CD2-CB 4.11Å; L15-P173 HydrophobicContact CD2-CG 4.25Å; L15-V175 HydrophobicContact CD2-CG2 3.88Å
16L87.6Confident70.3Confident1 Ų159.6 Ų59.61%0.00532%0.323CS..PPolyproline II helixtrans-77.7132178.7-172.265.9000111.1D20 V22 I67 V113 V174 I176 I230L16-D20 HydrophobicContact CD1-CB 4.37Å; L16-V22 HydrophobicContact CD1-CG1 3.85Å; L16-I67 HydrophobicContact CD1-CD1 3.74Å; L16-I67 HydrophobicContact CD2-CD1 3.61Å; L16-I67 HydrophobicContact CG-CD1 3.93Å; L16-V113 HydrophobicContact CB-CB 4.25Å; L16-V113 HydrophobicContact CD2-CB 4.08Å; L16-V113 HydrophobicContact CD2-CG1 4.09Å; L16-V113 HydrophobicContact CD2-CG2 4.37Å; L16-V113 HydrophobicContact CG-CB 4.1Å; L16-V113 HydrophobicContact CG-CG2 4.11Å; L16-V113 PolarHBondContact O-N 3.35Å; L16-V174 HydrophobicContact CB-CB 4.12Å; L16-V174 HydrophobicContact CB-CG1 4.31Å; L16-V174 WeakPolarHBondContact CB-O 3.04Å; L16-V174 HydrophobicContact CD2-CB 4.08Å; L16-V174 HydrophobicContact CD2-CG1 3.82Å; L16-V174 PolarHBondContact N-O 2.7Å; L16-I176 HydrophobicContact CD1-CG1 4.41Å; L16-I230 HydrophobicContact CD1-CG2 4.14Å; L16-I230 HydrophobicContact CD2-CD1 3.81Å; L16-I230 HydrophobicContact CD2-CG2 4.37Å
17H86.9Confident72.2Confident37 Ų3760.4 Ų60.417%0.17131%0.31CS..BIsolated β-bridgetrans-116.4155.7177.2-61.278.9000111.3L15 D20 S111 L112 Y236L15-H17 PolarHBondContact O-CE1 2.92Å; L15-H17 VanDerWaalsContact O-CE1 3.28Å; L15-H17 PolarHBondContact O-ND1 2.84Å; H17-D20 PolarHBondContact N-OD2 3.02Å; H17-D20 IonicContact ND1-OD2 2.64Å; H17-D20 WeakPolarHBondContact O-CB 3.31Å; H17-D20 PolarHBondContact O-N 2.83Å; H17-S111 WeakPolarHBondContact CA-O 3.32Å; H17-L112 VanDerWaalsContact NE2-CD2 3.31Å; H17-L112 WeakPolarHBondContact NE2-CD2 3.22Å; H17-Y236 HydrophobicContact CB-CD1 3.58Å; H17-Y236 HydrophobicContact CB-CE1 3.65Å; H17-Y236 AromaticContact CD2-CE1 3.61Å; H17-Y236 AromaticContact CG-CD1 3.86Å; H17-Y236 AromaticContact CG-CE1 3.41Å; H17-Y236 VanDerWaalsContact CG-CE1 3.41Å; H17-Y236 AromaticContact ND1-CE1 3.77Å
18F84.1Confident73.7Confident10 Ų1059.6 Ų59.64%0.04430%0.295CS..THydrogen-bonded Turntrans-65.8141.2167.4-72.9-74.8000109.6D20 I67 A69 L108 Q109 S111 V113 N117 I119F18-D20 VanDerWaalsContact C-N 3.3Å; F18-I67 HydrophobicContact CD1-CG2 4.01Å; F18-I67 HydrophobicContact CE1-CG2 4.28Å; F18-A69 HydrophobicContact CD1-CB 3.77Å; F18-A69 HydrophobicContact CE1-CB 3.74Å; F18-A69 HydrophobicContact CG-CB 4.19Å; F18-A69 HydrophobicContact CZ-CB 4.14Å; F18-L108 WeakPolarHBondContact CB-O 3.25Å; F18-Q109 CarbonylContact O-C 3.48Å; F18-Q109 VanDerWaalsContact O-C 3.27Å; F18-Q109 WeakPolarHBondContact O-CA 3.42Å; F18-S111 WeakPolarHBondContact CD2-O 3.42Å; F18-S111 VanDerWaalsContact CD2-OG 3.25Å; F18-S111 WeakPolarHBondContact CD2-OG 2.82Å; F18-S111 PolarHBondContact N-O 2.84Å; F18-V113 HydrophobicContact CD1-CG2 4.03Å; F18-V113 HydrophobicContact CD2-CG2 3.77Å; F18-V113 HydrophobicContact CE1-CG2 4.08Å; F18-V113 HydrophobicContact CE2-CG2 3.83Å; F18-V113 HydrophobicContact CG-CG2 3.91Å; F18-V113 HydrophobicContact CZ-CG2 4Å; F18-N117 HydrophobicContact CZ-CB 4.33Å; F18-I119 HydrophobicContact CE1-CG2 3.77Å; F18-I119 HydrophobicContact CZ-CG2 4.26Å
19G81.1Confident75Confident1 Ų159.1 Ų59.11%0.0129%0.293CS..THydrogen-bonded Turntrans87.7-10.4-174.600000114.9I67G19-I67 PolarHBondContact N-O 3.08Å
20D88.3Confident76.1Confident1 Ų158.1 Ų58.11%0.00529%0.289CS..  trans-62.5141.3170.4-77.2-21.8000110.9L16 H17 F18 V22 I67 L232 S235 Y236L16-D20 HydrophobicContact CD1-CB 4.37Å; H17-D20 PolarHBondContact N-OD2 3.02Å; H17-D20 IonicContact ND1-OD2 2.64Å; H17-D20 WeakPolarHBondContact O-CB 3.31Å; H17-D20 PolarHBondContact O-N 2.83Å; F18-D20 VanDerWaalsContact C-N 3.3Å; D20-V22 HydrophobicContact CB-CG1 4.24Å; D20-I67 PolarHBondContact O-N 3.5Å; D20-I67 VanDerWaalsContact O-N 3.13Å; D20-L232 HydrophobicContact CB-CD1 3.68Å; D20-S235 WeakPolarHBondContact OD1-CA 3.34Å; D20-Y236 WeakPolarHBondContact OD1-CD1 3.21Å; D20-Y236 PolarHBondContact OD1-N 3.38Å
21Q88.6Confident77.3Confident10 Ų1051.9 Ų51.95%0.04726%0.262CS..EExtended strand (participates in β ladder)trans-92121.5169.7-169.8178.77.200108.7R64 F65 F66 V124 Y233 L234Q21-R64 HydrophobicContact CG-CB 4.15Å; Q21-R64 VanDerWaalsContact NE2-CB 3.35Å; Q21-F65 CarbonylContact C-O 3.49Å; Q21-F65 WeakPolarHBondContact CA-O 3.35Å; Q21-F66 HydrophobicContact CB-CD1 4.06Å; Q21-F66 HydrophobicContact CB-CE1 3.82Å; Q21-F66 HydrophobicContact CG-CE1 4.25Å; Q21-V124 HydrophobicContact CG-CG2 4.16Å; Q21-Y233 VanDerWaalsContact CD-CD1 3.49Å; Q21-Y233 HydrophobicContact CG-CD1 4.03Å; Q21-Y233 WeakPolarHBondContact O-CA 3.47Å; Q21-Y233 WeakPolarHBondContact O-CB 3.44Å; Q21-Y233 PolarHBondContact O-N 3.29Å; Q21-L234 HydrophobicContact CB-CB 4.03Å; Q21-L234 PolarHBondContact N-O 3.48Å; Q21-L234 PolarHBondContact O-N 3.21Å
22V89.7Confident78.6Confident0 Ų045 Ų450%023%0.225CC..EExtended strand (participates in β ladder)trans-127.5164-173.9-58.10000112.2L16 D20 F24 F65 I67 I230 N231 L232L16-V22 HydrophobicContact CD1-CG1 3.85Å; D20-V22 HydrophobicContact CB-CG1 4.24Å; V22-F24 HydrophobicContact CG2-CD2 4.4Å; V22-F24 HydrophobicContact CG2-CE2 3.64Å; V22-F24 HydrophobicContact CG2-CZ 3.71Å; V22-F65 PolarHBondContact N-O 2.83Å; V22-F65 PolarHBondContact O-N 3.2Å; V22-I67 HydrophobicContact CG1-CD1 3.91Å; V22-I67 HydrophobicContact CG1-CG1 4.25Å; V22-I67 HydrophobicContact CG2-CD1 3.83Å; V22-I67 HydrophobicContact CG2-CG1 3.68Å; V22-I230 HydrophobicContact CB-CG2 3.94Å; V22-I230 HydrophobicContact CG1-CG2 3.87Å; V22-I230 HydrophobicContact CG2-CG2 4.33Å; V22-N231 CarbonylContact C-O 3.57Å; V22-N231 VanDerWaalsContact CA-O 3.27Å; V22-N231 WeakPolarHBondContact CA-O 3.37Å; V22-N231 WeakPolarHBondContact CB-O 3.4Å; V22-L232 HydrophobicContact CG1-CD1 4.44Å
23T86.7Confident79.8Confident2 Ų237.8 Ų37.81%0.01219%0.194CC..EExtended strand (participates in β ladder)trans-123.4144.3166.962.80000109.4L59 C63 R64 N231T23-L59 HydrophobicContact CG2-CD2 3.72Å; T23-C63 WeakPolarHBondContact CG2-O 3.32Å; T23-R64 HydrophobicContact CG2-CG 4.37Å; T23-N231 PolarHBondContact N-O 3.35Å; T23-N231 PolarHBondContact O-N 2.96Å
24F86.7Confident80.4Confident0 Ų032.9 Ų32.90%016%0.164CC..EExtended strand (participates in β ladder)trans-107.7120.4179.4-64.1-84.8000109.5V22 L33 L34 F65 L121 L182 W228 I230V22-F24 HydrophobicContact CG2-CD2 4.4Å; V22-F24 HydrophobicContact CG2-CE2 3.64Å; V22-F24 HydrophobicContact CG2-CZ 3.71Å; F24-L33 WeakPolarHBondContact O-CA 3.28Å; F24-L34 HydrophobicContact CB-CB 3.99Å; F24-L34 HydrophobicContact CB-CD2 4.36Å; F24-L34 HydrophobicContact CD2-CD2 4.14Å; F24-L34 PolarHBondContact O-N 3.47Å; F24-F65 HydrophobicContact CD2-CD2 4.09Å; F24-F65 HydrophobicContact CE2-CB 4.12Å; F24-F65 HydrophobicContact CE2-CD2 4.38Å; F24-F65 HydrophobicContact CE2-CG 4.38Å; F24-L121 HydrophobicContact CE2-CD1 3.97Å; F24-L121 HydrophobicContact CE2-CD2 3.73Å; F24-L121 HydrophobicContact CE2-CG 4.48Å; F24-L121 HydrophobicContact CZ-CD1 4.09Å; F24-L121 HydrophobicContact CZ-CD2 3.62Å; F24-L182 HydrophobicContact CD1-CD1 4.17Å; F24-L182 HydrophobicContact CE1-CD1 3.95Å; F24-L182 HydrophobicContact CZ-CD1 4.38Å; F24-W228 HydrophobicContact CB-CD2 4.44Å; F24-W228 HydrophobicContact CB-CE3 3.89Å; F24-W228 HydrophobicContact CD1-CB 4.22Å; F24-I230 HydrophobicContact CD1-CG1 4.05Å; F24-I230 HydrophobicContact CE1-CD1 4.06Å; F24-I230 HydrophobicContact CE1-CG1 3.76Å
25Y84.7Confident80.4Confident46 Ų4629 Ų2918%0.1815%0.147CC..EExtended strand (participates in β ladder)trans-120.9132-179.1179.1-116.2000110.7N27 G32 L33 L49 Q229Y25-N27 VanDerWaalsContact CD1-OD1 3.26Å; Y25-N27 WeakPolarHBondContact CD1-OD1 3.48Å; Y25-N27 WeakPolarHBondContact CE1-OD1 3.42Å; Y25-G32 WeakPolarHBondContact CA-O 3.23Å; Y25-L33 HydrophobicContact CD2-CD1 4.31Å; Y25-L49 HydrophobicContact CD2-CD1 4.22Å; Y25-L49 HydrophobicContact CE2-CD1 3.96Å; Y25-Q229 PolarHBondContact N-O 3.22Å; Y25-Q229 WeakPolarHBondContact O-CA 3.47Å; Y25-Q229 VanDerWaalsContact O-CB 3.3Å; Y25-Q229 WeakPolarHBondContact O-CB 3.41Å; Y25-Q229 PolarHBondContact O-N 2.92Å
26S84.2Confident79.7Confident1 Ų126.8 Ų26.81%0.00714%0.135CC..  trans-110.3139.7171.1171.90000111.4D28 G31 G32 I193 S227S26-D28 WeakPolarHBondContact OG-CB 3.25Å; S26-D28 PolarHBondContact OG-N 3.36Å; S26-D28 VanDerWaalsContact OG-N 3.16Å; S26-D28 PolarHBondContact OG-OD2 3.49Å; S26-G31 CarbonylContact O-C 3.59Å; S26-G31 WeakPolarHBondContact O-CA 3.18Å; S26-G32 PolarHBondContact N-O 3.19Å; S26-G32 PolarHBondContact O-N 2.81Å; S26-I193 WeakPolarHBondContact OG-CD1 3.44Å; S26-S227 WeakPolarHBondContact CB-O 3.46Å; S26-S227 PolarHBondContact OG-O 3.17Å
27N72.2Confident78.6Confident85 Ų8532.9 Ų32.946%0.45516%0.163SC..  trans-92.54.5176.2-67.214000113.1Y25Y25-N27 VanDerWaalsContact CD1-OD1 3.26Å; Y25-N27 WeakPolarHBondContact CD1-OD1 3.48Å; Y25-N27 WeakPolarHBondContact CE1-OD1 3.42Å
28D70Confident77.5Confident63 Ų6331.3 Ų31.334%0.33716%0.157SC..SBendtrans-63.7163.5-179.5-59.4-30000110.3S26 D30 G31 I193 T226S26-D28 WeakPolarHBondContact OG-CB 3.25Å; S26-D28 PolarHBondContact OG-N 3.36Å; S26-D28 VanDerWaalsContact OG-N 3.16Å; S26-D28 PolarHBondContact OG-OD2 3.49Å; D28-D30 PolarHBondContact O-N 2.79Å; D28-G31 VanDerWaalsContact O-CA 3.27Å; D28-G31 WeakPolarHBondContact O-CA 3.34Å; D28-G31 PolarHBondContact O-N 3.49Å; D28-I193 HydrophobicContact CB-CD1 4.1Å; D28-T226 WeakPolarHBondContact OD2-CB 3.33Å
29E63.8Low76.8Confident177 Ų17731 Ų3183%0.82716%0.156SC*.THydrogen-bonded Turntrans-59-35.9-175.8-68-161.9156.800113.1G31 R48E29-G31 VanDerWaalsContact C-N 3.33Å; E29-R48 PolarHBondContact O-NH2 2.98Å
30D63Low75.9Confident104 Ų10431.9 Ų31.956%0.55616%0.16SC*.THydrogen-bonded Turntrans-92.59.2171.8-64.8-34.3000112.9D28 I193D28-D30 PolarHBondContact O-N 2.79Å; D30-I193 HydrophobicContact CB-CG2 4.21Å
31G66Low74.9Confident8 Ų833.1 Ų33.18%0.08217%0.169CC..  trans-73.9159.5-175.300000114.4S26 D28 E29S26-G31 CarbonylContact O-C 3.59Å; S26-G31 WeakPolarHBondContact O-CA 3.18Å; D28-G31 VanDerWaalsContact O-CA 3.27Å; D28-G31 WeakPolarHBondContact O-CA 3.34Å; D28-G31 PolarHBondContact O-N 3.49Å; E29-G31 VanDerWaalsContact C-N 3.33Å
32G77.1Confident74Confident0 Ų034.8 Ų34.80%018%0.178CC..  trans-179.6-165.2-178.400000111.2Y25 S26 V46 T47Y25-G32 WeakPolarHBondContact CA-O 3.23Å; S26-G32 PolarHBondContact N-O 3.19Å; S26-G32 PolarHBondContact O-N 2.81Å; G32-V46 VanDerWaalsContact CA-CG1 3.42Å; G32-T47 CarbonylContact C-O 3.52Å; G32-T47 VanDerWaalsContact CA-O 3.29Å; G32-T47 WeakPolarHBondContact CA-O 3.23Å
33L79.7Confident73.2Confident5 Ų540.1 Ų40.13%0.02620%0.201CC..EExtended strand (participates in β ladder)trans-85.2129.9177.5-154.273.2000109.4F24 Y25 C35 V46 T47 L49 C63F24-L33 WeakPolarHBondContact O-CA 3.28Å; Y25-L33 HydrophobicContact CD2-CD1 4.31Å; L33-C35 PolarHBondContact O-N 2.87Å; L33-V46 WeakPolarHBondContact O-CA 3.41Å; L33-T47 PolarHBondContact N-O 3.34Å; L33-T47 PolarHBondContact O-N 2.87Å; L33-T47 PolarHBondContact O-OG1 3.47Å; L33-L49 HydrophobicContact CB-CD1 4.08Å; L33-C63 HydrophobicContact CD2-CB 3.23Å; L33-C63 VanDerWaalsContact CD2-SG 3.59Å; L33-C63 HydrophobicContact CG-CB 3.89Å
34L81.8Confident72.6Confident0 Ų040.4 Ų40.40%020%0.203CC..EExtended strand (participates in β ladder)trans-63.8122.4171.3-176.966.5000108.7F24 P44 C63 F65 L191 L196 W228F24-L34 HydrophobicContact CB-CB 3.99Å; F24-L34 HydrophobicContact CB-CD2 4.36Å; F24-L34 HydrophobicContact CD2-CD2 4.14Å; F24-L34 PolarHBondContact O-N 3.47Å; L34-P44 HydrophobicContact CD1-CB 4.39Å; L34-C63 WeakPolarHBondContact O-CA 3.37Å; L34-F65 HydrophobicContact CB-CE2 4.32Å; L34-F65 HydrophobicContact CD2-CE2 3.92Å; L34-F65 HydrophobicContact CD2-CZ 3.93Å; L34-F65 HydrophobicContact CG-CE2 3.94Å; L34-F65 HydrophobicContact CG-CZ 3.96Å; L34-L191 HydrophobicContact CD2-CD2 4.36Å; L34-L196 HydrophobicContact CD1-CD1 4.29Å; L34-L196 HydrophobicContact CD1-CD2 4.09Å; L34-W228 HydrophobicContact CB-CH2 4.36Å; L34-W228 HydrophobicContact CB-CZ3 4.06Å; L34-W228 HydrophobicContact CD1-CH2 4.4Å
35C78Confident71.9Confident6 Ų642.5 Ų42.54%0.04122%0.215CC..EExtended strand (participates in β ladder)trans-142.1170.3-17669.10000112.4L33 N45 T47 D62 C63L33-C35 PolarHBondContact O-N 2.87Å; C35-N45 PolarHBondContact N-O 2.85Å; C35-N45 PolarHBondContact O-N 3.13Å; C35-N45 PolarHBondContact SG-O 2.87Å; C35-N45 VanDerWaalsContact SG-O 3.39Å; C35-T47 WeakPolarHBondContact SG-CG2 3.42Å; C35-T47 PolarHBondContact SG-OG1 3.37Å; C35-D62 CarbonylContact C-O 3.55Å; C35-D62 WeakPolarHBondContact CA-O 3.49Å; C35-C63 HydrophobicContact CB-CB 4.3Å; C35-C63 WeakPolarHBondContact CB-SG 3.42Å
36M73.3Confident71.4Confident5 Ų541.2 Ų41.23%0.02521%0.211CC..EExtended strand (participates in β ladder)trans-115.9140.7172.2-175.4-174.272.900110.5G38 D62 H123 K125 S126 L149M36-G38 WeakPolarHBondContact CE-O 3.19Å; M36-G38 WeakPolarHBondContact CG-O 3.22Å; M36-G38 PolarHBondContact O-N 3.34Å; M36-D62 PolarHBondContact N-O 3.03Å; M36-H123 WeakPolarHBondContact CE-CE1 3.28Å; M36-H123 VanDerWaalsContact CE-ND1 3.35Å; M36-H123 WeakPolarHBondContact CE-ND1 3.41Å; M36-H123 PolarHBondContact SD-ND1 2.87Å; M36-H123 VanDerWaalsContact SD-ND1 3.38Å; M36-K125 HydrophobicContact CE-CD 4.5Å; M36-S126 VanDerWaalsContact CE-CB 3.46Å; M36-S126 VanDerWaalsContact SD-CB 3.57Å; M36-S126 PolarHBondContact SD-OG 2.87Å; M36-L149 HydrophobicContact CB-CD1 4.08Å; M36-L149 HydrophobicContact CG-CD1 3.78Å; M36-L149 HydrophobicContact SD-CD1 3.68Å
37E65Low70.8Confident129 Ų12944.3 Ų44.360%0.60323%0.23SC*.SBendtrans-80.456.3172.3-73.2-177.9-18000111.7S41 N45E37-S41 VanDerWaalsContact C-OG 3.27Å; E37-S41 VanDerWaalsContact CB-OG 3.27Å; E37-S41 WeakPolarHBondContact CB-OG 3.18Å; E37-S41 PolarHBondContact O-OG 3.19Å; E37-N45 HydrophobicContact CG-CB 4.38Å; E37-N45 PolarHBondContact OE1-ND2 2.73Å
38G63.1Low70.7Confident4 Ų448.7 Ų48.74%0.04124%0.241CC..THydrogen-bonded Turntrans71.9176.9177.200000115.5M36 I40 D448M36-G38 WeakPolarHBondContact CE-O 3.19Å; M36-G38 WeakPolarHBondContact CG-O 3.22Å; M36-G38 PolarHBondContact O-N 3.34Å; G38-I40 PolarHBondContact O-N 2.82Å; G38-D448 WeakPolarHBondContact CA-OD2 3.47Å
39Q68.9Low70.1Confident5 Ų547.1 Ų47.12%0.02323%0.232CC..THydrogen-bonded Turntrans-61.9-26.4-169.7-77.4-101.5-1.600114.9K125 K128 D444 F445 D448Q39-K125 PolarHBondContact NE2-O 3.5Å; Q39-K128 PolarHBondContact O-NZ 3.31Å; Q39-D444 HydrophobicContact CG-CB 4.2Å; Q39-F445 HydrophobicContact CB-CB 4.26Å; Q39-F445 HydrophobicContact CB-CD2 4.11Å; Q39-F445 HydrophobicContact CG-CB 4.34Å; Q39-D448 PolarHBondContact N-OD2 2.98Å
40I62.6Low69.5Low19 Ų1944.9 Ų44.910%0.09723%0.225CC..THydrogen-bonded Turntrans-83.4-37.8-170.6-61.9162.9000111.3G38 F445 D448 S449 A452 F476 I477G38-I40 PolarHBondContact O-N 2.82Å; I40-F445 HydrophobicContact CG1-CD2 4.36Å; I40-F445 HydrophobicContact CG1-CE2 4.16Å; I40-D448 VanDerWaalsContact CD1-C 3.43Å; I40-D448 HydrophobicContact CD1-CB 4.15Å; I40-S449 WeakPolarHBondContact CD1-OG 3.35Å; I40-A452 HydrophobicContact CD1-CB 4.27Å; I40-F476 HydrophobicContact CG2-CD1 4.16Å; I40-F476 HydrophobicContact CG2-CE1 3.93Å; I40-F476 WeakPolarHBondContact O-CE1 3.36Å; I40-I477 HydrophobicContact CG2-CG1 3.91Å
41S67.9Low68.8Low27 Ų2743.8 Ų43.819%0.18923%0.226CC..  trans-84.1126.8177.472.80000109E37 K43E37-S41 VanDerWaalsContact C-OG 3.27Å; E37-S41 VanDerWaalsContact CB-OG 3.27Å; E37-S41 WeakPolarHBondContact CB-OG 3.18Å; E37-S41 PolarHBondContact O-OG 3.19Å; S41-K43 PolarHBondContact O-N 3.32Å
42N70.1Confident67.8Low45 Ų4549 Ų4924%0.24126%0.256CS..  trans-86.812.4170.9-65.4-22.7000111.5K128 T148 L149N42-K128 PolarHBondContact OD1-NZ 3.19Å; N42-T148 CarbonylContact O-C 3.55Å; N42-T148 VanDerWaalsContact O-CA 3.27Å; N42-T148 WeakPolarHBondContact O-CA 3.4Å; N42-L149 WeakPolarHBondContact CB-O 3.05Å; N42-L149 PolarHBondContact O-N 3.42Å
43K73Confident66.3Low111 Ų11152.1 Ų52.148%0.48329%0.288SS..  trans-100.2117.8-175.1-69.1-175.7-176.4175.20109.9S41S41-K43 PolarHBondContact O-N 3.32Å
44P72.6Confident64.7Low8 Ų855.6 Ų55.65%0.05231%0.307CS..EExtended strand (participates in β ladder)trans-67.5143167.526.9-28.8000109.8L34 L130 F147 L196L34-P44 HydrophobicContact CD1-CB 4.39Å; P44-L130 HydrophobicContact CB-CD1 4.28Å; P44-L130 HydrophobicContact CG-CD1 3.89Å; P44-F147 WeakPolarHBondContact CD-O 3.37Å; P44-F147 HydrophobicContact CG-CB 3.82Å; P44-L196 HydrophobicContact CB-CD2 3.59Å; P44-L196 HydrophobicContact CG-CD2 3.58Å; P44-L196 WeakPolarHBondContact O-CD2 3.43Å
45N73.8Confident63.1Low45 Ų4556.6 Ų56.624%0.24131%0.311CS..EExtended strand (participates in β ladder)trans-134.3171.5179-159-3.4000109.8C35 E37 N197C35-N45 PolarHBondContact N-O 2.85Å; C35-N45 PolarHBondContact O-N 3.13Å; C35-N45 PolarHBondContact SG-O 2.87Å; C35-N45 VanDerWaalsContact SG-O 3.39Å; E37-N45 HydrophobicContact CG-CB 4.38Å; E37-N45 PolarHBondContact OE1-ND2 2.73Å; N45-N197 PolarHBondContact OD1-OD1 3.3Å
46V73Confident61.7Low18 Ų1858.1 Ų58.111%0.10932%0.32CS..EExtended strand (participates in β ladder)trans-118.9115.5177.7-178.90000109.2G32 L33 I193 L196 W228G32-V46 VanDerWaalsContact CA-CG1 3.42Å; L33-V46 WeakPolarHBondContact O-CA 3.41Å; V46-I193 HydrophobicContact CG2-CG2 4.36Å; V46-L196 HydrophobicContact CG2-CB 4.41Å; V46-L196 HydrophobicContact CG2-CD1 4.13Å; V46-W228 HydrophobicContact CG2-CH2 3.93Å
47T72.6Confident60.6Low67 Ų6760.3 Ų60.341%0.41134%0.336SS..EExtended strand (participates in β ladder)trans-87.9123.8176.433.20000110.7G32 L33 C35G32-T47 CarbonylContact C-O 3.52Å; G32-T47 VanDerWaalsContact CA-O 3.29Å; G32-T47 WeakPolarHBondContact CA-O 3.23Å; L33-T47 PolarHBondContact N-O 3.34Å; L33-T47 PolarHBondContact O-N 2.87Å; L33-T47 PolarHBondContact O-OG1 3.47Å; C35-T47 WeakPolarHBondContact SG-CG2 3.42Å; C35-T47 PolarHBondContact SG-OG1 3.37Å
48R69Low59.9Low177 Ų17755.7 Ų55.767%0.66832%0.318SS*.PPolyproline II helixtrans-76.6132.1177.9-156.4175.8-161.9-177.76.9110.5E29E29-R48 PolarHBondContact O-NH2 2.98Å
49L57.3Low59.7Low30 Ų3056.1 Ų56.116%0.15732%0.319CS..PPolyproline II helixtrans-86.4118.2172.1-87.1100.3000110.7Y25 L33 S51 F55 S58Y25-L49 HydrophobicContact CD2-CD1 4.22Å; Y25-L49 HydrophobicContact CE2-CD1 3.96Å; L33-L49 HydrophobicContact CB-CD1 4.08Å; L49-S51 PolarHBondContact O-N 2.86Å; L49-F55 HydrophobicContact CD1-CE1 4.28Å; L49-F55 HydrophobicContact CD2-CD1 3.33Å; L49-F55 HydrophobicContact CD2-CD2 4.36Å; L49-F55 HydrophobicContact CD2-CE1 3.4Å; L49-F55 HydrophobicContact CD2-CE2 4.39Å; L49-F55 HydrophobicContact CD2-CG 3.82Å; L49-F55 HydrophobicContact CD2-CZ 3.93Å; L49-F55 HydrophobicContact CG-CE1 4.43Å; L49-S58 VanDerWaalsContact CD2-OG 3.26Å; L49-S58 WeakPolarHBondContact CD2-OG 3.31Å
50N52Low59.7Low129 Ų12957.7 Ų57.769%0.6933%0.329SS*.  trans-80.6101.4166.7-68.5-13.4000108.6N54N50-N54 PolarHBondContact O-ND2 3.27Å
51S48.1Very low60.2Low81 Ų8158 Ų5857%0.56633%0.329SS*.SBendtrans68149.7176.3830000117.3L49 G53 N54L49-S51 PolarHBondContact O-N 2.86Å; S51-G53 PolarHBondContact O-N 3.21Å; S51-N54 PolarHBondContact O-N 3.14Å
52V45.8Very low60.7Low119 Ų11958.4 Ų58.472%0.72133%0.329SS*.G310 helixtrans-65.3-20.6-175.71770000113.1N54 F55V52-N54 VanDerWaalsContact C-N 3.29Å; V52-N54 PolarHBondContact O-N 3.21Å; V52-F55 HydrophobicContact CB-CE2 4.3Å; V52-F55 HydrophobicContact CG1-CD2 4.37Å; V52-F55 HydrophobicContact CG1-CE2 4.01Å; V52-F55 WeakPolarHBondContact O-CD2 3.35Å
53G44.5Very low61.3Low65 Ų6556.4 Ų56.467%0.6732%0.319SS*.G310 helixtrans-71.9-19.6-179.600000114.6S51S51-G53 PolarHBondContact O-N 3.21Å
54N46.4Very low62Low78 Ų7851.2 Ų51.242%0.41730%0.296SS..G310 helixtrans-97.57.2-167.4-72.4-20.2000114.9N50 S51 V52 T56 S57 S58N50-N54 PolarHBondContact O-ND2 3.27Å; S51-N54 PolarHBondContact O-N 3.14Å; V52-N54 VanDerWaalsContact C-N 3.29Å; V52-N54 PolarHBondContact O-N 3.21Å; N54-T56 VanDerWaalsContact C-N 3.28Å; N54-T56 PolarHBondContact O-N 3.12Å; N54-S57 PolarHBondContact O-N 3.18Å; N54-S57 VanDerWaalsContact O-N 3.13Å; N54-S57 PolarHBondContact O-OG 3.27Å; N54-S58 PolarHBondContact O-N 2.84Å; N54-S58 PolarHBondContact O-OG 3.37Å
55F47.3Very low62.7Low20 Ų2050.9 Ų50.99%0.08829%0.294CS..Hα-helixtrans-54.3-39.8-175.8-84-73.7000113.6L49 V52 S57 S58 L59L49-F55 HydrophobicContact CD1-CE1 4.28Å; L49-F55 HydrophobicContact CD2-CD1 3.33Å; L49-F55 HydrophobicContact CD2-CD2 4.36Å; L49-F55 HydrophobicContact CD2-CE1 3.4Å; L49-F55 HydrophobicContact CD2-CE2 4.39Å; L49-F55 HydrophobicContact CD2-CG 3.82Å; L49-F55 HydrophobicContact CD2-CZ 3.93Å; L49-F55 HydrophobicContact CG-CE1 4.43Å; V52-F55 HydrophobicContact CB-CE2 4.3Å; V52-F55 HydrophobicContact CG1-CD2 4.37Å; V52-F55 HydrophobicContact CG1-CE2 4.01Å; V52-F55 WeakPolarHBondContact O-CD2 3.35Å; F55-S57 PolarHBondContact O-N 3.18Å; F55-S58 WeakPolarHBondContact CA-OG 3.3Å; F55-S58 PolarHBondContact O-N 2.69Å; F55-S58 PolarHBondContact O-OG 3.43Å; F55-L59 VanDerWaalsContact O-CD1 3.3Å; F55-L59 WeakPolarHBondContact O-CD1 3.25Å; F55-L59 VanDerWaalsContact O-CG 3.3Å; F55-L59 WeakPolarHBondContact O-CG 3.3Å; F55-L59 PolarHBondContact O-N 2.64Å; F55-L59 VanDerWaalsContact O-N 3.12Å
56T49Very low63.3Low38 Ų3850.7 Ų50.723%0.23329%0.291CS..Hα-helixtrans-63.3-42.9-179.652.60000111.7N54 S58 C301 P361N54-T56 VanDerWaalsContact C-N 3.28Å; N54-T56 PolarHBondContact O-N 3.12Å; T56-S58 VanDerWaalsContact C-N 3.28Å; T56-S58 PolarHBondContact O-N 3.19Å; T56-C301 HydrophobicContact CG2-CB 3.92Å; T56-P361 WeakPolarHBondContact OG1-CG 3.46Å
57S50.4Low64Low52 Ų5249.9 Ų49.936%0.36429%0.286SS..Hα-helixtrans-67.7-26.8178.169.50000113.5N54 F55N54-S57 PolarHBondContact O-N 3.18Å; N54-S57 VanDerWaalsContact O-N 3.13Å; N54-S57 PolarHBondContact O-OG 3.27Å; F55-S57 PolarHBondContact O-N 3.18Å
58S50.8Low64.6Low31 Ų3147.6 Ų47.622%0.21727%0.271CS..Hα-helixtrans-94-14.5-17559.50000114.7L49 N54 F55 T56 T60L49-S58 VanDerWaalsContact CD2-OG 3.26Å; L49-S58 WeakPolarHBondContact CD2-OG 3.31Å; N54-S58 PolarHBondContact O-N 2.84Å; N54-S58 PolarHBondContact O-OG 3.37Å; F55-S58 WeakPolarHBondContact CA-OG 3.3Å; F55-S58 PolarHBondContact O-N 2.69Å; F55-S58 PolarHBondContact O-OG 3.43Å; T56-S58 VanDerWaalsContact C-N 3.28Å; T56-S58 PolarHBondContact O-N 3.19Å; S58-T60 PolarHBondContact O-N 3.49Å
59L57.8Low65.1Low13 Ų1339.5 Ų39.57%0.06824%0.242CC..  trans-75.551174.4-74.7157.4000112.5T23 F55 R64 Y233 R302T23-L59 HydrophobicContact CG2-CD2 3.72Å; F55-L59 VanDerWaalsContact O-CD1 3.3Å; F55-L59 WeakPolarHBondContact O-CD1 3.25Å; F55-L59 VanDerWaalsContact O-CG 3.3Å; F55-L59 WeakPolarHBondContact O-CG 3.3Å; F55-L59 PolarHBondContact O-N 2.64Å; F55-L59 VanDerWaalsContact O-N 3.12Å; L59-R64 PolarHBondContact O-NE 3.4Å; L59-R64 PolarHBondContact O-NH2 3.04Å; L59-Y233 HydrophobicContact CD2-CD2 4.44Å; L59-R302 HydrophobicContact CD1-CB 4.26Å; L59-R302 HydrophobicContact CD1-CG 4.46Å
60T69.1Low65.8Low38 Ų3840.3 Ų40.323%0.23325%0.245CC..  trans-69.1160.8174.662.90000111.2S58 D62 C63S58-T60 PolarHBondContact O-N 3.49Å; T60-D62 PolarHBondContact O-N 3.32Å; T60-C63 PolarHBondContact O-N 3.48Å; T60-C63 VanDerWaalsContact O-N 3.13Å
61R74.7Confident66.4Low27 Ų2735 Ų3510%0.10222%0.216CC..G310 helixtrans-56.6-20.2175.1-70172.659.5-132.8-8.2113.4C63 H123 K125 E293 D444R61-C63 PolarHBondContact O-N 2.97Å; R61-H123 PolarHBondContact O-NE2 2.84Å; R61-K125 HydrophobicContact CB-CB 4.25Å; R61-E293 WeakPolarHBondContact CD-OE1 3.2Å; R61-E293 WeakPolarHBondContact CG-OE1 3.34Å; R61-D444 IonicContact CZ-OD2 3.94Å; R61-D444 IonicContact NH1-OD1 3.59Å; R61-D444 PolarHBondContact NH1-OD1 2.73Å; R61-D444 VanDerWaalsContact NH1-OD1 3.17Å; R61-D444 IonicContact NH1-OD2 3.85Å; R61-D444 PolarHBondContact NH1-OD2 2.99Å; R61-D444 IonicContact NH2-OD2 2.83Å; R61-D444 PolarHBondContact NH2-OD2 2.94Å
62D77.1Confident66.6Low35 Ų3538 Ų3819%0.18722%0.219CC..G310 helixtrans-69.5-10.8177.6-70.6-55.7000114.4C35 M36 T60 H123 K125C35-D62 CarbonylContact C-O 3.55Å; C35-D62 WeakPolarHBondContact CA-O 3.49Å; M36-D62 PolarHBondContact N-O 3.03Å; T60-D62 PolarHBondContact O-N 3.32Å; D62-H123 PolarHBondContact O-NE2 3.24Å; D62-K125 WeakPolarHBondContact OD1-CD 3.42Å; D62-K125 WeakPolarHBondContact OD1-CE 3.28Å; D62-K125 IonicContact OD1-NZ 3.47Å; D62-K125 PolarHBondContact OD1-NZ 2.9Å; D62-K125 IonicContact OD2-NZ 3.58Å; D62-K125 PolarHBondContact OD2-NZ 3.2Å
63C83.3Confident66.6Low2 Ų236.1 Ų36.11%0.01420%0.2CC..G310 helixtrans-118.25.2-174.3-48.60000113.3T23 L33 L34 C35 T60 R61T23-C63 WeakPolarHBondContact CG2-O 3.32Å; L33-C63 HydrophobicContact CD2-CB 3.23Å; L33-C63 VanDerWaalsContact CD2-SG 3.59Å; L33-C63 HydrophobicContact CG-CB 3.89Å; L34-C63 WeakPolarHBondContact O-CA 3.37Å; C35-C63 HydrophobicContact CB-CB 4.3Å; C35-C63 WeakPolarHBondContact CB-SG 3.42Å; T60-C63 PolarHBondContact O-N 3.48Å; T60-C63 VanDerWaalsContact O-N 3.13Å; R61-C63 PolarHBondContact O-N 2.97Å
64R86.8Confident66Low3 Ų340.2 Ų40.21%0.01121%0.206CC..  trans-102.5134.5-171.7-51.7-179.2-164.9156.45.1110.2Q21 T23 L59 H123 V124 Y233 E293Q21-R64 HydrophobicContact CG-CB 4.15Å; Q21-R64 VanDerWaalsContact NE2-CB 3.35Å; T23-R64 HydrophobicContact CG2-CG 4.37Å; L59-R64 PolarHBondContact O-NE 3.4Å; L59-R64 PolarHBondContact O-NH2 3.04Å; R64-H123 PolarHBondContact O-CD2 2.94Å; R64-H123 VanDerWaalsContact O-CD2 3.27Å; R64-V124 HydrophobicContact CB-CB 4.14Å; R64-V124 HydrophobicContact CB-CG2 3.94Å; R64-V124 WeakPolarHBondContact O-CG2 3.42Å; R64-V124 PolarHBondContact O-N 2.79Å; R64-Y233 PolarHBondContact NH1-OH 3.33Å; R64-Y233 PolarHBondContact NH2-OH 2.88Å; R64-E293 IonicContact CZ-OE1 3.18Å; R64-E293 IonicContact NH1-OE1 3.52Å; R64-E293 PolarHBondContact NH1-OE1 2.99Å; R64-E293 IonicContact NH2-OE1 3.97Å; R64-E293 PolarHBondContact NH2-OE1 2.99Å
65F87.7Confident65.6Low1 Ų140.9 Ų40.90%0.00421%0.209CC..EExtended strand (participates in β ladder)trans-131.1140-179.5-63.8-93.6000111Q21 V22 F24 L34 L121 L122 H123Q21-F65 CarbonylContact C-O 3.49Å; Q21-F65 WeakPolarHBondContact CA-O 3.35Å; V22-F65 PolarHBondContact N-O 2.83Å; V22-F65 PolarHBondContact O-N 3.2Å; F24-F65 HydrophobicContact CD2-CD2 4.09Å; F24-F65 HydrophobicContact CE2-CB 4.12Å; F24-F65 HydrophobicContact CE2-CD2 4.38Å; F24-F65 HydrophobicContact CE2-CG 4.38Å; L34-F65 HydrophobicContact CB-CE2 4.32Å; L34-F65 HydrophobicContact CD2-CE2 3.92Å; L34-F65 HydrophobicContact CD2-CZ 3.93Å; L34-F65 HydrophobicContact CG-CE2 3.94Å; L34-F65 HydrophobicContact CG-CZ 3.96Å; F65-L121 HydrophobicContact CD1-CB 4.27Å; F65-L122 CarbonylContact C-O 3.59Å; F65-L122 VanDerWaalsContact CA-O 3.24Å; F65-L122 WeakPolarHBondContact CA-O 3.47Å; F65-H123 HydrophobicContact CD1-CB 3.97Å; F65-H123 HydrophobicContact CE1-CB 3.74Å; F65-H123 AromaticContact CE1-CD2 3.68Å; F65-H123 AromaticContact CZ-CD2 3.7Å
66F87.8Confident64.9Low41 Ų4148.6 Ų48.618%0.1825%0.246CC..EExtended strand (participates in β ladder)trans-86.2136.8165.1-72.7-68.4000110.2Q21 L68 L122 V124Q21-F66 HydrophobicContact CB-CD1 4.06Å; Q21-F66 HydrophobicContact CB-CE1 3.82Å; Q21-F66 HydrophobicContact CG-CE1 4.25Å; F66-L68 HydrophobicContact CB-CD2 4.32Å; F66-L68 HydrophobicContact CB-CG 4.47Å; F66-L122 HydrophobicContact CB-CB 4.25Å; F66-L122 HydrophobicContact CD2-CD2 4.23Å; F66-L122 PolarHBondContact N-O 3.28Å; F66-L122 PolarHBondContact O-N 3.04Å; F66-V124 HydrophobicContact CD2-CG2 3.63Å; F66-V124 HydrophobicContact CE2-CB 4.47Å; F66-V124 HydrophobicContact CE2-CG1 4.36Å; F66-V124 HydrophobicContact CE2-CG2 3.56Å; F66-V124 HydrophobicContact CG-CG2 4.39Å; F66-V124 HydrophobicContact CZ-CG2 4.26Å
67I86.3Confident64Low0 Ų054.2 Ų54.20%027%0.274CS..EExtended strand (participates in β ladder)trans-88.3114.2170.7-57.2-171.7000108.8L16 F18 G19 D20 V22 V113 I119 L121L16-I67 HydrophobicContact CD1-CD1 3.74Å; L16-I67 HydrophobicContact CD2-CD1 3.61Å; L16-I67 HydrophobicContact CG-CD1 3.93Å; F18-I67 HydrophobicContact CD1-CG2 4.01Å; F18-I67 HydrophobicContact CE1-CG2 4.28Å; G19-I67 PolarHBondContact N-O 3.08Å; D20-I67 PolarHBondContact O-N 3.5Å; D20-I67 VanDerWaalsContact O-N 3.13Å; V22-I67 HydrophobicContact CG1-CD1 3.91Å; V22-I67 HydrophobicContact CG1-CG1 4.25Å; V22-I67 HydrophobicContact CG2-CD1 3.83Å; V22-I67 HydrophobicContact CG2-CG1 3.68Å; I67-V113 HydrophobicContact CG2-CG2 4.33Å; I67-I119 HydrophobicContact CG2-CB 4.13Å; I67-I119 HydrophobicContact CG2-CD1 4.21Å; I67-I119 HydrophobicContact CG2-CG2 4.02Å; I67-L121 HydrophobicContact CG1-CD2 4.32Å
68L85.2Confident63.1Low19 Ų1955.6 Ų55.610%0.09928%0.283CS..EExtended strand (participates in β ladder)trans-110.4144.5179.3-60.1-179.5000110.3F66 Q105 I119 Q120 L122F66-L68 HydrophobicContact CB-CD2 4.32Å; F66-L68 HydrophobicContact CB-CG 4.47Å; L68-Q105 VanDerWaalsContact CA-NE2 3.26Å; L68-Q105 HydrophobicContact CD2-CG 4.15Å; L68-Q105 VanDerWaalsContact CD2-NE2 3.27Å; L68-I119 CarbonylContact O-C 3.56Å; L68-I119 VanDerWaalsContact O-CA 3.31Å; L68-I119 WeakPolarHBondContact O-CA 3.32Å; L68-Q120 HydrophobicContact CB-CB 4.17Å; L68-Q120 PolarHBondContact N-O 3.38Å; L68-Q120 PolarHBondContact O-N 3.45Å; L68-L122 HydrophobicContact CD1-CB 3.75Å; L68-L122 HydrophobicContact CD1-CD2 4.01Å; L68-L122 HydrophobicContact CD1-CG 4.47Å; L68-L122 HydrophobicContact CG-CB 4.38Å
69A80.6Confident62.1Low7 Ų761.8 Ų61.86%0.05831%0.313CS..EExtended strand (participates in β ladder)trans-67.6153.717100000111.6F18 Q71 L108F18-A69 HydrophobicContact CD1-CB 3.77Å; F18-A69 HydrophobicContact CE1-CB 3.74Å; F18-A69 HydrophobicContact CG-CB 4.19Å; F18-A69 HydrophobicContact CZ-CB 4.14Å; A69-Q71 PolarHBondContact O-N 2.94Å; A69-L108 HydrophobicContact CB-CB 4.2Å; A69-L108 HydrophobicContact CB-CD1 3.74Å
70M71.2Confident60.9Low47 Ų4769.4 Ų69.423%0.23235%0.348CS..PPolyproline II helixtrans-52.9127.5174.4-177.9-161-178.200111.8K72 I118 W158M70-K72 HydrophobicContact CE-CD 4.44Å; M70-K72 HydrophobicContact CE-CG 3.59Å; M70-K72 HydrophobicContact SD-CG 4.18Å; M70-I118 HydrophobicContact CB-CB 4.03Å; M70-I118 HydrophobicContact CB-CG2 3.87Å; M70-I118 HydrophobicContact CG-CB 4.38Å; M70-I118 HydrophobicContact CG-CG2 3.95Å; M70-I118 PolarHBondContact N-O 2.81Å; M70-I118 HydrophobicContact SD-CB 4.41Å; M70-I118 HydrophobicContact SD-CD1 3.94Å; M70-I118 HydrophobicContact SD-CG2 4.38Å; M70-W158 HydrophobicContact CE-CD2 3.89Å; M70-W158 HydrophobicContact CE-CE3 3.83Å; M70-W158 HydrophobicContact CE-CH2 3.27Å; M70-W158 HydrophobicContact CE-CZ2 3.29Å; M70-W158 HydrophobicContact CE-CZ3 3.54Å; M70-W158 HydrophobicContact CG-CD2 4.39Å; M70-W158 HydrophobicContact CG-CZ2 4.44Å
71Q64.7Low59Low17 Ų1773.5 Ų73.58%0.07937%0.369CS..PPolyproline II helixtrans-100.9121.9167.4-57.7-170.52.900109.1A69 N101A69-Q71 PolarHBondContact O-N 2.94Å; Q71-N101 PolarHBondContact OE1-ND2 3.48Å
72K52.4Low56.8Low144 Ų14481.6 Ų81.663%0.62641%0.408SS*.PPolyproline II helixtrans-86.8118.6172.9-76.3-176.9178.7-1770108.6M70 L74M70-K72 HydrophobicContact CE-CD 4.44Å; M70-K72 HydrophobicContact CE-CG 3.59Å; M70-K72 HydrophobicContact SD-CG 4.18Å; K72-L74 PolarHBondContact O-N 3.38Å
73Y45Very low54.7Low80 Ų8085 Ų8531%0.31443%0.429SS..PPolyproline II helixtrans-73.4118.1161-106.7-88.1000108.6N75 Q153Y73-N75 PolarHBondContact O-N 2.76Å; Y73-Q153 WeakPolarHBondContact CE2-O 3.38Å
74L33.2Very low52.2Low151 Ų15195.9 Ų95.979%0.79147%0.47SS*.  trans-75.266.6169.1-75.9170.3000109.4K72K72-L74 PolarHBondContact O-N 3.38Å
75N37.1Very low49.5Very low93 Ų93104.4 Ų104.450%0.49751%0.508SS..  trans-98.433.4179.7-117.31.2000112.8Y73 N77 C78Y73-N75 PolarHBondContact O-N 2.76Å; N75-N77 PolarHBondContact O-N 2.71Å; N75-N77 VanDerWaalsContact O-N 3.11Å; N75-C78 PolarHBondContact O-N 2.86Å
76E33.3Very low46.8Very low182 Ų182114.3 Ų114.385%0.8555%0.545SS*.THydrogen-bonded Turntrans-61.9-15174.2-82-168.3161.900113.1
77N30.8Very low44.3Very low156 Ų156116.4 Ų116.483%0.83456%0.563SS**THydrogen-bonded Turntrans-100.7-1.8-177.8-73.6-15.1000115.9N75N75-N77 PolarHBondContact O-N 2.71Å; N75-N77 VanDerWaalsContact O-N 3.11Å
78C29.9Very low41.8Very low81 Ų81121.7 Ų121.755%0.54759%0.591SS.*SBendtrans-97-5.9-173.8-137.90000114.9N75N75-C78 PolarHBondContact O-N 2.86Å
79L31.6Very low39.3Very low161 Ų161127.7 Ų127.784%0.84362%0.616SS**SBendtrans-81.5-10.3-179.5-83.7162.9000114.7
80E30.8Very low37Very low173 Ų173132.3 Ų132.381%0.80864%0.64SS**SBendtrans-101.8-3.9-173.9-72.8-159.3157.200116.8
81N29.4Very low35.3Very low124 Ų124134.2 Ų134.266%0.66365%0.65SS**  trans-143.178179.8-72.2-56.5000113.7T83N81-T83 PolarHBondContact O-N 2.95Å
82E29.2Very low33.9Very low197 Ų197141 Ų14192%0.92168%0.681SS**  trans-65.29.8176.6-88.6-160152.300116
83T33.7Very low33.3Very low105 Ų105139.9 Ų139.964%0.64468%0.679SS**SBendtrans-139.8114.6-178.755.50000112.4N81N81-T83 PolarHBondContact O-N 2.95Å
84R29.5Very low32.9Very low232 Ų232137.2 Ų137.288%0.87567%0.671SS**  trans82.471.2163.8-46.5173.8-163.91784.4117.4
85F29.9Very low33.2Very low181 Ų181131.7 Ų131.779%0.79465%0.651SS**  trans-133.9135.3153.8-84.6-78.3000113
86R32Very low33.3Very low209 Ų209130.6 Ų130.679%0.78965%0.65SS**  trans-67.7141.1-175.9-74.9177.2171.1163.9-4.6110.9D88R86-D88 PolarHBondContact O-N 3.46Å; R86-D88 VanDerWaalsContact O-N 3.15Å
87P34.2Very low33.7Very low85 Ų85124.4 Ų124.455%0.55262%0.623SS**THydrogen-bonded Turntrans-64-18.3-174.724-33000115K89 L90 I91P87-K89 VanDerWaalsContact C-N 3.31Å; P87-K89 PolarHBondContact O-N 3.17Å; P87-L90 WeakPolarHBondContact O-CB 3.26Å; P87-L90 PolarHBondContact O-N 3.4Å; P87-L90 VanDerWaalsContact O-N 3.15Å; P87-I91 PolarHBondContact O-N 3.05Å
88D33.5Very low34.5Very low112 Ų112119.6 Ų119.660%0.59960%0.597SS**Hα-helixtrans-63-33.1-174.9-60.4-26.3000113.6R86 I91R86-D88 PolarHBondContact O-N 3.46Å; R86-D88 VanDerWaalsContact O-N 3.15Å; D88-I91 PolarHBondContact O-N 3.22Å
89K33.7Very low35.4Very low144 Ų144121.2 Ų121.263%0.62660%0.596SS**Hα-helixtrans-72.9-31.5177-76.5-167.9173.6-169.30113.3P87 I91 E92 E93P87-K89 VanDerWaalsContact C-N 3.31Å; P87-K89 PolarHBondContact O-N 3.17Å; K89-I91 PolarHBondContact O-N 3.38Å; K89-E92 PolarHBondContact O-N 3.26Å; K89-E93 PolarHBondContact O-N 3Å; K89-E93 VanDerWaalsContact O-N 3.14Å
90L32.8Very low36.3Very low105 Ų105118.8 Ų118.855%0.5558%0.581SS.*Hα-helixtrans-64.7-29175-81.4161.1000111.3P87 S94P87-L90 WeakPolarHBondContact O-CB 3.26Å; P87-L90 PolarHBondContact O-N 3.4Å; P87-L90 VanDerWaalsContact O-N 3.15Å; L90-S94 WeakPolarHBondContact O-CB 3.39Å; L90-S94 PolarHBondContact O-N 3.16Å; L90-S94 PolarHBondContact O-OG 3.15Å
91I34.1Very low37.2Very low87 Ų87111.1 Ų111.145%0.44655%0.545SS..Hα-helixtrans-74.2-42.6-178.9-58.3169.8000111.3P87 D88 K89 S94 G95 F493P87-I91 PolarHBondContact O-N 3.05Å; D88-I91 PolarHBondContact O-N 3.22Å; K89-I91 PolarHBondContact O-N 3.38Å; I91-S94 WeakPolarHBondContact CA-OG 3.39Å; I91-S94 PolarHBondContact O-OG 3.22Å; I91-G95 PolarHBondContact O-N 3.42Å; I91-F493 HydrophobicContact CG2-CE1 4.4Å
92E35.7Very low38.5Very low158 Ų158108.1 Ų108.174%0.73853%0.534SS*.Hα-helixtrans-68.8-42.6176.6-76.5-175167.300112K89 G95 C96K89-E92 PolarHBondContact O-N 3.26Å; E92-G95 PolarHBondContact O-N 2.87Å; E92-C96 PolarHBondContact O-N 3.17Å
93E39.5Very low39.6Very low122 Ų122103.6 Ų103.657%0.5751%0.511SS*.Hα-helixtrans-65.5-46.1175.9-72.3178175.900110.9K89 G95 C96 D97K89-E93 PolarHBondContact O-N 3Å; K89-E93 VanDerWaalsContact O-N 3.14Å; E93-G95 VanDerWaalsContact C-N 3.29Å; E93-G95 PolarHBondContact O-N 2.95Å; E93-C96 PolarHBondContact O-N 2.95Å; E93-D97 WeakPolarHBondContact O-CB 3.19Å; E93-D97 PolarHBondContact O-N 3.22Å
94S37.9Very low40.4Very low23 Ų23102.7 Ų102.716%0.16150%0.501CS..Hα-helixtrans-65.6-29175.161.20000113.6L90 I91 N98L90-S94 WeakPolarHBondContact O-CB 3.39Å; L90-S94 PolarHBondContact O-N 3.16Å; L90-S94 PolarHBondContact O-OG 3.15Å; I91-S94 WeakPolarHBondContact CA-OG 3.39Å; I91-S94 PolarHBondContact O-OG 3.22Å; S94-N98 WeakPolarHBondContact O-CB 3.3Å; S94-N98 PolarHBondContact O-N 3.11Å; S94-N98 PolarHBondContact O-ND2 3.35Å
95G38.9Very low41.6Very low35 Ų3592.5 Ų92.536%0.36146%0.463SS..Hα-helixtrans-67.8-45.2173.400000112.5I91 E92 E93 N98 E99I91-G95 PolarHBondContact O-N 3.42Å; E92-G95 PolarHBondContact O-N 2.87Å; E93-G95 VanDerWaalsContact C-N 3.29Å; E93-G95 PolarHBondContact O-N 2.95Å; G95-N98 PolarHBondContact O-N 3.26Å; G95-E99 PolarHBondContact O-N 3.41Å
96C39Very low42.9Very low70 Ų7092.3 Ų92.347%0.47346%0.457SS..Hα-helixtrans-66.7-41176-159.80000111.4E92 E93 E99 Q100E92-C96 PolarHBondContact O-N 3.17Å; E93-C96 PolarHBondContact O-N 2.95Å; C96-E99 PolarHBondContact O-N 3.49Å; C96-Q100 WeakPolarHBondContact O-CG 3.46Å; C96-Q100 PolarHBondContact O-N 3.39Å
97D42.5Very low44.2Very low53 Ų5392.2 Ų92.228%0.28346%0.457SS..Hα-helixtrans-65.9-40.9175.4-70.2-19000111.4E93 E99 Q100 N101E93-D97 WeakPolarHBondContact O-CB 3.19Å; E93-D97 PolarHBondContact O-N 3.22Å; D97-E99 VanDerWaalsContact C-N 3.34Å; D97-E99 PolarHBondContact O-N 2.94Å; D97-Q100 PolarHBondContact O-N 3.4Å; D97-N101 WeakPolarHBondContact O-CB 3.47Å; D97-N101 PolarHBondContact O-N 3.39Å; D97-N101 PolarHBondContact O-ND2 3.18Å
98N47.5Very low45.3Very low54 Ų5491 Ų9129%0.28945%0.445SS..Hα-helixtrans-63.9-38.1174.8-82-20.4000111.8S94 G95 S102S94-N98 WeakPolarHBondContact O-CB 3.3Å; S94-N98 PolarHBondContact O-N 3.11Å; S94-N98 PolarHBondContact O-ND2 3.35Å; G95-N98 PolarHBondContact O-N 3.26Å; N98-S102 VanDerWaalsContact O-CB 3.23Å; N98-S102 WeakPolarHBondContact O-CB 3.26Å; N98-S102 PolarHBondContact O-N 2.78Å; N98-S102 PolarHBondContact O-OG 2.87Å
99E48.5Very low46.5Very low115 Ų11588.5 Ų88.554%0.53743%0.43SS..Hα-helixtrans-65.5-44.1172.7-93.6-158.9-159.200112.5G95 C96 D97 N101 S102 K103G95-E99 PolarHBondContact O-N 3.41Å; C96-E99 PolarHBondContact O-N 3.49Å; D97-E99 VanDerWaalsContact C-N 3.34Å; D97-E99 PolarHBondContact O-N 2.94Å; E99-N101 VanDerWaalsContact C-N 3.34Å; E99-S102 PolarHBondContact O-N 3.43Å; E99-K103 WeakPolarHBondContact O-CB 3.44Å; E99-K103 VanDerWaalsContact O-CG 3.23Å; E99-K103 WeakPolarHBondContact O-CG 3.48Å; E99-K103 PolarHBondContact O-N 3.23Å; E99-K103 IonicContact OE2-NZ 3.35Å; E99-K103 PolarHBondContact OE2-NZ 2.77Å
100Q49.9Very low48Very low111 Ų11188.4 Ų88.452%0.51943%0.432SS..Hα-helixtrans-63.6-42.8176.3-72.3-1732200111C96 D97 K103 M104C96-Q100 WeakPolarHBondContact O-CG 3.46Å; C96-Q100 PolarHBondContact O-N 3.39Å; D97-Q100 PolarHBondContact O-N 3.4Å; Q100-K103 CarbonylContact O-C 3.55Å; Q100-K103 PolarHBondContact O-N 3.19Å; Q100-M104 WeakPolarHBondContact O-CB 3.49Å; Q100-M104 PolarHBondContact O-N 2.84Å
101N50.9Low50.3Low11 Ų1185.2 Ų85.26%0.05942%0.418CS..Hα-helixtrans-63.8-42.3174.9-73.9-19.3000111.3Q71 D97 E99 K103 M104 Q105Q71-N101 PolarHBondContact OE1-ND2 3.48Å; D97-N101 WeakPolarHBondContact O-CB 3.47Å; D97-N101 PolarHBondContact O-N 3.39Å; D97-N101 PolarHBondContact O-ND2 3.18Å; E99-N101 VanDerWaalsContact C-N 3.34Å; N101-K103 VanDerWaalsContact C-N 3.34Å; N101-K103 PolarHBondContact O-N 3.44Å; N101-M104 CarbonylContact O-C 3.59Å; N101-M104 PolarHBondContact O-N 2.99Å; N101-Q105 VanDerWaalsContact O-CB 3.29Å; N101-Q105 WeakPolarHBondContact O-CB 3.37Å; N101-Q105 PolarHBondContact O-N 3.06Å
102S55.1Low52.6Low61 Ų6183.4 Ų83.443%0.42741%0.409SS..Hα-helixtrans-60.8-42.8173.7-58.70000111.5N98 E99 Q105 R106N98-S102 VanDerWaalsContact O-CB 3.23Å; N98-S102 WeakPolarHBondContact O-CB 3.26Å; N98-S102 PolarHBondContact O-N 2.78Å; N98-S102 PolarHBondContact O-OG 2.87Å; E99-S102 PolarHBondContact O-N 3.43Å; S102-Q105 PolarHBondContact O-N 3.35Å; S102-R106 WeakPolarHBondContact O-CG 3.46Å; S102-R106 PolarHBondContact O-N 2.84Å
103K52.5Low55Low103 Ų10375.9 Ų75.945%0.44837%0.374SS..Hα-helixtrans-66.7-39.6175.5-72.5165.1-170.2157.20111.3E99 Q100 N101 R107E99-K103 WeakPolarHBondContact O-CB 3.44Å; E99-K103 VanDerWaalsContact O-CG 3.23Å; E99-K103 WeakPolarHBondContact O-CG 3.48Å; E99-K103 PolarHBondContact O-N 3.23Å; E99-K103 IonicContact OE2-NZ 3.35Å; E99-K103 PolarHBondContact OE2-NZ 2.77Å; Q100-K103 CarbonylContact O-C 3.55Å; Q100-K103 PolarHBondContact O-N 3.19Å; N101-K103 VanDerWaalsContact C-N 3.34Å; N101-K103 PolarHBondContact O-N 3.44Å; K103-R107 WeakPolarHBondContact O-CG 3.42Å; K103-R107 PolarHBondContact O-N 3Å; K103-R107 VanDerWaalsContact O-N 3.15Å
104M51.7Low57.3Low86 Ų8674.5 Ų74.542%0.42436%0.364SS..Hα-helixtrans-65.9-40.9174.9-136.9-159.2-53.500110.8Q100 N101 R107 L108Q100-M104 WeakPolarHBondContact O-CB 3.49Å; Q100-M104 PolarHBondContact O-N 2.84Å; N101-M104 CarbonylContact O-C 3.59Å; N101-M104 PolarHBondContact O-N 2.99Å; M104-R107 WeakPolarHBondContact O-CB 3.33Å; M104-R107 PolarHBondContact O-N 3.43Å; M104-L108 HydrophobicContact CG-CD1 4.42Å; M104-L108 WeakPolarHBondContact O-CB 3.34Å; M104-L108 WeakPolarHBondContact O-CG 3.41Å; M104-L108 PolarHBondContact O-N 2.85Å; M104-L108 HydrophobicContact SD-CD1 4.42Å
105Q54.5Low59.6Low17 Ų1773.5 Ų73.58%0.07936%0.357CS..Hα-helixtrans-61.9-47.8177.6-158.17130.700110.9L68 N101 S102 R107 L108 Q109L68-Q105 VanDerWaalsContact CA-NE2 3.26Å; L68-Q105 HydrophobicContact CD2-CG 4.15Å; L68-Q105 VanDerWaalsContact CD2-NE2 3.27Å; N101-Q105 VanDerWaalsContact O-CB 3.29Å; N101-Q105 WeakPolarHBondContact O-CB 3.37Å; N101-Q105 PolarHBondContact O-N 3.06Å; S102-Q105 PolarHBondContact O-N 3.35Å; Q105-R107 VanDerWaalsContact C-N 3.26Å; Q105-R107 PolarHBondContact O-N 3.04Å; Q105-L108 CarbonylContact O-C 3.58Å; Q105-L108 PolarHBondContact O-N 3.34Å; Q105-L108 VanDerWaalsContact O-N 3.1Å; Q105-Q109 WeakPolarHBondContact O-CB 3.47Å; Q105-Q109 PolarHBondContact O-N 3.36Å
106R57.2Low61.7Low177 Ų17773 Ų7367%0.66835%0.352SS*.Hα-helixtrans-59.7-36.4175.7-72.9179.9-167.8169.23.4112.4S102S102-R106 WeakPolarHBondContact O-CG 3.46Å; S102-R106 PolarHBondContact O-N 2.84Å
107R57.7Low64.1Low208 Ų20872.2 Ų72.279%0.78534%0.343SS*.Hα-helixtrans-70.4-33175.5-72174.7-177.3-176.91.6112.8K103 M104 Q105K103-R107 WeakPolarHBondContact O-CG 3.42Å; K103-R107 PolarHBondContact O-N 3Å; K103-R107 VanDerWaalsContact O-N 3.15Å; M104-R107 WeakPolarHBondContact O-CB 3.33Å; M104-R107 PolarHBondContact O-N 3.43Å; Q105-R107 VanDerWaalsContact C-N 3.26Å; Q105-R107 PolarHBondContact O-N 3.04Å
108L58.5Low66.1Low59 Ų5972.1 Ų72.131%0.30934%0.342SS..Hα-helixtrans-89.9-16.3-178.1-69.9169.1000113.1F18 A69 M104 Q105 E110 S111F18-L108 WeakPolarHBondContact CB-O 3.25Å; A69-L108 HydrophobicContact CB-CB 4.2Å; A69-L108 HydrophobicContact CB-CD1 3.74Å; M104-L108 HydrophobicContact CG-CD1 4.42Å; M104-L108 WeakPolarHBondContact O-CB 3.34Å; M104-L108 WeakPolarHBondContact O-CG 3.41Å; M104-L108 PolarHBondContact O-N 2.85Å; M104-L108 HydrophobicContact SD-CD1 4.42Å; Q105-L108 CarbonylContact O-C 3.58Å; Q105-L108 PolarHBondContact O-N 3.34Å; Q105-L108 VanDerWaalsContact O-N 3.1Å; L108-E110 PolarHBondContact O-N 2.71Å; L108-S111 WeakPolarHBondContact O-CB 3.47Å; L108-S111 PolarHBondContact O-N 3.42Å; L108-S111 PolarHBondContact O-OG 3.43Å
109Q58.1Low68Low60 Ų6069.5 Ų69.528%0.2833%0.328SS..THydrogen-bonded Turntrans-60.6-10.2-178.9-130.9160.4-18.900114.2F18 Q105 Y236F18-Q109 CarbonylContact O-C 3.48Å; F18-Q109 VanDerWaalsContact O-C 3.27Å; F18-Q109 WeakPolarHBondContact O-CA 3.42Å; Q105-Q109 WeakPolarHBondContact O-CB 3.47Å; Q105-Q109 PolarHBondContact O-N 3.36Å; Q109-Y236 WeakPolarHBondContact O-CD2 3.43Å
110E66Low69.8Low142 Ų14264.1 Ų64.166%0.66430%0.303SS*.THydrogen-bonded Turntrans-106.80.2176.8-58.9-179.4177.100112L108 Y236L108-E110 PolarHBondContact O-N 2.71Å; E110-Y236 HydrophobicContact CB-CE2 4.34Å; E110-Y236 HydrophobicContact CG-CE2 3.98Å
111S80.4Confident71.6Confident38 Ų3858.9 Ų58.927%0.26628%0.279SS..SBendtrans-89.6147.3-176.368.10000112.8H17 F18 L108H17-S111 WeakPolarHBondContact CA-O 3.32Å; F18-S111 WeakPolarHBondContact CD2-O 3.42Å; F18-S111 VanDerWaalsContact CD2-OG 3.25Å; F18-S111 WeakPolarHBondContact CD2-OG 2.82Å; F18-S111 PolarHBondContact N-O 2.84Å; L108-S111 WeakPolarHBondContact O-CB 3.47Å; L108-S111 PolarHBondContact O-N 3.42Å; L108-S111 PolarHBondContact O-OG 3.43Å
112L83.1Confident73.3Confident49 Ų4959.5 Ų59.526%0.25728%0.282SS..BIsolated β-bridgetrans-71.7143.6178.2-74165.1000111.9L15 H17 Y114L15-L112 HydrophobicContact CB-CD2 3.45Å; L15-L112 VanDerWaalsContact CB-CD2 3.45Å; L15-L112 HydrophobicContact CD1-CD1 4.23Å; L15-L112 HydrophobicContact CD1-CD2 3.77Å; L15-L112 HydrophobicContact CG-CD2 4.26Å; H17-L112 VanDerWaalsContact NE2-CD2 3.31Å; H17-L112 WeakPolarHBondContact NE2-CD2 3.22Å; L112-Y114 HydrophobicContact CB-CE2 3.79Å; L112-Y114 WeakPolarHBondContact O-CD2 3.44Å
113V85.5Confident74.8Confident0 Ų056.6 Ų56.60%026%0.262CS..PPolyproline II helixtrans-91.4120.9173.4-1770000109.2L16 F18 I67 I119 I161 V174L16-V113 HydrophobicContact CB-CB 4.25Å; L16-V113 HydrophobicContact CD2-CB 4.08Å; L16-V113 HydrophobicContact CD2-CG1 4.09Å; L16-V113 HydrophobicContact CD2-CG2 4.37Å; L16-V113 HydrophobicContact CG-CB 4.1Å; L16-V113 HydrophobicContact CG-CG2 4.11Å; L16-V113 PolarHBondContact O-N 3.35Å; F18-V113 HydrophobicContact CD1-CG2 4.03Å; F18-V113 HydrophobicContact CD2-CG2 3.77Å; F18-V113 HydrophobicContact CE1-CG2 4.08Å; F18-V113 HydrophobicContact CE2-CG2 3.83Å; F18-V113 HydrophobicContact CG-CG2 3.91Å; F18-V113 HydrophobicContact CZ-CG2 4Å; I67-V113 HydrophobicContact CG2-CG2 4.33Å; V113-I119 HydrophobicContact CG1-CG2 4.35Å; V113-I161 HydrophobicContact CG1-CD1 3.39Å; V113-V174 HydrophobicContact CG1-CG2 4.26Å; V113-V174 PolarHBondContact O-N 3.09Å
114Y88Confident76.2Confident92 Ų9253.3 Ų53.336%0.36125%0.25SS..BIsolated β-bridgetrans-104.9151.7176.8-60.6-86.4000111.1L112 G116 N117 G171 D172 P173L112-Y114 HydrophobicContact CB-CE2 3.79Å; L112-Y114 WeakPolarHBondContact O-CD2 3.44Å; Y114-G116 PolarHBondContact O-N 3.45Å; Y114-N117 PolarHBondContact N-ND2 3.23Å; Y114-N117 VanDerWaalsContact O-CB 3.25Å; Y114-N117 WeakPolarHBondContact O-CB 3.3Å; Y114-N117 PolarHBondContact O-N 3.19Å; Y114-G171 WeakPolarHBondContact CD1-O 3.23Å; Y114-D172 CarbonylContact C-O 3.49Å; Y114-D172 WeakPolarHBondContact CA-O 3.45Å; Y114-P173 HydrophobicContact CD1-CB 3.99Å; Y114-P173 HydrophobicContact CE1-CB 3.93Å
115Y86.2Confident77.7Confident2 Ų249.7 Ų49.71%0.00823%0.232CC..THydrogen-bonded Turntrans-58129.5168.6-74.5-70.1000110I161 P163 K168 Q169 I170 G171 D172 V174 D178 V180Y115-I161 HydrophobicContact CD1-CG2 3.8Å; Y115-I161 HydrophobicContact CE1-CG2 3.96Å; Y115-P163 HydrophobicContact CD1-CB 3.78Å; Y115-P163 HydrophobicContact CD1-CG 4.18Å; Y115-P163 HydrophobicContact CE1-CB 3.79Å; Y115-P163 HydrophobicContact CG-CB 4.18Å; Y115-P163 HydrophobicContact CG-CG 4.38Å; Y115-K168 HydrophobicContact CD2-CD 4.43Å; Y115-K168 HydrophobicContact CE2-CB 4.3Å; Y115-K168 HydrophobicContact CE2-CD 3.49Å; Y115-K168 VanDerWaalsContact CE2-CD 3.49Å; Y115-Q169 WeakPolarHBondContact CB-O 3.37Å; Y115-I170 CarbonylContact O-C 3.59Å; Y115-G171 PolarHBondContact O-N 3.25Å; Y115-D172 HydrophobicContact CD2-CB 4.02Å; Y115-D172 VanDerWaalsContact CD2-O 3.26Å; Y115-D172 WeakPolarHBondContact CD2-O 3.5Å; Y115-D172 PolarHBondContact N-O 3.44Å; Y115-V174 HydrophobicContact CD1-CG2 3.93Å; Y115-V174 HydrophobicContact CD2-CG2 3.96Å; Y115-V174 HydrophobicContact CE1-CG1 4.49Å; Y115-V174 HydrophobicContact CE1-CG2 3.93Å; Y115-V174 HydrophobicContact CE2-CB 4.38Å; Y115-V174 HydrophobicContact CE2-CG2 3.95Å; Y115-V174 HydrophobicContact CG-CG2 3.96Å; Y115-D178 WeakPolarHBondContact OH-CB 3Å; Y115-D178 PolarHBondContact OH-OD2 3Å; Y115-V180 HydrophobicContact CE1-CB 4.47Å; Y115-V180 HydrophobicContact CE1-CG1 3.73Å
116G83.2Confident78.8Confident26 Ų2648.9 Ų48.927%0.26823%0.228SC..THydrogen-bonded Turntrans96.5-12.9-172.400000114.7Y114 I161Y114-G116 PolarHBondContact O-N 3.45Å; G116-I161 PolarHBondContact N-O 2.77Å
117N88.3Confident79.9Confident52 Ų5244.2 Ų44.228%0.27822%0.217SC..  trans-65.6144.5173.9-76.23.5000111.1F18 Y114 I160 I161F18-N117 HydrophobicContact CZ-CB 4.33Å; Y114-N117 PolarHBondContact N-ND2 3.23Å; Y114-N117 VanDerWaalsContact O-CB 3.25Å; Y114-N117 WeakPolarHBondContact O-CB 3.3Å; Y114-N117 PolarHBondContact O-N 3.19Å; N117-I160 WeakPolarHBondContact O-CA 3.46Å; N117-I161 PolarHBondContact O-N 3.38Å
118I84.5Confident81.1Confident51 Ų5135.2 Ų35.226%0.26218%0.183SC..EExtended strand (participates in β ladder)trans-87.8124.3172-59.3169000108.3M70 W158 F159 I160M70-I118 HydrophobicContact CB-CB 4.03Å; M70-I118 HydrophobicContact CB-CG2 3.87Å; M70-I118 HydrophobicContact CG-CB 4.38Å; M70-I118 HydrophobicContact CG-CG2 3.95Å; M70-I118 PolarHBondContact N-O 2.81Å; M70-I118 HydrophobicContact SD-CB 4.41Å; M70-I118 HydrophobicContact SD-CD1 3.94Å; M70-I118 HydrophobicContact SD-CG2 4.38Å; I118-W158 HydrophobicContact CG2-CB 3.62Å; I118-W158 HydrophobicContact CG2-CD2 4.5Å; I118-W158 HydrophobicContact CG2-CG 3.87Å; I118-F159 CarbonylContact C-O 3.58Å; I118-F159 WeakPolarHBondContact CA-O 2.95Å; I118-I160 HydrophobicContact CG1-CD1 4.46Å; I118-I160 HydrophobicContact CG1-CG1 3.75Å
119I87.5Confident82.3Confident0 Ų032.5 Ų32.50%017%0.169CC..EExtended strand (participates in β ladder)trans-121.9159.8-179.169.1157.2000111.2F18 I67 L68 V113 L121 F159 I161 L182F18-I119 HydrophobicContact CE1-CG2 3.77Å; F18-I119 HydrophobicContact CZ-CG2 4.26Å; I67-I119 HydrophobicContact CG2-CB 4.13Å; I67-I119 HydrophobicContact CG2-CD1 4.21Å; I67-I119 HydrophobicContact CG2-CG2 4.02Å; L68-I119 CarbonylContact O-C 3.56Å; L68-I119 VanDerWaalsContact O-CA 3.31Å; L68-I119 WeakPolarHBondContact O-CA 3.32Å; V113-I119 HydrophobicContact CG1-CG2 4.35Å; I119-L121 HydrophobicContact CD1-CD2 3.72Å; I119-L121 HydrophobicContact CD1-CG 4.23Å; I119-F159 HydrophobicContact CG1-CB 4.12Å; I119-F159 VanDerWaalsContact CG1-O 3.32Å; I119-F159 WeakPolarHBondContact CG1-O 3.41Å; I119-F159 PolarHBondContact N-O 2.97Å; I119-F159 PolarHBondContact O-N 2.98Å; I119-I161 HydrophobicContact CD1-CD1 3.67Å; I119-I161 HydrophobicContact CD1-CG1 3.66Å; I119-I161 HydrophobicContact CG1-CD1 4.16Å; I119-I161 HydrophobicContact CG1-CG1 4Å; I119-I161 HydrophobicContact CG2-CD1 3.66Å; I119-I161 HydrophobicContact CG2-CG1 4.23Å; I119-L182 HydrophobicContact CD1-CD2 4.08Å
120Q87.3Confident83.6Confident2 Ų229.7 Ų29.71%0.00916%0.156CC..EExtended strand (participates in β ladder)trans-119.6145.4166.9-71.4174-36.300108.9L68 I129 S157L68-Q120 HydrophobicContact CB-CB 4.17Å; L68-Q120 PolarHBondContact N-O 3.38Å; L68-Q120 PolarHBondContact O-N 3.45Å; Q120-I129 HydrophobicContact CB-CG2 4.31Å; Q120-S157 PolarHBondContact NE2-OG 2.93Å
121L87.1Confident84.4Confident0 Ų024.6 Ų24.60%013%0.13CC..EExtended strand (participates in β ladder)trans-112.2109.2-179.3-63.7179000109.7F24 F65 I67 I119 I129 L130 L182F24-L121 HydrophobicContact CE2-CD1 3.97Å; F24-L121 HydrophobicContact CE2-CD2 3.73Å; F24-L121 HydrophobicContact CE2-CG 4.48Å; F24-L121 HydrophobicContact CZ-CD1 4.09Å; F24-L121 HydrophobicContact CZ-CD2 3.62Å; F65-L121 HydrophobicContact CD1-CB 4.27Å; I67-L121 HydrophobicContact CG1-CD2 4.32Å; I119-L121 HydrophobicContact CD1-CD2 3.72Å; I119-L121 HydrophobicContact CD1-CG 4.23Å; L121-I129 WeakPolarHBondContact O-CA 3.33Å; L121-L130 HydrophobicContact CB-CB 4.13Å; L121-L130 HydrophobicContact CD1-CD2 3.98Å; L121-L130 PolarHBondContact O-N 3.25Å; L121-L182 HydrophobicContact CD1-CD1 3.97Å
122L87Confident84.4Confident25 Ų2522.8 Ų22.813%0.13112%0.118CC..EExtended strand (participates in β ladder)trans-97.1118.6177.2175.170.4000109.7F65 F66 L68 N127 I129F65-L122 CarbonylContact C-O 3.59Å; F65-L122 VanDerWaalsContact CA-O 3.24Å; F65-L122 WeakPolarHBondContact CA-O 3.47Å; F66-L122 HydrophobicContact CB-CB 4.25Å; F66-L122 HydrophobicContact CD2-CD2 4.23Å; F66-L122 PolarHBondContact N-O 3.28Å; F66-L122 PolarHBondContact O-N 3.04Å; L68-L122 HydrophobicContact CD1-CB 3.75Å; L68-L122 HydrophobicContact CD1-CD2 4.01Å; L68-L122 HydrophobicContact CD1-CG 4.47Å; L68-L122 HydrophobicContact CG-CB 4.38Å; L122-N127 VanDerWaalsContact CD1-C 3.49Å; L122-I129 HydrophobicContact CD1-CG1 3.85Å
123H86.3Confident83.9Confident0 Ų023.2 Ų23.20%012%0.118CC..EExtended strand (participates in β ladder)trans-75.7127.1178.3-176.9-117.6000111.5M36 R61 D62 R64 F65 K125 S126 N127 K128 L149M36-H123 WeakPolarHBondContact CE-CE1 3.28Å; M36-H123 VanDerWaalsContact CE-ND1 3.35Å; M36-H123 WeakPolarHBondContact CE-ND1 3.41Å; M36-H123 PolarHBondContact SD-ND1 2.87Å; M36-H123 VanDerWaalsContact SD-ND1 3.38Å; R61-H123 PolarHBondContact O-NE2 2.84Å; D62-H123 PolarHBondContact O-NE2 3.24Å; R64-H123 PolarHBondContact O-CD2 2.94Å; R64-H123 VanDerWaalsContact O-CD2 3.27Å; F65-H123 HydrophobicContact CD1-CB 3.97Å; F65-H123 HydrophobicContact CE1-CB 3.74Å; F65-H123 AromaticContact CE1-CD2 3.68Å; F65-H123 AromaticContact CZ-CD2 3.7Å; H123-K125 PolarHBondContact O-N 3.13Å; H123-S126 PolarHBondContact ND1-N 2.79Å; H123-S126 PolarHBondContact ND1-OG 2.84Å; H123-N127 WeakPolarHBondContact O-CA 3.42Å; H123-N127 PolarHBondContact O-N 2.96Å; H123-K128 WeakPolarHBondContact CB-O 3.46Å; H123-K128 PolarHBondContact N-O 2.7Å; H123-L149 HydrophobicContact CB-CD2 4.09Å
124V82.8Confident83.1Confident34 Ų3429.1 Ų29.121%0.20614%0.143CC..THydrogen-bonded Turntrans-67.7-41.5-168.4175.60000113.1Q21 R64 F66Q21-V124 HydrophobicContact CG-CG2 4.16Å; R64-V124 HydrophobicContact CB-CB 4.14Å; R64-V124 HydrophobicContact CB-CG2 3.94Å; R64-V124 WeakPolarHBondContact O-CG2 3.42Å; R64-V124 PolarHBondContact O-N 2.79Å; F66-V124 HydrophobicContact CD2-CG2 3.63Å; F66-V124 HydrophobicContact CE2-CB 4.47Å; F66-V124 HydrophobicContact CE2-CG1 4.36Å; F66-V124 HydrophobicContact CE2-CG2 3.56Å; F66-V124 HydrophobicContact CG-CG2 4.39Å; F66-V124 HydrophobicContact CZ-CG2 4.26Å
125K81.9Confident81.8Confident10 Ų1029.1 Ų29.14%0.04315%0.147CC..THydrogen-bonded Turntrans-72.6-45.4-177.1-172.3-172175-176.90112.7M36 Q39 R61 D62 H123 D444 D448M36-K125 HydrophobicContact CE-CD 4.5Å; Q39-K125 PolarHBondContact NE2-O 3.5Å; R61-K125 HydrophobicContact CB-CB 4.25Å; D62-K125 WeakPolarHBondContact OD1-CD 3.42Å; D62-K125 WeakPolarHBondContact OD1-CE 3.28Å; D62-K125 IonicContact OD1-NZ 3.47Å; D62-K125 PolarHBondContact OD1-NZ 2.9Å; D62-K125 IonicContact OD2-NZ 3.58Å; D62-K125 PolarHBondContact OD2-NZ 3.2Å; H123-K125 PolarHBondContact O-N 3.13Å; K125-D444 HydrophobicContact CG-CB 4.35Å; K125-D448 VanDerWaalsContact CE-OD2 3.29Å; K125-D448 WeakPolarHBondContact CE-OD2 3.15Å; K125-D448 IonicContact NZ-OD1 3.5Å; K125-D448 PolarHBondContact NZ-OD1 3.49Å; K125-D448 VanDerWaalsContact NZ-OD1 3.14Å; K125-D448 IonicContact NZ-OD2 3.85Å; K125-D448 PolarHBondContact NZ-OD2 2.98Å
126S78.1Confident80.2Confident0 Ų035.7 Ų35.70%018%0.181CC..THydrogen-bonded Turntrans-87.9-17.3-177.554.30000114.3M36 H123 K128M36-S126 VanDerWaalsContact CE-CB 3.46Å; M36-S126 VanDerWaalsContact SD-CB 3.57Å; M36-S126 PolarHBondContact SD-OG 2.87Å; H123-S126 PolarHBondContact ND1-N 2.79Å; H123-S126 PolarHBondContact ND1-OG 2.84Å; S126-K128 PolarHBondContact O-N 2.74Å
127N80.1Confident78.6Confident79 Ų7936 Ų3642%0.42218%0.179SC..THydrogen-bonded Turntrans56.832.1-170.8-156.239.7000112.7L122 H123L122-N127 VanDerWaalsContact CD1-C 3.49Å; H123-N127 WeakPolarHBondContact O-CA 3.42Å; H123-N127 PolarHBondContact O-N 2.96Å
128K83.6Confident76.7Confident18 Ų1840.1 Ų40.18%0.07821%0.209CC..EExtended strand (participates in β ladder)trans-108147.3178.6-66.6176.2-178173.20110.3Q39 N42 H123 S126 L149 E151Q39-K128 PolarHBondContact O-NZ 3.31Å; N42-K128 PolarHBondContact OD1-NZ 3.19Å; H123-K128 WeakPolarHBondContact CB-O 3.46Å; H123-K128 PolarHBondContact N-O 2.7Å; S126-K128 PolarHBondContact O-N 2.74Å; K128-L149 HydrophobicContact CB-CB 3.89Å; K128-L149 HydrophobicContact CB-CD2 4.44Å; K128-L149 HydrophobicContact CD-CB 4.36Å; K128-E151 HydrophobicContact CG-CG 3.88Å
129I84.3Confident75Confident3 Ų345 Ų452%0.01523%0.231CC..EExtended strand (participates in β ladder)trans-95.8139.2-179.9-54.8-175.5000110.3Q120 L121 L122 L149 E150 Q153Q120-I129 HydrophobicContact CB-CG2 4.31Å; L121-I129 WeakPolarHBondContact O-CA 3.33Å; L122-I129 HydrophobicContact CD1-CG1 3.85Å; I129-L149 WeakPolarHBondContact O-CA 3.42Å; I129-E150 PolarHBondContact N-O 3.23Å; I129-E150 PolarHBondContact O-N 3.5Å; I129-Q153 HydrophobicContact CD1-CB 4.27Å; I129-Q153 HydrophobicContact CD1-CG 3.56Å
130L85.5Confident72.8Confident1 Ų149.8 Ų49.81%0.00525%0.252CS..EExtended strand (participates in β ladder)trans-69.4131.4175.2-17366000110.3P44 L121 F147 L149 S157 F159 L191P44-L130 HydrophobicContact CB-CD1 4.28Å; P44-L130 HydrophobicContact CG-CD1 3.89Å; L121-L130 HydrophobicContact CB-CB 4.13Å; L121-L130 HydrophobicContact CD1-CD2 3.98Å; L121-L130 PolarHBondContact O-N 3.25Å; L130-F147 HydrophobicContact CD1-CB 4.31Å; L130-L149 HydrophobicContact CB-CD2 4.05Å; L130-L149 HydrophobicContact CD1-CD2 4.23Å; L130-L149 HydrophobicContact CD1-CG 4.35Å; L130-S157 WeakPolarHBondContact O-CA 3.43Å; L130-F159 HydrophobicContact CB-CE2 4.13Å; L130-F159 HydrophobicContact CD2-CE1 4.37Å; L130-F159 HydrophobicContact CD2-CE2 3.94Å; L130-F159 HydrophobicContact CD2-CZ 3.73Å; L130-F159 HydrophobicContact CG-CE2 3.9Å; L130-F159 HydrophobicContact CG-CZ 3.81Å; L130-F159 WeakPolarHBondContact O-CE2 3.36Å; L130-L191 HydrophobicContact CD2-CD1 4.45Å; L130-L191 HydrophobicContact CD2-CD2 4.25Å
131R82.4Confident70.8Confident34 Ų3459.9 Ų59.913%0.12830%0.295CS..EExtended strand (participates in β ladder)trans-131.6147.5178.4-68.2-178.467168.611.8111.7F147 T148 E150 E156R131-F147 CarbonylContact O-C 3.43Å; R131-F147 VanDerWaalsContact O-CA 3.25Å; R131-F147 WeakPolarHBondContact O-CA 3.41Å; R131-T148 PolarHBondContact N-O 2.95Å; R131-T148 PolarHBondContact O-N 3.4Å; R131-E150 IonicContact CZ-OE2 3.39Å; R131-E150 IonicContact NE-OE2 2.68Å; R131-E150 IonicContact NH1-OE2 2.6Å; R131-E150 PolarHBondContact NH1-OE2 3.03Å; R131-E156 WeakPolarHBondContact CA-O 3.43Å; R131-E156 HydrophobicContact CB-CB 4.5Å; R131-E156 IonicContact CZ-OE2 2.73Å; R131-E156 IonicContact NE-OE2 3.87Å; R131-E156 PolarHBondContact NE-OE2 2.87Å; R131-E156 IonicContact NH2-OE2 2.79Å; R131-E156 PolarHBondContact NH2-OE2 3.01Å
132A79.6Confident68.7Low1 Ų164.4 Ų64.41%0.00832%0.32CS..EExtended strand (participates in β ladder)trans-109.6100.9173.500000110.1V145 F147 E156 F159 A184 A187A132-V145 HydrophobicContact CB-CG1 3.98Å; A132-F147 HydrophobicContact CB-CD1 3.79Å; A132-F147 HydrophobicContact CB-CE1 3.51Å; A132-F147 HydrophobicContact CB-CZ 4.43Å; A132-E156 PolarHBondContact N-O 3.36Å; A132-F159 HydrophobicContact CB-CZ 4.43Å; A132-A184 HydrophobicContact CB-CB 3.56Å; A132-A187 HydrophobicContact CB-CB 3.68Å
133K73Confident67Low57 Ų5765 Ų6525%0.24833%0.328CS..EExtended strand (participates in β ladder)trans-89131.8178.3-77.3-175.8174.8-177.60110.6V145 R146 E150 E156K133-V145 CarbonylContact O-C 3.55Å; K133-V145 WeakPolarHBondContact O-CA 3.47Å; K133-R146 PolarHBondContact N-O 2.97Å; K133-R146 PolarHBondContact O-N 3.49Å; K133-E150 WeakPolarHBondContact CE-OE2 3.43Å; K133-E150 IonicContact NZ-OE1 2.67Å; K133-E150 PolarHBondContact NZ-OE1 3.44Å; K133-E150 IonicContact NZ-OE2 3.33Å; K133-E150 PolarHBondContact NZ-OE2 3.34Å; K133-E156 WeakPolarHBondContact CG-OE2 3.34Å
134K69.5Low65.8Low124 Ų12466.3 Ų66.354%0.53934%0.338SS..EExtended strand (participates in β ladder)trans-94.2100.8174-172.3173.8-177.4175.70108.6A143K134-A143 HydrophobicContact CD-CB 4.02Å; K134-A143 HydrophobicContact CG-CB 3.66Å
135E60.3Low65.1Low92 Ų9266 Ų6643%0.4334%0.335SS..EExtended strand (participates in β ladder)trans-89.6120.4174.3-81.5179.217300109.3S137 S144E135-S137 PolarHBondContact O-N 3.08Å; E135-S144 PolarHBondContact N-O 3.03Å; E135-S144 PolarHBondContact O-N 2.86Å
136L51.7Low64.5Low140 Ų14070 Ų7073%0.73335%0.35SS*.EExtended strand (participates in β ladder)trans-77.7102.4164.9-79.8144.6000107.3A143L136-A143 HydrophobicContact CD2-CB 4.43Å
137S50.9Low64.5Low33 Ų3370.5 Ų70.523%0.23135%0.352CS..  trans-69.4127.2172.3-58.10000108.7E135 E139 F140E135-S137 PolarHBondContact O-N 3.08Å; S137-E139 PolarHBondContact O-N 3.47Å; S137-F140 PolarHBondContact O-N 2.88Å
138P48.5Very low64.4Low138 Ų13867.5 Ų67.590%0.89634%0.337SS*.THydrogen-bonded Turntrans-65.3-24.4-178.822.8-31.4000113.2
139E48.2Very low64Low155 Ų15566.7 Ų66.772%0.72433%0.333SS*.THydrogen-bonded Turntrans-79.4-20.2-179.6-65.6-179.7157.500113.8S137S137-E139 PolarHBondContact O-N 3.47Å
140F40.4Very low63.5Low99 Ų9968.1 Ų68.143%0.43434%0.34SS..  trans-129.4132.3-175-60.2-78000109.4S137 D142S137-F140 PolarHBondContact O-N 2.88Å; F140-D142 PolarHBondContact O-N 3.23Å
141K46.9Very low62.6Low214 Ų21470.8 Ų70.893%0.9335%0.352SS*.SBendtrans-64.3-3.8174.1-75.5-175.8175.9-179.50113.5
142D43.1Very low61.8Low96 Ų9676.8 Ų76.851%0.51338%0.376SS..SBendtrans-98.3128.7-177.6-59.6-32.5000111.2F140 S144F140-D142 PolarHBondContact O-N 3.23Å; D142-S144 PolarHBondContact O-N 3.11Å
143A50.8Low61.1Low37 Ų3779.6 Ų79.631%0.30639%0.389SS..EExtended strand (participates in β ladder)trans-78.9119.4174.300000109.9K134 L136K134-A143 HydrophobicContact CD-CB 4.02Å; K134-A143 HydrophobicContact CG-CB 3.66Å; L136-A143 HydrophobicContact CD2-CB 4.43Å
144S60Low61Low28 Ų2877.7 Ų77.720%0.19639%0.386CS..EExtended strand (participates in β ladder)trans-89.2143.3173.570.70000110E135 D142E135-S144 PolarHBondContact N-O 3.03Å; E135-S144 PolarHBondContact O-N 2.86Å; D142-S144 PolarHBondContact O-N 3.11Å
145V67.9Low61.2Low26 Ų2675.6 Ų75.616%0.15838%0.381CS..EExtended strand (participates in β ladder)trans-101.5128.6176.6-178.70000109A132 K133 F147 A187A132-V145 HydrophobicContact CB-CG1 3.98Å; K133-V145 CarbonylContact O-C 3.55Å; K133-V145 WeakPolarHBondContact O-CA 3.47Å; V145-F147 HydrophobicContact CG1-CZ 4.31Å; V145-A187 HydrophobicContact CB-CB 4.36Å; V145-A187 HydrophobicContact CG1-CB 3.58Å; V145-A187 HydrophobicContact CG2-CB 3.81Å
146R70.6Confident61.9Low95 Ų9573.7 Ų73.736%0.35837%0.372SS..EExtended strand (participates in β ladder)trans-117.5128.3176.3-165.2179.6-158.9156.413.5110.5K133 T148K133-R146 PolarHBondContact N-O 2.97Å; K133-R146 PolarHBondContact O-N 3.49Å; R146-T148 HydrophobicContact CG-CG2 4.35Å
147F78Confident63.4Low10 Ų1067 Ų674%0.04434%0.337CS..EExtended strand (participates in β ladder)trans-85.8131.6172.8-61.5-78.8000110.8P44 L130 R131 A132 V145 F159 A184 L191 Q195P44-F147 WeakPolarHBondContact CD-O 3.37Å; P44-F147 HydrophobicContact CG-CB 3.82Å; L130-F147 HydrophobicContact CD1-CB 4.31Å; R131-F147 CarbonylContact O-C 3.43Å; R131-F147 VanDerWaalsContact O-CA 3.25Å; R131-F147 WeakPolarHBondContact O-CA 3.41Å; A132-F147 HydrophobicContact CB-CD1 3.79Å; A132-F147 HydrophobicContact CB-CE1 3.51Å; A132-F147 HydrophobicContact CB-CZ 4.43Å; V145-F147 HydrophobicContact CG1-CZ 4.31Å; F147-F159 HydrophobicContact CD1-CE1 4.3Å; F147-F159 HydrophobicContact CD1-CZ 4.1Å; F147-F159 AromaticContact CE1-CE1 3.79Å; F147-F159 HydrophobicContact CE1-CE1 3.79Å; F147-F159 HydrophobicContact CE1-CZ 4.01Å; F147-A184 HydrophobicContact CE1-CB 4.36Å; F147-L191 HydrophobicContact CB-CD1 4.49Å; F147-L191 HydrophobicContact CD1-CD1 3.61Å; F147-L191 HydrophobicContact CD2-CD1 3.69Å; F147-L191 HydrophobicContact CE1-CD1 3.62Å; F147-L191 HydrophobicContact CE2-CD1 3.7Å; F147-L191 HydrophobicContact CG-CD1 3.65Å; F147-L191 HydrophobicContact CZ-CB 4.28Å; F147-L191 HydrophobicContact CZ-CD1 3.67Å; F147-Q195 HydrophobicContact CD2-CB 4.42Å; F147-Q195 HydrophobicContact CE2-CB 4.1Å; F147-Q195 VanDerWaalsContact CE2-OE1 3.27Å
148T76.6Confident64.9Low17 Ų1767.5 Ų67.510%0.10433%0.333CS..EExtended strand (participates in β ladder)trans-140.6150.5178.6540000110.4N42 R131 R146N42-T148 CarbonylContact O-C 3.55Å; N42-T148 VanDerWaalsContact O-CA 3.27Å; N42-T148 WeakPolarHBondContact O-CA 3.4Å; R131-T148 PolarHBondContact N-O 2.95Å; R131-T148 PolarHBondContact O-N 3.4Å; R146-T148 HydrophobicContact CG-CG2 4.35Å
149L75.8Confident66.7Low0 Ų060.9 Ų60.90%029%0.291CS..EExtended strand (participates in β ladder)trans-98.5120.1172.6-75.8162.4000109.1M36 N42 H123 K128 I129 L130M36-L149 HydrophobicContact CB-CD1 4.08Å; M36-L149 HydrophobicContact CG-CD1 3.78Å; M36-L149 HydrophobicContact SD-CD1 3.68Å; N42-L149 WeakPolarHBondContact CB-O 3.05Å; N42-L149 PolarHBondContact O-N 3.42Å; H123-L149 HydrophobicContact CB-CD2 4.09Å; K128-L149 HydrophobicContact CB-CB 3.89Å; K128-L149 HydrophobicContact CB-CD2 4.44Å; K128-L149 HydrophobicContact CD-CB 4.36Å; I129-L149 WeakPolarHBondContact O-CA 3.42Å; L130-L149 HydrophobicContact CB-CD2 4.05Å; L130-L149 HydrophobicContact CD1-CD2 4.23Å; L130-L149 HydrophobicContact CD1-CG 4.35Å
150E73.8Confident68.6Low34 Ų3455.3 Ų55.316%0.15927%0.265CS..EExtended strand (participates in β ladder)trans-135.1157.3179.2-61.4-171155.200111.1I129 R131 K133I129-E150 PolarHBondContact N-O 3.23Å; I129-E150 PolarHBondContact O-N 3.5Å; R131-E150 IonicContact CZ-OE2 3.39Å; R131-E150 IonicContact NE-OE2 2.68Å; R131-E150 IonicContact NH1-OE2 2.6Å; R131-E150 PolarHBondContact NH1-OE2 3.03Å; K133-E150 WeakPolarHBondContact CE-OE2 3.43Å; K133-E150 IonicContact NZ-OE1 2.67Å; K133-E150 PolarHBondContact NZ-OE1 3.44Å; K133-E150 IonicContact NZ-OE2 3.33Å; K133-E150 PolarHBondContact NZ-OE2 3.34Å
151E67.2Low70.8Confident56 Ų5650.6 Ų50.626%0.26225%0.245SC..SBendtrans-78.6-26.5179.1-62.8174.7-168.100112.4K128 Q153 R490K128-E151 HydrophobicContact CG-CG 3.88Å; E151-Q153 PolarHBondContact O-N 3.46Å; E151-R490 VanDerWaalsContact CD-CB 3.47Å; E151-R490 WeakPolarHBondContact OE1-CB 3.34Å; E151-R490 WeakPolarHBondContact OE2-CA 3.2Å; E151-R490 WeakPolarHBondContact OE2-CB 3.47Å
152Y65.4Low72.8Confident160 Ų16043.3 Ų43.363%0.62721%0.214SC*.  trans-69.1129.8179.2-77.8-80.6000111.6
153Q65.8Low74.8Confident60 Ų6040.3 Ų40.328%0.2820%0.2SC..  trans-93.2111.2174.7-39.4-160.25.800108.6Y73 I129 E151Y73-Q153 WeakPolarHBondContact CE2-O 3.38Å; I129-Q153 HydrophobicContact CD1-CB 4.27Å; I129-Q153 HydrophobicContact CD1-CG 3.56Å; E151-Q153 PolarHBondContact O-N 3.46Å
154G69.7Low76.3Confident17 Ų1740.6 Ų40.618%0.17520%0.2CC..  trans-141.9172.217500000111E156 S157G154-E156 PolarHBondContact O-N 2.97Å; G154-S157 VanDerWaalsContact O-CB 3.29Å; G154-S157 WeakPolarHBondContact O-CB 3.43Å; G154-S157 PolarHBondContact O-N 3.1Å; G154-S157 PolarHBondContact O-OG 3.42Å
155D73.1Confident77.2Confident81 Ų8144.2 Ų44.243%0.43321%0.21SC..G310 helixtrans-58.1-20.9-172.3-56.11.3000114.2S157 W158D155-S157 PolarHBondContact O-N 3.1Å; D155-W158 HydrophobicContact CB-CD2 4.28Å; D155-W158 HydrophobicContact CB-CE3 4.13Å; D155-W158 HydrophobicContact CB-CH2 3.85Å; D155-W158 HydrophobicContact CB-CZ2 4.04Å; D155-W158 HydrophobicContact CB-CZ3 3.91Å; D155-W158 WeakPolarHBondContact O-CB 3.35Å; D155-W158 PolarHBondContact O-N 3.36Å; D155-W158 WeakPolarHBondContact OD1-CH2 3.46Å; D155-W158 VanDerWaalsContact OD1-CZ2 3.24Å; D155-W158 WeakPolarHBondContact OD1-CZ2 3.31Å
156E76.8Confident77.7Confident51 Ų5153.4 Ų53.424%0.23825%0.247CC..G310 helixtrans-70.1-9.8173.3-65-178.5158.800114.3R131 A132 K133 G154 W158 R186R131-E156 WeakPolarHBondContact CA-O 3.43Å; R131-E156 HydrophobicContact CB-CB 4.5Å; R131-E156 IonicContact CZ-OE2 2.73Å; R131-E156 IonicContact NE-OE2 3.87Å; R131-E156 PolarHBondContact NE-OE2 2.87Å; R131-E156 IonicContact NH2-OE2 2.79Å; R131-E156 PolarHBondContact NH2-OE2 3.01Å; A132-E156 PolarHBondContact N-O 3.36Å; K133-E156 WeakPolarHBondContact CG-OE2 3.34Å; G154-E156 PolarHBondContact O-N 2.97Å; E156-W158 VanDerWaalsContact C-N 3.34Å; E156-R186 HydrophobicContact CG-CG 4.32Å
157S81.8Confident78.1Confident0 Ų055.6 Ų55.60%026%0.261CS..G310 helixtrans-86.9-2.5176.364.60000113.8Q120 L130 G154 D155 F159Q120-S157 PolarHBondContact NE2-OG 2.93Å; L130-S157 WeakPolarHBondContact O-CA 3.43Å; G154-S157 VanDerWaalsContact O-CB 3.29Å; G154-S157 WeakPolarHBondContact O-CB 3.43Å; G154-S157 PolarHBondContact O-N 3.1Å; G154-S157 PolarHBondContact O-OG 3.42Å; D155-S157 PolarHBondContact O-N 3.1Å; S157-F159 VanDerWaalsContact O-CD2 3.26Å; S157-F159 WeakPolarHBondContact O-CD2 3.25Å
158W82.6Confident78.4Confident43 Ų4356.9 Ų56.916%0.16327%0.267CS..  trans-84.7118.7-173.6-64.1-10.6000112.1M70 I118 D155 E156 C185M70-W158 HydrophobicContact CE-CD2 3.89Å; M70-W158 HydrophobicContact CE-CE3 3.83Å; M70-W158 HydrophobicContact CE-CH2 3.27Å; M70-W158 HydrophobicContact CE-CZ2 3.29Å; M70-W158 HydrophobicContact CE-CZ3 3.54Å; M70-W158 HydrophobicContact CG-CD2 4.39Å; M70-W158 HydrophobicContact CG-CZ2 4.44Å; I118-W158 HydrophobicContact CG2-CB 3.62Å; I118-W158 HydrophobicContact CG2-CD2 4.5Å; I118-W158 HydrophobicContact CG2-CG 3.87Å; D155-W158 HydrophobicContact CB-CD2 4.28Å; D155-W158 HydrophobicContact CB-CE3 4.13Å; D155-W158 HydrophobicContact CB-CH2 3.85Å; D155-W158 HydrophobicContact CB-CZ2 4.04Å; D155-W158 HydrophobicContact CB-CZ3 3.91Å; D155-W158 WeakPolarHBondContact O-CB 3.35Å; D155-W158 PolarHBondContact O-N 3.36Å; D155-W158 WeakPolarHBondContact OD1-CH2 3.46Å; D155-W158 VanDerWaalsContact OD1-CZ2 3.24Å; D155-W158 WeakPolarHBondContact OD1-CZ2 3.31Å; E156-W158 VanDerWaalsContact C-N 3.34Å; W158-C185 HydrophobicContact CB-CB 4.09Å; W158-C185 PolarHBondContact O-N 3.17Å; W158-C185 PolarHBondContact O-SG 3.06Å
159F87.3Confident78.7Confident0 Ų062.6 Ų62.60%029%0.292CS..EExtended strand (participates in β ladder)trans-115.6132.5174.6-67.6-90.4000110.6I118 I119 L130 A132 F147 S157 L182 F183 A184I118-F159 CarbonylContact C-O 3.58Å; I118-F159 WeakPolarHBondContact CA-O 2.95Å; I119-F159 HydrophobicContact CG1-CB 4.12Å; I119-F159 VanDerWaalsContact CG1-O 3.32Å; I119-F159 WeakPolarHBondContact CG1-O 3.41Å; I119-F159 PolarHBondContact N-O 2.97Å; I119-F159 PolarHBondContact O-N 2.98Å; L130-F159 HydrophobicContact CB-CE2 4.13Å; L130-F159 HydrophobicContact CD2-CE1 4.37Å; L130-F159 HydrophobicContact CD2-CE2 3.94Å; L130-F159 HydrophobicContact CD2-CZ 3.73Å; L130-F159 HydrophobicContact CG-CE2 3.9Å; L130-F159 HydrophobicContact CG-CZ 3.81Å; L130-F159 WeakPolarHBondContact O-CE2 3.36Å; A132-F159 HydrophobicContact CB-CZ 4.43Å; F147-F159 HydrophobicContact CD1-CE1 4.3Å; F147-F159 HydrophobicContact CD1-CZ 4.1Å; F147-F159 AromaticContact CE1-CE1 3.79Å; F147-F159 HydrophobicContact CE1-CE1 3.79Å; F147-F159 HydrophobicContact CE1-CZ 4.01Å; S157-F159 VanDerWaalsContact O-CD2 3.26Å; S157-F159 WeakPolarHBondContact O-CD2 3.25Å; F159-L182 HydrophobicContact CD1-CB 4.29Å; F159-F183 CarbonylContact C-O 3.54Å; F159-F183 VanDerWaalsContact CA-O 3.29Å; F159-F183 WeakPolarHBondContact CA-O 3.34Å; F159-A184 HydrophobicContact CD1-CB 4.08Å; F159-A184 HydrophobicContact CE1-CB 3.79Å; F159-A184 HydrophobicContact CZ-CB 4.48Å
160I87.4Confident79.1Confident37 Ų3768.7 Ų68.719%0.1932%0.324CS..EExtended strand (participates in β ladder)trans-93128.1171.1-66.8157000108.5N117 I118 Q162 F183 C185N117-I160 WeakPolarHBondContact O-CA 3.46Å; I118-I160 HydrophobicContact CG1-CD1 4.46Å; I118-I160 HydrophobicContact CG1-CG1 3.75Å; I160-Q162 HydrophobicContact CG2-CG 3.92Å; I160-Q162 PolarHBondContact O-N 3.36Å; I160-F183 HydrophobicContact CB-CB 4.46Å; I160-F183 PolarHBondContact N-O 2.93Å; I160-F183 PolarHBondContact O-N 2.78Å; I160-C185 WeakPolarHBondContact CD1-SG 3.35Å; I160-C185 WeakPolarHBondContact CG1-SG 3.27Å
161I86.6Confident79.4Confident0 Ų069.2 Ų69.20%034%0.338CS..EExtended strand (participates in β ladder)trans-78.5115.2170.4-65.7163.8000108.9V113 Y115 G116 N117 I119 V174 V180 L182V113-I161 HydrophobicContact CG1-CD1 3.39Å; Y115-I161 HydrophobicContact CD1-CG2 3.8Å; Y115-I161 HydrophobicContact CE1-CG2 3.96Å; G116-I161 PolarHBondContact N-O 2.77Å; N117-I161 PolarHBondContact O-N 3.38Å; I119-I161 HydrophobicContact CD1-CD1 3.67Å; I119-I161 HydrophobicContact CD1-CG1 3.66Å; I119-I161 HydrophobicContact CG1-CD1 4.16Å; I119-I161 HydrophobicContact CG1-CG1 4Å; I119-I161 HydrophobicContact CG2-CD1 3.66Å; I119-I161 HydrophobicContact CG2-CG1 4.23Å; I161-V174 HydrophobicContact CG2-CG2 3.96Å; I161-V180 HydrophobicContact CG2-CB 3.95Å; I161-V180 HydrophobicContact CG2-CG1 3.93Å; I161-V180 HydrophobicContact CG2-CG2 4.35Å; I161-L182 HydrophobicContact CG1-CD2 3.83Å
162Q87.9Confident80.4Confident62 Ų6269.6 Ų69.629%0.2934%0.342SS..EExtended strand (participates in β ladder)trans-111.3146.2176.6-68.8179.9-26.300111.1I160 V180 T181I160-Q162 HydrophobicContact CG2-CG 3.92Å; I160-Q162 PolarHBondContact O-N 3.36Å; Q162-V180 WeakPolarHBondContact O-CA 3.3Å; Q162-T181 WeakPolarHBondContact CB-OG1 3.25Å; Q162-T181 PolarHBondContact N-O 3.08Å; Q162-T181 PolarHBondContact O-N 3.2Å; Q162-T181 PolarHBondContact O-OG1 3.47Å
163P86.9Confident81.4Confident32 Ų3264.1 Ų64.121%0.20833%0.326CS..EExtended strand (participates in β ladder)trans-72.8133.7176.828.2-30.9000110.5Y115 K168Y115-P163 HydrophobicContact CD1-CB 3.78Å; Y115-P163 HydrophobicContact CD1-CG 4.18Å; Y115-P163 HydrophobicContact CE1-CB 3.79Å; Y115-P163 HydrophobicContact CG-CB 4.18Å; Y115-P163 HydrophobicContact CG-CG 4.38Å; P163-K168 HydrophobicContact CB-CB 3.67Å; P163-K168 HydrophobicContact CG-CB 4.46Å; P163-K168 WeakPolarHBondContact CG-O 2.99Å
164S80.3Confident82.4Confident44 Ų4461.3 Ų61.331%0.30831%0.313SS..SBendtrans-79-25.3172.866.60000112.7K179S164-K179 WeakPolarHBondContact CB-O 3.27Å; S164-K179 PolarHBondContact N-O 2.96Å; S164-K179 VanDerWaalsContact OG-C 3.29Å; S164-K179 WeakPolarHBondContact OG-CB 3.47Å; S164-K179 PolarHBondContact OG-O 3.35Å
165Y79.9Confident83.2Confident104 Ų10461.9 Ų61.941%0.40831%0.313SS..SBendtrans-96.5134.7-178.8-64.5-65.2000111.8H167 K168 K179Y165-H167 VanDerWaalsContact CB-CE1 3.46Å; Y165-H167 WeakPolarHBondContact CB-CE1 3.24Å; Y165-H167 AromaticContact CG-CE1 3.8Å; Y165-H167 PolarHBondContact O-N 3.16Å; Y165-H167 VanDerWaalsContact O-N 3.1Å; Y165-K168 PolarHBondContact O-N 3.32Å; Y165-K168 VanDerWaalsContact O-N 3.16Å; Y165-K179 HydrophobicContact CE2-CB 3.98Å; Y165-K179 HydrophobicContact CE2-CG 4.36Å
166K78.7Confident83.7Confident218 Ų21859.3 Ų59.395%0.94830%0.299SS*.THydrogen-bonded Turntrans-61.8-19.5-179.2-64.2-175.6179-179.20115.3
167H79Confident83.9Confident141 Ų14158.1 Ų58.165%0.65330%0.3SS*.THydrogen-bonded Turntrans-86.2-11.3-179.367.8-97.7000113.5Y165Y165-H167 VanDerWaalsContact CB-CE1 3.46Å; Y165-H167 WeakPolarHBondContact CB-CE1 3.24Å; Y165-H167 AromaticContact CG-CE1 3.8Å; Y165-H167 PolarHBondContact O-N 3.16Å; Y165-H167 VanDerWaalsContact O-N 3.1Å
168K83.6Confident84.1Confident37 Ų3759.2 Ų59.216%0.16131%0.306CS..  trans-97.2138.5172.1-62.8-147.5-177.2-164.40109.6Y115 P163 Y165 D178Y115-K168 HydrophobicContact CD2-CD 4.43Å; Y115-K168 HydrophobicContact CE2-CB 4.3Å; Y115-K168 HydrophobicContact CE2-CD 3.49Å; Y115-K168 VanDerWaalsContact CE2-CD 3.49Å; P163-K168 HydrophobicContact CB-CB 3.67Å; P163-K168 HydrophobicContact CG-CB 4.46Å; P163-K168 WeakPolarHBondContact CG-O 2.99Å; Y165-K168 PolarHBondContact O-N 3.32Å; Y165-K168 VanDerWaalsContact O-N 3.16Å; K168-D178 IonicContact NZ-OD1 2.84Å; K168-D178 PolarHBondContact NZ-OD1 3.03Å; K168-D178 IonicContact NZ-OD2 2.57Å; K168-D178 PolarHBondContact NZ-OD2 3.34Å
169Q83.1Confident84.3Confident137 Ų13759.6 Ų59.664%0.6431%0.309SS*.  trans-114.4161.5-177.9-62-175.518.600111.3Y115 G171 D172Y115-Q169 WeakPolarHBondContact CB-O 3.37Å; Q169-G171 PolarHBondContact O-N 2.96Å; Q169-D172 PolarHBondContact N-OD2 2.9Å; Q169-D172 WeakPolarHBondContact O-CB 3.2Å; Q169-D172 PolarHBondContact O-N 2.85Å
170I83.3Confident84.3Confident128 Ų12859.6 Ų59.666%0.65631%0.309SS*.THydrogen-bonded Turntrans-61.2128.3169.9-68.3163.2000108Y115Y115-I170 CarbonylContact O-C 3.59Å
171G81.9Confident84.2Confident45 Ų4558.5 Ų58.546%0.46430%0.304SS..THydrogen-bonded Turntrans103.3-15.3-17400000114.7Y114 Y115 Q169Y114-G171 WeakPolarHBondContact CD1-O 3.23Å; Y115-G171 PolarHBondContact O-N 3.25Å; Q169-G171 PolarHBondContact O-N 2.96Å
172D87.5Confident84.2Confident65 Ų6558.5 Ų58.535%0.34830%0.304SS..SBendtrans-73145.2172.8-67.2-26.9000110.4Y114 Y115 Q169Y114-D172 CarbonylContact C-O 3.49Å; Y114-D172 WeakPolarHBondContact CA-O 3.45Å; Y115-D172 HydrophobicContact CD2-CB 4.02Å; Y115-D172 VanDerWaalsContact CD2-O 3.26Å; Y115-D172 WeakPolarHBondContact CD2-O 3.5Å; Y115-D172 PolarHBondContact N-O 3.44Å; Q169-D172 PolarHBondContact N-OD2 2.9Å; Q169-D172 WeakPolarHBondContact O-CB 3.2Å; Q169-D172 PolarHBondContact O-N 2.85Å
173P86.2Confident84Confident45 Ų4558.2 Ų58.229%0.29230%0.302SS..BIsolated β-bridgetrans-68.8139175.629.2-34.3000110.5L15 Y114 V175L15-P173 HydrophobicContact CD1-CB 4.27Å; L15-P173 HydrophobicContact CD2-CB 4.11Å; L15-P173 HydrophobicContact CD2-CG 4.25Å; Y114-P173 HydrophobicContact CD1-CB 3.99Å; Y114-P173 HydrophobicContact CE1-CB 3.93Å; P173-V175 PolarHBondContact O-N 2.81Å
174V86.4Confident84Confident0 Ų056.8 Ų56.80%029%0.293CS..PPolyproline II helixtrans-76.4125.1177.7-176.50000108.8L16 V113 Y115 I161 V180 I230L16-V174 HydrophobicContact CB-CB 4.12Å; L16-V174 HydrophobicContact CB-CG1 4.31Å; L16-V174 WeakPolarHBondContact CB-O 3.04Å; L16-V174 HydrophobicContact CD2-CB 4.08Å; L16-V174 HydrophobicContact CD2-CG1 3.82Å; L16-V174 PolarHBondContact N-O 2.7Å; V113-V174 HydrophobicContact CG1-CG2 4.26Å; V113-V174 PolarHBondContact O-N 3.09Å; Y115-V174 HydrophobicContact CD1-CG2 3.93Å; Y115-V174 HydrophobicContact CD2-CG2 3.96Å; Y115-V174 HydrophobicContact CE1-CG1 4.49Å; Y115-V174 HydrophobicContact CE1-CG2 3.93Å; Y115-V174 HydrophobicContact CE2-CB 4.38Å; Y115-V174 HydrophobicContact CE2-CG2 3.95Å; Y115-V174 HydrophobicContact CG-CG2 3.96Å; I161-V174 HydrophobicContact CG2-CG2 3.96Å; V174-V180 HydrophobicContact CG1-CG1 4.21Å; V174-I230 HydrophobicContact CG1-CD1 4.19Å
175V86.3Confident84Confident30 Ų3056.5 Ų56.518%0.18229%0.291CS..BIsolated β-bridgetrans-92.6140178.6176.60000109V13 L15 P173 G177 D178V13-V175 HydrophobicContact CG1-CB 4.18Å; V13-V175 HydrophobicContact CG1-CG1 3.31Å; V13-V175 HydrophobicContact CG1-CG2 3.76Å; L15-V175 HydrophobicContact CD2-CG2 3.88Å; P173-V175 PolarHBondContact O-N 2.81Å; V175-G177 PolarHBondContact O-N 3.08Å; V175-D178 WeakPolarHBondContact CA-OD2 3.44Å; V175-D178 VanDerWaalsContact CB-OD2 3.25Å; V175-D178 WeakPolarHBondContact CB-OD2 3.44Å; V175-D178 PolarHBondContact N-OD2 3.15Å; V175-D178 WeakPolarHBondContact O-CB 3.28Å; V175-D178 PolarHBondContact O-N 3.38Å; V175-D178 VanDerWaalsContact O-N 3.07Å
176I83.3Confident83.9Confident27 Ų2760.6 Ų60.614%0.13831%0.305CS..THydrogen-bonded Turntrans-64.2131.8176.1-67.6157.8000109.8E14 L16 L232E14-I176 HydrophobicContact CB-CD1 3.72Å; E14-I176 PolarHBondContact O-N 3.33Å; L16-I176 HydrophobicContact CD1-CG1 4.41Å; I176-L232 HydrophobicContact CD1-CB 3.82Å; I176-L232 HydrophobicContact CD1-CD1 4.38Å; I176-L232 HydrophobicContact CD1-CD2 3.7Å; I176-L232 HydrophobicContact CD1-CG 4.17Å; I176-L232 HydrophobicContact CG1-CB 4.16Å; I176-L232 HydrophobicContact CG2-CB 3.7Å
177G81.2Confident83.7Confident25 Ų2550.9 Ų50.926%0.25827%0.265SS..THydrogen-bonded Turntrans92.4-5.3-173.400000114.2V175 Q229 I230V175-G177 PolarHBondContact O-N 3.08Å; G177-Q229 WeakPolarHBondContact O-CG 3.26Å; G177-Q229 PolarHBondContact O-NE2 3.43Å; G177-I230 WeakPolarHBondContact CA-O 3.3Å; G177-I230 PolarHBondContact N-O 3.09Å
178D86.8Confident83.4Confident23 Ų2346.4 Ų46.412%0.12326%0.257CS..  trans-65.2151.5173.1-78.4-28.6000112.5Y115 K168 V175 V180 Q229 I230Y115-D178 WeakPolarHBondContact OH-CB 3Å; Y115-D178 PolarHBondContact OH-OD2 3Å; K168-D178 IonicContact NZ-OD1 2.84Å; K168-D178 PolarHBondContact NZ-OD1 3.03Å; K168-D178 IonicContact NZ-OD2 2.57Å; K168-D178 PolarHBondContact NZ-OD2 3.34Å; V175-D178 WeakPolarHBondContact CA-OD2 3.44Å; V175-D178 VanDerWaalsContact CB-OD2 3.25Å; V175-D178 WeakPolarHBondContact CB-OD2 3.44Å; V175-D178 PolarHBondContact N-OD2 3.15Å; V175-D178 WeakPolarHBondContact O-CB 3.28Å; V175-D178 PolarHBondContact O-N 3.38Å; V175-D178 VanDerWaalsContact O-N 3.07Å; D178-V180 HydrophobicContact CB-CG1 4.44Å; D178-Q229 WeakPolarHBondContact O-CA 3.38Å; D178-I230 PolarHBondContact O-N 3.15Å; D178-I230 VanDerWaalsContact O-N 3.14Å
179K85.7Confident83.2Confident51 Ų5145.7 Ų45.722%0.22226%0.257CS..EExtended strand (participates in β ladder)trans-89123.8167.6-65.4-169.2-176.7-171.30110.6S164 Y165 W228S164-K179 WeakPolarHBondContact CB-O 3.27Å; S164-K179 PolarHBondContact N-O 2.96Å; S164-K179 VanDerWaalsContact OG-C 3.29Å; S164-K179 WeakPolarHBondContact OG-CB 3.47Å; S164-K179 PolarHBondContact OG-O 3.35Å; Y165-K179 HydrophobicContact CE2-CB 3.98Å; Y165-K179 HydrophobicContact CE2-CG 4.36Å; K179-W228 CarbonylContact C-O 3.54Å; K179-W228 WeakPolarHBondContact CA-O 3.47Å
180V87.9Confident83.1Confident0 Ų039.4 Ų39.40%023%0.228CC..EExtended strand (participates in β ladder)trans-125160.7-179.6-49.50000111.4Y115 I161 Q162 V174 D178 L182 W228 I230Y115-V180 HydrophobicContact CE1-CB 4.47Å; Y115-V180 HydrophobicContact CE1-CG1 3.73Å; I161-V180 HydrophobicContact CG2-CB 3.95Å; I161-V180 HydrophobicContact CG2-CG1 3.93Å; I161-V180 HydrophobicContact CG2-CG2 4.35Å; Q162-V180 WeakPolarHBondContact O-CA 3.3Å; V174-V180 HydrophobicContact CG1-CG1 4.21Å; D178-V180 HydrophobicContact CB-CG1 4.44Å; V180-L182 HydrophobicContact CG2-CD2 4.44Å; V180-L182 HydrophobicContact CG2-CG 4.48Å; V180-W228 HydrophobicContact CG2-CB 4.42Å; V180-W228 PolarHBondContact N-O 3.25Å; V180-W228 PolarHBondContact O-N 2.77Å; V180-I230 HydrophobicContact CB-CD1 4.48Å; V180-I230 HydrophobicContact CG1-CD1 3.92Å; V180-I230 HydrophobicContact CG1-CG1 4.25Å; V180-I230 HydrophobicContact CG2-CD1 3.72Å; V180-I230 HydrophobicContact CG2-CG1 3.78Å
181T86Confident82.9Confident14 Ų1433.3 Ų33.39%0.08620%0.197CC..EExtended strand (participates in β ladder)trans-112.4132.1166.151.20000108.6Q162 N225Q162-T181 WeakPolarHBondContact CB-OG1 3.25Å; Q162-T181 PolarHBondContact N-O 3.08Å; Q162-T181 PolarHBondContact O-N 3.2Å; Q162-T181 PolarHBondContact O-OG1 3.47Å; T181-N225 HydrophobicContact CG2-CB 4.13Å
182L86.1Confident82.7Confident1 Ų132.1 Ų32.11%0.00518%0.18CC..EExtended strand (participates in β ladder)trans-97.8111.3179.1-66.8171.5000108.9F24 I119 L121 F159 I161 V180 A190 L191F24-L182 HydrophobicContact CD1-CD1 4.17Å; F24-L182 HydrophobicContact CE1-CD1 3.95Å; F24-L182 HydrophobicContact CZ-CD1 4.38Å; I119-L182 HydrophobicContact CD1-CD2 4.08Å; L121-L182 HydrophobicContact CD1-CD1 3.97Å; F159-L182 HydrophobicContact CD1-CB 4.29Å; I161-L182 HydrophobicContact CG1-CD2 3.83Å; V180-L182 HydrophobicContact CG2-CD2 4.44Å; V180-L182 HydrophobicContact CG2-CG 4.48Å; L182-A190 CarbonylContact O-C 3.22Å; L182-A190 WeakPolarHBondContact O-CA 3.31Å; L182-L191 HydrophobicContact CB-CB 4.1Å; L182-L191 HydrophobicContact CB-CD2 4.5Å; L182-L191 HydrophobicContact CD1-CD2 3.91Å; L182-L191 PolarHBondContact O-N 3.39Å
183F84.7Confident81.8Confident56 Ų5629.2 Ų29.225%0.24617%0.165CC..EExtended strand (participates in β ladder)trans-100.7119.1-177.4-174.6-93.4000111.3F159 I160 C185 G188F159-F183 CarbonylContact C-O 3.54Å; F159-F183 VanDerWaalsContact CA-O 3.29Å; F159-F183 WeakPolarHBondContact CA-O 3.34Å; I160-F183 HydrophobicContact CB-CB 4.46Å; I160-F183 PolarHBondContact N-O 2.93Å; I160-F183 PolarHBondContact O-N 2.78Å; F183-C185 PolarHBondContact O-N 2.94Å; F183-G188 WeakPolarHBondContact CE2-O 3.33Å; F183-G188 WeakPolarHBondContact CZ-O 3.38Å
184A85.2Confident80.9Confident1 Ų133.6 Ų33.61%0.00818%0.179CC..EExtended strand (participates in β ladder)trans-74.9113.7177.400000110.4A132 F147 F159 R186 A187 G188 C189A132-A184 HydrophobicContact CB-CB 3.56Å; F147-A184 HydrophobicContact CE1-CB 4.36Å; F159-A184 HydrophobicContact CD1-CB 4.08Å; F159-A184 HydrophobicContact CE1-CB 3.79Å; F159-A184 HydrophobicContact CZ-CB 4.48Å; A184-R186 PolarHBondContact O-N 3.45Å; A184-A187 HydrophobicContact CB-CB 3.93Å; A184-G188 PolarHBondContact O-N 3.37Å; A184-C189 WeakPolarHBondContact CB-O 3.31Å; A184-C189 PolarHBondContact N-O 3.14Å
185C81.3Confident79.8Confident39 Ų3936.9 Ų36.926%0.26419%0.194SC..THydrogen-bonded Turntrans-57.6-49.2-170.5-57.30000112.5W158 I160 F183W158-C185 HydrophobicContact CB-CB 4.09Å; W158-C185 PolarHBondContact O-N 3.17Å; W158-C185 PolarHBondContact O-SG 3.06Å; I160-C185 WeakPolarHBondContact CD1-SG 3.35Å; I160-C185 WeakPolarHBondContact CG1-SG 3.27Å; F183-C185 PolarHBondContact O-N 2.94Å
186R78.1Confident78.5Confident190 Ų19036.5 Ų36.572%0.71719%0.191SC*.THydrogen-bonded Turntrans-80.9-38.3-173.6-172.459.4174.4169.6-1.2112.9E156 A184 G188E156-R186 HydrophobicContact CG-CG 4.32Å; A184-R186 PolarHBondContact O-N 3.45Å; R186-G188 VanDerWaalsContact C-N 3.29Å
187A74.3Confident77.3Confident13 Ų1338.6 Ų38.611%0.10720%0.203CC..THydrogen-bonded Turntrans-73.8-24.7179.500000112.2A132 V145 A184 C189A132-A187 HydrophobicContact CB-CB 3.68Å; V145-A187 HydrophobicContact CB-CB 4.36Å; V145-A187 HydrophobicContact CG1-CB 3.58Å; V145-A187 HydrophobicContact CG2-CB 3.81Å; A184-A187 HydrophobicContact CB-CB 3.93Å; A187-C189 VanDerWaalsContact C-N 3.32Å
188G73.3Confident75.7Confident47 Ų4740.5 Ų40.549%0.48521%0.212SC..THydrogen-bonded Turntrans74.819.9178.100000113.7F183 A184 R186F183-G188 WeakPolarHBondContact CE2-O 3.33Å; F183-G188 WeakPolarHBondContact CZ-O 3.38Å; A184-G188 PolarHBondContact O-N 3.37Å; R186-G188 VanDerWaalsContact C-N 3.29Å
189C78.7Confident73.5Confident22 Ų2244.7 Ų44.715%0.14923%0.234CC..EExtended strand (participates in β ladder)trans-131.9154.7-179.575.40000112.1A184 A187A184-C189 WeakPolarHBondContact CB-O 3.31Å; A184-C189 PolarHBondContact N-O 3.14Å; A187-C189 VanDerWaalsContact C-N 3.32Å
190A80.4Confident71.3Confident5 Ų546.2 Ų46.24%0.04125%0.25CC..EExtended strand (participates in β ladder)trans-75.7149.2170.800000111.2L182 N192 Q195 N225L182-A190 CarbonylContact O-C 3.22Å; L182-A190 WeakPolarHBondContact O-CA 3.31Å; A190-N192 PolarHBondContact O-N 3.08Å; A190-Q195 PolarHBondContact O-OE1 3.41Å; A190-Q195 VanDerWaalsContact O-OE1 3.12Å; A190-N225 HydrophobicContact CB-CB 4.41Å
191L80.1Confident68.7Low0 Ų055.4 Ų55.40%029%0.289CS..  trans-68.694.8171.8-179.471.2000109.3L34 L130 F147 L182 L196 T226 W228L34-L191 HydrophobicContact CD2-CD2 4.36Å; L130-L191 HydrophobicContact CD2-CD1 4.45Å; L130-L191 HydrophobicContact CD2-CD2 4.25Å; F147-L191 HydrophobicContact CB-CD1 4.49Å; F147-L191 HydrophobicContact CD1-CD1 3.61Å; F147-L191 HydrophobicContact CD2-CD1 3.69Å; F147-L191 HydrophobicContact CE1-CD1 3.62Å; F147-L191 HydrophobicContact CE2-CD1 3.7Å; F147-L191 HydrophobicContact CG-CD1 3.65Å; F147-L191 HydrophobicContact CZ-CB 4.28Å; F147-L191 HydrophobicContact CZ-CD1 3.67Å; L182-L191 HydrophobicContact CB-CB 4.1Å; L182-L191 HydrophobicContact CB-CD2 4.5Å; L182-L191 HydrophobicContact CD1-CD2 3.91Å; L182-L191 PolarHBondContact O-N 3.39Å; L191-L196 HydrophobicContact CD1-CD1 4.08Å; L191-L196 HydrophobicContact CD1-CG 4.46Å; L191-L196 HydrophobicContact CG-CD1 4.25Å; L191-T226 PolarHBondContact O-OG1 2.93Å; L191-W228 HydrophobicContact CD2-CZ2 4.42Å; L191-W228 HydrophobicContact CG-CZ2 4.48Å; L191-W228 PolarHBondContact O-NE1 2.79Å
192N77.6Confident66Low21 Ų2161.6 Ų61.611%0.11232%0.317CS..  trans-103.5137.2-176.5-73.4-26.8000112.6A190 K194 Q195 L196 N225 T226A190-N192 PolarHBondContact O-N 3.08Å; N192-K194 PolarHBondContact O-N 2.95Å; N192-Q195 HydrophobicContact CB-CG 4.34Å; N192-Q195 WeakPolarHBondContact O-CB 3.35Å; N192-Q195 PolarHBondContact O-N 2.97Å; N192-L196 PolarHBondContact O-N 3.47Å; N192-N225 WeakPolarHBondContact OD1-CA 3.36Å; N192-T226 WeakPolarHBondContact CA-OG1 3.48Å; N192-T226 HydrophobicContact CB-CG2 4.25Å; N192-T226 PolarHBondContact OD1-N 3.14Å; N192-T226 PolarHBondContact OD1-OG1 2.88Å
193I67.3Low63.4Low4 Ų466.1 Ų66.12%0.02134%0.338CS..Hα-helixtrans-53.8-40176.9-62.2159.7000111.9S26 D28 D30 V46 Q195 L196 N197 T226 W228S26-I193 WeakPolarHBondContact OG-CD1 3.44Å; D28-I193 HydrophobicContact CB-CD1 4.1Å; D30-I193 HydrophobicContact CB-CG2 4.21Å; V46-I193 HydrophobicContact CG2-CG2 4.36Å; I193-Q195 PolarHBondContact O-N 2.97Å; I193-L196 WeakPolarHBondContact O-CB 3.37Å; I193-L196 PolarHBondContact O-N 3.03Å; I193-N197 PolarHBondContact O-N 3.27Å; I193-T226 HydrophobicContact CB-CG2 3.92Å; I193-T226 HydrophobicContact CD1-CG2 3.78Å; I193-T226 HydrophobicContact CG1-CG2 3.77Å; I193-W228 HydrophobicContact CG1-CH2 3.84Å; I193-W228 HydrophobicContact CG1-CZ2 3.82Å
194K67.5Low60.5Low137 Ų13772.3 Ų72.360%0.59637%0.365SS*.Hα-helixtrans-59.4-35.1177.4-66.8-176.2179.8177.20112.4N192 S198N192-K194 PolarHBondContact O-N 2.95Å; K194-S198 WeakPolarHBondContact O-CB 3.31Å; K194-S198 PolarHBondContact O-N 3.41Å; K194-S198 PolarHBondContact O-OG 3.35Å
195Q63.4Low57.7Low69 Ų6979.9 Ų79.932%0.32241%0.405SS..Hα-helixtrans-74.7-29.7176.9-67.2173.6-2100112.1F147 A190 N192 I193F147-Q195 HydrophobicContact CD2-CB 4.42Å; F147-Q195 HydrophobicContact CE2-CB 4.1Å; F147-Q195 VanDerWaalsContact CE2-OE1 3.27Å; A190-Q195 PolarHBondContact O-OE1 3.41Å; A190-Q195 VanDerWaalsContact O-OE1 3.12Å; N192-Q195 HydrophobicContact CB-CG 4.34Å; N192-Q195 WeakPolarHBondContact O-CB 3.35Å; N192-Q195 PolarHBondContact O-N 2.97Å; I193-Q195 PolarHBondContact O-N 2.97Å
196L59.1Low55.1Low22 Ų2286 Ų8612%0.11543%0.431CS..Hα-helixtrans-71-42.9174.5-75.5144.6000112.1L34 P44 V46 L191 N192 I193 W228L34-L196 HydrophobicContact CD1-CD1 4.29Å; L34-L196 HydrophobicContact CD1-CD2 4.09Å; P44-L196 HydrophobicContact CB-CD2 3.59Å; P44-L196 HydrophobicContact CG-CD2 3.58Å; P44-L196 WeakPolarHBondContact O-CD2 3.43Å; V46-L196 HydrophobicContact CG2-CB 4.41Å; V46-L196 HydrophobicContact CG2-CD1 4.13Å; L191-L196 HydrophobicContact CD1-CD1 4.08Å; L191-L196 HydrophobicContact CD1-CG 4.46Å; L191-L196 HydrophobicContact CG-CD1 4.25Å; N192-L196 PolarHBondContact O-N 3.47Å; I193-L196 WeakPolarHBondContact O-CB 3.37Å; I193-L196 PolarHBondContact O-N 3.03Å; L196-W228 HydrophobicContact CD1-CH2 4.3Å; L196-W228 HydrophobicContact CD1-CZ2 3.93Å
197N59.2Low52.6Low71 Ų7180.7 Ų80.738%0.3842%0.424SS..Hα-helixtrans-85.8-6.1-175.7-68.6-8.8000114.2N45 I193 N199N45-N197 PolarHBondContact OD1-OD1 3.3Å; I193-N197 PolarHBondContact O-N 3.27Å; N197-N199 PolarHBondContact O-N 3.23Å
198S46.5Very low50.3Low65 Ų6587 Ų8746%0.45546%0.455SS..  trans-68.6123-173-77.80000113K194K194-S198 WeakPolarHBondContact O-CB 3.31Å; K194-S198 PolarHBondContact O-N 3.41Å; K194-S198 PolarHBondContact O-OG 3.35Å
199N40.8Very low48.3Very low111 Ų11191.1 Ų91.159%0.59447%0.471SS*.  trans-75.7145.4168.8-84-40.2000111N197 K201 Q202N197-N199 PolarHBondContact O-N 3.23Å; N199-K201 PolarHBondContact O-N 3.12Å; N199-Q202 PolarHBondContact O-N 3.21Å
200P39.2Very low46Very low83 Ų8397 Ų9754%0.53950%0.501SS..G310 helixtrans-61.6-17.5-175.924.3-33.9000114.2Q202 H203P200-Q202 VanDerWaalsContact C-N 3.34Å; P200-H203 PolarHBondContact O-CD2 2.89Å
201K33.9Very low43.7Very low192 Ų192102 Ų10284%0.83553%0.534SS*.G310 helixtrans-83.4-5.5179.1-66.9-172177.3-175.20114.2N199N199-K201 PolarHBondContact O-N 3.12Å
202Q30Very low41.3Very low144 Ų144110.6 Ų110.667%0.67357%0.573SS**G310 helixtrans-111.525.5-176.7-70.8-175.7-11.800113.5N199 P200 K204N199-Q202 PolarHBondContact O-N 3.21Å; P200-Q202 VanDerWaalsContact C-N 3.34Å; Q202-K204 PolarHBondContact O-N 2.93Å
203H31.3Very low38.8Very low96 Ų96112.8 Ų112.844%0.44460%0.6SS.*  trans-70.661164.6-65-66.9000110.5P200P200-H203 PolarHBondContact O-CD2 2.89Å
204K23.9Very low37Very low186 Ų186120.4 Ų120.481%0.80964%0.64SS**  trans-119.1126.4166-99.3-176.6175.7178.60107.3Q202Q202-K204 PolarHBondContact O-N 2.93Å
205L26.3Very low34.9Very low161 Ų161121.4 Ų121.484%0.84365%0.651SS**  trans84.290.1158.8-135.479.1000116.4
206M26.4Very low33.2Very low167 Ų167124.8 Ų124.882%0.82367%0.671SS**  trans-153.377.3138.1-110.4170.472.800107.8
207S25.2Very low31.6Very low79 Ų79130.8 Ų130.855%0.55270%0.704SS**  trans-66.8154157.448.60000109.2
208D26.8Very low29.9Very low145 Ų145134.3 Ų134.378%0.77572%0.723SS**  trans91.972.1171.4-49-23.5000114.8
209T31.6Very low29Very low134 Ų134139.7 Ų139.782%0.82275%0.746SS**  trans-150.676.9141.8-0.40000109.3
210D28.6Very low28.5Very low146 Ų146139.1 Ų139.178%0.78175%0.751SS**  trans-57.7133156.4-82.7-36.5000108H212D210-H212 PolarHBondContact O-N 3.12Å
211P32.8Very low28.3Very low110 Ų110140.8 Ų140.871%0.71476%0.755SS**SBendtrans-70.7-0.6-166.4-15.829.7000115.1
212H30.5Very low28.4Very low180 Ų180139.2 Ų139.283%0.83376%0.756SS**SBendtrans-145.384-173.7-63.3-55.7000110.9D210D210-H212 PolarHBondContact O-N 3.12Å
213G25.6Very low29.2Very low66 Ų66139.5 Ų139.568%0.6876%0.762SS**  trans-168.481.9177.600000112.7N215G213-N215 VanDerWaalsContact C-N 3.25Å; G213-N215 PolarHBondContact O-N 2.93Å
214I28.3Very low30.5Very low165 Ų165139.5 Ų139.585%0.84677%0.765SS**  trans-64.492.5161.1-61.4166.2000106
215N24.2Very low32.6Very low157 Ų157134.5 Ų134.584%0.8475%0.748SS**  trans-125.5104.9169.1-129.42000109.7G213 N217G213-N215 VanDerWaalsContact C-N 3.25Å; G213-N215 PolarHBondContact O-N 2.93Å; N215-N217 PolarHBondContact O-N 3.4Å
216N26.5Very low34.9Very low140 Ų140127.4 Ų127.475%0.74971%0.711SS**  trans-61.396.6172-71.8-29.9000109.5
217N25.3Very low37.5Very low149 Ų149120.4 Ų120.480%0.79768%0.678SS**  trans-178.187.7150.8-97-8.2000108.7N215N215-N217 PolarHBondContact O-N 3.4Å
218N25.2Very low40.5Very low145 Ų145116.6 Ų116.678%0.77565%0.652SS**  trans164.581.8145.5-78.6-14.1000108.8S220N218-S220 PolarHBondContact O-N 3Å
219N25.5Very low43.4Very low177 Ų177111.6 Ų111.695%0.94762%0.624SS**THydrogen-bonded Turntrans-71.238.9180-81.4-25.2000114.3
220S32.3Very low46Very low99 Ų99105.2 Ų105.269%0.69259%0.585SS**THydrogen-bonded Turntrans-132.8-18.2-178.3-1610000117.3N218N218-S220 PolarHBondContact O-N 3Å
221D33.1Very low48.8Very low118 Ų11899 Ų9963%0.63155%0.551SS**SBendtrans-109.4-3.1-174.2-68.6-36.9000114.9N223D221-N223 PolarHBondContact O-N 2.91Å
222N36.8Very low51.4Low159 Ų15994.2 Ų94.285%0.8552%0.52SS*.THydrogen-bonded Turntrans-780.4-175.7-145.317.9000114.3
223N47.4Very low54.1Low151 Ų15186.1 Ų86.181%0.80748%0.482SS*.THydrogen-bonded Turntrans-109.816.2-174.5-145.840000114.1D221 N225D221-N223 PolarHBondContact O-N 2.91Å; N223-N225 PolarHBondContact O-N 3.42Å; N223-N225 VanDerWaalsContact O-N 3.13Å
224N57.7Low57Low95 Ų9583.1 Ų83.151%0.50845%0.45SS..  trans-77.714.4-177.2-79.3-23.5000114.9T226N224-T226 PolarHBondContact O-N 2.58Å
225N68.9Low59.7Low81 Ų8176.4 Ų76.443%0.43342%0.418SS..PPolyproline II helixtrans-76.3124.2175.9-72.6-13.2000110.1T181 A190 N192 N223 S227T181-N225 HydrophobicContact CG2-CB 4.13Å; A190-N225 HydrophobicContact CB-CB 4.41Å; N192-N225 WeakPolarHBondContact OD1-CA 3.36Å; N223-N225 PolarHBondContact O-N 3.42Å; N223-N225 VanDerWaalsContact O-N 3.13Å; N225-S227 PolarHBondContact O-N 2.57Å
226T73.5Confident62.5Low12 Ų1271 Ų717%0.07439%0.387CS..PPolyproline II helixtrans-73131.4-178.959.90000110.6D28 L191 N192 I193 N224 W228D28-T226 WeakPolarHBondContact OD2-CB 3.33Å; L191-T226 PolarHBondContact O-OG1 2.93Å; N192-T226 WeakPolarHBondContact CA-OG1 3.48Å; N192-T226 HydrophobicContact CB-CG2 4.25Å; N192-T226 PolarHBondContact OD1-N 3.14Å; N192-T226 PolarHBondContact OD1-OG1 2.88Å; I193-T226 HydrophobicContact CB-CG2 3.92Å; I193-T226 HydrophobicContact CD1-CG2 3.78Å; I193-T226 HydrophobicContact CG1-CG2 3.77Å; N224-T226 PolarHBondContact O-N 2.58Å; T226-W228 PolarHBondContact OG1-NE1 3Å
227S82.6Confident65.1Low20 Ų2070 Ų7014%0.1438%0.377CS..PPolyproline II helixtrans-90.6118.8-178.968.10000110.4S26 N225S26-S227 WeakPolarHBondContact CB-O 3.46Å; S26-S227 PolarHBondContact OG-O 3.17Å; N225-S227 PolarHBondContact O-N 2.57Å
228W87Confident67.9Low0 Ų065.3 Ų65.30%035%0.352CS..EExtended strand (participates in β ladder)trans-99.9119.8179.5-64.3101.2000110F24 L34 V46 K179 V180 L191 I193 L196 T226F24-W228 HydrophobicContact CB-CD2 4.44Å; F24-W228 HydrophobicContact CB-CE3 3.89Å; F24-W228 HydrophobicContact CD1-CB 4.22Å; L34-W228 HydrophobicContact CB-CH2 4.36Å; L34-W228 HydrophobicContact CB-CZ3 4.06Å; L34-W228 HydrophobicContact CD1-CH2 4.4Å; V46-W228 HydrophobicContact CG2-CH2 3.93Å; K179-W228 CarbonylContact C-O 3.54Å; K179-W228 WeakPolarHBondContact CA-O 3.47Å; V180-W228 HydrophobicContact CG2-CB 4.42Å; V180-W228 PolarHBondContact N-O 3.25Å; V180-W228 PolarHBondContact O-N 2.77Å; L191-W228 HydrophobicContact CD2-CZ2 4.42Å; L191-W228 HydrophobicContact CG-CZ2 4.48Å; L191-W228 PolarHBondContact O-NE1 2.79Å; I193-W228 HydrophobicContact CG1-CH2 3.84Å; I193-W228 HydrophobicContact CG1-CZ2 3.82Å; L196-W228 HydrophobicContact CD1-CH2 4.3Å; L196-W228 HydrophobicContact CD1-CZ2 3.93Å; T226-W228 PolarHBondContact OG1-NE1 3Å
229Q87.7Confident70.6Confident39 Ų3960.2 Ų60.218%0.18233%0.325CS..EExtended strand (participates in β ladder)trans-80.1120.9169-170.817220.600109.7Y25 G177 D178Y25-Q229 PolarHBondContact N-O 3.22Å; Y25-Q229 WeakPolarHBondContact O-CA 3.47Å; Y25-Q229 VanDerWaalsContact O-CB 3.3Å; Y25-Q229 WeakPolarHBondContact O-CB 3.41Å; Y25-Q229 PolarHBondContact O-N 2.92Å; G177-Q229 WeakPolarHBondContact O-CG 3.26Å; G177-Q229 PolarHBondContact O-NE2 3.43Å; D178-Q229 WeakPolarHBondContact O-CA 3.38Å
230I86.5Confident73.2Confident1 Ų155.5 Ų55.51%0.00530%0.299CS..EExtended strand (participates in β ladder)trans-86.3115.4176.7-52.4-175.5000108.9L16 V22 F24 V174 G177 D178 V180L16-I230 HydrophobicContact CD1-CG2 4.14Å; L16-I230 HydrophobicContact CD2-CD1 3.81Å; L16-I230 HydrophobicContact CD2-CG2 4.37Å; V22-I230 HydrophobicContact CB-CG2 3.94Å; V22-I230 HydrophobicContact CG1-CG2 3.87Å; V22-I230 HydrophobicContact CG2-CG2 4.33Å; F24-I230 HydrophobicContact CD1-CG1 4.05Å; F24-I230 HydrophobicContact CE1-CD1 4.06Å; F24-I230 HydrophobicContact CE1-CG1 3.76Å; V174-I230 HydrophobicContact CG1-CD1 4.19Å; G177-I230 WeakPolarHBondContact CA-O 3.3Å; G177-I230 PolarHBondContact N-O 3.09Å; D178-I230 PolarHBondContact O-N 3.15Å; D178-I230 VanDerWaalsContact O-N 3.14Å; V180-I230 HydrophobicContact CB-CD1 4.48Å; V180-I230 HydrophobicContact CG1-CD1 3.92Å; V180-I230 HydrophobicContact CG1-CG1 4.25Å; V180-I230 HydrophobicContact CG2-CD1 3.72Å; V180-I230 HydrophobicContact CG2-CG1 3.78Å
231N87.7Confident75.3Confident14 Ų1458.1 Ų58.18%0.07530%0.301CS..EExtended strand (participates in β ladder)trans-108.1126.9172.8-61.1-49.2000109.7V22 T23V22-N231 CarbonylContact C-O 3.57Å; V22-N231 VanDerWaalsContact CA-O 3.27Å; V22-N231 WeakPolarHBondContact CA-O 3.37Å; V22-N231 WeakPolarHBondContact CB-O 3.4Å; T23-N231 PolarHBondContact N-O 3.35Å; T23-N231 PolarHBondContact O-N 2.96Å
232L88Confident77.7Confident10 Ų1059.6 Ų59.65%0.05230%0.303CS..EExtended strand (participates in β ladder)trans-66.1132.9170.8-17468.5000109D20 V22 I176 R303D20-L232 HydrophobicContact CB-CD1 3.68Å; V22-L232 HydrophobicContact CG1-CD1 4.44Å; I176-L232 HydrophobicContact CD1-CB 3.82Å; I176-L232 HydrophobicContact CD1-CD1 4.38Å; I176-L232 HydrophobicContact CD1-CD2 3.7Å; I176-L232 HydrophobicContact CD1-CG 4.17Å; I176-L232 HydrophobicContact CG1-CB 4.16Å; I176-L232 HydrophobicContact CG2-CB 3.7Å; L232-R303 WeakPolarHBondContact O-CG 3.49Å
233Y85.7Confident80.2Confident10 Ų1053.1 Ų53.14%0.03927%0.269CS..EExtended strand (participates in β ladder)trans-104.7-48.9172175.7-95.5000110.7Q21 L59 R64 R303 T304Q21-Y233 VanDerWaalsContact CD-CD1 3.49Å; Q21-Y233 HydrophobicContact CG-CD1 4.03Å; Q21-Y233 WeakPolarHBondContact O-CA 3.47Å; Q21-Y233 WeakPolarHBondContact O-CB 3.44Å; Q21-Y233 PolarHBondContact O-N 3.29Å; L59-Y233 HydrophobicContact CD2-CD2 4.44Å; R64-Y233 PolarHBondContact NH1-OH 3.33Å; R64-Y233 PolarHBondContact NH2-OH 2.88Å; Y233-R303 WeakPolarHBondContact O-CA 3.43Å; Y233-T304 HydrophobicContact CD1-CG2 4.03Å; Y233-T304 HydrophobicContact CE1-CG2 3.39Å; Y233-T304 HydrophobicContact CE2-CG2 4.24Å; Y233-T304 VanDerWaalsContact CZ-CG2 3.49Å; Y233-T304 PolarHBondContact O-N 2.97Å; Y233-T304 VanDerWaalsContact O-O 3.08Å
234L86.9Confident82.1Confident3 Ų346 Ų462%0.01623%0.23CC..EExtended strand (participates in β ladder)trans-141.5127.5176.7179.869.7000108.8Q21 D238 N239 K245 T304Q21-L234 HydrophobicContact CB-CB 4.03Å; Q21-L234 PolarHBondContact N-O 3.48Å; Q21-L234 PolarHBondContact O-N 3.21Å; L234-D238 HydrophobicContact CD1-CB 3.67Å; L234-N239 HydrophobicContact CD2-CB 3.91Å; L234-N239 HydrophobicContact CG-CB 4.34Å; L234-K245 HydrophobicContact CD2-CD 4.12Å; L234-T304 HydrophobicContact CB-CG2 4.3Å; L234-T304 HydrophobicContact CD1-CG2 4.13Å
235S86.1Confident83.6Confident24 Ų2442.6 Ų42.617%0.16821%0.211CC..  trans-70.1146.8175.5-179.40000111.1D20 Q237 D238 N239D20-S235 WeakPolarHBondContact OD1-CA 3.34Å; S235-Q237 PolarHBondContact O-N 3Å; S235-Q237 PolarHBondContact OG-N 3.43Å; S235-D238 PolarHBondContact O-N 3.32Å; S235-D238 VanDerWaalsContact O-N 3.15Å; S235-N239 WeakPolarHBondContact O-CB 3.28Å; S235-N239 PolarHBondContact O-N 2.84Å; S235-N239 VanDerWaalsContact O-N 3.14Å
236Y81.6Confident84.4Confident45 Ų4538.9 Ų38.918%0.17619%0.192CC..THydrogen-bonded Turntrans-54.9-31.6171.180.7-87.2000112.8H17 D20 Q109 E110 N239H17-Y236 HydrophobicContact CB-CD1 3.58Å; H17-Y236 HydrophobicContact CB-CE1 3.65Å; H17-Y236 AromaticContact CD2-CE1 3.61Å; H17-Y236 AromaticContact CG-CD1 3.86Å; H17-Y236 AromaticContact CG-CE1 3.41Å; H17-Y236 VanDerWaalsContact CG-CE1 3.41Å; H17-Y236 AromaticContact ND1-CE1 3.77Å; D20-Y236 WeakPolarHBondContact OD1-CD1 3.21Å; D20-Y236 PolarHBondContact OD1-N 3.38Å; Q109-Y236 WeakPolarHBondContact O-CD2 3.43Å; E110-Y236 HydrophobicContact CB-CE2 4.34Å; E110-Y236 HydrophobicContact CG-CE2 3.98Å; Y236-N239 PolarHBondContact O-N 2.87Å
237Q82Confident84.8Confident119 Ų11939 Ų3956%0.55620%0.196SC*.THydrogen-bonded Turntrans-67.7-36.4-179.8-63.1-175.5-15.400112.2S235S235-Q237 PolarHBondContact O-N 3Å; S235-Q237 PolarHBondContact OG-N 3.43Å
238D83.4Confident85.2Confident50 Ų5039.9 Ų39.927%0.26720%0.199SC..THydrogen-bonded Turntrans-83.3-16.3178.2-74.7-2.8000112.2L234 S235 L240 G305 A306L234-D238 HydrophobicContact CD1-CB 3.67Å; S235-D238 PolarHBondContact O-N 3.32Å; S235-D238 VanDerWaalsContact O-N 3.15Å; D238-L240 PolarHBondContact O-N 3.06Å; D238-G305 WeakPolarHBondContact OD2-CA 3.26Å; D238-A306 HydrophobicContact CB-CB 4.04Å; D238-A306 PolarHBondContact OD2-N 3.31Å
239N81.9Confident85.4Confident38 Ų3840.5 Ų40.520%0.20320%0.202CC..  trans-8253.3-175.2-169.621.5000112.9L234 S235 Y236 K245L234-N239 HydrophobicContact CD2-CB 3.91Å; L234-N239 HydrophobicContact CG-CB 4.34Å; S235-N239 WeakPolarHBondContact O-CB 3.28Å; S235-N239 PolarHBondContact O-N 2.84Å; S235-N239 VanDerWaalsContact O-N 3.14Å; Y236-N239 PolarHBondContact O-N 2.87Å; N239-K245 WeakPolarHBondContact OD1-CE 3.38Å; N239-K245 PolarHBondContact OD1-NZ 3.19Å
240L81.4Confident85.7Confident78 Ų7838.7 Ų38.741%0.40819%0.194SC..  trans-83.9148.7179.4-59.3174.9000111.4D238 I243 K245D238-L240 PolarHBondContact O-N 3.06Å; L240-I243 HydrophobicContact CB-CD1 4.07Å; L240-I243 HydrophobicContact CD1-CD1 3.55Å; L240-I243 HydrophobicContact CG-CD1 4.45Å; L240-K245 PolarHBondContact O-NZ 2.96Å
241E75.3Confident86Confident154 Ų15439.4 Ų39.472%0.7220%0.197SC*.SBendtrans-80.6-25.1-176.1-71.3-173.9173.900114N384E241-N384 PolarHBondContact O-ND2 2.92Å
242H84.2Confident86.2Confident148 Ų14838.8 Ų38.869%0.68519%0.193SC*.SBendtrans-98.33.9-172.8-61.9-52000114.7N384H242-N384 PolarHBondContact O-N 3.37Å
243I88.2Confident86.4Confident24 Ų2439.4 Ų39.412%0.12320%0.195CC..BIsolated β-bridgetrans-124144.4-173.2-69158.8000108.7L240 K245 F381 I382L240-I243 HydrophobicContact CB-CD1 4.07Å; L240-I243 HydrophobicContact CD1-CD1 3.55Å; L240-I243 HydrophobicContact CG-CD1 4.45Å; I243-K245 PolarHBondContact O-N 3.44Å; I243-F381 HydrophobicContact CB-CB 4.48Å; I243-F381 HydrophobicContact CD1-CB 3.83Å; I243-F381 HydrophobicContact CD1-CD1 4.28Å; I243-F381 HydrophobicContact CD1-CD2 3.85Å; I243-F381 HydrophobicContact CD1-CE2 4.5Å; I243-F381 HydrophobicContact CD1-CG 3.72Å; I243-F381 HydrophobicContact CG1-CB 3.88Å; I243-F381 HydrophobicContact CG1-CG 4.3Å; I243-F381 HydrophobicContact CG2-CB 3.75Å; I243-F381 HydrophobicContact CG2-CD1 3.97Å; I243-F381 HydrophobicContact CG2-CG 4.1Å; I243-I382 WeakPolarHBondContact CA-O 3.46Å
244L88.5Confident86.7Confident0 Ų039 Ų390%019%0.194CC..  trans-68.4124.5172.8-175.868.7000110D248 I250 V294 G307 F313 M369 I382 I432L244-D248 HydrophobicContact CD1-CB 4.33Å; L244-I250 HydrophobicContact CD1-CG2 3.82Å; L244-V294 HydrophobicContact CD1-CG2 4.17Å; L244-V294 HydrophobicContact CD2-CG1 4.43Å; L244-G307 VanDerWaalsContact O-CA 3.3Å; L244-G307 WeakPolarHBondContact O-CA 3.47Å; L244-G307 PolarHBondContact O-N 3.35Å; L244-F313 HydrophobicContact CD2-CE1 4.19Å; L244-M369 HydrophobicContact CD2-CE 4.47Å; L244-M369 HydrophobicContact CD2-SD 4.13Å; L244-I382 HydrophobicContact CB-CB 4.17Å; L244-I382 HydrophobicContact CB-CG2 4.22Å; L244-I382 HydrophobicContact CD2-CG2 4.21Å; L244-I382 PolarHBondContact N-O 3.26Å; L244-I432 HydrophobicContact CD1-CG2 4.22Å; L244-I432 HydrophobicContact CD2-CD1 4.04Å
245K87.9Confident86.8Confident25 Ų2540.8 Ų40.811%0.10921%0.207CC..BIsolated β-bridgetrans-132165.3179.156.4-173.7172-156.30111.7L234 N239 L240 I243 G247 D248L234-K245 HydrophobicContact CD2-CD 4.12Å; N239-K245 WeakPolarHBondContact OD1-CE 3.38Å; N239-K245 PolarHBondContact OD1-NZ 3.19Å; L240-K245 PolarHBondContact O-NZ 2.96Å; I243-K245 PolarHBondContact O-N 3.44Å; K245-G247 PolarHBondContact O-N 3.22Å; K245-D248 WeakPolarHBondContact CE-OD1 3.19Å; K245-D248 VanDerWaalsContact CG-CG 3.47Å; K245-D248 WeakPolarHBondContact CG-OD1 3.23Å; K245-D248 VanDerWaalsContact CG-OD2 3.23Å; K245-D248 WeakPolarHBondContact CG-OD2 3.41Å; K245-D248 PolarHBondContact N-OD2 3.01Å; K245-D248 VanDerWaalsContact N-OD2 3.1Å; K245-D248 WeakPolarHBondContact O-CB 3.13Å; K245-D248 PolarHBondContact O-N 3.47Å
246G85.4Confident86.9Confident3 Ų345.6 Ų45.63%0.03123%0.227CC..THydrogen-bonded Turntrans-62.7133.3174.200000112.5V294 T304 G305G246-V294 WeakPolarHBondContact CA-O 3.14Å; G246-T304 WeakPolarHBondContact CA-OG1 3.24Å; G246-G305 PolarHBondContact N-O 2.75Å; G246-G305 VanDerWaalsContact N-O 3.12Å
247G83.8Confident87.1Confident15 Ų1545 Ų4516%0.15523%0.231CC..THydrogen-bonded Turntrans93.5-7.7-175.600000114.5K245 V294K245-G247 PolarHBondContact O-N 3.22Å; G247-V294 PolarHBondContact N-O 3.14Å
248D89.7Confident87.3Confident38 Ų3844.6 Ų44.620%0.20323%0.229CC..  trans-69.5144174.8-76.4-12.1000111.4L244 K245 E293 V294L244-D248 HydrophobicContact CD1-CB 4.33Å; K245-D248 WeakPolarHBondContact CE-OD1 3.19Å; K245-D248 VanDerWaalsContact CG-CG 3.47Å; K245-D248 WeakPolarHBondContact CG-OD1 3.23Å; K245-D248 VanDerWaalsContact CG-OD2 3.23Å; K245-D248 WeakPolarHBondContact CG-OD2 3.41Å; K245-D248 PolarHBondContact N-OD2 3.01Å; K245-D248 VanDerWaalsContact N-OD2 3.1Å; K245-D248 WeakPolarHBondContact O-CB 3.13Å; K245-D248 PolarHBondContact O-N 3.47Å; D248-E293 WeakPolarHBondContact O-CA 3.44Å; D248-V294 PolarHBondContact O-N 3.34Å
249V91.1Very high87.6Confident12 Ų1243.7 Ų43.77%0.07322%0.223CC..EExtended strand (participates in β ladder)trans-103.3124.3174.5-176.90000109.3L291 W292 L318 V435 V440V249-L291 HydrophobicContact CG1-CB 4.06Å; V249-L291 HydrophobicContact CG1-CD2 3.94Å; V249-L291 HydrophobicContact CG1-CG 4.5Å; V249-W292 CarbonylContact C-O 3.57Å; V249-W292 WeakPolarHBondContact CA-O 3.29Å; V249-L318 HydrophobicContact CG1-CD2 3.94Å; V249-L318 HydrophobicContact CG2-CD1 4.3Å; V249-L318 HydrophobicContact CG2-CD2 4.4Å; V249-V435 HydrophobicContact CB-CB 4.45Å; V249-V435 HydrophobicContact CG1-CB 4.28Å; V249-V435 HydrophobicContact CG1-CG2 4.23Å; V249-V435 VanDerWaalsContact O-CB 3.31Å; V249-V435 WeakPolarHBondContact O-CB 3.14Å; V249-V435 WeakPolarHBondContact O-CG2 3.44Å; V249-V435 PolarHBondContact O-N 2.96Å; V249-V440 HydrophobicContact CB-CG2 3.87Å; V249-V440 HydrophobicContact CG1-CG2 4.11Å; V249-V440 HydrophobicContact CG2-CG1 3.96Å; V249-V440 HydrophobicContact CG2-CG2 4.08Å
250I93.6Very high88Confident1 Ų142.4 Ų42.41%0.00522%0.215CC..EExtended strand (participates in β ladder)trans-125.2162.5-175.966168.7000111.9L244 L252 W292 V294 L315 I432 L433L244-I250 HydrophobicContact CD1-CG2 3.82Å; I250-L252 HydrophobicContact CD1-CD2 3.84Å; I250-L252 HydrophobicContact CD1-CG 4.09Å; I250-W292 HydrophobicContact CG1-CB 4.38Å; I250-W292 PolarHBondContact N-O 2.83Å; I250-W292 PolarHBondContact O-N 2.83Å; I250-V294 HydrophobicContact CD1-CG2 3.41Å; I250-V294 VanDerWaalsContact CD1-CG2 3.41Å; I250-V294 HydrophobicContact CG1-CG2 3.61Å; I250-V294 HydrophobicContact CG2-CG2 4.15Å; I250-L315 HydrophobicContact CD1-CD2 4.42Å; I250-I432 HydrophobicContact CB-CG2 4.04Å; I250-I432 HydrophobicContact CD1-CG2 3.77Å; I250-I432 HydrophobicContact CG2-CG2 3.78Å; I250-L433 CarbonylContact C-O 3.6Å; I250-L433 VanDerWaalsContact CA-O 3.31Å; I250-L433 WeakPolarHBondContact CA-O 3.18Å
251R92.9Very high88.5Confident17 Ų1738.8 Ų38.86%0.06420%0.196CC..EExtended strand (participates in β ladder)trans-111.8136.9160.3-64.1-174.3179.288.61.8108.9F260 A290 L291 L433 V435R251-F260 HydrophobicContact CB-CD1 4.12Å; R251-F260 HydrophobicContact CB-CE1 4.1Å; R251-A290 HydrophobicContact CG-CB 4.5Å; R251-L291 HydrophobicContact CG-CD2 3.78Å; R251-L433 HydrophobicContact CB-CB 4.31Å; R251-L433 PolarHBondContact N-O 2.81Å; R251-L433 PolarHBondContact O-N 3.31Å; R251-V435 HydrophobicContact CG-CG2 3.95Å
252L93.1Very high89.2Confident0 Ų031.6 Ų31.60%016%0.163CC..EExtended strand (participates in β ladder)trans-99.2115.4173.8-67.6169.2000108.6I250 L261 L315 I390 F430 I432I250-L252 HydrophobicContact CD1-CD2 3.84Å; I250-L252 HydrophobicContact CD1-CG 4.09Å; L252-L261 HydrophobicContact CB-CB 3.96Å; L252-L261 HydrophobicContact CB-CD2 4.26Å; L252-L261 HydrophobicContact CD1-CD2 3.7Å; L252-L261 PolarHBondContact O-N 3.5Å; L252-L315 HydrophobicContact CD1-CD1 3.78Å; L252-I390 HydrophobicContact CD1-CD1 4Å; L252-I390 HydrophobicContact CD2-CD1 4.28Å; L252-F430 HydrophobicContact CB-CD1 4.17Å; L252-F430 HydrophobicContact CD2-CB 4.43Å; L252-I432 HydrophobicContact CD2-CG1 3.97Å
253F92.1Very high89.4Confident23 Ų2324.6 Ų24.610%0.10113%0.131CC..EExtended strand (participates in β ladder)trans-109.1118.2179.4179.2-101.9000109.9S255 E258 F260 T283 F430 A431 L433F253-S255 PolarHBondContact O-N 3.02Å; F253-E258 VanDerWaalsContact CE2-C 3.41Å; F253-E258 HydrophobicContact CE2-CB 4.47Å; F253-E258 VanDerWaalsContact CZ-CA 3.44Å; F253-E258 HydrophobicContact CZ-CB 3.9Å; F253-E258 HydrophobicContact CZ-CG 4.3Å; F253-F260 HydrophobicContact CB-CD1 4.04Å; F253-F260 HydrophobicContact CB-CE1 3.84Å; F253-F260 AromaticContact CD2-CD1 3.95Å; F253-F260 HydrophobicContact CD2-CD1 3.95Å; F253-F260 HydrophobicContact CD2-CD2 4.07Å; F253-F260 AromaticContact CD2-CE1 3.75Å; F253-F260 HydrophobicContact CD2-CE1 3.75Å; F253-F260 AromaticContact CD2-CE2 3.87Å; F253-F260 HydrophobicContact CD2-CE2 3.87Å; F253-F260 HydrophobicContact CD2-CG 4.11Å; F253-F260 AromaticContact CD2-CZ 3.71Å; F253-F260 HydrophobicContact CD2-CZ 3.71Å; F253-F260 HydrophobicContact CE2-CE2 4.21Å; F253-F260 HydrophobicContact CE2-CZ 4.36Å; F253-F260 HydrophobicContact CG-CE1 4.21Å; F253-F260 HydrophobicContact CG-CZ 4.44Å; F253-T283 HydrophobicContact CE2-CG2 4.41Å; F253-T283 HydrophobicContact CZ-CG2 4.1Å; F253-F430 CarbonylContact O-C 3.56Å; F253-F430 VanDerWaalsContact O-CA 3.32Å; F253-F430 WeakPolarHBondContact O-CA 3.39Å; F253-A431 HydrophobicContact CB-CB 4.38Å; F253-A431 PolarHBondContact N-O 2.84Å; F253-A431 PolarHBondContact O-N 3.45Å; F253-L433 HydrophobicContact CB-CD1 4.05Å
254H91.9Very high89.3Confident3 Ų325.2 Ų25.21%0.01413%0.134CC..EExtended strand (participates in β ladder)trans-72.2116.1174.4-166.4-60.8000109.2E256 A257 E258 K259 L274 E428 F430H254-E256 PolarHBondContact ND1-N 2.91Å; H254-A257 HydrophobicContact CB-CB 4.35Å; H254-A257 PolarHBondContact ND1-N 3.37Å; H254-A257 VanDerWaalsContact ND1-N 3.14Å; H254-E258 VanDerWaalsContact O-CA 3.28Å; H254-E258 WeakPolarHBondContact O-CA 3.29Å; H254-E258 PolarHBondContact O-N 3.35Å; H254-K259 WeakPolarHBondContact CB-O 3.47Å; H254-K259 PolarHBondContact N-O 3.19Å; H254-K259 PolarHBondContact O-N 3.37Å; H254-L274 HydrophobicContact CB-CD1 4.29Å; H254-L274 HydrophobicContact CB-CD2 4.05Å; H254-E428 IonicContact CE1-OE2 3.01Å; H254-E428 IonicContact NE2-OE2 2.76Å; H254-E428 PolarHBondContact NE2-OE2 2.87Å; H254-E428 VanDerWaalsContact NE2-OE2 3.09Å; H254-F430 HydrophobicContact CB-CD1 4.23Å; H254-F430 HydrophobicContact CB-CE1 4.01Å; H254-F430 AromaticContact CD2-CE1 3.84Å; H254-F430 AromaticContact CD2-CE2 3.98Å; H254-F430 AromaticContact CD2-CZ 3.58Å
255S88.9Confident89Confident40 Ų4030.6 Ų30.628%0.2816%0.159SC..THydrogen-bonded Turntrans-66-48.4-17353.30000113.1F253 V429F253-S255 PolarHBondContact O-N 3.02Å; S255-V429 PolarHBondContact N-O 3.49Å; S255-V429 WeakPolarHBondContact OG-CB 3.41Å; S255-V429 PolarHBondContact OG-O 2.89Å
256E88Confident88.6Confident125 Ų12531.6 Ų31.658%0.58416%0.163SC*.THydrogen-bonded Turntrans-70.3-50.9-178.4-170.574173.200112.8H254 E258H254-E256 PolarHBondContact ND1-N 2.91Å; E256-E258 PolarHBondContact O-N 3.49Å
257A85.2Confident88.2Confident33 Ų3338 Ų3827%0.27319%0.192SC..THydrogen-bonded Turntrans-74-9.5179.900000114.2H254 K259 L274H254-A257 HydrophobicContact CB-CB 4.35Å; H254-A257 PolarHBondContact ND1-N 3.37Å; H254-A257 VanDerWaalsContact ND1-N 3.14Å; A257-K259 VanDerWaalsContact C-N 3.32Å; A257-K259 HydrophobicContact CB-CD 4.22Å; A257-K259 WeakPolarHBondContact O-CE 3.39Å; A257-K259 VanDerWaalsContact O-CG 3.31Å; A257-K259 WeakPolarHBondContact O-CG 3.48Å; A257-K259 PolarHBondContact O-N 3.45Å; A257-L274 HydrophobicContact CB-CD1 4.49Å
258E87.5Confident87.8Confident109 Ų10944 Ų4451%0.50922%0.22SC..THydrogen-bonded Turntrans51.139.9-173.4-61.4-165.2166.800115.6F253 H254 E256 T282F253-E258 VanDerWaalsContact CE2-C 3.41Å; F253-E258 HydrophobicContact CE2-CB 4.47Å; F253-E258 VanDerWaalsContact CZ-CA 3.44Å; F253-E258 HydrophobicContact CZ-CB 3.9Å; F253-E258 HydrophobicContact CZ-CG 4.3Å; H254-E258 VanDerWaalsContact O-CA 3.28Å; H254-E258 WeakPolarHBondContact O-CA 3.29Å; H254-E258 PolarHBondContact O-N 3.35Å; E256-E258 PolarHBondContact O-N 3.49Å; E258-T282 HydrophobicContact CB-CG2 4.19Å; E258-T282 WeakPolarHBondContact O-CB 3.14Å; E258-T282 PolarHBondContact OE2-OG1 2.64Å
259K88.8Confident87.3Confident31 Ų3148.2 Ų48.214%0.13524%0.239CC..EExtended strand (participates in β ladder)trans-125.1146.5-174.2-68.9166.1-160-176.90112H254 A257 L274 R275 T276 Y416H254-K259 WeakPolarHBondContact CB-O 3.47Å; H254-K259 PolarHBondContact N-O 3.19Å; H254-K259 PolarHBondContact O-N 3.37Å; A257-K259 VanDerWaalsContact C-N 3.32Å; A257-K259 HydrophobicContact CB-CD 4.22Å; A257-K259 WeakPolarHBondContact O-CE 3.39Å; A257-K259 VanDerWaalsContact O-CG 3.31Å; A257-K259 WeakPolarHBondContact O-CG 3.48Å; A257-K259 PolarHBondContact O-N 3.45Å; K259-L274 HydrophobicContact CB-CB 3.8Å; K259-L274 HydrophobicContact CB-CD2 4.22Å; K259-L274 HydrophobicContact CB-CG 4.42Å; K259-L274 HydrophobicContact CD-CB 3.95Å; K259-L274 HydrophobicContact CG-CB 4.47Å; K259-R275 WeakPolarHBondContact CB-O 3.46Å; K259-R275 WeakPolarHBondContact CG-O 3.37Å; K259-T276 WeakPolarHBondContact CD-OG1 3.27Å; K259-T276 WeakPolarHBondContact CE-OG1 3.22Å; K259-T276 PolarHBondContact NZ-OG1 3.01Å; K259-Y416 HydrophobicContact CD-CD2 4.2Å; K259-Y416 HydrophobicContact CD-CG 4.36Å; K259-Y416 VanDerWaalsContact NZ-CD1 3.25Å; K259-Y416 VanDerWaalsContact NZ-CG 3.3Å; K259-Y416 VanDerWaalsContact NZ-CZ 3.34Å
260F91.3Very high87Confident12 Ų1250.3 Ų50.35%0.05325%0.249CC..EExtended strand (participates in β ladder)trans-85.5140.1173-74.2-77.6000111.3R251 F253 T262 R275 A290 L433R251-F260 HydrophobicContact CB-CD1 4.12Å; R251-F260 HydrophobicContact CB-CE1 4.1Å; F253-F260 HydrophobicContact CB-CD1 4.04Å; F253-F260 HydrophobicContact CB-CE1 3.84Å; F253-F260 AromaticContact CD2-CD1 3.95Å; F253-F260 HydrophobicContact CD2-CD1 3.95Å; F253-F260 HydrophobicContact CD2-CD2 4.07Å; F253-F260 AromaticContact CD2-CE1 3.75Å; F253-F260 HydrophobicContact CD2-CE1 3.75Å; F253-F260 AromaticContact CD2-CE2 3.87Å; F253-F260 HydrophobicContact CD2-CE2 3.87Å; F253-F260 HydrophobicContact CD2-CG 4.11Å; F253-F260 AromaticContact CD2-CZ 3.71Å; F253-F260 HydrophobicContact CD2-CZ 3.71Å; F253-F260 HydrophobicContact CE2-CE2 4.21Å; F253-F260 HydrophobicContact CE2-CZ 4.36Å; F253-F260 HydrophobicContact CG-CE1 4.21Å; F253-F260 HydrophobicContact CG-CZ 4.44Å; F260-T262 HydrophobicContact CB-CG2 4.27Å; F260-T262 PolarHBondContact O-N 3.01Å; F260-R275 PolarHBondContact O-N 2.89Å; F260-A290 HydrophobicContact CB-CB 4.33Å; F260-L433 HydrophobicContact CE1-CD1 3.96Å; F260-L433 HydrophobicContact CZ-CD1 4.38Å
261L92Very high86.6Confident2 Ų253.8 Ų53.81%0.0126%0.263CS..EExtended strand (participates in β ladder)trans-71.2112.7167.2-174.968000109.7L252 V272 L274 W292 L418L252-L261 HydrophobicContact CB-CB 3.96Å; L252-L261 HydrophobicContact CB-CD2 4.26Å; L252-L261 HydrophobicContact CD1-CD2 3.7Å; L252-L261 PolarHBondContact O-N 3.5Å; L261-V272 HydrophobicContact CD1-CG1 3.62Å; L261-V272 HydrophobicContact CG-CG1 4.26Å; L261-L274 HydrophobicContact CB-CD2 4.48Å; L261-L274 HydrophobicContact CD1-CD2 4.49Å; L261-W292 HydrophobicContact CD2-CZ2 4.14Å; L261-W292 HydrophobicContact CG-CZ2 4.05Å; L261-W292 PolarHBondContact O-NE1 2.7Å; L261-L418 HydrophobicContact CD1-CD1 3.16Å
262T90.2Very high86.4Confident2 Ų253.2 Ų53.21%0.01226%0.261CS..EExtended strand (participates in β ladder)trans-125.8154-175.6480000111.3F260 V272 F273 R275 K289 A290F260-T262 HydrophobicContact CB-CG2 4.27Å; F260-T262 PolarHBondContact O-N 3.01Å; T262-V272 WeakPolarHBondContact O-CA 3.36Å; T262-F273 PolarHBondContact N-O 2.84Å; T262-F273 PolarHBondContact O-N 3.47Å; T262-F273 VanDerWaalsContact O-O 3.09Å; T262-F273 WeakPolarHBondContact OG1-CD2 3.46Å; T262-F273 WeakPolarHBondContact OG1-CE2 3.45Å; T262-F273 PolarHBondContact OG1-O 3.25Å; T262-F273 VanDerWaalsContact OG1-O 3.1Å; T262-R275 HydrophobicContact CG2-CB 4Å; T262-R275 WeakPolarHBondContact OG1-CB 3.47Å; T262-K289 WeakPolarHBondContact CA-O 3.42Å; T262-A290 HydrophobicContact CG2-CB 3.62Å
263C88.3Confident86.3Confident2 Ų253.3 Ų53.31%0.01426%0.262CS..EExtended strand (participates in β ladder)trans-120.3130.3166.1176.60000110.2Y271 V272 K289 W292 L357C263-Y271 VanDerWaalsContact CA-O 3.29Å; C263-Y271 WeakPolarHBondContact CA-O 3.06Å; C263-Y271 PolarHBondContact SG-O 3.26Å; C263-Y271 VanDerWaalsContact SG-O 3.34Å; C263-V272 HydrophobicContact CB-CG2 4.35Å; C263-K289 PolarHBondContact N-O 3.12Å; C263-K289 WeakPolarHBondContact O-CB 3.31Å; C263-W292 HydrophobicContact CB-CH2 4.35Å; C263-W292 HydrophobicContact CB-CZ2 4.33Å; C263-L357 HydrophobicContact CB-CD1 4.31Å; C263-L357 WeakPolarHBondContact SG-CD1 3.46Å
264D86Confident86.2Confident36 Ų3652.2 Ų52.219%0.19326%0.257CS..EExtended strand (participates in β ladder)trans-142.3163.4172.5-148.2-10.4000111Y271 F273 K289D264-Y271 PolarHBondContact N-O 2.98Å; D264-Y271 PolarHBondContact O-N 3.4Å; D264-F273 HydrophobicContact CB-CE1 3.66Å; D264-F273 HydrophobicContact CB-CZ 3.82Å; D264-K289 HydrophobicContact CB-CD 4.23Å; D264-K289 VanDerWaalsContact CG-CD 3.45Å; D264-K289 WeakPolarHBondContact OD1-CD 3.44Å; D264-K289 IonicContact OD1-NZ 2.85Å; D264-K289 PolarHBondContact OD1-NZ 3.3Å; D264-K289 VanDerWaalsContact OD2-CD 3.23Å; D264-K289 WeakPolarHBondContact OD2-CD 3.17Å; D264-K289 IonicContact OD2-NZ 3.13Å; D264-K289 PolarHBondContact OD2-NZ 2.68Å
265E82.2Confident85.9Confident114 Ų11455.9 Ų55.953%0.53327%0.271SS..EExtended strand (participates in β ladder)trans-84.9128.6174.8-168.1174.7-176.300109.8N268 E269 L270E265-N268 WeakPolarHBondContact OE1-CA 3.1Å; E265-E269 WeakPolarHBondContact CA-O 3.43Å; E265-L270 HydrophobicContact CB-CD2 4.06Å
266Y79.4Confident85.6Confident45 Ų4555.2 Ų55.218%0.17627%0.265CS..EExtended strand (participates in β ladder)trans-136.1127.9173.3-175.7-99.3000107.7N268 E269 Y271 I406 D407 D409 M415Y266-N268 VanDerWaalsContact C-N 3.28Å; Y266-N268 PolarHBondContact O-N 3.05Å; Y266-E269 PolarHBondContact N-O 2.74Å; Y266-E269 PolarHBondContact O-N 3.49Å; Y266-Y271 HydrophobicContact CD1-CE2 4.47Å; Y266-I406 HydrophobicContact CD1-CG2 4.23Å; Y266-D407 HydrophobicContact CE2-CB 3.92Å; Y266-D409 PolarHBondContact OH-OD2 2.68Å; Y266-M415 HydrophobicContact CD2-CE 4.13Å; Y266-M415 HydrophobicContact CD2-SD 4.31Å; Y266-M415 HydrophobicContact CG-SD 4.39Å
267E76.3Confident85.2Confident138 Ų13851 Ų5165%0.64525%0.248SC*.THydrogen-bonded Turntrans51.441-175.2-61-171.6149.400114.8E269E267-E269 PolarHBondContact O-N 3.18Å
268N75.1Confident84.5Confident141 Ų14156.4 Ų56.475%0.75427%0.265SS*.THydrogen-bonded Turntrans62.511-176.4-59-23.3000115.6E265 Y266E265-N268 WeakPolarHBondContact OE1-CA 3.1Å; Y266-N268 VanDerWaalsContact C-N 3.28Å; Y266-N268 PolarHBondContact O-N 3.05Å
269E80.3Confident83.6Confident127 Ų12756.7 Ų56.759%0.59326%0.262SS*.EExtended strand (participates in β ladder)trans-114.1147.5173-73.5-72.4162.300110E265 Y266 E267 Y271E265-E269 WeakPolarHBondContact CA-O 3.43Å; Y266-E269 PolarHBondContact N-O 2.74Å; Y266-E269 PolarHBondContact O-N 3.49Å; E267-E269 PolarHBondContact O-N 3.18Å; E269-Y271 HydrophobicContact CB-CD2 4.34Å; E269-Y271 HydrophobicContact CB-CE2 3.68Å
270L84.2Confident82.6Confident55 Ų5561 Ų6129%0.28830%0.303SS..EExtended strand (participates in β ladder)trans-90119.9179.5-72.4171.5000110.1E265 T320 L322 L357E265-L270 HydrophobicContact CB-CD2 4.06Å; L270-T320 HydrophobicContact CD1-CG2 4.09Å; L270-T320 HydrophobicContact CD2-CG2 4.29Å; L270-L322 HydrophobicContact CD1-CD1 3.75Å; L270-L357 HydrophobicContact CD1-CD1 4.38Å
271Y85.5Confident81.6Confident75 Ų7562.6 Ų62.629%0.29432%0.319SS..EExtended strand (participates in β ladder)trans-110.9143177.1-71.3-86.4000111.3C263 D264 Y266 E269 I406C263-Y271 VanDerWaalsContact CA-O 3.29Å; C263-Y271 WeakPolarHBondContact CA-O 3.06Å; C263-Y271 PolarHBondContact SG-O 3.26Å; C263-Y271 VanDerWaalsContact SG-O 3.34Å; D264-Y271 PolarHBondContact N-O 2.98Å; D264-Y271 PolarHBondContact O-N 3.4Å; Y266-Y271 HydrophobicContact CD1-CE2 4.47Å; E269-Y271 HydrophobicContact CB-CD2 4.34Å; E269-Y271 HydrophobicContact CB-CE2 3.68Å; Y271-I406 HydrophobicContact CD1-CD1 4.21Å; Y271-I406 HydrophobicContact CD1-CG2 4.37Å; Y271-I406 HydrophobicContact CG-CD1 4.43Å; Y271-I406 HydrophobicContact CG-CG2 4.42Å
272V88.1Confident80.6Confident4 Ų463.4 Ų63.42%0.02432%0.324CS..EExtended strand (participates in β ladder)trans-103.4122.8169-178.80000108.1L261 T262 C263 W292 L324 L355 L357 L418L261-V272 HydrophobicContact CD1-CG1 3.62Å; L261-V272 HydrophobicContact CG-CG1 4.26Å; T262-V272 WeakPolarHBondContact O-CA 3.36Å; C263-V272 HydrophobicContact CB-CG2 4.35Å; V272-W292 HydrophobicContact CG1-CH2 4.25Å; V272-W292 HydrophobicContact CG1-CZ2 4.29Å; V272-W292 HydrophobicContact CG2-CH2 4.17Å; V272-L324 HydrophobicContact CB-CD1 4.41Å; V272-L324 HydrophobicContact CG1-CD1 3.93Å; V272-L324 HydrophobicContact CG2-CD1 4.03Å; V272-L355 HydrophobicContact CB-CB 4.25Å; V272-L355 HydrophobicContact CG1-CB 4.32Å; V272-L357 HydrophobicContact CG2-CD2 3.95Å; V272-L357 HydrophobicContact CG2-CG 3.9Å; V272-L418 HydrophobicContact CG1-CD1 4.39Å
273F90.9Very high79.5Confident2 Ų267 Ų671%0.00935%0.346CS..EExtended strand (participates in β ladder)trans-149.2162.1-172.161.8-92.8000112.2T262 D264 R275 I406 M415 Y416T262-F273 PolarHBondContact N-O 2.84Å; T262-F273 PolarHBondContact O-N 3.47Å; T262-F273 VanDerWaalsContact O-O 3.09Å; T262-F273 WeakPolarHBondContact OG1-CD2 3.46Å; T262-F273 WeakPolarHBondContact OG1-CE2 3.45Å; T262-F273 PolarHBondContact OG1-O 3.25Å; T262-F273 VanDerWaalsContact OG1-O 3.1Å; D264-F273 HydrophobicContact CB-CE1 3.66Å; D264-F273 HydrophobicContact CB-CZ 3.82Å; F273-R275 HydrophobicContact CD2-CB 4.24Å; F273-R275 HydrophobicContact CE2-CB 3.84Å; F273-R275 HydrophobicContact CE2-CG 4.26Å; F273-I406 HydrophobicContact CB-CD1 3.89Å; F273-M415 HydrophobicContact CB-CB 4.31Å; F273-M415 HydrophobicContact CD1-CB 4.32Å; F273-M415 HydrophobicContact CD1-CG 4.26Å; F273-M415 HydrophobicContact CD1-SD 4.02Å; F273-M415 HydrophobicContact CD2-CB 3.73Å; F273-M415 HydrophobicContact CD2-CG 3.82Å; F273-M415 HydrophobicContact CE1-CE 4.18Å; F273-M415 HydrophobicContact CE1-CG 4.05Å; F273-M415 HydrophobicContact CE1-SD 3.64Å; F273-M415 HydrophobicContact CE2-CB 4.04Å; F273-M415 HydrophobicContact CE2-CG 3.58Å; F273-M415 HydrophobicContact CE2-SD 4.27Å; F273-M415 HydrophobicContact CG-CB 3.88Å; F273-M415 HydrophobicContact CG-CG 4.15Å; F273-M415 HydrophobicContact CG-SD 4.49Å; F273-M415 HydrophobicContact CZ-CB 4.47Å; F273-M415 HydrophobicContact CZ-CE 3.96Å; F273-M415 HydrophobicContact CZ-CG 3.71Å; F273-M415 HydrophobicContact CZ-SD 3.78Å; F273-Y416 CarbonylContact C-O 3.58Å; F273-Y416 VanDerWaalsContact CA-O 3.32Å; F273-Y416 WeakPolarHBondContact CA-O 3.09Å; F273-Y416 VanDerWaalsContact CB-O 3.26Å; F273-Y416 WeakPolarHBondContact CB-O 3.11Å
274L89.4Confident78.5Confident1 Ų170.6 Ų70.61%0.00537%0.368CS..EExtended strand (participates in β ladder)trans-86118.4168-71.9179.1000109.6H254 A257 K259 L261 A401 Y416 L418 F430H254-L274 HydrophobicContact CB-CD1 4.29Å; H254-L274 HydrophobicContact CB-CD2 4.05Å; A257-L274 HydrophobicContact CB-CD1 4.49Å; K259-L274 HydrophobicContact CB-CB 3.8Å; K259-L274 HydrophobicContact CB-CD2 4.22Å; K259-L274 HydrophobicContact CB-CG 4.42Å; K259-L274 HydrophobicContact CD-CB 3.95Å; K259-L274 HydrophobicContact CG-CB 4.47Å; L261-L274 HydrophobicContact CB-CD2 4.48Å; L261-L274 HydrophobicContact CD1-CD2 4.49Å; L274-A401 HydrophobicContact CD1-CB 3.54Å; L274-Y416 PolarHBondContact N-O 3.27Å; L274-Y416 WeakPolarHBondContact O-CB 3.44Å; L274-Y416 PolarHBondContact O-N 3.34Å; L274-L418 HydrophobicContact CD1-CD2 3.79Å; L274-L418 HydrophobicContact CD1-CG 4.39Å; L274-L418 HydrophobicContact CD2-CD1 4.43Å; L274-L418 HydrophobicContact CD2-CD2 4.37Å; L274-L418 HydrophobicContact CG-CD1 4.04Å; L274-L418 HydrophobicContact CG-CD2 3.79Å; L274-L418 HydrophobicContact CG-CG 3.98Å; L274-F430 HydrophobicContact CD2-CE1 4.23Å
275R87Confident77.6Confident80 Ų8069.8 Ų69.830%0.30237%0.366SS..EExtended strand (participates in β ladder)trans-87.9126.5-177.2-176.7175.2-175.3161.29.3112.5K259 F260 T262 F273 I414K259-R275 WeakPolarHBondContact CB-O 3.46Å; K259-R275 WeakPolarHBondContact CG-O 3.37Å; F260-R275 PolarHBondContact O-N 2.89Å; T262-R275 HydrophobicContact CG2-CB 4Å; T262-R275 WeakPolarHBondContact OG1-CB 3.47Å; F273-R275 HydrophobicContact CD2-CB 4.24Å; F273-R275 HydrophobicContact CE2-CB 3.84Å; F273-R275 HydrophobicContact CE2-CG 4.26Å; R275-I414 WeakPolarHBondContact CA-O 2.9Å
276T82.6Confident77.5Confident25 Ų2570 Ų7015%0.15337%0.365CS..PPolyproline II helixtrans-85.2143170.8-620000112K259 I414 Y416K259-T276 WeakPolarHBondContact CD-OG1 3.27Å; K259-T276 WeakPolarHBondContact CE-OG1 3.22Å; K259-T276 PolarHBondContact NZ-OG1 3.01Å; T276-I414 PolarHBondContact N-O 3.07Å; T276-Y416 HydrophobicContact CG2-CE2 4.41Å; T276-Y416 WeakPolarHBondContact OG1-CD2 3.49Å; T276-Y416 WeakPolarHBondContact OG1-CE2 3.23Å
277T78.6Confident77.6Confident38 Ų3868.1 Ų68.123%0.23336%0.359CS..  trans-130.4133.7175.6-171.90000111R279 T282 A285T277-R279 PolarHBondContact O-N 3.43Å; T277-R279 VanDerWaalsContact O-N 3.16Å; T277-T282 HydrophobicContact CG2-CG2 3.68Å; T277-A285 HydrophobicContact CG2-CB 3.78Å
278F70.8Confident78Confident145 Ų14561.8 Ų61.864%0.63633%0.329SS*.  trans-85.230.2179.6-53.7-73.1000113K412 I414F278-K412 HydrophobicContact CE2-CB 4.17Å; F278-K412 HydrophobicContact CE2-CD 4.24Å; F278-K412 HydrophobicContact CZ-CB 4.11Å; F278-K412 HydrophobicContact CZ-CD 4.37Å; F278-I414 HydrophobicContact CE2-CG2 4.02Å; F278-I414 HydrophobicContact CZ-CG2 4.47Å
279R69.5Low78.6Confident115 Ų11557.1 Ų57.143%0.43430%0.302SS..SBendtrans-94.7148176.9-69.8-176.8174.9-173.9-3.3109.2T277 A281 T284T277-R279 PolarHBondContact O-N 3.43Å; T277-R279 VanDerWaalsContact O-N 3.16Å; R279-A281 PolarHBondContact O-N 2.93Å; R279-T284 PolarHBondContact NH1-O 3.44Å
280A66.1Low79.1Confident122 Ų12251.1 Ų51.1100%1.00828%0.275SS*.SBendtrans-57.6-30.4175.700000113.3
281A70.3Confident79.4Confident45 Ų4548.5 Ų48.537%0.37226%0.261SS..  trans-124.6105.5173.600000110.2R279 T283 T284R279-A281 PolarHBondContact O-N 2.93Å; A281-T283 VanDerWaalsContact C-N 3.3Å; A281-T283 PolarHBondContact O-N 3.46Å; A281-T284 HydrophobicContact CB-CG2 3.93Å; A281-T284 PolarHBondContact O-N 2.9Å; A281-T284 PolarHBondContact O-OG1 3.39Å
282T72.1Confident79.8Confident20 Ų2045 Ų4512%0.12325%0.247CC..G310 helixtrans-60.1-37.2-178.448.40000112.5E258 T277 T284 A285E258-T282 HydrophobicContact CB-CG2 4.19Å; E258-T282 WeakPolarHBondContact O-CB 3.14Å; E258-T282 PolarHBondContact OE2-OG1 2.64Å; T277-T282 HydrophobicContact CG2-CG2 3.68Å; T282-T284 PolarHBondContact O-N 3.45Å; T282-T284 VanDerWaalsContact O-N 3.09Å; T282-A285 VanDerWaalsContact O-CB 3.32Å; T282-A285 WeakPolarHBondContact O-CB 3.21Å; T282-A285 PolarHBondContact O-N 3.03Å
283T67.2Low79.9Confident78 Ų7845.1 Ų45.148%0.47925%0.248SC..G310 helixtrans-60.2-21179.157.90000114.4F253 A281 A285F253-T283 HydrophobicContact CE2-CG2 4.41Å; F253-T283 HydrophobicContact CZ-CG2 4.1Å; A281-T283 VanDerWaalsContact C-N 3.3Å; A281-T283 PolarHBondContact O-N 3.46Å; T283-A285 VanDerWaalsContact C-N 3.32Å
284T67.4Low79.9Confident77 Ų7745 Ų4547%0.47225%0.247SC..G310 helixtrans-79.3-14.4176.369.50000113.2R279 A281 T282 K286R279-T284 PolarHBondContact NH1-O 3.44Å; A281-T284 HydrophobicContact CB-CG2 3.93Å; A281-T284 PolarHBondContact O-N 2.9Å; A281-T284 PolarHBondContact O-OG1 3.39Å; T282-T284 PolarHBondContact O-N 3.45Å; T282-T284 VanDerWaalsContact O-N 3.09Å; T284-K286 PolarHBondContact O-N 3.22Å
285A67.7Low79.9Confident18 Ų1846 Ų4615%0.14925%0.252CS..  trans-83.157-175.500000112.7T277 T282 T283 S287T277-A285 HydrophobicContact CG2-CB 3.78Å; T282-A285 VanDerWaalsContact O-CB 3.32Å; T282-A285 WeakPolarHBondContact O-CB 3.21Å; T282-A285 PolarHBondContact O-N 3.03Å; T283-A285 VanDerWaalsContact C-N 3.32Å; A285-S287 PolarHBondContact O-N 3.46Å
286K78.4Confident80Confident118 Ų11842.7 Ų42.751%0.51324%0.24SC..  trans-71.8100.5-179.1-62.2178.8-177178.10111.1T284 K511T284-K286 PolarHBondContact O-N 3.22Å; K286-K511 PolarHBondContact O-NZ 3.4Å
287S83.2Confident80.2Confident6 Ų643.9 Ų43.94%0.04225%0.245CC..  trans-87.1152.6171.9-173.20000111.3A285 K289 E515A285-S287 PolarHBondContact O-N 3.46Å; S287-K289 VanDerWaalsContact C-N 3.31Å; S287-K289 PolarHBondContact OG-N 2.85Å; S287-E515 PolarHBondContact OG-OE2 3.06Å
288S83.9Confident80.3Confident5 Ų545.8 Ų45.84%0.03525%0.251CS..G310 helixtrans-70.7-29.7169.757.80000112.2A290 L291 E515 H516S288-A290 PolarHBondContact O-N 2.87Å; S288-A290 VanDerWaalsContact O-N 3.13Å; S288-L291 WeakPolarHBondContact O-CB 3.11Å; S288-L291 WeakPolarHBondContact O-CD1 3.34Å; S288-L291 WeakPolarHBondContact O-CG 3.36Å; S288-L291 PolarHBondContact O-N 3.15Å; S288-E515 PolarHBondContact N-OE2 2.99Å; S288-E515 PolarHBondContact OG-OE2 2.88Å; S288-H516 PolarHBondContact OG-CE1 2.92Å
289K87.6Confident80.5Confident43 Ų4343 Ų4319%0.18725%0.249CC..G310 helixtrans-73.95.6177.7-56.8-169.8-177.1-175.40115.1T262 C263 D264 S287 H317 I319T262-K289 WeakPolarHBondContact CA-O 3.42Å; C263-K289 PolarHBondContact N-O 3.12Å; C263-K289 WeakPolarHBondContact O-CB 3.31Å; D264-K289 HydrophobicContact CB-CD 4.23Å; D264-K289 VanDerWaalsContact CG-CD 3.45Å; D264-K289 WeakPolarHBondContact OD1-CD 3.44Å; D264-K289 IonicContact OD1-NZ 2.85Å; D264-K289 PolarHBondContact OD1-NZ 3.3Å; D264-K289 VanDerWaalsContact OD2-CD 3.23Å; D264-K289 WeakPolarHBondContact OD2-CD 3.17Å; D264-K289 IonicContact OD2-NZ 3.13Å; D264-K289 PolarHBondContact OD2-NZ 2.68Å; S287-K289 VanDerWaalsContact C-N 3.31Å; S287-K289 PolarHBondContact OG-N 2.85Å; K289-H317 PolarHBondContact O-NE2 3.21Å; K289-I319 HydrophobicContact CB-CD1 4.41Å; K289-I319 HydrophobicContact CG-CD1 3.95Å
290A90Very high80.7Confident1 Ų140.3 Ų40.31%0.00824%0.244CC..G310 helixtrans-107.210.7179.700000112.5R251 F260 T262 S288 W292R251-A290 HydrophobicContact CG-CB 4.5Å; F260-A290 HydrophobicContact CB-CB 4.33Å; T262-A290 HydrophobicContact CG2-CB 3.62Å; S288-A290 PolarHBondContact O-N 2.87Å; S288-A290 VanDerWaalsContact O-N 3.13Å; A290-W292 VanDerWaalsContact O-CD1 3.24Å
291L91.7Very high81Confident1 Ų138.5 Ų38.51%0.00522%0.223CC..  trans-99128.7-168.6-67.7171.7000111.2V249 R251 S288 H317 L318 V435 L443V249-L291 HydrophobicContact CG1-CB 4.06Å; V249-L291 HydrophobicContact CG1-CD2 3.94Å; V249-L291 HydrophobicContact CG1-CG 4.5Å; R251-L291 HydrophobicContact CG-CD2 3.78Å; S288-L291 WeakPolarHBondContact O-CB 3.11Å; S288-L291 WeakPolarHBondContact O-CD1 3.34Å; S288-L291 WeakPolarHBondContact O-CG 3.36Å; S288-L291 PolarHBondContact O-N 3.15Å; L291-H317 PolarHBondContact O-CD2 3.06Å; L291-L318 HydrophobicContact CB-CB 4.01Å; L291-L318 HydrophobicContact CB-CD2 4.01Å; L291-L318 HydrophobicContact CD1-CD2 4.18Å; L291-L318 WeakPolarHBondContact O-CB 3.44Å; L291-L318 PolarHBondContact O-N 2.81Å; L291-V435 HydrophobicContact CD2-CB 4.11Å; L291-V435 HydrophobicContact CD2-CG1 3.92Å; L291-V435 HydrophobicContact CD2-CG2 3.26Å; L291-L443 HydrophobicContact CD1-CD1 3.32Å
292W92.9Very high81.3Confident0 Ų039.6 Ų39.60%022%0.217CC..EExtended strand (participates in β ladder)trans-126.9124.6-177.1-58.588.3000109.3V249 I250 L261 C263 V272 A290 L315 K316 H317 L324 L357V249-W292 CarbonylContact C-O 3.57Å; V249-W292 WeakPolarHBondContact CA-O 3.29Å; I250-W292 HydrophobicContact CG1-CB 4.38Å; I250-W292 PolarHBondContact N-O 2.83Å; I250-W292 PolarHBondContact O-N 2.83Å; L261-W292 HydrophobicContact CD2-CZ2 4.14Å; L261-W292 HydrophobicContact CG-CZ2 4.05Å; L261-W292 PolarHBondContact O-NE1 2.7Å; C263-W292 HydrophobicContact CB-CH2 4.35Å; C263-W292 HydrophobicContact CB-CZ2 4.33Å; V272-W292 HydrophobicContact CG1-CH2 4.25Å; V272-W292 HydrophobicContact CG1-CZ2 4.29Å; V272-W292 HydrophobicContact CG2-CH2 4.17Å; A290-W292 VanDerWaalsContact O-CD1 3.24Å; W292-L315 HydrophobicContact CE3-CB 4.21Å; W292-K316 CarbonylContact C-O 3.59Å; W292-K316 VanDerWaalsContact CA-O 3.28Å; W292-K316 WeakPolarHBondContact CA-O 3.48Å; W292-H317 HydrophobicContact CE3-CB 3.87Å; W292-H317 HydrophobicContact CH2-CB 4.01Å; W292-H317 HydrophobicContact CZ3-CB 3.58Å; W292-L324 HydrophobicContact CH2-CD1 4.1Å; W292-L324 HydrophobicContact CZ3-CB 4.08Å; W292-L324 HydrophobicContact CZ3-CD1 4.29Å; W292-L357 HydrophobicContact CH2-CD2 3.96Å; W292-L357 HydrophobicContact CZ3-CD2 3.9Å
293E91.4Very high81.7Confident8 Ų840.9 Ų40.94%0.03722%0.22CC..EExtended strand (participates in β ladder)trans-80.8129.5167.8-175.5178.5-179.100108.5R61 R64 D248 K316 L318R61-E293 WeakPolarHBondContact CD-OE1 3.2Å; R61-E293 WeakPolarHBondContact CG-OE1 3.34Å; R64-E293 IonicContact CZ-OE1 3.18Å; R64-E293 IonicContact NH1-OE1 3.52Å; R64-E293 PolarHBondContact NH1-OE1 2.99Å; R64-E293 IonicContact NH2-OE1 3.97Å; R64-E293 PolarHBondContact NH2-OE1 2.99Å; D248-E293 WeakPolarHBondContact O-CA 3.44Å; E293-K316 HydrophobicContact CB-CB 4.36Å; E293-K316 PolarHBondContact N-O 3.46Å; E293-K316 PolarHBondContact O-N 3.12Å; E293-L318 HydrophobicContact CB-CD1 4.47Å
294V91.1Very high82.5Confident0 Ų037.6 Ų37.60%020%0.2CC..EExtended strand (participates in β ladder)trans-92129.9179.3-177.60000109.4L244 G246 G247 D248 I250 F313 L315L244-V294 HydrophobicContact CD1-CG2 4.17Å; L244-V294 HydrophobicContact CD2-CG1 4.43Å; G246-V294 WeakPolarHBondContact CA-O 3.14Å; G247-V294 PolarHBondContact N-O 3.14Å; D248-V294 PolarHBondContact O-N 3.34Å; I250-V294 HydrophobicContact CD1-CG2 3.41Å; I250-V294 VanDerWaalsContact CD1-CG2 3.41Å; I250-V294 HydrophobicContact CG1-CG2 3.61Å; I250-V294 HydrophobicContact CG2-CG2 4.15Å; V294-F313 HydrophobicContact CG1-CD1 3.75Å; V294-F313 HydrophobicContact CG1-CE1 4.41Å; V294-L315 HydrophobicContact CG2-CD2 4Å
295E89.1Confident83.3Confident22 Ų2234.1 Ų34.110%0.10318%0.179CC..EExtended strand (participates in β ladder)trans-113.2120.6169.5-65.5179.8176.800109.3F313 R314 Y323E295-F313 CarbonylContact O-C 3.56Å; E295-F313 VanDerWaalsContact O-CA 3.32Å; E295-F313 WeakPolarHBondContact O-CA 3.48Å; E295-R314 HydrophobicContact CB-CB 4.22Å; E295-R314 PolarHBondContact N-O 2.89Å; E295-R314 PolarHBondContact O-N 3.3Å; E295-Y323 PolarHBondContact OE1-OH 2.79Å; E295-Y323 WeakPolarHBondContact OE2-CE1 3.43Å
296V88.8Confident84.3Confident9 Ų933.4 Ų33.46%0.05517%0.173CC..EExtended strand (participates in β ladder)trans-87.5120172-174.40000107.7H298 T304 F313V296-H298 PolarHBondContact O-N 3.34Å; V296-T304 PolarHBondContact N-OG1 3.03Å; V296-T304 PolarHBondContact O-OG1 3.26Å; V296-F313 HydrophobicContact CG2-CD1 3.92Å; V296-F313 HydrophobicContact CG2-CE1 3.69Å
297I86.1Confident84.7Confident50 Ų5027.8 Ų27.826%0.25615%0.149SC..  trans-72.5122.6-178.8-63.7170.9000108.6L312 R314 V366I297-L312 HydrophobicContact CB-CB 4.08Å; I297-L312 WeakPolarHBondContact CB-O 3.26Å; I297-L312 HydrophobicContact CD1-CB 3.83Å; I297-L312 HydrophobicContact CG1-CB 4.38Å; I297-L312 PolarHBondContact N-O 3Å; I297-R314 HydrophobicContact CD1-CG 4Å; I297-R314 HydrophobicContact CG1-CG 4.24Å; I297-V366 HydrophobicContact CD1-CB 4.2Å; I297-V366 HydrophobicContact CD1-CG1 3.51Å; I297-V366 HydrophobicContact CD1-CG2 3.71Å
298H81.9Confident85Confident79 Ų7929.8 Ų29.837%0.36616%0.157SC..  trans-110.7164.1176.3-162.377.9000110.6V296 D300 R303V296-H298 PolarHBondContact O-N 3.34Å; H298-D300 VanDerWaalsContact C-N 3.33Å; H298-D300 PolarHBondContact CD2-N 2.97Å; H298-R303 HydrophobicContact CB-CB 4.34Å; H298-R303 WeakPolarHBondContact CB-O 3.1Å
299S74.3Confident85.1Confident85 Ų8532.2 Ų32.259%0.59417%0.166SC*.SBendtrans-63.2-40176.852.80000112
300D74Confident85Confident60 Ų6034.3 Ų34.332%0.32118%0.179SC..SBendtrans-83.4118.6167.6-173.6-3.4000110.4H298 R302 R303H298-D300 VanDerWaalsContact C-N 3.33Å; H298-D300 PolarHBondContact CD2-N 2.97Å; D300-R302 PolarHBondContact O-N 3.37Å; D300-R302 PolarHBondContact OD1-N 3.46Å; D300-R303 HydrophobicContact CB-CB 4.25Å; D300-R303 HydrophobicContact CB-CG 4.19Å; D300-R303 PolarHBondContact O-N 3.09Å; D300-R303 VanDerWaalsContact O-N 3.08Å; D300-R303 IonicContact OD2-NE 3.02Å
301C72.4Confident85Confident84 Ų8435.1 Ų35.157%0.56818%0.184SC*.THydrogen-bonded Turntrans-59-15177-64.40000114.1T56T56-C301 HydrophobicContact CG2-CB 3.92Å
302R75.2Confident85Confident67 Ų6737 Ų3725%0.25320%0.195SC..THydrogen-bonded Turntrans-90.9-9-179.8-62175.7179.8170.51.6114.1L59 D300L59-R302 HydrophobicContact CD1-CB 4.26Å; L59-R302 HydrophobicContact CD1-CG 4.46Å; D300-R302 PolarHBondContact O-N 3.37Å; D300-R302 PolarHBondContact OD1-N 3.46Å
303R81.2Confident85Confident48 Ų4837 Ų3718%0.18120%0.195CC..  trans-116.4158-171.5-70.9178.1-178.8-150-2.8111.6E14 L232 Y233 H298 D300E14-R303 VanDerWaalsContact CD-NH1 3.29Å; E14-R303 IonicContact OE1-NH1 2.72Å; E14-R303 PolarHBondContact OE1-NH1 2.9Å; E14-R303 IonicContact OE2-CZ 2.84Å; E14-R303 IonicContact OE2-NH1 2.89Å; E14-R303 PolarHBondContact OE2-NH1 2.84Å; E14-R303 IonicContact OE2-NH2 3.29Å; E14-R303 PolarHBondContact OE2-NH2 3.28Å; L232-R303 WeakPolarHBondContact O-CG 3.49Å; Y233-R303 WeakPolarHBondContact O-CA 3.43Å; H298-R303 HydrophobicContact CB-CB 4.34Å; H298-R303 WeakPolarHBondContact CB-O 3.1Å; D300-R303 HydrophobicContact CB-CB 4.25Å; D300-R303 HydrophobicContact CB-CG 4.19Å; D300-R303 PolarHBondContact O-N 3.09Å; D300-R303 VanDerWaalsContact O-N 3.08Å; D300-R303 IonicContact OD2-NE 3.02Å
304T84.2Confident85Confident9 Ų938.4 Ų38.46%0.05520%0.199CC..  trans-131.8173.1161.7-155.70000108.8Y233 L234 G246 V296Y233-T304 HydrophobicContact CD1-CG2 4.03Å; Y233-T304 HydrophobicContact CE1-CG2 3.39Å; Y233-T304 HydrophobicContact CE2-CG2 4.24Å; Y233-T304 VanDerWaalsContact CZ-CG2 3.49Å; Y233-T304 PolarHBondContact O-N 2.97Å; Y233-T304 VanDerWaalsContact O-O 3.08Å; L234-T304 HydrophobicContact CB-CG2 4.3Å; L234-T304 HydrophobicContact CD1-CG2 4.13Å; G246-T304 WeakPolarHBondContact CA-OG1 3.24Å; V296-T304 PolarHBondContact N-OG1 3.03Å; V296-T304 PolarHBondContact O-OG1 3.26Å
305G84.9Confident85Confident3 Ų338.4 Ų38.43%0.03120%0.199CC..  trans-148.8-173.3-177.900000112.1D238 G246D238-G305 WeakPolarHBondContact OD2-CA 3.26Å; G246-G305 PolarHBondContact N-O 2.75Å; G246-G305 VanDerWaalsContact N-O 3.12Å
306A86.9Confident85.1Confident3 Ų338.3 Ų38.33%0.02520%0.199CC..BIsolated β-bridgetrans-65.2139.4169.600000110.6D238 H308 F381D238-A306 HydrophobicContact CB-CB 4.04Å; D238-A306 PolarHBondContact OD2-N 3.31Å; A306-H308 PolarHBondContact O-CE1 3.25Å; A306-H308 PolarHBondContact O-N 3.24Å; A306-H308 PolarHBondContact O-ND1 3.13Å; A306-F381 HydrophobicContact CB-CD1 3.86Å; A306-F381 HydrophobicContact CB-CE1 3.57Å
307G87.2Confident85.2Confident0 Ų038 Ų380%020%0.197CC..  trans-79.2115.7179.500000111.5L244 I382L244-G307 VanDerWaalsContact O-CA 3.3Å; L244-G307 WeakPolarHBondContact O-CA 3.47Å; L244-G307 PolarHBondContact O-N 3.35Å; G307-I382 PolarHBondContact O-N 3.49Å
308H89.2Confident85.2Confident48 Ų4836.8 Ų36.822%0.22219%0.19CC..BIsolated β-bridgetrans-102.2161.3174-5478.1000110.5A306 N310 S311 D379 G380 F381A306-H308 PolarHBondContact O-CE1 3.25Å; A306-H308 PolarHBondContact O-N 3.24Å; A306-H308 PolarHBondContact O-ND1 3.13Å; H308-N310 VanDerWaalsContact CB-OD1 3.32Å; H308-N310 WeakPolarHBondContact CB-OD1 3.33Å; H308-N310 PolarHBondContact O-N 3.28Å; H308-S311 WeakPolarHBondContact CB-OG 3.3Å; H308-S311 PolarHBondContact N-OG 3.35Å; H308-S311 WeakPolarHBondContact O-CB 3.45Å; H308-S311 PolarHBondContact O-N 3.21Å; H308-S311 PolarHBondContact O-OG 3.22Å; H308-D379 PolarHBondContact CD2-O 2.97Å; H308-G380 WeakPolarHBondContact CA-O 3.39Å; H308-F381 AromaticContact CD2-CD1 3.79Å; H308-F381 AromaticContact CD2-CE1 3.73Å; H308-F381 AromaticContact CE1-CE1 3.65Å; H308-F381 AromaticContact NE2-CD1 3.66Å; H308-F381 AromaticContact NE2-CE1 3.11Å; H308-F381 WeakPolarHBondContact NE2-CE1 3.23Å; H308-F381 AromaticContact NE2-CZ 3.77Å
309W85.8Confident85.3Confident57 Ų5735.4 Ų35.422%0.21619%0.185CC..THydrogen-bonded Turntrans-62.1-24.6178.2-70.2110.8000114.3S371 G380 F381 I382 A386 V388W309-S371 VanDerWaalsContact CZ3-CA 3.49Å; W309-G380 PolarHBondContact N-O 3.47Å; W309-F381 PolarHBondContact NE1-O 2.84Å; W309-I382 HydrophobicContact CD2-CD1 4.38Å; W309-I382 HydrophobicContact CD2-CG1 3.77Å; W309-I382 HydrophobicContact CE3-CD1 3.97Å; W309-I382 HydrophobicContact CE3-CG1 3.83Å; W309-I382 HydrophobicContact CG-CG1 4.29Å; W309-I382 HydrophobicContact CH2-CG1 4.26Å; W309-I382 HydrophobicContact CH2-CG2 4.06Å; W309-I382 HydrophobicContact CZ2-CB 4.45Å; W309-I382 HydrophobicContact CZ2-CG1 4.19Å; W309-I382 HydrophobicContact CZ2-CG2 4.27Å; W309-I382 HydrophobicContact CZ3-CD1 4.16Å; W309-I382 HydrophobicContact CZ3-CG1 4.08Å; W309-I382 HydrophobicContact CZ3-CG2 4.43Å; W309-A386 HydrophobicContact CH2-CB 4.12Å; W309-V388 HydrophobicContact CH2-CG1 3.9Å; W309-V388 HydrophobicContact CZ3-CG1 3.75Å
310N85.8Confident85.7Confident87 Ų8733.7 Ų33.747%0.46517%0.171SC..THydrogen-bonded Turntrans-930.8173.964.22.1000113.7H308 D379H308-N310 VanDerWaalsContact CB-OD1 3.32Å; H308-N310 WeakPolarHBondContact CB-OD1 3.33Å; H308-N310 PolarHBondContact O-N 3.28Å; N310-D379 PolarHBondContact ND2-OD1 2.98Å
311S90.3Very high86.1Confident17 Ų1732.3 Ų32.312%0.11917%0.171CC..  trans-74154.6179.8-63.70000111.8H308 F313H308-S311 WeakPolarHBondContact CB-OG 3.3Å; H308-S311 PolarHBondContact N-OG 3.35Å; H308-S311 WeakPolarHBondContact O-CB 3.45Å; H308-S311 PolarHBondContact O-N 3.21Å; H308-S311 PolarHBondContact O-OG 3.22Å; S311-F313 WeakPolarHBondContact O-CD2 3.43Å; S311-F313 WeakPolarHBondContact O-CE2 3.35Å
312L92.1Very high86.9Confident42 Ų4229.7 Ų29.722%0.2215%0.151CC..EExtended strand (participates in β ladder)trans-100.2136.7173.3-59.9174.7000109.2I297 V366 E368 T393I297-L312 HydrophobicContact CB-CB 4.08Å; I297-L312 WeakPolarHBondContact CB-O 3.26Å; I297-L312 HydrophobicContact CD1-CB 3.83Å; I297-L312 HydrophobicContact CG1-CB 4.38Å; I297-L312 PolarHBondContact N-O 3Å; L312-V366 HydrophobicContact CB-CG1 3.82Å; L312-V366 HydrophobicContact CD1-CG1 4.32Å; L312-V366 HydrophobicContact CD2-CG1 4.23Å; L312-V366 HydrophobicContact CG-CG1 4.36Å; L312-E368 HydrophobicContact CD2-CG 3.52Å; L312-T393 HydrophobicContact CD2-CG2 4.08Å
313F92.2Very high87.6Confident0 Ų026.7 Ų26.70%014%0.14CC..EExtended strand (participates in β ladder)trans-121.8148.5-172.6-59.9-90.8000111.8L244 V294 E295 V296 S311 F367 M369 I382L244-F313 HydrophobicContact CD2-CE1 4.19Å; V294-F313 HydrophobicContact CG1-CD1 3.75Å; V294-F313 HydrophobicContact CG1-CE1 4.41Å; E295-F313 CarbonylContact O-C 3.56Å; E295-F313 VanDerWaalsContact O-CA 3.32Å; E295-F313 WeakPolarHBondContact O-CA 3.48Å; V296-F313 HydrophobicContact CG2-CD1 3.92Å; V296-F313 HydrophobicContact CG2-CE1 3.69Å; S311-F313 WeakPolarHBondContact O-CD2 3.43Å; S311-F313 WeakPolarHBondContact O-CE2 3.35Å; F313-F367 PolarHBondContact N-O 3.17Å; F313-F367 PolarHBondContact O-N 3.23Å; F313-M369 HydrophobicContact CB-CE 3.96Å; F313-M369 HydrophobicContact CD1-CE 4.06Å; F313-M369 HydrophobicContact CD2-CB 4.34Å; F313-M369 HydrophobicContact CD2-CE 4.22Å; F313-M369 HydrophobicContact CD2-CG 3.85Å; F313-M369 HydrophobicContact CD2-SD 4.21Å; F313-M369 HydrophobicContact CE2-CB 4.2Å; F313-M369 HydrophobicContact CE2-CG 4.13Å; F313-M369 HydrophobicContact CE2-SD 4.31Å; F313-M369 HydrophobicContact CG-CE 3.82Å; F313-M369 HydrophobicContact CG-CG 4.4Å; F313-M369 HydrophobicContact CG-SD 4.33Å; F313-I382 HydrophobicContact CE1-CD1 4.38Å; F313-I382 HydrophobicContact CE2-CD1 3.91Å; F313-I382 HydrophobicContact CZ-CD1 3.48Å; F313-I382 VanDerWaalsContact CZ-CD1 3.48Å
314R91.5Very high88.1Confident36 Ų3624.4 Ų24.414%0.13613%0.131CC..EExtended strand (participates in β ladder)trans-116.5146.6159.4-56.1-170.9172.998.30.9109.7E295 I297 Y323 T362 T365E295-R314 HydrophobicContact CB-CB 4.22Å; E295-R314 PolarHBondContact N-O 2.89Å; E295-R314 PolarHBondContact O-N 3.3Å; I297-R314 HydrophobicContact CD1-CG 4Å; I297-R314 HydrophobicContact CG1-CG 4.24Å; R314-Y323 HydrophobicContact CB-CD1 4.11Å; R314-Y323 HydrophobicContact CB-CE1 4.48Å; R314-T362 PolarHBondContact NH2-O 3.46Å; R314-T365 WeakPolarHBondContact CD-OG1 3.35Å; R314-T365 PolarHBondContact NE-OG1 3.05Å; R314-T365 VanDerWaalsContact NE-OG1 3.15Å
315L92.3Very high88.4Confident0 Ų024.4 Ų24.40%013%0.131CC..EExtended strand (participates in β ladder)trans-114.8115.7177.8-62.6174.1000108.6I250 L252 W292 V294 Y323 L324 M369I250-L315 HydrophobicContact CD1-CD2 4.42Å; L252-L315 HydrophobicContact CD1-CD1 3.78Å; W292-L315 HydrophobicContact CE3-CB 4.21Å; V294-L315 HydrophobicContact CG2-CD2 4Å; L315-Y323 CarbonylContact O-C 3.56Å; L315-Y323 WeakPolarHBondContact O-CA 3.34Å; L315-L324 HydrophobicContact CB-CB 4.12Å; L315-L324 HydrophobicContact CB-CD2 4.38Å; L315-L324 HydrophobicContact CD1-CD2 3.9Å; L315-L324 PolarHBondContact O-N 3.3Å; L315-M369 HydrophobicContact CD2-CE 4.11Å
316K90.6Very high88.4Confident20 Ų2024.7 Ų24.79%0.08713%0.133CC..EExtended strand (participates in β ladder)trans-106.5122.4-179.1-174.5-178.5-173.6172.70109.8W292 E293 L318 G321 L322 Y323W292-K316 CarbonylContact C-O 3.59Å; W292-K316 VanDerWaalsContact CA-O 3.28Å; W292-K316 WeakPolarHBondContact CA-O 3.48Å; E293-K316 HydrophobicContact CB-CB 4.36Å; E293-K316 PolarHBondContact N-O 3.46Å; E293-K316 PolarHBondContact O-N 3.12Å; K316-L318 PolarHBondContact O-N 3.22Å; K316-G321 WeakPolarHBondContact CE-O 3.34Å; K316-L322 CarbonylContact C-O 3.51Å; K316-L322 WeakPolarHBondContact CA-O 3.29Å; K316-Y323 HydrophobicContact CB-CD1 3.95Å; K316-Y323 HydrophobicContact CB-CE1 3.9Å; K316-Y323 HydrophobicContact CD-CE1 4Å; K316-Y323 HydrophobicContact CG-CD1 4.28Å; K316-Y323 HydrophobicContact CG-CE1 4.07Å
317H90.9Very high88.1Confident4 Ų429.8 Ų29.82%0.01916%0.155CC..EExtended strand (participates in β ladder)trans-67.7120.5176-176.9-121.7000109.6K289 L291 W292 I319 T320 G321 L322 L357K289-H317 PolarHBondContact O-NE2 3.21Å; L291-H317 PolarHBondContact O-CD2 3.06Å; W292-H317 HydrophobicContact CE3-CB 3.87Å; W292-H317 HydrophobicContact CH2-CB 4.01Å; W292-H317 HydrophobicContact CZ3-CB 3.58Å; H317-I319 VanDerWaalsContact C-N 3.35Å; H317-I319 PolarHBondContact O-N 3.26Å; H317-T320 WeakPolarHBondContact CB-OG1 3.28Å; H317-T320 WeakPolarHBondContact ND1-CG2 3.34Å; H317-T320 PolarHBondContact ND1-N 3.33Å; H317-T320 PolarHBondContact ND1-OG1 3.36Å; H317-T320 PolarHBondContact O-N 2.94Å; H317-G321 WeakPolarHBondContact O-CA 3.4Å; H317-G321 PolarHBondContact O-N 2.65Å; H317-L322 PolarHBondContact N-O 3.13Å; H317-L357 HydrophobicContact CB-CD1 4.38Å; H317-L357 HydrophobicContact CB-CD2 4.32Å
318L86.1Confident87.2Confident23 Ų2333.9 Ų33.912%0.1218%0.176CC..THydrogen-bonded Turntrans-62.9-40-166.2-174.367.3000112.7V249 L291 E293 K316 V440 L443V249-L318 HydrophobicContact CG1-CD2 3.94Å; V249-L318 HydrophobicContact CG2-CD1 4.3Å; V249-L318 HydrophobicContact CG2-CD2 4.4Å; L291-L318 HydrophobicContact CB-CB 4.01Å; L291-L318 HydrophobicContact CB-CD2 4.01Å; L291-L318 HydrophobicContact CD1-CD2 4.18Å; L291-L318 WeakPolarHBondContact O-CB 3.44Å; L291-L318 PolarHBondContact O-N 2.81Å; E293-L318 HydrophobicContact CB-CD1 4.47Å; K316-L318 PolarHBondContact O-N 3.22Å; L318-V440 HydrophobicContact CD2-CG1 4.33Å; L318-L443 HydrophobicContact CD2-CD1 4.25Å; L318-L443 HydrophobicContact CD2-CD2 3.71Å; L318-L443 HydrophobicContact CG-CD2 4.1Å
319I83.3Confident85.9Confident50 Ų5035.5 Ų35.526%0.25619%0.185SC..THydrogen-bonded Turntrans-73.9-46.4-175.9-61.8178.1000111.4K289 H317 L443K289-I319 HydrophobicContact CB-CD1 4.41Å; K289-I319 HydrophobicContact CG-CD1 3.95Å; H317-I319 VanDerWaalsContact C-N 3.35Å; H317-I319 PolarHBondContact O-N 3.26Å; I319-L443 HydrophobicContact CG1-CD1 4.44Å
320T84Confident84.4Confident50 Ų5040.4 Ų40.431%0.30721%0.208SC..THydrogen-bonded Turntrans-85.2-20.7-175.8580000112.4L270 H317 L322L270-T320 HydrophobicContact CD1-CG2 4.09Å; L270-T320 HydrophobicContact CD2-CG2 4.29Å; H317-T320 WeakPolarHBondContact CB-OG1 3.28Å; H317-T320 WeakPolarHBondContact ND1-CG2 3.34Å; H317-T320 PolarHBondContact ND1-N 3.33Å; H317-T320 PolarHBondContact ND1-OG1 3.36Å; H317-T320 PolarHBondContact O-N 2.94Å; T320-L322 PolarHBondContact O-N 2.9Å
321G83Confident82.7Confident30 Ų3040.4 Ų40.431%0.30921%0.207SC..  trans7114.4-175.500000114K316 H317K316-G321 WeakPolarHBondContact CE-O 3.34Å; H317-G321 WeakPolarHBondContact O-CA 3.4Å; H317-G321 PolarHBondContact O-N 2.65Å
322L88.9Confident80.4Confident29 Ų2945.8 Ų45.815%0.15223%0.234CC..PPolyproline II helixtrans-99.5153.1-177.1-55176.5000111.3L270 K316 H317 T320 L357 S358 K359L270-L322 HydrophobicContact CD1-CD1 3.75Å; K316-L322 CarbonylContact C-O 3.51Å; K316-L322 WeakPolarHBondContact CA-O 3.29Å; H317-L322 PolarHBondContact N-O 3.13Å; T320-L322 PolarHBondContact O-N 2.9Å; L322-L357 HydrophobicContact CB-CB 3.8Å; L322-L357 HydrophobicContact CB-CD1 4.11Å; L322-L357 HydrophobicContact CB-CD2 4.45Å; L322-L357 HydrophobicContact CB-CG 4.35Å; L322-L357 HydrophobicContact CD1-CB 3.9Å; L322-L357 HydrophobicContact CD1-CD1 4.07Å; L322-S358 CarbonylContact C-O 3.5Å; L322-S358 WeakPolarHBondContact CB-O 3.28Å; L322-K359 HydrophobicContact CD2-CB 4.12Å; L322-K359 HydrophobicContact CD2-CG 3.38Å
323Y90.1Very high78Confident4 Ų450.5 Ų50.52%0.01626%0.26CS..EExtended strand (participates in β ladder)trans-90141.2179.8-61.8-79.9000111.9E295 R314 L315 K316 C325 L357 S358 P361 T365E295-Y323 PolarHBondContact OE1-OH 2.79Å; E295-Y323 WeakPolarHBondContact OE2-CE1 3.43Å; R314-Y323 HydrophobicContact CB-CD1 4.11Å; R314-Y323 HydrophobicContact CB-CE1 4.48Å; L315-Y323 CarbonylContact O-C 3.56Å; L315-Y323 WeakPolarHBondContact O-CA 3.34Å; K316-Y323 HydrophobicContact CB-CD1 3.95Å; K316-Y323 HydrophobicContact CB-CE1 3.9Å; K316-Y323 HydrophobicContact CD-CE1 4Å; K316-Y323 HydrophobicContact CG-CD1 4.28Å; K316-Y323 HydrophobicContact CG-CE1 4.07Å; Y323-C325 PolarHBondContact O-N 3.46Å; Y323-L357 CarbonylContact O-C 3.57Å; Y323-L357 VanDerWaalsContact O-CA 3.26Å; Y323-L357 WeakPolarHBondContact O-CA 3.42Å; Y323-S358 PolarHBondContact N-O 3.49Å; Y323-S358 PolarHBondContact O-N 2.86Å; Y323-P361 HydrophobicContact CD2-CB 4.2Å; Y323-P361 HydrophobicContact CE2-CB 3.88Å; Y323-P361 HydrophobicContact CE2-CG 4.18Å; Y323-T365 HydrophobicContact CG-CG2 4.48Å
324L91.6Very high75.3Confident0 Ų059.7 Ų59.70%030%0.3CS..EExtended strand (participates in β ladder)trans-61.5131.1169.2-171.766.7000109.8V272 W292 L315 L355 T365 F367V272-L324 HydrophobicContact CB-CD1 4.41Å; V272-L324 HydrophobicContact CG1-CD1 3.93Å; V272-L324 HydrophobicContact CG2-CD1 4.03Å; W292-L324 HydrophobicContact CH2-CD1 4.1Å; W292-L324 HydrophobicContact CZ3-CB 4.08Å; W292-L324 HydrophobicContact CZ3-CD1 4.29Å; L315-L324 HydrophobicContact CB-CB 4.12Å; L315-L324 HydrophobicContact CB-CD2 4.38Å; L315-L324 HydrophobicContact CD1-CD2 3.9Å; L315-L324 PolarHBondContact O-N 3.3Å; L324-L355 HydrophobicContact CD1-CB 4.12Å; L324-L355 HydrophobicContact CD1-CD1 4.49Å; L324-L355 HydrophobicContact CD1-CD2 4.32Å; L324-L355 HydrophobicContact CG-CD2 4.36Å; L324-T365 WeakPolarHBondContact O-CA 3.46Å; L324-F367 HydrophobicContact CB-CE2 4.05Å; L324-F367 HydrophobicContact CB-CZ 4.36Å; L324-F367 HydrophobicContact CD2-CE1 4.47Å; L324-F367 HydrophobicContact CD2-CE2 4.06Å; L324-F367 HydrophobicContact CD2-CZ 3.91Å; L324-F367 HydrophobicContact CG-CE2 4.06Å; L324-F367 HydrophobicContact CG-CZ 3.88Å; L324-F367 WeakPolarHBondContact O-CE2 3.31Å
325C89.6Confident72.9Confident9 Ų963 Ų636%0.06133%0.328CS..EExtended strand (participates in β ladder)trans-147153.7170.963.40000110.7Y323 T356 S358 T365Y323-C325 PolarHBondContact O-N 3.46Å; C325-T356 PolarHBondContact N-O 2.87Å; C325-T356 CarbonylContact O-C 3.55Å; C325-T356 PolarHBondContact O-N 3.46Å; C325-T356 WeakPolarHBondContact SG-CG2 3.26Å; C325-S358 VanDerWaalsContact SG-CB 3.52Å; C325-T365 HydrophobicContact CB-CG2 4.02Å
326P85.6Confident70Confident9 Ų966.9 Ų66.96%0.05837%0.369CS..EExtended strand (participates in β ladder)trans-85.5138.1170.730.2-25.8000112F354 L355 E364 H392 L420P326-F354 CarbonylContact C-O 3.53Å; P326-F354 WeakPolarHBondContact CA-O 3.28Å; P326-L355 HydrophobicContact CB-CD2 4.33Å; P326-E364 WeakPolarHBondContact CD-O 3.46Å; P326-H392 WeakPolarHBondContact CG-CE1 3.41Å; P326-H392 WeakPolarHBondContact CG-ND1 3.31Å; P326-L420 HydrophobicContact CB-CD1 3.33Å; P326-L420 HydrophobicContact CB-CG 4.4Å; P326-L420 HydrophobicContact CG-CD1 3.92Å
327K79.4Confident67.5Low111 Ų11174.6 Ų74.648%0.48341%0.405SS..EExtended strand (participates in β ladder)trans-101118.9168.1-170.6164.1173.3-175.80108.8S353 F354 T356K327-S353 WeakPolarHBondContact O-CA 3.44Å; K327-F354 HydrophobicContact CB-CD2 4.23Å; K327-F354 HydrophobicContact CB-CE1 4.34Å; K327-F354 HydrophobicContact CB-CE2 3.83Å; K327-F354 HydrophobicContact CB-CZ 3.9Å; K327-F354 HydrophobicContact CD-CE2 3.86Å; K327-F354 HydrophobicContact CD-CZ 3.6Å; K327-F354 HydrophobicContact CG-CE1 4.34Å; K327-F354 HydrophobicContact CG-CE2 4.19Å; K327-F354 HydrophobicContact CG-CZ 3.83Å; K327-F354 PolarHBondContact N-O 2.96Å; K327-F354 PolarHBondContact O-N 3.25Å; K327-T356 HydrophobicContact CB-CG2 3.72Å; K327-T356 HydrophobicContact CD-CG2 4.4Å
328I68.7Low64.7Low86 Ų8684.3 Ų84.344%0.44145%0.45SS..EExtended strand (participates in β ladder)trans-97.3116.9-179.2-57.6172.3000108.2I351I328-I351 HydrophobicContact CG2-CG2 3.34Å
329I63Low62.3Low82 Ų8285.6 Ų85.642%0.42147%0.469SS..EExtended strand (participates in β ladder)trans-100.4122.3169.9-61.9-173.7000108.2I331 E352 F354I329-I331 PolarHBondContact O-N 3.4Å; I329-E352 PolarHBondContact N-O 2.88Å; I329-E352 VanDerWaalsContact N-O 3.08Å; I329-F354 HydrophobicContact CD1-CE1 3.48Å; I329-F354 VanDerWaalsContact CD1-CE1 3.48Å; I329-F354 HydrophobicContact CD1-CZ 4.09Å; I329-F354 HydrophobicContact CG1-CE1 3.76Å; I329-F354 HydrophobicContact CG1-CZ 4.48Å
330K54.3Low59.9Low160 Ų16088.3 Ų88.370%0.69650%0.499SS*.EExtended strand (participates in β ladder)trans-83.8111.3167.8-71.1-177.7178.2-179.50108.4N332K330-N332 PolarHBondContact O-N 3.18Å; K330-N332 VanDerWaalsContact O-N 3.09Å
331I49.1Very low57.5Low86 Ų8695.2 Ų95.244%0.44153%0.525SS..  trans-73101169.5-55.9173.2000106.8I329 N333 E352I329-I331 PolarHBondContact O-N 3.4Å; I331-N333 PolarHBondContact O-N 3.02Å; I331-E352 HydrophobicContact CD1-CB 4.38Å
332N41.9Very low55.3Low130 Ų13098.8 Ų98.870%0.69555%0.545SS*.  trans-76.7105.1166.3-78.8-19.1000107.1K330 K334K330-N332 PolarHBondContact O-N 3.18Å; K330-N332 VanDerWaalsContact O-N 3.09Å; N332-K334 VanDerWaalsContact C-N 3.26Å; N332-K334 PolarHBondContact O-N 2.85Å
333N41.7Very low52.6Low142 Ų142107.3 Ų107.376%0.75958%0.581SS**  trans-58.589.3170.4-69.1-9.2000109.5I331I331-N333 PolarHBondContact O-N 3.02Å
334K36.7Very low49.9Very low193 Ų193115.7 Ų115.784%0.83962%0.621SS**  trans-124.148.5169-73.6-164.8178.6-175.70109.9N332N332-K334 VanDerWaalsContact C-N 3.26Å; N332-K334 PolarHBondContact O-N 2.85Å
335S40.4Very low47Very low105 Ų105123.9 Ų123.973%0.73466%0.659SS**  trans-112.798.815344.60000106.7E337S335-E337 VanDerWaalsContact C-N 3.34Å; S335-E337 PolarHBondContact O-N 3.25Å
336G31.9Very low44.4Very low82 Ų82133 Ų13385%0.84570%0.7SS**  trans-70.394.7168.100000108.5
337E36.8Very low42Very low181 Ų181139.3 Ų139.385%0.84673%0.734SS**  trans-122.6119.9156.6-74.9-168.916600108S335 G339S335-E337 VanDerWaalsContact C-N 3.34Å; S335-E337 PolarHBondContact O-N 3.25Å; E337-G339 VanDerWaalsContact C-N 3.25Å; E337-G339 PolarHBondContact O-N 3.5Å
338Q33.3Very low40.1Very low208 Ų208141.6 Ų141.697%0.97275%0.751SS**  trans-69.378.9-175.8-65.1170.8-8.400109.5
339G34.8Very low38.7Very low51 Ų51139.8 Ų139.853%0.52675%0.754SS.*  trans-104.2102.2169.500000109.5E337 F341E337-G339 VanDerWaalsContact C-N 3.25Å; E337-G339 PolarHBondContact O-N 3.5Å; G339-F341 VanDerWaalsContact C-N 3.34Å; G339-F341 PolarHBondContact O-N 2.71Å
340A33.2Very low37.6Very low106 Ų106140.5 Ų140.588%0.87677%0.765SS**  trans-64.588.7176.800000110.9
341F33.6Very low37.3Very low195 Ų195137.1 Ų137.186%0.85575%0.754SS**  trans-103.8127.2163-76.2-76.6000110.4G339G339-F341 VanDerWaalsContact C-N 3.34Å; G339-F341 PolarHBondContact O-N 2.71Å
342S36.2Very low37.7Very low105 Ų105136.5 Ų136.573%0.73475%0.749SS**  trans-55.5141.4-174.638.50000113.5Q344S342-Q344 PolarHBondContact O-N 2.85Å
343K32.8Very low38.7Very low208 Ų208130.4 Ų130.490%0.90472%0.716SS**SBendtrans-48.297.7170.4-63.3169.9178.1176.40112.1
344Q33Very low40.4Very low181 Ų181125 Ų12585%0.84669%0.686SS**  trans-162129.7153-106.1161.99.300106.9S342S342-Q344 PolarHBondContact O-N 2.85Å
345E31.8Very low42.6Very low172 Ų172116.1 Ų116.180%0.80465%0.648SS**  trans78.7106.9179.2-53.9-173.3172.600115.4D347E345-D347 PolarHBondContact O-N 3.48Å
346Q34.4Very low44.7Very low199 Ų199112.6 Ų112.693%0.9362%0.622SS**  trans-66.382.7162.5-70.2169.7-26.100106.9D348Q346-D348 PolarHBondContact O-N 3.24Å
347D35Very low47.4Very low142 Ų142109.7 Ų109.776%0.75959%0.587SS**  trans-66.7101.1169.4-88.9-19.8000108E345 G349E345-D347 PolarHBondContact O-N 3.48Å; D347-G349 PolarHBondContact O-N 3.34Å; D347-G349 VanDerWaalsContact O-N 3.11Å
348D39.8Very low49.7Very low159 Ų159102.6 Ų102.685%0.8556%0.557SS**  trans-43.6117.8160.4-94.5-30.2000107.6Q346 C350Q346-D348 PolarHBondContact O-N 3.24Å; D348-C350 PolarHBondContact O-N 2.87Å
349G39.5Very low51.9Low48 Ų48100.9 Ų100.950%0.49555%0.547SS..  trans-46.2117.7-172.900000110.7D347 I351D347-G349 PolarHBondContact O-N 3.34Å; D347-G349 VanDerWaalsContact O-N 3.11Å; G349-I351 VanDerWaalsContact O-CG1 3.27Å; G349-I351 WeakPolarHBondContact O-CG1 3.39Å; G349-I351 PolarHBondContact O-N 3.43Å
350C39.8Very low54Low97 Ų97104.9 Ų104.966%0.65555%0.552SS**  trans-54.4102.9-172.5-172.40000110D348 E352D348-C350 PolarHBondContact O-N 2.87Å; C350-E352 PolarHBondContact O-N 3.43Å
351I47.7Very low56.3Low90 Ų90101.1 Ų101.146%0.46252%0.518SS..EExtended strand (participates in β ladder)trans-8396.1178.3-57-177.9000106.7I328 G349 S353I328-I351 HydrophobicContact CG2-CG2 3.34Å; G349-I351 VanDerWaalsContact O-CG1 3.27Å; G349-I351 WeakPolarHBondContact O-CG1 3.39Å; G349-I351 PolarHBondContact O-N 3.43Å; I351-S353 PolarHBondContact O-N 3.32Å
352E56.6Low58.7Low72 Ų7294 Ų9434%0.33649%0.491SS..EExtended strand (participates in β ladder)trans-75.2114.5171.8-134.7-170.9175.400109.2I329 I331 C350 H419I329-E352 PolarHBondContact N-O 2.88Å; I329-E352 VanDerWaalsContact N-O 3.08Å; I331-E352 HydrophobicContact CD1-CB 4.38Å; C350-E352 PolarHBondContact O-N 3.43Å; E352-H419 IonicContact OE1-CE1 3.17Å; E352-H419 PolarHBondContact OE1-CE1 3.05Å; E352-H419 IonicContact OE1-ND1 3.21Å
353S64.1Low60.9Low2 Ų296.8 Ų96.81%0.01449%0.486CS..EExtended strand (participates in β ladder)trans-121.1131.3177.9420000109.5K327 I351 H419 L420K327-S353 WeakPolarHBondContact O-CA 3.44Å; I351-S353 PolarHBondContact O-N 3.32Å; S353-H419 WeakPolarHBondContact O-CA 3.19Å; S353-L420 PolarHBondContact O-N 3.41Å; S353-L420 VanDerWaalsContact O-N 3.07Å
354F77.7Confident63.4Low30 Ų3090.8 Ų90.813%0.13246%0.461CS..EExtended strand (participates in β ladder)trans-128.8162.3-177.560.1-90000111.3P326 K327 I329 L418P326-F354 CarbonylContact C-O 3.53Å; P326-F354 WeakPolarHBondContact CA-O 3.28Å; K327-F354 HydrophobicContact CB-CD2 4.23Å; K327-F354 HydrophobicContact CB-CE1 4.34Å; K327-F354 HydrophobicContact CB-CE2 3.83Å; K327-F354 HydrophobicContact CB-CZ 3.9Å; K327-F354 HydrophobicContact CD-CE2 3.86Å; K327-F354 HydrophobicContact CD-CZ 3.6Å; K327-F354 HydrophobicContact CG-CE1 4.34Å; K327-F354 HydrophobicContact CG-CE2 4.19Å; K327-F354 HydrophobicContact CG-CZ 3.83Å; K327-F354 PolarHBondContact N-O 2.96Å; K327-F354 PolarHBondContact O-N 3.25Å; I329-F354 HydrophobicContact CD1-CE1 3.48Å; I329-F354 VanDerWaalsContact CD1-CE1 3.48Å; I329-F354 HydrophobicContact CD1-CZ 4.09Å; I329-F354 HydrophobicContact CG1-CE1 3.76Å; I329-F354 HydrophobicContact CG1-CZ 4.48Å; F354-L418 WeakPolarHBondContact CA-O 3.44Å
355L82.5Confident66Low5 Ų582.1 Ų82.13%0.02642%0.421CS..EExtended strand (participates in β ladder)trans-85.2137.6-179.9-65.1170.6000111.8V272 L324 P326 I399 L418V272-L355 HydrophobicContact CB-CB 4.25Å; V272-L355 HydrophobicContact CG1-CB 4.32Å; L324-L355 HydrophobicContact CD1-CB 4.12Å; L324-L355 HydrophobicContact CD1-CD1 4.49Å; L324-L355 HydrophobicContact CD1-CD2 4.32Å; L324-L355 HydrophobicContact CG-CD2 4.36Å; P326-L355 HydrophobicContact CB-CD2 4.33Å; L355-I399 HydrophobicContact CD1-CD1 3.84Å; L355-I399 HydrophobicContact CD1-CG1 4.1Å; L355-I399 HydrophobicContact CD1-CG2 3.85Å; L355-I399 HydrophobicContact CD2-CD1 4.37Å; L355-L418 HydrophobicContact CD1-CB 3.9Å; L355-L418 HydrophobicContact CD1-CD1 4.11Å; L355-L418 HydrophobicContact CG-CB 4.45Å
356T85.2Confident68.8Low31 Ų3174.5 Ų74.519%0.1939%0.386CS..EExtended strand (participates in β ladder)trans-140.3-173.9176-169.40000109.7C325 K327C325-T356 PolarHBondContact N-O 2.87Å; C325-T356 CarbonylContact O-C 3.55Å; C325-T356 PolarHBondContact O-N 3.46Å; C325-T356 WeakPolarHBondContact SG-CG2 3.26Å; K327-T356 HydrophobicContact CB-CG2 3.72Å; K327-T356 HydrophobicContact CD-CG2 4.4Å
357L87.2Confident71.6Confident22 Ų2265 Ų6512%0.11534%0.342CS..EExtended strand (participates in β ladder)trans-113.4143.5174.9-63.9178.6000112.3C263 L270 V272 W292 H317 L322 Y323C263-L357 HydrophobicContact CB-CD1 4.31Å; C263-L357 WeakPolarHBondContact SG-CD1 3.46Å; L270-L357 HydrophobicContact CD1-CD1 4.38Å; V272-L357 HydrophobicContact CG2-CD2 3.95Å; V272-L357 HydrophobicContact CG2-CG 3.9Å; W292-L357 HydrophobicContact CH2-CD2 3.96Å; W292-L357 HydrophobicContact CZ3-CD2 3.9Å; H317-L357 HydrophobicContact CB-CD1 4.38Å; H317-L357 HydrophobicContact CB-CD2 4.32Å; L322-L357 HydrophobicContact CB-CB 3.8Å; L322-L357 HydrophobicContact CB-CD1 4.11Å; L322-L357 HydrophobicContact CB-CD2 4.45Å; L322-L357 HydrophobicContact CB-CG 4.35Å; L322-L357 HydrophobicContact CD1-CB 3.9Å; L322-L357 HydrophobicContact CD1-CD1 4.07Å; Y323-L357 CarbonylContact O-C 3.57Å; Y323-L357 VanDerWaalsContact O-CA 3.26Å; Y323-L357 WeakPolarHBondContact O-CA 3.42Å
358S85.8Confident74.2Confident32 Ų3260.9 Ų60.922%0.22432%0.318CS..EExtended strand (participates in β ladder)trans-120.1147.3172.61760000111.1L322 Y323 C325 E360L322-S358 CarbonylContact C-O 3.5Å; L322-S358 WeakPolarHBondContact CB-O 3.28Å; Y323-S358 PolarHBondContact N-O 3.49Å; Y323-S358 PolarHBondContact O-N 2.86Å; C325-S358 VanDerWaalsContact SG-CB 3.52Å; S358-E360 PolarHBondContact OG-N 3.13Å; S358-E360 PolarHBondContact OG-O 3.37Å
359K80.1Confident76.6Confident171 Ų17153.4 Ų53.474%0.74328%0.278SS*.SBendtrans-75.2-36.9175-73.5175-179.9178.10112.6L322L322-K359 HydrophobicContact CD2-CB 4.12Å; L322-K359 HydrophobicContact CD2-CG 3.38Å
360E78.3Confident79Confident135 Ų13552.4 Ų52.463%0.63126%0.261SS*.SBendtrans-102.6137.4-172-67.8-177.4-179.100111.7S358 T362S358-E360 PolarHBondContact OG-N 3.13Å; S358-E360 PolarHBondContact OG-O 3.37Å; E360-T362 VanDerWaalsContact C-N 3.3Å; E360-T362 HydrophobicContact CB-CG2 4.2Å; E360-T362 PolarHBondContact O-N 2.93Å
361P80.7Confident81.2Confident27 Ų2748.3 Ų48.318%0.17523%0.234CC..  trans-76.779.3176.931.6-33.5000110.6T56 Y323T56-P361 WeakPolarHBondContact OG1-CG 3.46Å; Y323-P361 HydrophobicContact CD2-CB 4.2Å; Y323-P361 HydrophobicContact CE2-CB 3.88Å; Y323-P361 HydrophobicContact CE2-CG 4.18Å
362T83.6Confident82.8Confident45 Ų4546.1 Ų46.128%0.27623%0.225SC..  trans-84.9-171.2177.4630000112.1R314 E360 E364 T365R314-T362 PolarHBondContact NH2-O 3.46Å; E360-T362 VanDerWaalsContact C-N 3.3Å; E360-T362 HydrophobicContact CB-CG2 4.2Å; E360-T362 PolarHBondContact O-N 2.93Å; T362-E364 VanDerWaalsContact C-N 3.28Å; T362-E364 PolarHBondContact OG1-N 3.31Å; T362-T365 PolarHBondContact N-OG1 2.99Å; T362-T365 PolarHBondContact O-OG1 3.35Å
363Y83.2Confident83.6Confident165 Ų16545.9 Ų45.965%0.64723%0.231SC*.G310 helixtrans-75.4-17.3172.966.6-87.6000112.8T365 A394Y363-T365 VanDerWaalsContact C-N 3.31Å; Y363-A394 HydrophobicContact CD2-CB 4.01Å; Y363-A394 HydrophobicContact CE2-CB 4.35Å
364E85.3Confident83.7Confident81 Ų8154.8 Ų54.838%0.37927%0.272SS..G310 helixtrans-81.1-9.5177.4-60.8-178.7159.300113P326 T362 V366 H392P326-E364 WeakPolarHBondContact CD-O 3.46Å; T362-E364 VanDerWaalsContact C-N 3.28Å; T362-E364 PolarHBondContact OG1-N 3.31Å; E364-V366 VanDerWaalsContact C-N 3.31Å; E364-H392 PolarHBondContact O-CD2 3.36Å; E364-H392 PolarHBondContact O-NE2 3.33Å
365T87.1Confident82.8Confident0 Ų064 Ų640%031%0.307CS..G310 helixtrans-93.17.2177.358.60000112.7R314 Y323 L324 C325 T362 Y363 F367R314-T365 WeakPolarHBondContact CD-OG1 3.35Å; R314-T365 PolarHBondContact NE-OG1 3.05Å; R314-T365 VanDerWaalsContact NE-OG1 3.15Å; Y323-T365 HydrophobicContact CG-CG2 4.48Å; L324-T365 WeakPolarHBondContact O-CA 3.46Å; C325-T365 HydrophobicContact CB-CG2 4.02Å; T362-T365 PolarHBondContact N-OG1 2.99Å; T362-T365 PolarHBondContact O-OG1 3.35Å; Y363-T365 VanDerWaalsContact C-N 3.31Å; T365-F367 VanDerWaalsContact O-CD2 3.29Å; T365-F367 WeakPolarHBondContact O-CD2 3.1Å; T365-F367 WeakPolarHBondContact O-CE2 3.44Å
366V90.7Very high81.7Confident12 Ų1270.1 Ų70.17%0.07333%0.334CS..  trans-99.3127.2-169.9-173.40000111.2I297 L312 E364 H392 T393I297-V366 HydrophobicContact CD1-CB 4.2Å; I297-V366 HydrophobicContact CD1-CG1 3.51Å; I297-V366 HydrophobicContact CD1-CG2 3.71Å; L312-V366 HydrophobicContact CB-CG1 3.82Å; L312-V366 HydrophobicContact CD1-CG1 4.32Å; L312-V366 HydrophobicContact CD2-CG1 4.23Å; L312-V366 HydrophobicContact CG-CG1 4.36Å; E364-V366 VanDerWaalsContact C-N 3.31Å; V366-H392 PolarHBondContact O-CD2 3.28Å; V366-T393 WeakPolarHBondContact CG1-OG1 3.48Å; V366-T393 WeakPolarHBondContact O-CB 3.37Å; V366-T393 PolarHBondContact O-N 3.14Å; V366-T393 PolarHBondContact O-OG1 3.33Å
367F93Very high80.6Confident0 Ų076.1 Ų76.10%036%0.36CS..EExtended strand (participates in β ladder)trans-124.9146.9-179.1-59.9-90.5000111.8F313 L324 T365 I390 C391 H392 T393 I399F313-F367 PolarHBondContact N-O 3.17Å; F313-F367 PolarHBondContact O-N 3.23Å; L324-F367 HydrophobicContact CB-CE2 4.05Å; L324-F367 HydrophobicContact CB-CZ 4.36Å; L324-F367 HydrophobicContact CD2-CE1 4.47Å; L324-F367 HydrophobicContact CD2-CE2 4.06Å; L324-F367 HydrophobicContact CD2-CZ 3.91Å; L324-F367 HydrophobicContact CG-CE2 4.06Å; L324-F367 HydrophobicContact CG-CZ 3.88Å; L324-F367 WeakPolarHBondContact O-CE2 3.31Å; T365-F367 VanDerWaalsContact O-CD2 3.29Å; T365-F367 WeakPolarHBondContact O-CD2 3.1Å; T365-F367 WeakPolarHBondContact O-CE2 3.44Å; F367-I390 HydrophobicContact CB-CG2 3.91Å; F367-I390 HydrophobicContact CD1-CG2 3.75Å; F367-I390 HydrophobicContact CG-CG2 4.07Å; F367-C391 CarbonylContact C-O 3.52Å; F367-C391 VanDerWaalsContact CA-O 3.22Å; F367-C391 WeakPolarHBondContact CA-O 3.41Å; F367-H392 HydrophobicContact CD1-CB 4.01Å; F367-H392 HydrophobicContact CE1-CB 3.86Å; F367-H392 AromaticContact CE1-CD2 3.96Å; F367-T393 PolarHBondContact N-OG1 2.82Å; F367-I399 HydrophobicContact CE1-CD1 4.28Å
368E91.4Very high79.6Confident54 Ų5479 Ų7925%0.25238%0.381SS..EExtended strand (participates in β ladder)trans-102.6140.6168.6-72.9173.3-167.700108.6L312 C391 T393 R396L312-E368 HydrophobicContact CD2-CG 3.52Å; E368-C391 HydrophobicContact CB-CB 4.39Å; E368-C391 PolarHBondContact N-O 3.13Å; E368-C391 PolarHBondContact O-N 3.46Å; E368-T393 HydrophobicContact CG-CG2 4.38Å; E368-R396 VanDerWaalsContact CD-NH1 3.26Å; E368-R396 IonicContact OE1-CZ 3.17Å; E368-R396 IonicContact OE1-NH1 3.09Å; E368-R396 PolarHBondContact OE1-NH1 3.32Å; E368-R396 IonicContact OE1-NH2 3.12Å; E368-R396 PolarHBondContact OE1-NH2 3.21Å; E368-R396 IonicContact OE2-CZ 2.96Å; E368-R396 IonicContact OE2-NH1 3.19Å; E368-R396 PolarHBondContact OE2-NH1 3.19Å
369M89.9Confident79Confident3 Ų382.8 Ų82.82%0.01540%0.399CS..EExtended strand (participates in β ladder)trans-108117.4175.2-63.8-173.9-169.800109.4L244 F313 L315 I382 V388 I432L244-M369 HydrophobicContact CD2-CE 4.47Å; L244-M369 HydrophobicContact CD2-SD 4.13Å; F313-M369 HydrophobicContact CB-CE 3.96Å; F313-M369 HydrophobicContact CD1-CE 4.06Å; F313-M369 HydrophobicContact CD2-CB 4.34Å; F313-M369 HydrophobicContact CD2-CE 4.22Å; F313-M369 HydrophobicContact CD2-CG 3.85Å; F313-M369 HydrophobicContact CD2-SD 4.21Å; F313-M369 HydrophobicContact CE2-CB 4.2Å; F313-M369 HydrophobicContact CE2-CG 4.13Å; F313-M369 HydrophobicContact CE2-SD 4.31Å; F313-M369 HydrophobicContact CG-CE 3.82Å; F313-M369 HydrophobicContact CG-CG 4.4Å; F313-M369 HydrophobicContact CG-SD 4.33Å; L315-M369 HydrophobicContact CD2-CE 4.11Å; M369-I382 HydrophobicContact CB-CD1 4.22Å; M369-I382 HydrophobicContact SD-CD1 4.34Å; M369-V388 HydrophobicContact CB-CB 4.3Å; M369-V388 HydrophobicContact CB-CG1 4.4Å; M369-V388 HydrophobicContact SD-CG2 4.49Å; M369-I432 HydrophobicContact SD-CD1 3.74Å
370D88.8Confident79.1Confident26 Ų2675.3 Ų75.314%0.13937%0.371CS..EExtended strand (participates in β ladder)trans-102.4136.1178.2-179.652.2000111.3K376 V388 R389 W398 K424D370-K376 IonicContact OD1-NZ 2.68Å; D370-K376 PolarHBondContact OD1-NZ 3.15Å; D370-V388 CarbonylContact O-C 3.54Å; D370-V388 VanDerWaalsContact O-CA 3.29Å; D370-V388 WeakPolarHBondContact O-CA 3.29Å; D370-R389 PolarHBondContact N-O 3.32Å; D370-R389 PolarHBondContact O-N 3.11Å; D370-R389 IonicContact OD2-NH1 2.82Å; D370-W398 HydrophobicContact CB-CH2 3.68Å; D370-W398 HydrophobicContact CB-CZ3 3.83Å; D370-K424 WeakPolarHBondContact OD2-CE 3.26Å; D370-K424 IonicContact OD2-NZ 2.79Å; D370-K424 PolarHBondContact OD2-NZ 3.44Å
371S86.2Confident79.5Confident11 Ų1173 Ų738%0.07736%0.359CS..EExtended strand (participates in β ladder)trans-70.6147.2178.5-171.80000112W309 S373W309-S371 VanDerWaalsContact CZ3-CA 3.49Å; S371-S373 VanDerWaalsContact C-N 3.35Å; S371-S373 PolarHBondContact OG-N 3.5Å; S371-S373 VanDerWaalsContact OG-N 3.15Å
372T80.6Confident79.8Confident45 Ų4571.8 Ų71.828%0.27635%0.351SS..SBendtrans-80.5-17.6168.849.60000112.9F387 V429T372-F387 HydrophobicContact CG2-CB 4.12Å; T372-F387 PolarHBondContact N-O 3.2Å; T372-F387 WeakPolarHBondContact OG1-CB 3.46Å; T372-F387 PolarHBondContact OG1-O 2.94Å; T372-F387 VanDerWaalsContact OG1-O 3.08Å; T372-V429 HydrophobicContact CG2-CB 4.39Å; T372-V429 HydrophobicContact CG2-CG1 3.76Å; T372-V429 HydrophobicContact CG2-CG2 3.66Å
373S74.2Confident80Confident67 Ų6772.7 Ų72.747%0.46936%0.358SS..SBendtrans-82.9141.3-177.6-52.60000112.7S371S371-S373 VanDerWaalsContact C-N 3.35Å; S371-S373 PolarHBondContact OG-N 3.5Å; S371-S373 VanDerWaalsContact OG-N 3.15Å
374H65.9Low80Confident189 Ų18966.8 Ų66.888%0.87534%0.337SS*.SBendtrans-76.9-21.6179.5-69.8-71.2000114.5K376H374-K376 PolarHBondContact O-N 3.44Å
375Y59.5Low80Confident223 Ų22367.3 Ų67.388%0.87534%0.343SS*.  trans-80.7107.2175.8-74-87.2000109.4
376K58.5Low80.1Confident133 Ų13367.7 Ų67.758%0.57835%0.346SS*.  trans-118117.8-178.5-66.1-171.7173.1-159.50110.6D370 H374D370-K376 IonicContact OD1-NZ 2.68Å; D370-K376 PolarHBondContact OD1-NZ 3.15Å; H374-K376 PolarHBondContact O-N 3.44Å
377E62.3Low80.1Confident158 Ų15872.1 Ų72.174%0.73836%0.364SS*.  trans-95.2121.8144.3-72175.5178.700105.5D379 G380E377-D379 PolarHBondContact O-N 3.24Å; E377-D379 VanDerWaalsContact O-N 3.17Å; E377-G380 PolarHBondContact O-N 3.07Å
378S67.1Low80Confident81 Ų8172.1 Ų72.157%0.56636%0.364SS*.THydrogen-bonded Turntrans-57.9-28.1-179.946.50000112.5
379D72.1Confident80Confident112 Ų11270.4 Ų70.460%0.59936%0.356SS*.THydrogen-bonded Turntrans-96.714.4178.1-63.9-26.7000112.8H308 N310 E377H308-D379 PolarHBondContact CD2-O 2.97Å; N310-D379 PolarHBondContact ND2-OD1 2.98Å; E377-D379 PolarHBondContact O-N 3.24Å; E377-D379 VanDerWaalsContact O-N 3.17Å
380G83.6Confident80.1Confident15 Ų1570.4 Ų70.416%0.15536%0.356CS..  trans-72.2147.8174.800000112.5H308 W309 E377H308-G380 WeakPolarHBondContact CA-O 3.39Å; W309-G380 PolarHBondContact N-O 3.47Å; E377-G380 PolarHBondContact O-N 3.07Å
381F86.2Confident80.2Confident87 Ų8769.3 Ų69.338%0.38235%0.35SS..BIsolated β-bridgetrans-72.6149.9172.9-63.8-68.2000112.5I243 A306 H308 W309 P383I243-F381 HydrophobicContact CB-CB 4.48Å; I243-F381 HydrophobicContact CD1-CB 3.83Å; I243-F381 HydrophobicContact CD1-CD1 4.28Å; I243-F381 HydrophobicContact CD1-CD2 3.85Å; I243-F381 HydrophobicContact CD1-CE2 4.5Å; I243-F381 HydrophobicContact CD1-CG 3.72Å; I243-F381 HydrophobicContact CG1-CB 3.88Å; I243-F381 HydrophobicContact CG1-CG 4.3Å; I243-F381 HydrophobicContact CG2-CB 3.75Å; I243-F381 HydrophobicContact CG2-CD1 3.97Å; I243-F381 HydrophobicContact CG2-CG 4.1Å; A306-F381 HydrophobicContact CB-CD1 3.86Å; A306-F381 HydrophobicContact CB-CE1 3.57Å; H308-F381 AromaticContact CD2-CD1 3.79Å; H308-F381 AromaticContact CD2-CE1 3.73Å; H308-F381 AromaticContact CE1-CE1 3.65Å; H308-F381 AromaticContact NE2-CD1 3.66Å; H308-F381 AromaticContact NE2-CE1 3.11Å; H308-F381 WeakPolarHBondContact NE2-CE1 3.23Å; H308-F381 AromaticContact NE2-CZ 3.77Å; W309-F381 PolarHBondContact NE1-O 2.84Å; F381-P383 WeakPolarHBondContact O-CD 3.45Å
382I87.2Confident80.4Confident0 Ų069 Ų690%035%0.347CS..  trans-85113.8172.1-56.9-177.9000108.8I243 L244 G307 W309 F313 M369 A386 I432I243-I382 WeakPolarHBondContact CA-O 3.46Å; L244-I382 HydrophobicContact CB-CB 4.17Å; L244-I382 HydrophobicContact CB-CG2 4.22Å; L244-I382 HydrophobicContact CD2-CG2 4.21Å; L244-I382 PolarHBondContact N-O 3.26Å; G307-I382 PolarHBondContact O-N 3.49Å; W309-I382 HydrophobicContact CD2-CD1 4.38Å; W309-I382 HydrophobicContact CD2-CG1 3.77Å; W309-I382 HydrophobicContact CE3-CD1 3.97Å; W309-I382 HydrophobicContact CE3-CG1 3.83Å; W309-I382 HydrophobicContact CG-CG1 4.29Å; W309-I382 HydrophobicContact CH2-CG1 4.26Å; W309-I382 HydrophobicContact CH2-CG2 4.06Å; W309-I382 HydrophobicContact CZ2-CB 4.45Å; W309-I382 HydrophobicContact CZ2-CG1 4.19Å; W309-I382 HydrophobicContact CZ2-CG2 4.27Å; W309-I382 HydrophobicContact CZ3-CD1 4.16Å; W309-I382 HydrophobicContact CZ3-CG1 4.08Å; W309-I382 HydrophobicContact CZ3-CG2 4.43Å; F313-I382 HydrophobicContact CE1-CD1 4.38Å; F313-I382 HydrophobicContact CE2-CD1 3.91Å; F313-I382 HydrophobicContact CZ-CD1 3.48Å; F313-I382 VanDerWaalsContact CZ-CD1 3.48Å; M369-I382 HydrophobicContact CB-CD1 4.22Å; M369-I382 HydrophobicContact SD-CD1 4.34Å; I382-A386 HydrophobicContact CG2-CB 3.82Å; I382-I432 HydrophobicContact CG2-CD1 4.32Å
383P87.1Confident80.8Confident64 Ų6467.4 Ų67.442%0.41634%0.338SS..BIsolated β-bridgetrans-72.6155.8178.729.5-33000111.8F381 A386F381-P383 WeakPolarHBondContact O-CD 3.45Å; P383-A386 HydrophobicContact CG-CB 4.11Å; P383-A386 VanDerWaalsContact O-CB 3.24Å; P383-A386 WeakPolarHBondContact O-CB 3.25Å; P383-A386 PolarHBondContact O-N 3.17Å
384N83.9Confident81.3Confident42 Ų4267 Ų6723%0.22534%0.338CS..THydrogen-bonded Turntrans-59141167.5-74.9-18.3000110.6E241 H242 A386 P434E241-N384 PolarHBondContact O-ND2 2.92Å; H242-N384 PolarHBondContact O-N 3.37Å; N384-A386 VanDerWaalsContact C-N 3.29Å; N384-A386 PolarHBondContact O-N 2.93Å; N384-P434 HydrophobicContact CB-CG 4.18Å
385N85.7Confident82.2Confident91 Ų9159.8 Ų59.849%0.48731%0.309SS..THydrogen-bonded Turntrans67.618.8-172.9-55.8-34.8000115.4I432 P434N385-I432 WeakPolarHBondContact CA-O 3.5Å; N385-I432 PolarHBondContact N-O 3.18Å; N385-I432 PolarHBondContact OD1-O 2.98Å; N385-P434 WeakPolarHBondContact OD1-CD 3.44Å
386A89.3Confident83.5Confident9 Ų955.1 Ų55.17%0.07429%0.29CS..  trans-62.4146.9172.200000112.5W309 I382 P383 N384 V388 I432W309-A386 HydrophobicContact CH2-CB 4.12Å; I382-A386 HydrophobicContact CG2-CB 3.82Å; P383-A386 HydrophobicContact CG-CB 4.11Å; P383-A386 VanDerWaalsContact O-CB 3.24Å; P383-A386 WeakPolarHBondContact O-CB 3.25Å; P383-A386 PolarHBondContact O-N 3.17Å; N384-A386 VanDerWaalsContact C-N 3.29Å; N384-A386 PolarHBondContact O-N 2.93Å; A386-V388 HydrophobicContact CB-CG1 4.2Å; A386-I432 PolarHBondContact O-N 2.97Å
387F90.1Very high85Confident104 Ų10450.4 Ų50.446%0.45627%0.27SS..EExtended strand (participates in β ladder)trans-96.4117.1170.3-71-82.7000109.6T372 V429 F430 A431T372-F387 HydrophobicContact CG2-CB 4.12Å; T372-F387 PolarHBondContact N-O 3.2Å; T372-F387 WeakPolarHBondContact OG1-CB 3.46Å; T372-F387 PolarHBondContact OG1-O 2.94Å; T372-F387 VanDerWaalsContact OG1-O 3.08Å; F387-V429 HydrophobicContact CB-CG1 3.71Å; F387-V429 HydrophobicContact CD1-CG1 3.78Å; F387-V429 HydrophobicContact CG-CG1 4.2Å; F387-F430 WeakPolarHBondContact CA-O 3.47Å; F387-A431 HydrophobicContact CD1-CB 3.87Å; F387-A431 HydrophobicContact CE1-CB 3.68Å; F387-A431 HydrophobicContact CZ-CB 4.4Å
388V91.1Very high86.2Confident0 Ų045 Ų450%024%0.243CC..EExtended strand (participates in β ladder)trans-125.8152.2-172.4-54.20000112.1W309 M369 D370 A386 I390 F430 I432W309-V388 HydrophobicContact CH2-CG1 3.9Å; W309-V388 HydrophobicContact CZ3-CG1 3.75Å; M369-V388 HydrophobicContact CB-CB 4.3Å; M369-V388 HydrophobicContact CB-CG1 4.4Å; M369-V388 HydrophobicContact SD-CG2 4.49Å; D370-V388 CarbonylContact O-C 3.54Å; D370-V388 VanDerWaalsContact O-CA 3.29Å; D370-V388 WeakPolarHBondContact O-CA 3.29Å; A386-V388 HydrophobicContact CB-CG1 4.2Å; V388-I390 HydrophobicContact CG2-CG1 4.08Å; V388-F430 HydrophobicContact CG2-CB 4.4Å; V388-F430 PolarHBondContact N-O 3.45Å; V388-F430 PolarHBondContact O-N 3.34Å; V388-I432 HydrophobicContact CB-CD1 4.39Å; V388-I432 HydrophobicContact CG1-CD1 3.65Å; V388-I432 HydrophobicContact CG1-CG1 4.29Å; V388-I432 HydrophobicContact CG2-CD1 3.8Å; V388-I432 HydrophobicContact CG2-CG1 3.87Å
389R90Very high87.3Confident19 Ų1941.3 Ų41.37%0.07222%0.217CC..EExtended strand (participates in β ladder)trans-104135.9162.5-56.3-173.6-172.988.35.5108D370 W398 D425 N426 V429D370-R389 PolarHBondContact N-O 3.32Å; D370-R389 PolarHBondContact O-N 3.11Å; D370-R389 IonicContact OD2-NH1 2.82Å; R389-W398 HydrophobicContact CB-CE3 3.69Å; R389-W398 HydrophobicContact CB-CZ3 3.5Å; R389-D425 PolarHBondContact NE-O 3.3Å; R389-D425 VanDerWaalsContact NE-O 3.16Å; R389-N426 PolarHBondContact NH2-OD1 3.4Å; R389-V429 HydrophobicContact CG-CG2 4.25Å
390I92.1Very high88Confident2 Ų240.1 Ų40.11%0.0121%0.206CC..EExtended strand (participates in β ladder)trans-105118.3-174.4-55.8173.4000108.5L252 F367 V388 I399 F430L252-I390 HydrophobicContact CD1-CD1 4Å; L252-I390 HydrophobicContact CD2-CD1 4.28Å; F367-I390 HydrophobicContact CB-CG2 3.91Å; F367-I390 HydrophobicContact CD1-CG2 3.75Å; F367-I390 HydrophobicContact CG-CG2 4.07Å; V388-I390 HydrophobicContact CG2-CG1 4.08Å; I390-I399 HydrophobicContact CB-CD1 3.82Å; I390-I399 HydrophobicContact CB-CG1 4.31Å; I390-I399 HydrophobicContact CD1-CD1 4.46Å; I390-I399 HydrophobicContact CG2-CD1 3.56Å; I390-I399 HydrophobicContact CG2-CG1 4.3Å; I390-I399 PolarHBondContact O-N 2.87Å; I390-F430 HydrophobicContact CD1-CB 4.39Å; I390-F430 HydrophobicContact CD1-CD2 4.16Å; I390-F430 HydrophobicContact CD1-CG 4.23Å; I390-F430 HydrophobicContact CG1-CD2 4.4Å
391C90.8Very high88.2Confident3 Ų340.3 Ų40.32%0.0221%0.206CC..EExtended strand (participates in β ladder)trans-106.3131.2176.2-175.20000109.8F367 E368 M397 W398F367-C391 CarbonylContact C-O 3.52Å; F367-C391 VanDerWaalsContact CA-O 3.22Å; F367-C391 WeakPolarHBondContact CA-O 3.41Å; E368-C391 HydrophobicContact CB-CB 4.39Å; E368-C391 PolarHBondContact N-O 3.13Å; E368-C391 PolarHBondContact O-N 3.46Å; C391-M397 CarbonylContact C-O 3.35Å; C391-M397 WeakPolarHBondContact CA-O 3.46Å; C391-W398 HydrophobicContact CB-CD2 3.94Å; C391-W398 HydrophobicContact CB-CE3 3.68Å; C391-W398 HydrophobicContact CB-CH2 3.83Å; C391-W398 HydrophobicContact CB-CZ2 4.08Å; C391-W398 HydrophobicContact CB-CZ3 3.62Å
392H91Very high88Confident4 Ų437.3 Ų37.32%0.01920%0.197CC..EExtended strand (participates in β ladder)trans-75.7125.6168.4177.1-124.2000110.2P326 E364 V366 F367 S395 R396 M397 L420P326-H392 WeakPolarHBondContact CG-CE1 3.41Å; P326-H392 WeakPolarHBondContact CG-ND1 3.31Å; E364-H392 PolarHBondContact O-CD2 3.36Å; E364-H392 PolarHBondContact O-NE2 3.33Å; V366-H392 PolarHBondContact O-CD2 3.28Å; F367-H392 HydrophobicContact CD1-CB 4.01Å; F367-H392 HydrophobicContact CE1-CB 3.86Å; F367-H392 AromaticContact CE1-CD2 3.96Å; H392-S395 PolarHBondContact ND1-N 3.21Å; H392-S395 PolarHBondContact ND1-OG 3.28Å; H392-R396 WeakPolarHBondContact O-CA 3.34Å; H392-R396 PolarHBondContact O-N 3.22Å; H392-M397 PolarHBondContact N-O 3.48Å; H392-L420 HydrophobicContact CB-CD1 4.42Å; H392-L420 HydrophobicContact CB-CD2 4.43Å
393T88.3Confident87.6Confident13 Ų1345.7 Ų45.78%0.0824%0.236CC..THydrogen-bonded Turntrans-71.7-38.6-166.7-43.80000112.5L312 V366 F367 E368L312-T393 HydrophobicContact CD2-CG2 4.08Å; V366-T393 WeakPolarHBondContact CG1-OG1 3.48Å; V366-T393 WeakPolarHBondContact O-CB 3.37Å; V366-T393 PolarHBondContact O-N 3.14Å; V366-T393 PolarHBondContact O-OG1 3.33Å; F367-T393 PolarHBondContact N-OG1 2.82Å; E368-T393 HydrophobicContact CG-CG2 4.38Å
394A86.3Confident87.4Confident57 Ų5746.5 Ų46.547%0.47124%0.236SC..THydrogen-bonded Turntrans-75.9-39.4-174.600000112.9Y363Y363-A394 HydrophobicContact CD2-CB 4.01Å; Y363-A394 HydrophobicContact CE2-CB 4.35Å
395S84.3Confident87.3Confident38 Ų3847 Ų4727%0.26624%0.238SC..THydrogen-bonded Turntrans-91.3-11.9176.466.60000113.7H392 M397H392-S395 PolarHBondContact ND1-N 3.21Å; H392-S395 PolarHBondContact ND1-OG 3.28Å; S395-M397 WeakPolarHBondContact O-CG 3.33Å; S395-M397 PolarHBondContact O-N 3.27Å; S395-M397 WeakPolarHBondContact OG-CG 3.43Å
396R87Confident87Confident125 Ų12544 Ų4447%0.47222%0.222SC..THydrogen-bonded Turntrans55.233.3-172.9-66.3-71.7-178.3-177.3-12113.1E368 H392E368-R396 VanDerWaalsContact CD-NH1 3.26Å; E368-R396 IonicContact OE1-CZ 3.17Å; E368-R396 IonicContact OE1-NH1 3.09Å; E368-R396 PolarHBondContact OE1-NH1 3.32Å; E368-R396 IonicContact OE1-NH2 3.12Å; E368-R396 PolarHBondContact OE1-NH2 3.21Å; E368-R396 IonicContact OE2-CZ 2.96Å; E368-R396 IonicContact OE2-NH1 3.19Å; E368-R396 PolarHBondContact OE2-NH1 3.19Å; H392-R396 WeakPolarHBondContact O-CA 3.34Å; H392-R396 PolarHBondContact O-N 3.22Å
397M89.2Confident86.5Confident35 Ų3543.9 Ų43.917%0.17222%0.22CC..EExtended strand (participates in β ladder)trans-109.3148.7179.3-58.3175.980.100111.3C391 H392 S395 L420 T421C391-M397 CarbonylContact C-O 3.35Å; C391-M397 WeakPolarHBondContact CA-O 3.46Å; H392-M397 PolarHBondContact N-O 3.48Å; S395-M397 WeakPolarHBondContact O-CG 3.33Å; S395-M397 PolarHBondContact O-N 3.27Å; S395-M397 WeakPolarHBondContact OG-CG 3.43Å; M397-L420 HydrophobicContact CB-CB 3.81Å; M397-L420 HydrophobicContact CB-CD1 4.36Å; M397-L420 HydrophobicContact CB-CD2 4.43Å; M397-L420 HydrophobicContact CB-CG 4.45Å; M397-L420 HydrophobicContact CE-CB 3.93Å; M397-L420 WeakPolarHBondContact CE-O 3.36Å; M397-L420 HydrophobicContact SD-CB 4.12Å; M397-T421 CarbonylContact C-O 3.35Å; M397-T421 WeakPolarHBondContact CA-O 3.34Å; M397-T421 WeakPolarHBondContact CB-O 3.22Å
398W88.7Confident85.8Confident44 Ų4443.6 Ų43.617%0.16723%0.227CC..EExtended strand (participates in β ladder)trans-95143.4-178.1-59.588.4000111.6D370 R389 C391 K400 L420 T421 K424D370-W398 HydrophobicContact CB-CH2 3.68Å; D370-W398 HydrophobicContact CB-CZ3 3.83Å; R389-W398 HydrophobicContact CB-CE3 3.69Å; R389-W398 HydrophobicContact CB-CZ3 3.5Å; C391-W398 HydrophobicContact CB-CD2 3.94Å; C391-W398 HydrophobicContact CB-CE3 3.68Å; C391-W398 HydrophobicContact CB-CH2 3.83Å; C391-W398 HydrophobicContact CB-CZ2 4.08Å; C391-W398 HydrophobicContact CB-CZ3 3.62Å; W398-K400 PolarHBondContact O-N 3.1Å; W398-L420 CarbonylContact O-C 3.58Å; W398-L420 VanDerWaalsContact O-CA 3.26Å; W398-L420 WeakPolarHBondContact O-CA 3.34Å; W398-T421 HydrophobicContact CB-CG2 4.23Å; W398-T421 PolarHBondContact N-O 3.16Å; W398-T421 PolarHBondContact O-N 3.02Å; W398-K424 HydrophobicContact CD2-CG 4.35Å; W398-K424 HydrophobicContact CH2-CD 4.35Å; W398-K424 HydrophobicContact CZ2-CD 3.94Å; W398-K424 HydrophobicContact CZ2-CG 4.13Å
399I89.9Confident85.1Confident4 Ų449.3 Ų49.32%0.02126%0.257CS..EExtended strand (participates in β ladder)trans-69.9128.5172.9-60.7179000109.3L355 F367 I390 L418 L420 F430L355-I399 HydrophobicContact CD1-CD1 3.84Å; L355-I399 HydrophobicContact CD1-CG1 4.1Å; L355-I399 HydrophobicContact CD1-CG2 3.85Å; L355-I399 HydrophobicContact CD2-CD1 4.37Å; F367-I399 HydrophobicContact CE1-CD1 4.28Å; I390-I399 HydrophobicContact CB-CD1 3.82Å; I390-I399 HydrophobicContact CB-CG1 4.31Å; I390-I399 HydrophobicContact CD1-CD1 4.46Å; I390-I399 HydrophobicContact CG2-CD1 3.56Å; I390-I399 HydrophobicContact CG2-CG1 4.3Å; I390-I399 PolarHBondContact O-N 2.87Å; I399-L418 HydrophobicContact CG2-CD2 3.82Å; I399-L420 HydrophobicContact CB-CD2 4.5Å; I399-L420 HydrophobicContact CG1-CD2 3.8Å; I399-F430 HydrophobicContact CB-CE2 4.3Å; I399-F430 HydrophobicContact CG2-CE2 3.93Å; I399-F430 HydrophobicContact CG2-CZ 3.85Å
400K86.8Confident84.1Confident86 Ų8650.4 Ų50.437%0.37427%0.271SS..EExtended strand (participates in β ladder)trans-124.5132180-163.7-168.9174.3175.60111.2W398 H419 T421 E428W398-K400 PolarHBondContact O-N 3.1Å; K400-H419 PolarHBondContact N-O 3.09Å; K400-H419 PolarHBondContact O-N 2.67Å; K400-T421 HydrophobicContact CB-CG2 3.87Å; K400-T421 HydrophobicContact CD-CG2 4.21Å; K400-T421 HydrophobicContact CG-CG2 4.3Å; K400-E428 VanDerWaalsContact CA-OE2 3.31Å; K400-E428 WeakPolarHBondContact CA-OE2 3.48Å; K400-E428 HydrophobicContact CB-CG 4.47Å; K400-E428 HydrophobicContact CG-CG 3.9Å; K400-E428 WeakPolarHBondContact CG-OE1 3.38Å
401A87.2Confident82.9Confident18.5 Ų18.558.6 Ų58.615%0.15331%0.314CS..EExtended strand (participates in β ladder)trans-66.5144.8168.800000111.6L274 E428L274-A401 HydrophobicContact CD1-CB 3.54Å; A401-E428 PolarHBondContact N-OE2 3.2Å
402S83Confident82.3Confident25 Ų2565.4 Ų65.418%0.17534%0.344CS..EExtended strand (participates in β ladder)trans-128.6159.7174134.90000111I404 Y416 K417 H419S402-I404 VanDerWaalsContact C-N 3.32Å; S402-I404 WeakPolarHBondContact OG-CD1 3.49Å; S402-I404 WeakPolarHBondContact OG-CG1 3.2Å; S402-I404 PolarHBondContact OG-N 3.35Å; S402-I404 VanDerWaalsContact OG-N 3.14Å; S402-Y416 WeakPolarHBondContact O-CD1 3.45Å; S402-K417 VanDerWaalsContact CB-O 3.24Å; S402-K417 WeakPolarHBondContact CB-O 3.38Å; S402-K417 PolarHBondContact N-O 3.19Å; S402-K417 VanDerWaalsContact OG-C 3.31Å; S402-K417 PolarHBondContact OG-O 3.49Å; S402-H419 WeakPolarHBondContact CB-CD2 3.3Å; S402-H419 WeakPolarHBondContact CB-NE2 3.33Å; S402-H419 PolarHBondContact OG-NE2 3.11Å
403E78.7Confident81.6Confident175.5 Ų175.567 Ų6782%0.8235%0.354SS*.EExtended strand (participates in β ladder)trans-91.30.7171.9-64.7-174.417100112.5L405E403-L405 PolarHBondContact O-N 3.32Å
404I81.7Confident81.3Confident82.5 Ų82.568.3 Ų68.342%0.42336%0.36SS..EExtended strand (participates in β ladder)trans-71.6122.4179.1-59.8171.9000109.4S402 K417S402-I404 VanDerWaalsContact C-N 3.32Å; S402-I404 WeakPolarHBondContact OG-CD1 3.49Å; S402-I404 WeakPolarHBondContact OG-CG1 3.2Å; S402-I404 PolarHBondContact OG-N 3.35Å; S402-I404 VanDerWaalsContact OG-N 3.14Å; I404-K417 HydrophobicContact CB-CB 4.22Å; I404-K417 HydrophobicContact CG2-CB 4.42Å; I404-K417 HydrophobicContact CG2-CD 4.29Å; I404-K417 WeakPolarHBondContact O-CB 3.24Å; I404-K417 PolarHBondContact O-N 3.12Å
405L81.5Confident81.3Confident50.5 Ų50.566.3 Ų66.326%0.26434%0.341SS..EExtended strand (participates in β ladder)trans-86.3139.1178.2-67.4167.5000110.9E403 T408 P413 M415 Y416E403-L405 PolarHBondContact O-N 3.32Å; L405-T408 HydrophobicContact CB-CG2 4.15Å; L405-P413 HydrophobicContact CB-CB 4.39Å; L405-P413 HydrophobicContact CD1-CB 3.65Å; L405-P413 HydrophobicContact CD1-CG 3.42Å; L405-P413 VanDerWaalsContact CD1-CG 3.44Å; L405-P413 HydrophobicContact CD2-CB 3.83Å; L405-P413 HydrophobicContact CD2-CG 4.27Å; L405-P413 HydrophobicContact CG-CB 4.15Å; L405-P413 HydrophobicContact CG-CG 4.38Å; L405-M415 WeakPolarHBondContact CA-O 3.44Å; L405-Y416 HydrophobicContact CD2-CD1 3.93Å; L405-Y416 HydrophobicContact CD2-CD2 3.87Å; L405-Y416 HydrophobicContact CD2-CE1 3.7Å; L405-Y416 HydrophobicContact CD2-CE2 3.53Å; L405-Y416 HydrophobicContact CD2-CG 4.04Å; L405-Y416 VanDerWaalsContact CD2-CZ 3.48Å; L405-Y416 HydrophobicContact CG-CE1 4.42Å
406I79.2Confident81.4Confident29.5 Ų29.566.7 Ų66.715%0.15134%0.338CS..SBendtrans-87.4-40.1173.7-56174.4000109.7Y266 Y271 F273 T408 M415 K417Y266-I406 HydrophobicContact CD1-CG2 4.23Å; Y271-I406 HydrophobicContact CD1-CD1 4.21Å; Y271-I406 HydrophobicContact CD1-CG2 4.37Å; Y271-I406 HydrophobicContact CG-CD1 4.43Å; Y271-I406 HydrophobicContact CG-CG2 4.42Å; F273-I406 HydrophobicContact CB-CD1 3.89Å; I406-T408 PolarHBondContact O-N 3.29Å; I406-M415 HydrophobicContact CB-CB 4Å; I406-M415 HydrophobicContact CD1-CB 4.41Å; I406-M415 HydrophobicContact CG1-CB 4.46Å; I406-M415 PolarHBondContact N-O 3.25Å; I406-K417 HydrophobicContact CD1-CB 4.4Å; I406-K417 HydrophobicContact CD1-CG 4.46Å; I406-K417 HydrophobicContact CG1-CB 4.11Å; I406-K417 HydrophobicContact CG1-CG 4.43Å
407D79.8Confident81.3Confident5.5 Ų5.563.2 Ų63.23%0.02933%0.326CS..  trans-96.153.9-173.760.2-26.4000112.6Y266 D409 A410 P413 I414 M415Y266-D407 HydrophobicContact CE2-CB 3.92Å; D407-D409 PolarHBondContact O-N 3.11Å; D407-D409 VanDerWaalsContact O-N 3.13Å; D407-A410 HydrophobicContact CB-CB 4.39Å; D407-A410 PolarHBondContact O-N 3.02Å; D407-P413 WeakPolarHBondContact O-CB 3.09Å; D407-P413 WeakPolarHBondContact OD1-CA 3.09Å; D407-P413 VanDerWaalsContact OD1-CB 3.28Å; D407-P413 WeakPolarHBondContact OD1-CB 3.16Å; D407-P413 WeakPolarHBondContact OD2-CA 3.19Å; D407-I414 PolarHBondContact OD1-N 3.15Å; D407-I414 WeakPolarHBondContact OD2-CG1 3.44Å; D407-I414 PolarHBondContact OD2-N 3.16Å; D407-M415 HydrophobicContact CB-CB 4.38Å; D407-M415 HydrophobicContact CB-CG 4.23Å; D407-M415 HydrophobicContact CB-SD 4.45Å; D407-M415 WeakPolarHBondContact OD1-CB 3.24Å; D407-M415 PolarHBondContact OD1-N 3.22Å; D407-M415 PolarHBondContact OD2-N 3.19Å
408T76.1Confident81.3Confident98.5 Ų98.561.6 Ų61.660%0.60432%0.318SS*.THydrogen-bonded Turntrans-61.8-21.9-178.849.70000113.9L405 I406 A410L405-T408 HydrophobicContact CB-CG2 4.15Å; I406-T408 PolarHBondContact O-N 3.29Å; T408-A410 VanDerWaalsContact C-N 3.32Å
409D75.7Confident81.1Confident119 Ų11960.8 Ų60.864%0.63632%0.316SS*.THydrogen-bonded Turntrans-81.5-13.1-177.2-46.6-43.9000112.8Y266 D407Y266-D409 PolarHBondContact OH-OD2 2.68Å; D407-D409 PolarHBondContact O-N 3.11Å; D407-D409 VanDerWaalsContact O-N 3.13Å
410A68.9Low81Confident43 Ų4361.1 Ų61.136%0.35532%0.318SS..SBendtrans-84.8139.1179.800000111.5D407 T408 K412D407-A410 HydrophobicContact CB-CB 4.39Å; D407-A410 PolarHBondContact O-N 3.02Å; T408-A410 VanDerWaalsContact C-N 3.32Å; A410-K412 PolarHBondContact O-N 3.17Å
411D66.5Low81Confident174 Ų17458.4 Ų58.493%0.9331%0.308SS*.SBendtrans-52.4-28.5175.3-72.1-25.8000113.4
412K77.8Confident80.8Confident146.5 Ų146.561.3 Ų61.364%0.63733%0.327SS*.SBendtrans-136.492.4177.1-70.3-173.5-178.8-179.40109.8F278 A410 I414F278-K412 HydrophobicContact CE2-CB 4.17Å; F278-K412 HydrophobicContact CE2-CD 4.24Å; F278-K412 HydrophobicContact CZ-CB 4.11Å; F278-K412 HydrophobicContact CZ-CD 4.37Å; A410-K412 PolarHBondContact O-N 3.17Å; K412-I414 PolarHBondContact O-N 3.4Å
413P77.4Confident80.8Confident37 Ų3767.7 Ų67.724%0.2435%0.352CS..  trans-69.4133.6-178.428.8-35.1000110.7L405 D407L405-P413 HydrophobicContact CB-CB 4.39Å; L405-P413 HydrophobicContact CD1-CB 3.65Å; L405-P413 HydrophobicContact CD1-CG 3.42Å; L405-P413 VanDerWaalsContact CD1-CG 3.44Å; L405-P413 HydrophobicContact CD2-CB 3.83Å; L405-P413 HydrophobicContact CD2-CG 4.27Å; L405-P413 HydrophobicContact CG-CB 4.15Å; L405-P413 HydrophobicContact CG-CG 4.38Å; D407-P413 WeakPolarHBondContact O-CB 3.09Å; D407-P413 WeakPolarHBondContact OD1-CA 3.09Å; D407-P413 VanDerWaalsContact OD1-CB 3.28Å; D407-P413 WeakPolarHBondContact OD1-CB 3.16Å; D407-P413 WeakPolarHBondContact OD2-CA 3.19Å
414I82.8Confident80.9Confident39.5 Ų39.564.2 Ų64.220%0.20333%0.334CS..  trans-120.7-10.8-176.756.4167000112.8R275 T276 F278 D407 K412R275-I414 WeakPolarHBondContact CA-O 2.9Å; T276-I414 PolarHBondContact N-O 3.07Å; F278-I414 HydrophobicContact CE2-CG2 4.02Å; F278-I414 HydrophobicContact CZ-CG2 4.47Å; D407-I414 PolarHBondContact OD1-N 3.15Å; D407-I414 WeakPolarHBondContact OD2-CG1 3.44Å; D407-I414 PolarHBondContact OD2-N 3.16Å; K412-I414 PolarHBondContact O-N 3.4Å
415M85.8Confident81Confident15 Ų1563.3 Ų63.37%0.07433%0.33CS..EExtended strand (participates in β ladder)trans-104.5102.6-170.3-54.7-166-174.800112Y266 F273 L405 I406 D407Y266-M415 HydrophobicContact CD2-CE 4.13Å; Y266-M415 HydrophobicContact CD2-SD 4.31Å; Y266-M415 HydrophobicContact CG-SD 4.39Å; F273-M415 HydrophobicContact CB-CB 4.31Å; F273-M415 HydrophobicContact CD1-CB 4.32Å; F273-M415 HydrophobicContact CD1-CG 4.26Å; F273-M415 HydrophobicContact CD1-SD 4.02Å; F273-M415 HydrophobicContact CD2-CB 3.73Å; F273-M415 HydrophobicContact CD2-CG 3.82Å; F273-M415 HydrophobicContact CE1-CE 4.18Å; F273-M415 HydrophobicContact CE1-CG 4.05Å; F273-M415 HydrophobicContact CE1-SD 3.64Å; F273-M415 HydrophobicContact CE2-CB 4.04Å; F273-M415 HydrophobicContact CE2-CG 3.58Å; F273-M415 HydrophobicContact CE2-SD 4.27Å; F273-M415 HydrophobicContact CG-CB 3.88Å; F273-M415 HydrophobicContact CG-CG 4.15Å; F273-M415 HydrophobicContact CG-SD 4.49Å; F273-M415 HydrophobicContact CZ-CB 4.47Å; F273-M415 HydrophobicContact CZ-CE 3.96Å; F273-M415 HydrophobicContact CZ-CG 3.71Å; F273-M415 HydrophobicContact CZ-SD 3.78Å; L405-M415 WeakPolarHBondContact CA-O 3.44Å; I406-M415 HydrophobicContact CB-CB 4Å; I406-M415 HydrophobicContact CD1-CB 4.41Å; I406-M415 HydrophobicContact CG1-CB 4.46Å; I406-M415 PolarHBondContact N-O 3.25Å; D407-M415 HydrophobicContact CB-CB 4.38Å; D407-M415 HydrophobicContact CB-CG 4.23Å; D407-M415 HydrophobicContact CB-SD 4.45Å; D407-M415 WeakPolarHBondContact OD1-CB 3.24Å; D407-M415 PolarHBondContact OD1-N 3.22Å; D407-M415 PolarHBondContact OD2-N 3.19Å
416Y86.8Confident81Confident47.5 Ų47.566.6 Ų66.619%0.18635%0.348CS..EExtended strand (participates in β ladder)trans-96.4126.6178.4-70.9-101.5000111.4K259 F273 L274 T276 S402 L405K259-Y416 HydrophobicContact CD-CD2 4.2Å; K259-Y416 HydrophobicContact CD-CG 4.36Å; K259-Y416 VanDerWaalsContact NZ-CD1 3.25Å; K259-Y416 VanDerWaalsContact NZ-CG 3.3Å; K259-Y416 VanDerWaalsContact NZ-CZ 3.34Å; F273-Y416 CarbonylContact C-O 3.58Å; F273-Y416 VanDerWaalsContact CA-O 3.32Å; F273-Y416 WeakPolarHBondContact CA-O 3.09Å; F273-Y416 VanDerWaalsContact CB-O 3.26Å; F273-Y416 WeakPolarHBondContact CB-O 3.11Å; L274-Y416 PolarHBondContact N-O 3.27Å; L274-Y416 WeakPolarHBondContact O-CB 3.44Å; L274-Y416 PolarHBondContact O-N 3.34Å; T276-Y416 HydrophobicContact CG2-CE2 4.41Å; T276-Y416 WeakPolarHBondContact OG1-CD2 3.49Å; T276-Y416 WeakPolarHBondContact OG1-CE2 3.23Å; S402-Y416 WeakPolarHBondContact O-CD1 3.45Å; L405-Y416 HydrophobicContact CD2-CD1 3.93Å; L405-Y416 HydrophobicContact CD2-CD2 3.87Å; L405-Y416 HydrophobicContact CD2-CE1 3.7Å; L405-Y416 HydrophobicContact CD2-CE2 3.53Å; L405-Y416 HydrophobicContact CD2-CG 4.04Å; L405-Y416 VanDerWaalsContact CD2-CZ 3.48Å; L405-Y416 HydrophobicContact CG-CE1 4.42Å
417K84.9Confident81.3Confident52 Ų5271 Ų7123%0.22637%0.366CS..EExtended strand (participates in β ladder)trans-68.5153.6-177.4-160.4173.6179.8-175.40111.4S402 I404 I406S402-K417 VanDerWaalsContact CB-O 3.24Å; S402-K417 WeakPolarHBondContact CB-O 3.38Å; S402-K417 PolarHBondContact N-O 3.19Å; S402-K417 VanDerWaalsContact OG-C 3.31Å; S402-K417 PolarHBondContact OG-O 3.49Å; I404-K417 HydrophobicContact CB-CB 4.22Å; I404-K417 HydrophobicContact CG2-CB 4.42Å; I404-K417 HydrophobicContact CG2-CD 4.29Å; I404-K417 WeakPolarHBondContact O-CB 3.24Å; I404-K417 PolarHBondContact O-N 3.12Å; I406-K417 HydrophobicContact CD1-CB 4.4Å; I406-K417 HydrophobicContact CD1-CG 4.46Å; I406-K417 HydrophobicContact CG1-CB 4.11Å; I406-K417 HydrophobicContact CG1-CG 4.43Å
418L87.5Confident81.7Confident1 Ų171.8 Ų71.81%0.00537%0.37CS..EExtended strand (participates in β ladder)trans-118.8138.5175.5-75.5150.4000109.8L261 V272 L274 F354 L355 I399 F430L261-L418 HydrophobicContact CD1-CD1 3.16Å; V272-L418 HydrophobicContact CG1-CD1 4.39Å; L274-L418 HydrophobicContact CD1-CD2 3.79Å; L274-L418 HydrophobicContact CD1-CG 4.39Å; L274-L418 HydrophobicContact CD2-CD1 4.43Å; L274-L418 HydrophobicContact CD2-CD2 4.37Å; L274-L418 HydrophobicContact CG-CD1 4.04Å; L274-L418 HydrophobicContact CG-CD2 3.79Å; L274-L418 HydrophobicContact CG-CG 3.98Å; F354-L418 WeakPolarHBondContact CA-O 3.44Å; L355-L418 HydrophobicContact CD1-CB 3.9Å; L355-L418 HydrophobicContact CD1-CD1 4.11Å; L355-L418 HydrophobicContact CG-CB 4.45Å; I399-L418 HydrophobicContact CG2-CD2 3.82Å; L418-F430 HydrophobicContact CD2-CZ 4.36Å
419H86.3Confident82.4Confident26 Ų2667.6 Ų67.612%0.1234%0.344CS..EExtended strand (participates in β ladder)trans-120.7164.9178.8-54.5-95.3000110.5E352 S353 K400 S402E352-H419 IonicContact OE1-CE1 3.17Å; E352-H419 PolarHBondContact OE1-CE1 3.05Å; E352-H419 IonicContact OE1-ND1 3.21Å; S353-H419 WeakPolarHBondContact O-CA 3.19Å; K400-H419 PolarHBondContact N-O 3.09Å; K400-H419 PolarHBondContact O-N 2.67Å; S402-H419 WeakPolarHBondContact CB-CD2 3.3Å; S402-H419 WeakPolarHBondContact CB-NE2 3.33Å; S402-H419 PolarHBondContact OG-NE2 3.11Å
420L87.1Confident83.2Confident12 Ų1262 Ų626%0.06331%0.314CS..EExtended strand (participates in β ladder)trans-101.4141.6165.3-67.5175.4000110.4P326 S353 H392 M397 W398 I399P326-L420 HydrophobicContact CB-CD1 3.33Å; P326-L420 HydrophobicContact CB-CG 4.4Å; P326-L420 HydrophobicContact CG-CD1 3.92Å; S353-L420 PolarHBondContact O-N 3.41Å; S353-L420 VanDerWaalsContact O-N 3.07Å; H392-L420 HydrophobicContact CB-CD1 4.42Å; H392-L420 HydrophobicContact CB-CD2 4.43Å; M397-L420 HydrophobicContact CB-CB 3.81Å; M397-L420 HydrophobicContact CB-CD1 4.36Å; M397-L420 HydrophobicContact CB-CD2 4.43Å; M397-L420 HydrophobicContact CB-CG 4.45Å; M397-L420 HydrophobicContact CE-CB 3.93Å; M397-L420 WeakPolarHBondContact CE-O 3.36Å; M397-L420 HydrophobicContact SD-CB 4.12Å; W398-L420 CarbonylContact O-C 3.58Å; W398-L420 VanDerWaalsContact O-CA 3.26Å; W398-L420 WeakPolarHBondContact O-CA 3.34Å; I399-L420 HydrophobicContact CB-CD2 4.5Å; I399-L420 HydrophobicContact CG1-CD2 3.8Å
421T86Confident84.3Confident28 Ų2860.2 Ų60.217%0.17230%0.3CS..EExtended strand (participates in β ladder)trans-129148.1175.4-1780000110.9M397 W398 K400 F423M397-T421 CarbonylContact C-O 3.35Å; M397-T421 WeakPolarHBondContact CA-O 3.34Å; M397-T421 WeakPolarHBondContact CB-O 3.22Å; W398-T421 HydrophobicContact CB-CG2 4.23Å; W398-T421 PolarHBondContact N-O 3.16Å; W398-T421 PolarHBondContact O-N 3.02Å; K400-T421 HydrophobicContact CB-CG2 3.87Å; K400-T421 HydrophobicContact CD-CG2 4.21Å; K400-T421 HydrophobicContact CG-CG2 4.3Å; T421-F423 VanDerWaalsContact C-N 3.29Å; T421-F423 VanDerWaalsContact CG2-O 3.26Å; T421-F423 WeakPolarHBondContact CG2-O 3.38Å; T421-F423 PolarHBondContact OG1-N 3.14Å
422S83.8Confident85.5Confident79 Ų7952 Ų5255%0.55226%0.255SS*.SBendtrans-73.7-22.9173.152.80000112.5
423F82.3Confident86.2Confident159.5 Ų159.547.5 Ų47.570%0.724%0.238SC*.SBendtrans-85.3128.1-176.3-63.7-78.2000112T421 D425T421-F423 VanDerWaalsContact C-N 3.29Å; T421-F423 VanDerWaalsContact CG2-O 3.26Å; T421-F423 WeakPolarHBondContact CG2-O 3.38Å; T421-F423 PolarHBondContact OG1-N 3.14Å; F423-D425 PolarHBondContact O-N 3.22Å
424K81.6Confident86.8Confident102.5 Ų102.548.4 Ų48.445%0.44624%0.244SC..  trans-80.999.5173.9-173.1-178-177.7177.40109.7D370 W398D370-K424 WeakPolarHBondContact OD2-CE 3.26Å; D370-K424 IonicContact OD2-NZ 2.79Å; D370-K424 PolarHBondContact OD2-NZ 3.44Å; W398-K424 HydrophobicContact CD2-CG 4.35Å; W398-K424 HydrophobicContact CH2-CD 4.35Å; W398-K424 HydrophobicContact CZ2-CD 3.94Å; W398-K424 HydrophobicContact CZ2-CG 4.13Å
425D83.5Confident87.1Confident64.5 Ų64.547.2 Ų47.235%0.34524%0.239SC..  trans-91.3143176.4-164.4-23.6000111R389 F423 K427 E428R389-D425 PolarHBondContact NE-O 3.3Å; R389-D425 VanDerWaalsContact NE-O 3.16Å; F423-D425 PolarHBondContact O-N 3.22Å; D425-K427 VanDerWaalsContact C-N 3.26Å; D425-K427 PolarHBondContact O-N 3.3Å; D425-K427 PolarHBondContact OD1-N 3.12Å; D425-E428 HydrophobicContact CB-CG 3.94Å
426N81.3Confident87Confident119.5 Ų119.550 Ų5064%0.63926%0.258SS*.SBendtrans-73-18.9175.4-74.9-22.2000113R389 V429R389-N426 PolarHBondContact NH2-OD1 3.4Å; N426-V429 VanDerWaalsContact O-CG2 3.26Å; N426-V429 WeakPolarHBondContact O-CG2 3.32Å
427K85.4Confident86.7Confident121 Ų12150.8 Ų50.853%0.52627%0.274SS..SBendtrans-79.6-23.7179-63.4-175.2176.9-168.70114.2D425 V429D425-K427 VanDerWaalsContact C-N 3.26Å; D425-K427 PolarHBondContact O-N 3.3Å; D425-K427 PolarHBondContact OD1-N 3.12Å; K427-V429 VanDerWaalsContact C-N 3.32Å; K427-V429 PolarHBondContact O-N 3.4Å
428E88.5Confident86.5Confident22 Ų2251.9 Ų51.910%0.10328%0.282CS..  trans-85.871.7-173.8-58.6-62.1158.800110.9H254 K400 A401 D425H254-E428 IonicContact CE1-OE2 3.01Å; H254-E428 IonicContact NE2-OE2 2.76Å; H254-E428 PolarHBondContact NE2-OE2 2.87Å; H254-E428 VanDerWaalsContact NE2-OE2 3.09Å; K400-E428 VanDerWaalsContact CA-OE2 3.31Å; K400-E428 WeakPolarHBondContact CA-OE2 3.48Å; K400-E428 HydrophobicContact CB-CG 4.47Å; K400-E428 HydrophobicContact CG-CG 3.9Å; K400-E428 WeakPolarHBondContact CG-OE1 3.38Å; A401-E428 PolarHBondContact N-OE2 3.2Å; D425-E428 HydrophobicContact CB-CG 3.94Å
429V90.5Very high86.3Confident11.5 Ų11.553.9 Ų53.97%0.0730%0.295CS..  trans-120.3130.6-172.3177.60000111.2S255 T372 F387 R389 N426 K427S255-V429 PolarHBondContact N-O 3.49Å; S255-V429 WeakPolarHBondContact OG-CB 3.41Å; S255-V429 PolarHBondContact OG-O 2.89Å; T372-V429 HydrophobicContact CG2-CB 4.39Å; T372-V429 HydrophobicContact CG2-CG1 3.76Å; T372-V429 HydrophobicContact CG2-CG2 3.66Å; F387-V429 HydrophobicContact CB-CG1 3.71Å; F387-V429 HydrophobicContact CD1-CG1 3.78Å; F387-V429 HydrophobicContact CG-CG1 4.2Å; R389-V429 HydrophobicContact CG-CG2 4.25Å; N426-V429 VanDerWaalsContact O-CG2 3.26Å; N426-V429 WeakPolarHBondContact O-CG2 3.32Å; K427-V429 VanDerWaalsContact C-N 3.32Å; K427-V429 PolarHBondContact O-N 3.4Å
430F93.2Very high86.2Confident1 Ų153.4 Ų53.40%0.00429%0.293CS..EExtended strand (participates in β ladder)trans-108.6129.4175.3-67.9-93.4000111L252 F253 H254 L274 F387 V388 I390 I399 L418L252-F430 HydrophobicContact CB-CD1 4.17Å; L252-F430 HydrophobicContact CD2-CB 4.43Å; F253-F430 CarbonylContact O-C 3.56Å; F253-F430 VanDerWaalsContact O-CA 3.32Å; F253-F430 WeakPolarHBondContact O-CA 3.39Å; H254-F430 HydrophobicContact CB-CD1 4.23Å; H254-F430 HydrophobicContact CB-CE1 4.01Å; H254-F430 AromaticContact CD2-CE1 3.84Å; H254-F430 AromaticContact CD2-CE2 3.98Å; H254-F430 AromaticContact CD2-CZ 3.58Å; L274-F430 HydrophobicContact CD2-CE1 4.23Å; F387-F430 WeakPolarHBondContact CA-O 3.47Å; V388-F430 HydrophobicContact CG2-CB 4.4Å; V388-F430 PolarHBondContact N-O 3.45Å; V388-F430 PolarHBondContact O-N 3.34Å; I390-F430 HydrophobicContact CD1-CB 4.39Å; I390-F430 HydrophobicContact CD1-CD2 4.16Å; I390-F430 HydrophobicContact CD1-CG 4.23Å; I390-F430 HydrophobicContact CG1-CD2 4.4Å; I399-F430 HydrophobicContact CB-CE2 4.3Å; I399-F430 HydrophobicContact CG2-CE2 3.93Å; I399-F430 HydrophobicContact CG2-CZ 3.85Å; L418-F430 HydrophobicContact CD2-CZ 4.36Å
431A92.2Very high86Confident6 Ų656.7 Ų56.75%0.0531%0.305CS..EExtended strand (participates in β ladder)trans-84.6129.9167.200000110.1F253 F387 L433F253-A431 HydrophobicContact CB-CB 4.38Å; F253-A431 PolarHBondContact N-O 2.84Å; F253-A431 PolarHBondContact O-N 3.45Å; F387-A431 HydrophobicContact CD1-CB 3.87Å; F387-A431 HydrophobicContact CE1-CB 3.68Å; F387-A431 HydrophobicContact CZ-CB 4.4Å; A431-L433 HydrophobicContact CB-CD2 4.4Å; A431-L433 PolarHBondContact O-N 3.25Å
432I91.3Very high86Confident0.5 Ų0.556.4 Ų56.40%0.00330%0.303CS..EExtended strand (participates in β ladder)trans-88.5103.2176-60.4177.8000109.2L244 I250 L252 M369 I382 N385 A386 V388L244-I432 HydrophobicContact CD1-CG2 4.22Å; L244-I432 HydrophobicContact CD2-CD1 4.04Å; I250-I432 HydrophobicContact CB-CG2 4.04Å; I250-I432 HydrophobicContact CD1-CG2 3.77Å; I250-I432 HydrophobicContact CG2-CG2 3.78Å; L252-I432 HydrophobicContact CD2-CG1 3.97Å; M369-I432 HydrophobicContact SD-CD1 3.74Å; I382-I432 HydrophobicContact CG2-CD1 4.32Å; N385-I432 WeakPolarHBondContact CA-O 3.5Å; N385-I432 PolarHBondContact N-O 3.18Å; N385-I432 PolarHBondContact OD1-O 2.98Å; A386-I432 PolarHBondContact O-N 2.97Å; V388-I432 HydrophobicContact CB-CD1 4.39Å; V388-I432 HydrophobicContact CG1-CD1 3.65Å; V388-I432 HydrophobicContact CG1-CG1 4.29Å; V388-I432 HydrophobicContact CG2-CD1 3.8Å; V388-I432 HydrophobicContact CG2-CG1 3.87Å
433L91.8Very high86.1Confident53 Ų5352.8 Ų52.828%0.27728%0.277SS..EExtended strand (participates in β ladder)trans-98.9115.1-179.4-57.1-179.1000110.4I250 R251 F253 F260 A431I250-L433 CarbonylContact C-O 3.6Å; I250-L433 VanDerWaalsContact CA-O 3.31Å; I250-L433 WeakPolarHBondContact CA-O 3.18Å; R251-L433 HydrophobicContact CB-CB 4.31Å; R251-L433 PolarHBondContact N-O 2.81Å; R251-L433 PolarHBondContact O-N 3.31Å; F253-L433 HydrophobicContact CB-CD1 4.05Å; F260-L433 HydrophobicContact CE1-CD1 3.96Å; F260-L433 HydrophobicContact CZ-CD1 4.38Å; A431-L433 HydrophobicContact CB-CD2 4.4Å; A431-L433 PolarHBondContact O-N 3.25Å
434P90.4Very high86.2Confident55 Ų5547 Ų4736%0.35725%0.253SS..EExtended strand (participates in β ladder)trans-67.8145.1178.330.5-34.6000110.6N384 N385N384-P434 HydrophobicContact CB-CG 4.18Å; N385-P434 WeakPolarHBondContact OD1-CD 3.44Å
435V88.3Confident86.5Confident15.5 Ų15.543.4 Ų43.49%0.09424%0.238CC..  trans-104.1125.5179.2-1770000109.4V249 R251 L291 A437 V439 V440V249-V435 HydrophobicContact CB-CB 4.45Å; V249-V435 HydrophobicContact CG1-CB 4.28Å; V249-V435 HydrophobicContact CG1-CG2 4.23Å; V249-V435 VanDerWaalsContact O-CB 3.31Å; V249-V435 WeakPolarHBondContact O-CB 3.14Å; V249-V435 WeakPolarHBondContact O-CG2 3.44Å; V249-V435 PolarHBondContact O-N 2.96Å; R251-V435 HydrophobicContact CG-CG2 3.95Å; L291-V435 HydrophobicContact CD2-CB 4.11Å; L291-V435 HydrophobicContact CD2-CG1 3.92Å; L291-V435 HydrophobicContact CD2-CG2 3.26Å; V435-A437 PolarHBondContact O-N 3.39Å; V435-V439 HydrophobicContact CG1-CB 4.07Å; V435-V439 HydrophobicContact CG1-CG1 4.11Å; V435-V440 HydrophobicContact CB-CG2 4.3Å; V435-V440 HydrophobicContact CG1-CG2 3.89Å
436P85.1Confident86.6Confident72.5 Ų72.540.3 Ų40.347%0.47122%0.221SC..  trans-55.3138.7176.8-29.938000113N438 V439 V440P436-N438 WeakPolarHBondContact CB-OD1 3.27Å; P436-N438 PolarHBondContact O-N 3.23Å; P436-V439 HydrophobicContact CB-CG2 4.38Å; P436-V439 WeakPolarHBondContact O-CB 3.44Å; P436-V439 PolarHBondContact O-N 3.22Å; P436-V439 VanDerWaalsContact O-N 3.09Å; P436-V440 PolarHBondContact O-N 3.1Å
437A80.7Confident86.7Confident65.5 Ų65.535.3 Ų35.354%0.54120%0.195SC..Hα-helixtrans-60.8-29.7-174.500000113.6V435 V440 R441V435-A437 PolarHBondContact O-N 3.39Å; A437-V440 PolarHBondContact O-N 2.95Å; A437-R441 WeakPolarHBondContact O-CG 3.43Å; A437-R441 PolarHBondContact O-N 3.05Å
438N80.5Confident86.8Confident73.5 Ų73.531.9 Ų31.939%0.39318%0.183SC..Hα-helixtrans-62.9-41.5174.461.7-27.5000112.6P436 V440 R441 D442P436-N438 WeakPolarHBondContact CB-OD1 3.27Å; P436-N438 PolarHBondContact O-N 3.23Å; N438-V440 VanDerWaalsContact C-N 3.32Å; N438-V440 PolarHBondContact O-N 3.48Å; N438-R441 PolarHBondContact O-N 3.38Å; N438-D442 PolarHBondContact O-N 3.1Å
439V82.6Confident86.8Confident44.5 Ų44.531.1 Ų31.127%0.2718%0.18SC..Hα-helixtrans-66.4-38.2177.7179.10000110.8V435 P436 D442 L443V435-V439 HydrophobicContact CG1-CB 4.07Å; V435-V439 HydrophobicContact CG1-CG1 4.11Å; P436-V439 HydrophobicContact CB-CG2 4.38Å; P436-V439 WeakPolarHBondContact O-CB 3.44Å; P436-V439 PolarHBondContact O-N 3.22Å; P436-V439 VanDerWaalsContact O-N 3.09Å; V439-D442 PolarHBondContact O-N 3.29Å; V439-L443 WeakPolarHBondContact O-CB 3.45Å; V439-L443 PolarHBondContact O-N 3.31Å
440V84.2Confident86.7Confident14.5 Ų14.532.5 Ų32.59%0.08819%0.185CC..Hα-helixtrans-64.6-45.8175.7-177.30000110.3V249 L318 V435 P436 A437 N438 D442 L443 D444V249-V440 HydrophobicContact CB-CG2 3.87Å; V249-V440 HydrophobicContact CG1-CG2 4.11Å; V249-V440 HydrophobicContact CG2-CG1 3.96Å; V249-V440 HydrophobicContact CG2-CG2 4.08Å; L318-V440 HydrophobicContact CD2-CG1 4.33Å; V435-V440 HydrophobicContact CB-CG2 4.3Å; V435-V440 HydrophobicContact CG1-CG2 3.89Å; P436-V440 PolarHBondContact O-N 3.1Å; A437-V440 PolarHBondContact O-N 2.95Å; N438-V440 VanDerWaalsContact C-N 3.32Å; N438-V440 PolarHBondContact O-N 3.48Å; V440-D442 VanDerWaalsContact C-N 3.34Å; V440-D442 PolarHBondContact O-N 2.93Å; V440-L443 WeakPolarHBondContact O-CA 3.09Å; V440-L443 WeakPolarHBondContact O-CB 3.27Å; V440-L443 PolarHBondContact O-N 2.72Å; V440-L443 VanDerWaalsContact O-N 3.08Å; V440-D444 WeakPolarHBondContact O-CB 3.48Å; V440-D444 VanDerWaalsContact O-CG 3.24Å; V440-D444 PolarHBondContact O-N 3.09Å
441R83.1Confident86.4Confident81 Ų8138.1 Ų38.131%0.30621%0.209SC..Hα-helixtrans-59.6-44.6175.6-72.3-172.5-57-116.67.2112.8A437 N438 L443 D444 F445A437-R441 WeakPolarHBondContact O-CG 3.43Å; A437-R441 PolarHBondContact O-N 3.05Å; N438-R441 PolarHBondContact O-N 3.38Å; R441-L443 VanDerWaalsContact C-N 3.26Å; R441-L443 PolarHBondContact O-N 3.08Å; R441-D444 PolarHBondContact O-N 3Å; R441-F445 WeakPolarHBondContact O-CB 3.27Å; R441-F445 PolarHBondContact O-N 2.99Å
442D86.1Confident86.1Confident23 Ų2339.4 Ų39.412%0.12322%0.22CC..Hα-helixtrans-62.3-36.3177.8-80.55.2000111.4N438 V439 V440 A446 F484 R509 L512N438-D442 PolarHBondContact O-N 3.1Å; V439-D442 PolarHBondContact O-N 3.29Å; V440-D442 VanDerWaalsContact C-N 3.34Å; V440-D442 PolarHBondContact O-N 2.93Å; D442-A446 WeakPolarHBondContact O-CB 3.47Å; D442-A446 PolarHBondContact O-N 3.23Å; D442-A446 VanDerWaalsContact O-N 3.12Å; D442-F484 HydrophobicContact CB-CE2 3.82Å; D442-F484 HydrophobicContact CB-CZ 3.88Å; D442-R509 IonicContact OD1-NE 3.51Å; D442-R509 IonicContact OD1-NH2 3.34Å; D442-R509 WeakPolarHBondContact OD2-CG 3.38Å; D442-R509 IonicContact OD2-CZ 2.79Å; D442-R509 IonicContact OD2-NE 3.74Å; D442-R509 PolarHBondContact OD2-NE 3.15Å; D442-R509 IonicContact OD2-NH2 2.71Å; D442-R509 PolarHBondContact OD2-NH2 3.12Å; D442-L512 HydrophobicContact CB-CD1 3.92Å
443L85.1Confident85.9Confident2 Ų239.4 Ų39.41%0.0122%0.22CC..Hα-helixtrans-70.4-46.4174.4-177.2151.4000112.4L291 L318 I319 V439 V440 R441 F445 A446 S447 L512L291-L443 HydrophobicContact CD1-CD1 3.32Å; L318-L443 HydrophobicContact CD2-CD1 4.25Å; L318-L443 HydrophobicContact CD2-CD2 3.71Å; L318-L443 HydrophobicContact CG-CD2 4.1Å; I319-L443 HydrophobicContact CG1-CD1 4.44Å; V439-L443 WeakPolarHBondContact O-CB 3.45Å; V439-L443 PolarHBondContact O-N 3.31Å; V440-L443 WeakPolarHBondContact O-CA 3.09Å; V440-L443 WeakPolarHBondContact O-CB 3.27Å; V440-L443 PolarHBondContact O-N 2.72Å; V440-L443 VanDerWaalsContact O-N 3.08Å; R441-L443 VanDerWaalsContact C-N 3.26Å; R441-L443 PolarHBondContact O-N 3.08Å; L443-F445 VanDerWaalsContact C-N 3.28Å; L443-F445 PolarHBondContact O-N 2.92Å; L443-A446 CarbonylContact O-C 3.57Å; L443-A446 WeakPolarHBondContact O-CB 3.31Å; L443-A446 PolarHBondContact O-N 3.15Å; L443-A446 VanDerWaalsContact O-N 3.1Å; L443-S447 WeakPolarHBondContact O-CB 3.4Å; L443-S447 PolarHBondContact O-N 3.13Å; L443-L512 HydrophobicContact CB-CD2 4.37Å; L443-L512 HydrophobicContact CD1-CD2 4.46Å
444D84.8Confident85.7Confident38 Ų3843.5 Ų43.520%0.20323%0.232CC..Hα-helixtrans-58.6-44.7178.2-70.8-30.5000110.1Q39 R61 K125 V440 R441 A446 S447 D448Q39-D444 HydrophobicContact CG-CB 4.2Å; R61-D444 IonicContact CZ-OD2 3.94Å; R61-D444 IonicContact NH1-OD1 3.59Å; R61-D444 PolarHBondContact NH1-OD1 2.73Å; R61-D444 VanDerWaalsContact NH1-OD1 3.17Å; R61-D444 IonicContact NH1-OD2 3.85Å; R61-D444 PolarHBondContact NH1-OD2 2.99Å; R61-D444 IonicContact NH2-OD2 2.83Å; R61-D444 PolarHBondContact NH2-OD2 2.94Å; K125-D444 HydrophobicContact CG-CB 4.35Å; V440-D444 WeakPolarHBondContact O-CB 3.48Å; V440-D444 VanDerWaalsContact O-CG 3.24Å; V440-D444 PolarHBondContact O-N 3.09Å; R441-D444 PolarHBondContact O-N 3Å; D444-A446 VanDerWaalsContact C-N 3.33Å; D444-A446 PolarHBondContact O-N 3.37Å; D444-S447 PolarHBondContact O-N 3.24Å; D444-D448 VanDerWaalsContact O-CB 3.29Å; D444-D448 WeakPolarHBondContact O-CB 3.41Å; D444-D448 PolarHBondContact O-N 2.87Å
445F87.4Confident85.5Confident27 Ų2743.3 Ų43.312%0.11824%0.235CC..Hα-helixtrans-57.6-45.1173.6176.6-94.9000112.2Q39 I40 R441 L443 S449 E480 L481 F484Q39-F445 HydrophobicContact CB-CB 4.26Å; Q39-F445 HydrophobicContact CB-CD2 4.11Å; Q39-F445 HydrophobicContact CG-CB 4.34Å; I40-F445 HydrophobicContact CG1-CD2 4.36Å; I40-F445 HydrophobicContact CG1-CE2 4.16Å; R441-F445 WeakPolarHBondContact O-CB 3.27Å; R441-F445 PolarHBondContact O-N 2.99Å; L443-F445 VanDerWaalsContact C-N 3.28Å; L443-F445 PolarHBondContact O-N 2.92Å; F445-S449 VanDerWaalsContact O-CB 3.25Å; F445-S449 WeakPolarHBondContact O-CB 3.43Å; F445-S449 PolarHBondContact O-N 3.06Å; F445-S449 PolarHBondContact O-OG 3.02Å; F445-E480 HydrophobicContact CE2-CB 4.19Å; F445-E480 HydrophobicContact CZ-CB 3.97Å; F445-L481 HydrophobicContact CE1-CD2 3.92Å; F445-L481 HydrophobicContact CZ-CD2 4.47Å; F445-F484 HydrophobicContact CD1-CB 4.16Å; F445-F484 HydrophobicContact CD1-CD1 4.15Å; F445-F484 AromaticContact CD1-CD2 3.42Å; F445-F484 HydrophobicContact CD1-CD2 3.42Å; F445-F484 VanDerWaalsContact CD1-CD2 3.42Å; F445-F484 HydrophobicContact CD1-CE1 4.39Å; F445-F484 AromaticContact CD1-CE2 3.72Å; F445-F484 HydrophobicContact CD1-CE2 3.72Å; F445-F484 AromaticContact CD1-CG 3.65Å; F445-F484 HydrophobicContact CD1-CG 3.65Å; F445-F484 HydrophobicContact CD1-CZ 4.18Å; F445-F484 HydrophobicContact CE1-CB 3.43Å; F445-F484 VanDerWaalsContact CE1-CB 3.43Å; F445-F484 AromaticContact CE1-CD1 3.98Å; F445-F484 HydrophobicContact CE1-CD1 3.98Å; F445-F484 AromaticContact CE1-CD2 3.63Å; F445-F484 HydrophobicContact CE1-CD2 3.63Å; F445-F484 HydrophobicContact CE1-CE2 4.35Å; F445-F484 AromaticContact CE1-CG 3.41Å; F445-F484 HydrophobicContact CE1-CG 3.41Å; F445-F484 VanDerWaalsContact CE1-CG 3.41Å; F445-F484 HydrophobicContact CG-CD2 4.24Å; F445-F484 HydrophobicContact CG-CE2 4.44Å; F445-F484 HydrophobicContact CZ-CB 4Å; F445-F484 HydrophobicContact CZ-CG 4.39Å
446A86.3Confident85.3Confident0 Ų043.2 Ų43.20%023%0.234CC..Hα-helixtrans-64.9-45.4177.200000112D442 L443 D444 S449 F450 L512 I518D442-A446 WeakPolarHBondContact O-CB 3.47Å; D442-A446 PolarHBondContact O-N 3.23Å; D442-A446 VanDerWaalsContact O-N 3.12Å; L443-A446 CarbonylContact O-C 3.57Å; L443-A446 WeakPolarHBondContact O-CB 3.31Å; L443-A446 PolarHBondContact O-N 3.15Å; L443-A446 VanDerWaalsContact O-N 3.1Å; D444-A446 VanDerWaalsContact C-N 3.33Å; D444-A446 PolarHBondContact O-N 3.37Å; A446-S449 WeakPolarHBondContact O-CB 3.36Å; A446-S449 PolarHBondContact O-N 3.16Å; A446-F450 WeakPolarHBondContact O-CB 3.37Å; A446-F450 PolarHBondContact O-N 2.76Å; A446-L512 HydrophobicContact CB-CB 4.37Å; A446-I518 HydrophobicContact CB-CD1 3.83Å; A446-I518 WeakPolarHBondContact O-CD1 3.13Å
447S84.3Confident85.3Confident13.5 Ų13.540.5 Ų40.59%0.09422%0.215CC..Hα-helixtrans-61.6-45.8178.2173.90000111.7L443 D444 S449 F450 K451L443-S447 WeakPolarHBondContact O-CB 3.4Å; L443-S447 PolarHBondContact O-N 3.13Å; D444-S447 PolarHBondContact O-N 3.24Å; S447-S449 VanDerWaalsContact C-N 3.29Å; S447-S449 PolarHBondContact O-N 2.62Å; S447-F450 WeakPolarHBondContact O-CB 3.23Å; S447-F450 PolarHBondContact O-N 3.03Å; S447-K451 WeakPolarHBondContact O-CG 3.42Å; S447-K451 PolarHBondContact O-N 3.4Å
448D86.2Confident85.5Confident50.5 Ų50.540.2 Ų40.227%0.2721%0.208SC..Hα-helixtrans-68.8-37.2178.9-67.6-17.1000111.2G38 Q39 I40 K125 D444 F450 K451 A452G38-D448 WeakPolarHBondContact CA-OD2 3.47Å; Q39-D448 PolarHBondContact N-OD2 2.98Å; I40-D448 VanDerWaalsContact CD1-C 3.43Å; I40-D448 HydrophobicContact CD1-CB 4.15Å; K125-D448 VanDerWaalsContact CE-OD2 3.29Å; K125-D448 WeakPolarHBondContact CE-OD2 3.15Å; K125-D448 IonicContact NZ-OD1 3.5Å; K125-D448 PolarHBondContact NZ-OD1 3.49Å; K125-D448 VanDerWaalsContact NZ-OD1 3.14Å; K125-D448 IonicContact NZ-OD2 3.85Å; K125-D448 PolarHBondContact NZ-OD2 2.98Å; D444-D448 VanDerWaalsContact O-CB 3.29Å; D444-D448 WeakPolarHBondContact O-CB 3.41Å; D444-D448 PolarHBondContact O-N 2.87Å; D448-F450 VanDerWaalsContact C-N 3.31Å; D448-F450 PolarHBondContact O-N 3.06Å; D448-K451 PolarHBondContact O-N 3.23Å; D448-K451 IonicContact OD1-NZ 3.99Å; D448-K451 PolarHBondContact OD1-NZ 3.27Å; D448-A452 VanDerWaalsContact O-CB 3.31Å; D448-A452 WeakPolarHBondContact O-CB 3.32Å; D448-A452 PolarHBondContact O-N 3.05Å
449S88.2Confident85.5Confident5 Ų539.5 Ų39.54%0.03520%0.204CC..Hα-helixtrans-61.6-43.8172.7-62.90000111.4I40 F445 A446 S447 A452 L453I40-S449 WeakPolarHBondContact CD1-OG 3.35Å; F445-S449 VanDerWaalsContact O-CB 3.25Å; F445-S449 WeakPolarHBondContact O-CB 3.43Å; F445-S449 PolarHBondContact O-N 3.06Å; F445-S449 PolarHBondContact O-OG 3.02Å; A446-S449 WeakPolarHBondContact O-CB 3.36Å; A446-S449 PolarHBondContact O-N 3.16Å; S447-S449 VanDerWaalsContact C-N 3.29Å; S447-S449 PolarHBondContact O-N 2.62Å; S449-A452 PolarHBondContact O-N 3.13Å; S449-L453 VanDerWaalsContact O-CB 3.32Å; S449-L453 WeakPolarHBondContact O-CB 3.44Å; S449-L453 VanDerWaalsContact O-CG 3.25Å; S449-L453 WeakPolarHBondContact O-CG 3.43Å; S449-L453 PolarHBondContact O-N 3.13Å
450F87.9Confident85.4Confident40.5 Ų40.538.1 Ų38.118%0.17820%0.195CC..Hα-helixtrans-61.9-46.7176172.9-98000111.9A446 S447 D448 A452 L453 R454 H516 N517 I518 Q521A446-F450 WeakPolarHBondContact O-CB 3.37Å; A446-F450 PolarHBondContact O-N 2.76Å; S447-F450 WeakPolarHBondContact O-CB 3.23Å; S447-F450 PolarHBondContact O-N 3.03Å; D448-F450 VanDerWaalsContact C-N 3.31Å; D448-F450 PolarHBondContact O-N 3.06Å; F450-A452 VanDerWaalsContact C-N 3.34Å; F450-A452 PolarHBondContact O-N 3.41Å; F450-L453 PolarHBondContact O-N 2.92Å; F450-R454 VanDerWaalsContact O-CB 3.25Å; F450-R454 WeakPolarHBondContact O-CB 3.38Å; F450-R454 PolarHBondContact O-N 3.16Å; F450-H516 WeakPolarHBondContact CD2-O 3.41Å; F450-N517 HydrophobicContact CD2-CB 4.48Å; F450-N517 HydrophobicContact CE2-CB 3.92Å; F450-I518 HydrophobicContact CB-CG1 4Å; F450-Q521 HydrophobicContact CD2-CG 3.71Å; F450-Q521 HydrophobicContact CE2-CG 3.55Å; F450-Q521 VanDerWaalsContact CE2-NE2 3.33Å
451K86.9Confident85.1Confident119 Ų11943 Ų4352%0.51722%0.22SC..Hα-helixtrans-60.8-45.4178.1-69.9170.2-166.3164.20111.3S447 D448 R454 A455S447-K451 WeakPolarHBondContact O-CG 3.42Å; S447-K451 PolarHBondContact O-N 3.4Å; D448-K451 PolarHBondContact O-N 3.23Å; D448-K451 IonicContact OD1-NZ 3.99Å; D448-K451 PolarHBondContact OD1-NZ 3.27Å; K451-R454 PolarHBondContact O-N 3.3Å; K451-A455 WeakPolarHBondContact O-CB 3.46Å; K451-A455 PolarHBondContact O-N 3.27Å
452A86.2Confident84.8Confident33 Ų3345.2 Ų45.227%0.27324%0.238SC..Hα-helixtrans-64.7-46.617900000112I40 D448 S449 F450 R454 A455 I456 I477I40-A452 HydrophobicContact CD1-CB 4.27Å; D448-A452 VanDerWaalsContact O-CB 3.31Å; D448-A452 WeakPolarHBondContact O-CB 3.32Å; D448-A452 PolarHBondContact O-N 3.05Å; S449-A452 PolarHBondContact O-N 3.13Å; F450-A452 VanDerWaalsContact C-N 3.34Å; F450-A452 PolarHBondContact O-N 3.41Å; A452-R454 VanDerWaalsContact C-N 3.34Å; A452-R454 PolarHBondContact O-N 3.37Å; A452-A455 PolarHBondContact O-N 2.96Å; A452-I456 WeakPolarHBondContact O-CG1 3.33Å; A452-I456 PolarHBondContact O-N 3.16Å; A452-I456 VanDerWaalsContact O-N 3.08Å; A452-I477 HydrophobicContact CB-CD1 3.64Å; A452-I477 HydrophobicContact CB-CG1 4.42Å
453L88.2Confident83.8Confident0.5 Ų0.550.6 Ų50.60%0.00326%0.262CS..Hα-helixtrans-61.9-41.9175.5-73.2175.3000111.9S449 F450 I456 L457 L474 I477 L478 L481 I518 I525S449-L453 VanDerWaalsContact O-CB 3.32Å; S449-L453 WeakPolarHBondContact O-CB 3.44Å; S449-L453 VanDerWaalsContact O-CG 3.25Å; S449-L453 WeakPolarHBondContact O-CG 3.43Å; S449-L453 PolarHBondContact O-N 3.13Å; F450-L453 PolarHBondContact O-N 2.92Å; L453-I456 PolarHBondContact O-N 3.17Å; L453-L457 WeakPolarHBondContact O-CB 3.25Å; L453-L457 PolarHBondContact O-N 3.22Å; L453-L474 HydrophobicContact CD2-CD1 3.67Å; L453-I477 HydrophobicContact CD1-CG2 4.4Å; L453-I477 HydrophobicContact CD2-CB 4.45Å; L453-I477 HydrophobicContact CD2-CG2 3.86Å; L453-I477 HydrophobicContact CG-CG2 3.9Å; L453-L478 HydrophobicContact CD2-CD2 4.33Å; L453-L481 HydrophobicContact CD1-CD1 3.95Å; L453-I518 HydrophobicContact CD1-CG2 4.1Å; L453-I525 HydrophobicContact CD2-CD1 3.97Å
454R86.5Confident83.1Confident140 Ų14052.4 Ų52.453%0.52828%0.281SS..Hα-helixtrans-63.3-42.2177.8-175.4179.6178.2176.20.9111.4F450 K451 A452 I456 L457 C458F450-R454 VanDerWaalsContact O-CB 3.25Å; F450-R454 WeakPolarHBondContact O-CB 3.38Å; F450-R454 PolarHBondContact O-N 3.16Å; K451-R454 PolarHBondContact O-N 3.3Å; A452-R454 VanDerWaalsContact C-N 3.34Å; A452-R454 PolarHBondContact O-N 3.37Å; R454-I456 VanDerWaalsContact C-N 3.35Å; R454-L457 PolarHBondContact O-N 3.42Å; R454-C458 WeakPolarHBondContact O-CB 3.31Å; R454-C458 PolarHBondContact O-N 3.15Å; R454-C458 PolarHBondContact O-SG 3.12Å; R454-C458 VanDerWaalsContact O-SG 3.36Å
455A86.4Confident82.5Confident50 Ų5055.1 Ų55.141%0.41329%0.291SS..Hα-helixtrans-60.8-45176.100000111.5K451 A452 C458 M459K451-A455 WeakPolarHBondContact O-CB 3.46Å; K451-A455 PolarHBondContact O-N 3.27Å; A452-A455 PolarHBondContact O-N 2.96Å; A455-C458 PolarHBondContact O-N 3.14Å; A455-M459 HydrophobicContact CB-CE 4.49Å; A455-M459 WeakPolarHBondContact O-CE 3.21Å; A455-M459 WeakPolarHBondContact O-CG 3.27Å; A455-M459 PolarHBondContact O-N 2.92Å; A455-M459 VanDerWaalsContact O-N 3.12Å
456I84.8Confident81.9Confident14.5 Ų14.554.2 Ų54.27%0.07429%0.287CS..Hα-helixtrans-63.7-41.4176.1-64169.4000111.3A452 L453 R454 M459 L460 L466 L474 I477A452-I456 WeakPolarHBondContact O-CG1 3.33Å; A452-I456 PolarHBondContact O-N 3.16Å; A452-I456 VanDerWaalsContact O-N 3.08Å; L453-I456 PolarHBondContact O-N 3.17Å; R454-I456 VanDerWaalsContact C-N 3.35Å; I456-M459 HydrophobicContact CB-CE 4.35Å; I456-M459 HydrophobicContact CG1-CE 4.2Å; I456-M459 PolarHBondContact O-N 3.27Å; I456-L460 WeakPolarHBondContact O-CB 3.4Å; I456-L460 PolarHBondContact O-N 3.44Å; I456-L466 HydrophobicContact CG2-CD1 4.34Å; I456-L466 HydrophobicContact CG2-CD2 3.96Å; I456-L474 HydrophobicContact CD1-CB 4.14Å; I456-L474 HydrophobicContact CD1-CD1 4.44Å; I456-L474 HydrophobicContact CG2-CB 4.39Å; I456-L474 HydrophobicContact CG2-CD1 4.38Å; I456-L474 HydrophobicContact CG2-CD2 4.4Å; I456-I477 HydrophobicContact CD1-CD1 3.59Å
457L84.3Confident81.5Confident15.5 Ų15.555.1 Ų55.18%0.08129%0.293CS..Hα-helixtrans-66.9-39178.7-166.683.6000112.4L453 R454 M459 L460 N461 K524 I525L453-L457 WeakPolarHBondContact O-CB 3.25Å; L453-L457 PolarHBondContact O-N 3.22Å; R454-L457 PolarHBondContact O-N 3.42Å; L457-M459 VanDerWaalsContact C-N 3.34Å; L457-L460 HydrophobicContact CD1-CD2 4.46Å; L457-L460 WeakPolarHBondContact O-CB 3.48Å; L457-L460 PolarHBondContact O-N 2.99Å; L457-N461 VanDerWaalsContact O-CG 3.3Å; L457-N461 PolarHBondContact O-N 3.38Å; L457-N461 PolarHBondContact O-ND2 3.27Å; L457-K524 HydrophobicContact CD1-CB 4.18Å; L457-K524 HydrophobicContact CD2-CB 3.76Å; L457-K524 HydrophobicContact CD2-CD 3.84Å; L457-K524 HydrophobicContact CD2-CG 4.43Å; L457-I525 HydrophobicContact CD1-CB 4.41Å; L457-I525 HydrophobicContact CD1-CG1 3.83Å
458C84.5Confident81.2Confident58.5 Ų58.556.5 Ų56.540%0.39530%0.298SS..Hα-helixtrans-59.1-48.2172.6-73.30000110.6R454 A455 L460 N461 D462R454-C458 WeakPolarHBondContact O-CB 3.31Å; R454-C458 PolarHBondContact O-N 3.15Å; R454-C458 PolarHBondContact O-SG 3.12Å; R454-C458 VanDerWaalsContact O-SG 3.36Å; A455-C458 PolarHBondContact O-N 3.14Å; C458-L460 VanDerWaalsContact C-N 3.3Å; C458-L460 PolarHBondContact O-N 3.35Å; C458-N461 PolarHBondContact O-N 3.32Å; C458-N461 VanDerWaalsContact O-N 3.11Å; C458-D462 VanDerWaalsContact O-CG 3.22Å; C458-D462 PolarHBondContact O-N 2.96Å
459M81.5Confident80.8Confident60 Ų6058.5 Ų58.530%0.29631%0.312SS..Hα-helixtrans-61.1-37.4177.1-67.8-175.5-73.500112.7A455 I456 L457 D462 H463 Q470A455-M459 HydrophobicContact CB-CE 4.49Å; A455-M459 WeakPolarHBondContact O-CE 3.21Å; A455-M459 WeakPolarHBondContact O-CG 3.27Å; A455-M459 PolarHBondContact O-N 2.92Å; A455-M459 VanDerWaalsContact O-N 3.12Å; I456-M459 HydrophobicContact CB-CE 4.35Å; I456-M459 HydrophobicContact CG1-CE 4.2Å; I456-M459 PolarHBondContact O-N 3.27Å; L457-M459 VanDerWaalsContact C-N 3.34Å; M459-D462 PolarHBondContact O-N 3.11Å; M459-H463 PolarHBondContact O-N 2.85Å; M459-Q470 HydrophobicContact CE-CG 4.01Å; M459-Q470 HydrophobicContact SD-CG 4.44Å; M459-Q470 PolarHBondContact SD-NE2 3.46Å
460L79.7Confident80.5Confident15 Ų1559.8 Ų59.88%0.07932%0.318CS..Hα-helixtrans-64.1-40.8174.8-177.4106.3000112.1I456 L457 C458 G464 L466 W590I456-L460 WeakPolarHBondContact O-CB 3.4Å; I456-L460 PolarHBondContact O-N 3.44Å; L457-L460 HydrophobicContact CD1-CD2 4.46Å; L457-L460 WeakPolarHBondContact O-CB 3.48Å; L457-L460 PolarHBondContact O-N 2.99Å; C458-L460 VanDerWaalsContact C-N 3.3Å; C458-L460 PolarHBondContact O-N 3.35Å; L460-G464 VanDerWaalsContact O-CA 3.24Å; L460-G464 WeakPolarHBondContact O-CA 3.2Å; L460-G464 PolarHBondContact O-N 3.05Å; L460-L466 HydrophobicContact CB-CD2 4.15Å; L460-L466 HydrophobicContact CD1-CD1 4.19Å; L460-L466 HydrophobicContact CD1-CD2 4.39Å; L460-L466 HydrophobicContact CD1-CG 4.02Å; L460-W590 HydrophobicContact CD1-CH2 3.67Å; L460-W590 VanDerWaalsContact CD1-CH2 3.45Å; L460-W590 HydrophobicContact CD1-CZ2 3.9Å; L460-W590 HydrophobicContact CD2-CH2 4.04Å
461N79.1Confident80.2Confident116.5 Ų116.558.1 Ų58.162%0.62331%0.31SS*.Hα-helixtrans-70.6-35.7178-69.3-22.7000112.1L457 C458L457-N461 VanDerWaalsContact O-CG 3.3Å; L457-N461 PolarHBondContact O-N 3.38Å; L457-N461 PolarHBondContact O-ND2 3.27Å; C458-N461 PolarHBondContact O-N 3.32Å; C458-N461 VanDerWaalsContact O-N 3.11Å
462D76.9Confident79.9Confident126.5 Ų126.555.8 Ų55.868%0.67630%0.298SS*.Hα-helixtrans-78-45-176.7-65.6-22.8000112.6C458 M459C458-D462 VanDerWaalsContact O-CG 3.22Å; C458-D462 PolarHBondContact O-N 2.96Å; M459-D462 PolarHBondContact O-N 3.11Å
463H65.4Low79.7Confident137.5 Ų137.557 Ų5764%0.63731%0.305SS*.Hα-helixtrans-99.7-14.2-175.1-62.5-54.9000114.1M459 K465M459-H463 PolarHBondContact O-N 2.85Å; H463-K465 PolarHBondContact O-N 3.41Å
464G68.5Low79.6Confident39.5 Ų39.557.1 Ų57.141%0.40731%0.305SS..SBendtrans71-18.4-176.200000115.3L460 M530L460-G464 VanDerWaalsContact O-CA 3.24Å; L460-G464 WeakPolarHBondContact O-CA 3.2Å; L460-G464 PolarHBondContact O-N 3.05Å; G464-M530 WeakPolarHBondContact O-CE 3.46Å
465K72.6Confident79.5Confident94 Ų9451.3 Ų51.341%0.40928%0.284SS..SBendtrans-131.9147.6177.3-74.2-168.9173.8-1520111.4H463 M530 Y580 E586H463-K465 PolarHBondContact O-N 3.41Å; K465-M530 HydrophobicContact CD-CE 4.43Å; K465-M530 HydrophobicContact CG-CE 3.72Å; K465-M530 VanDerWaalsContact CG-CE 3.49Å; K465-Y580 HydrophobicContact CB-CD1 4.37Å; K465-Y580 HydrophobicContact CB-CE1 4.02Å; K465-Y580 HydrophobicContact CD-CD1 4.22Å; K465-Y580 HydrophobicContact CD-CE1 4.24Å; K465-E586 IonicContact NZ-OE1 2.86Å; K465-E586 IonicContact NZ-OE2 2.75Å; K465-E586 PolarHBondContact NZ-OE2 3.35Å; K465-E586 VanDerWaalsContact NZ-OE2 3.1Å
466L76.3Confident79.4Confident8 Ų853.5 Ų53.54%0.04229%0.285CS..  trans-95.5142.2173.6-66.5174.9000110.6I456 L460 Q470 M471 L474 W590I456-L466 HydrophobicContact CG2-CD1 4.34Å; I456-L466 HydrophobicContact CG2-CD2 3.96Å; L460-L466 HydrophobicContact CB-CD2 4.15Å; L460-L466 HydrophobicContact CD1-CD1 4.19Å; L460-L466 HydrophobicContact CD1-CD2 4.39Å; L460-L466 HydrophobicContact CD1-CG 4.02Å; L466-Q470 HydrophobicContact CB-CB 4.31Å; L466-Q470 HydrophobicContact CD2-CB 4.15Å; L466-M471 HydrophobicContact CD1-SD 3.92Å; L466-L474 HydrophobicContact CD1-CD2 4.05Å; L466-W590 HydrophobicContact CD1-CH2 3.79Å; L466-W590 HydrophobicContact CD1-CZ2 3.76Å; L466-W590 HydrophobicContact CG-CZ2 4.35Å
467T77.9Confident79.5Confident20.5 Ų20.553.6 Ų53.613%0.12629%0.285CS..  trans-74.3161.2168.762.90000110.9T469 Q470 M471 Y580T467-T469 VanDerWaalsContact C-N 3.25Å; T467-T469 PolarHBondContact O-N 2.87Å; T467-T469 PolarHBondContact OG1-OG1 3.31Å; T467-T469 VanDerWaalsContact OG1-OG1 3.08Å; T467-Q470 WeakPolarHBondContact O-CB 3.45Å; T467-Q470 PolarHBondContact O-N 3.23Å; T467-Q470 VanDerWaalsContact OG1-CD 3.23Å; T467-Q470 WeakPolarHBondContact OG1-CG 3.49Å; T467-Q470 PolarHBondContact OG1-N 3.38Å; T467-Q470 PolarHBondContact OG1-OE1 3.03Å; T467-M471 PolarHBondContact O-N 3.17Å; T467-Y580 HydrophobicContact CG2-CE1 4.16Å
468E76.3Confident79.6Confident42.5 Ų42.552.9 Ų52.920%0.19928%0.282CS..Hα-helixtrans-56.2-38.3178.6-172.7-175.4-178.300112.8M471 R472 V579 L581E468-M471 PolarHBondContact O-N 3.36Å; E468-R472 WeakPolarHBondContact O-CG 3.25Å; E468-R472 PolarHBondContact O-N 3.12Å; E468-R472 IonicContact OE1-CZ 3.2Å; E468-R472 IonicContact OE1-NE 3.78Å; E468-R472 IonicContact OE1-NH1 2.6Å; E468-R472 PolarHBondContact OE1-NH1 3.4Å; E468-R472 IonicContact OE1-NH2 3.39Å; E468-R472 PolarHBondContact OE1-NH2 3.06Å; E468-R472 IonicContact OE2-NH1 3.74Å; E468-V579 PolarHBondContact N-O 2.95Å; E468-L581 HydrophobicContact CB-CD1 4.05Å; E468-L581 HydrophobicContact CB-CD2 4.38Å; E468-L581 HydrophobicContact CB-CG 4.43Å; E468-L581 HydrophobicContact CG-CD1 4.21Å; E468-L581 HydrophobicContact CG-CD2 4.02Å
469T78.3Confident79.6Confident91 Ų9151.9 Ų51.956%0.55828%0.275SS*.Hα-helixtrans-67.9-40.5177.653.80000112.2T467 S473T467-T469 VanDerWaalsContact C-N 3.25Å; T467-T469 PolarHBondContact O-N 2.87Å; T467-T469 PolarHBondContact OG1-OG1 3.31Å; T467-T469 VanDerWaalsContact OG1-OG1 3.08Å; T469-S473 WeakPolarHBondContact O-CB 3.37Å; T469-S473 PolarHBondContact O-N 3.12Å; T469-S473 PolarHBondContact O-OG 3.44Å
470Q82.3Confident79.7Confident33.5 Ų33.550.8 Ų50.816%0.15727%0.269CS..Hα-helixtrans-66.8-40.6175.8-70.5166.9-10.100111.4M459 L466 T467 S473 L474M459-Q470 HydrophobicContact CE-CG 4.01Å; M459-Q470 HydrophobicContact SD-CG 4.44Å; M459-Q470 PolarHBondContact SD-NE2 3.46Å; L466-Q470 HydrophobicContact CB-CB 4.31Å; L466-Q470 HydrophobicContact CD2-CB 4.15Å; T467-Q470 WeakPolarHBondContact O-CB 3.45Å; T467-Q470 PolarHBondContact O-N 3.23Å; T467-Q470 VanDerWaalsContact OG1-CD 3.23Å; T467-Q470 WeakPolarHBondContact OG1-CG 3.49Å; T467-Q470 PolarHBondContact OG1-N 3.38Å; T467-Q470 PolarHBondContact OG1-OE1 3.03Å; Q470-S473 WeakPolarHBondContact O-CB 3.37Å; Q470-S473 PolarHBondContact O-N 3.23Å; Q470-L474 PolarHBondContact O-N 3.14Å
471M80.8Confident80.1Confident5 Ų550 Ų503%0.02527%0.266CS..Hα-helixtrans-64.8-43.1177.7-165113-153.800111.9L466 T467 E468 S473 L474 I475 L581 A589 W590 V593L466-M471 HydrophobicContact CD1-SD 3.92Å; T467-M471 PolarHBondContact O-N 3.17Å; E468-M471 PolarHBondContact O-N 3.36Å; M471-S473 VanDerWaalsContact C-N 3.3Å; M471-S473 PolarHBondContact O-N 3.3Å; M471-L474 PolarHBondContact O-N 3.19Å; M471-L474 HydrophobicContact SD-CD2 4.37Å; M471-I475 HydrophobicContact CG-CD1 4.35Å; M471-I475 WeakPolarHBondContact O-CG1 3.18Å; M471-I475 PolarHBondContact O-N 2.97Å; M471-L581 HydrophobicContact CB-CD1 4.39Å; M471-L581 HydrophobicContact CG-CD1 4.15Å; M471-L581 HydrophobicContact SD-CD1 3.93Å; M471-L581 HydrophobicContact SD-CD2 3.99Å; M471-A589 HydrophobicContact CE-CB 3.5Å; M471-A589 VanDerWaalsContact CE-CB 3.42Å; M471-A589 WeakPolarHBondContact CE-O 3.5Å; M471-A589 HydrophobicContact CG-CB 3.97Å; M471-A589 HydrophobicContact SD-CB 3.88Å; M471-A589 WeakPolarHBondContact SD-CB 3.48Å; M471-W590 HydrophobicContact CE-CB 4.42Å; M471-W590 HydrophobicContact CE-CD2 3.85Å; M471-W590 HydrophobicContact CE-CE3 4.15Å; M471-W590 HydrophobicContact CE-CG 3.89Å; M471-W590 HydrophobicContact CE-CZ2 4.25Å; M471-V593 HydrophobicContact CE-CB 4.29Å; M471-V593 HydrophobicContact CE-CG2 3.44Å; M471-V593 VanDerWaalsContact CE-CG2 3.44Å; M471-V593 HydrophobicContact SD-CG2 4.26Å
472R80.4Confident80.2Confident70 Ų7045.3 Ų45.326%0.26424%0.241SC..Hα-helixtrans-59.4-42171.8-74.8-178.7-176.4153.8-1.7111.8E468 I475 F476 L564E468-R472 WeakPolarHBondContact O-CG 3.25Å; E468-R472 PolarHBondContact O-N 3.12Å; E468-R472 IonicContact OE1-CZ 3.2Å; E468-R472 IonicContact OE1-NE 3.78Å; E468-R472 IonicContact OE1-NH1 2.6Å; E468-R472 PolarHBondContact OE1-NH1 3.4Å; E468-R472 IonicContact OE1-NH2 3.39Å; E468-R472 PolarHBondContact OE1-NH2 3.06Å; E468-R472 IonicContact OE2-NH1 3.74Å; R472-I475 PolarHBondContact O-N 3.14Å; R472-F476 VanDerWaalsContact O-CB 3.31Å; R472-F476 WeakPolarHBondContact O-CB 3.36Å; R472-F476 PolarHBondContact O-N 3.02Å; R472-L564 HydrophobicContact CG-CD1 4.19Å; R472-L564 PolarHBondContact NH2-O 3.41Å
473S83Confident80.3Confident58.5 Ų58.542 Ų4241%0.40922%0.222SC..Hα-helixtrans-64.5-41.9178.4-56.20000111.5T469 Q470 M471 F476 I477T469-S473 WeakPolarHBondContact O-CB 3.37Å; T469-S473 PolarHBondContact O-N 3.12Å; T469-S473 PolarHBondContact O-OG 3.44Å; Q470-S473 WeakPolarHBondContact O-CB 3.37Å; Q470-S473 PolarHBondContact O-N 3.23Å; M471-S473 VanDerWaalsContact C-N 3.3Å; M471-S473 PolarHBondContact O-N 3.3Å; S473-F476 PolarHBondContact O-N 3.08Å; S473-I477 WeakPolarHBondContact O-CD1 3.43Å; S473-I477 VanDerWaalsContact O-CG1 3.23Å; S473-I477 WeakPolarHBondContact O-CG1 3.28Å; S473-I477 PolarHBondContact O-N 3.18Å
474L86.7Confident81.2Confident2 Ų235.5 Ų35.51%0.0119%0.192CC..Hα-helixtrans-61.9-50175.9179.759.4000111.8L453 I456 L466 Q470 M471 F476 I477 L478 I525 V593L453-L474 HydrophobicContact CD2-CD1 3.67Å; I456-L474 HydrophobicContact CD1-CB 4.14Å; I456-L474 HydrophobicContact CD1-CD1 4.44Å; I456-L474 HydrophobicContact CG2-CB 4.39Å; I456-L474 HydrophobicContact CG2-CD1 4.38Å; I456-L474 HydrophobicContact CG2-CD2 4.4Å; L466-L474 HydrophobicContact CD1-CD2 4.05Å; Q470-L474 PolarHBondContact O-N 3.14Å; M471-L474 PolarHBondContact O-N 3.19Å; M471-L474 HydrophobicContact SD-CD2 4.37Å; L474-F476 VanDerWaalsContact C-N 3.27Å; L474-F476 PolarHBondContact O-N 3.02Å; L474-I477 PolarHBondContact O-N 3.18Å; L474-L478 HydrophobicContact CD1-CD1 4.02Å; L474-L478 HydrophobicContact CD1-CG 4.19Å; L474-L478 HydrophobicContact CG-CD1 4.03Å; L474-L478 VanDerWaalsContact O-CG 3.29Å; L474-L478 WeakPolarHBondContact O-CG 3.28Å; L474-L478 PolarHBondContact O-N 3.29Å; L474-I525 HydrophobicContact CD1-CD1 4.17Å; L474-V593 HydrophobicContact CD2-CG1 3.98Å; L474-V593 HydrophobicContact CD2-CG2 3.95Å; L474-V593 HydrophobicContact CG-CG2 4.24Å
475I82.8Confident81.9Confident18.5 Ų18.533.7 Ų33.710%0.09517%0.173CC..Hα-helixtrans-58.9-43.2177.9-68.6169.6000110.2M471 R472 L478 S479 L560 L561 T592 V593 L596M471-I475 HydrophobicContact CG-CD1 4.35Å; M471-I475 WeakPolarHBondContact O-CG1 3.18Å; M471-I475 PolarHBondContact O-N 2.97Å; R472-I475 PolarHBondContact O-N 3.14Å; I475-L478 PolarHBondContact O-N 3.22Å; I475-S479 WeakPolarHBondContact O-CB 3.32Å; I475-S479 PolarHBondContact O-N 3.31Å; I475-S479 PolarHBondContact O-OG 3.12Å; I475-L560 HydrophobicContact CD1-CD2 4.21Å; I475-L561 HydrophobicContact CG2-CD1 4.47Å; I475-T592 HydrophobicContact CG2-CG2 4.49Å; I475-V593 HydrophobicContact CD1-CG2 4.47Å; I475-V593 HydrophobicContact CG1-CG2 3.73Å; I475-L596 HydrophobicContact CG2-CD1 4.07Å
476F85.2Confident81.9Confident97.5 Ų97.532.3 Ų32.343%0.42817%0.17SC..Hα-helixtrans-60.3-50.5177.3-179.1-98.3000112.1I40 R472 S473 L474 L478 S479 E480I40-F476 HydrophobicContact CG2-CD1 4.16Å; I40-F476 HydrophobicContact CG2-CE1 3.93Å; I40-F476 WeakPolarHBondContact O-CE1 3.36Å; R472-F476 VanDerWaalsContact O-CB 3.31Å; R472-F476 WeakPolarHBondContact O-CB 3.36Å; R472-F476 PolarHBondContact O-N 3.02Å; S473-F476 PolarHBondContact O-N 3.08Å; L474-F476 VanDerWaalsContact C-N 3.27Å; L474-F476 PolarHBondContact O-N 3.02Å; F476-L478 VanDerWaalsContact C-N 3.33Å; F476-L478 PolarHBondContact O-N 3.22Å; F476-S479 WeakPolarHBondContact CA-OG 3.37Å; F476-S479 PolarHBondContact O-N 3.17Å; F476-S479 VanDerWaalsContact O-N 3.14Å; F476-S479 PolarHBondContact O-OG 2.74Å; F476-E480 HydrophobicContact CD1-CG 4.3Å; F476-E480 HydrophobicContact CE1-CG 3.87Å; F476-E480 HydrophobicContact CE2-CG 4.23Å; F476-E480 HydrophobicContact CZ-CG 3.83Å; F476-E480 WeakPolarHBondContact O-CG 3.12Å; F476-E480 PolarHBondContact O-N 3.12Å
477I86.5Confident81.4Confident15.5 Ų15.532.5 Ų32.58%0.07917%0.174CC..Hα-helixtrans-59.7-44.4179-65.2156.8000111.1I40 A452 L453 I456 S473 L474 S479 E480 L481I40-I477 HydrophobicContact CG2-CG1 3.91Å; A452-I477 HydrophobicContact CB-CD1 3.64Å; A452-I477 HydrophobicContact CB-CG1 4.42Å; L453-I477 HydrophobicContact CD1-CG2 4.4Å; L453-I477 HydrophobicContact CD2-CB 4.45Å; L453-I477 HydrophobicContact CD2-CG2 3.86Å; L453-I477 HydrophobicContact CG-CG2 3.9Å; I456-I477 HydrophobicContact CD1-CD1 3.59Å; S473-I477 WeakPolarHBondContact O-CD1 3.43Å; S473-I477 VanDerWaalsContact O-CG1 3.23Å; S473-I477 WeakPolarHBondContact O-CG1 3.28Å; S473-I477 PolarHBondContact O-N 3.18Å; L474-I477 PolarHBondContact O-N 3.18Å; I477-S479 VanDerWaalsContact C-N 3.33Å; I477-S479 PolarHBondContact O-N 2.82Å; I477-E480 PolarHBondContact O-N 2.98Å; I477-L481 HydrophobicContact CG2-CD1 4.22Å; I477-L481 WeakPolarHBondContact O-CG 3.37Å; I477-L481 PolarHBondContact O-N 3.07Å
478L87.5Confident80.4Confident0 Ų037 Ų370%020%0.198CC..Hα-helixtrans-64.8-39.2178.6-66.7173.2000111.7L453 L474 I475 F476 L481 V482 V593 L596 I600L453-L478 HydrophobicContact CD2-CD2 4.33Å; L474-L478 HydrophobicContact CD1-CD1 4.02Å; L474-L478 HydrophobicContact CD1-CG 4.19Å; L474-L478 HydrophobicContact CG-CD1 4.03Å; L474-L478 VanDerWaalsContact O-CG 3.29Å; L474-L478 WeakPolarHBondContact O-CG 3.28Å; L474-L478 PolarHBondContact O-N 3.29Å; I475-L478 PolarHBondContact O-N 3.22Å; F476-L478 VanDerWaalsContact C-N 3.33Å; F476-L478 PolarHBondContact O-N 3.22Å; L478-L481 HydrophobicContact CD2-CD1 4.45Å; L478-L481 PolarHBondContact O-N 3.17Å; L478-V482 WeakPolarHBondContact O-CG2 3.42Å; L478-V482 PolarHBondContact O-N 3.32Å; L478-V482 VanDerWaalsContact O-N 3.08Å; L478-V593 HydrophobicContact CD1-CB 4.35Å; L478-V593 HydrophobicContact CD1-CG1 3.82Å; L478-V593 HydrophobicContact CD1-CG2 4.39Å; L478-L596 HydrophobicContact CB-CB 3.84Å; L478-L596 HydrophobicContact CB-CD1 3.9Å; L478-L596 HydrophobicContact CB-CG 4.49Å; L478-L596 HydrophobicContact CD1-CB 4.31Å; L478-I600 HydrophobicContact CB-CD1 4.19Å; L478-I600 HydrophobicContact CD2-CD1 3.63Å
479S83.4Confident79.3Confident37.5 Ų37.535.9 Ų35.926%0.26219%0.193SC..Hα-helixtrans-64.7-40.1175.365.60000112.5I475 F476 I477 L481 V482 M483I475-S479 WeakPolarHBondContact O-CB 3.32Å; I475-S479 PolarHBondContact O-N 3.31Å; I475-S479 PolarHBondContact O-OG 3.12Å; F476-S479 WeakPolarHBondContact CA-OG 3.37Å; F476-S479 PolarHBondContact O-N 3.17Å; F476-S479 VanDerWaalsContact O-N 3.14Å; F476-S479 PolarHBondContact O-OG 2.74Å; I477-S479 VanDerWaalsContact C-N 3.33Å; I477-S479 PolarHBondContact O-N 2.82Å; S479-L481 VanDerWaalsContact C-N 3.34Å; S479-L481 PolarHBondContact O-N 3.05Å; S479-V482 PolarHBondContact O-N 2.77Å; S479-M483 WeakPolarHBondContact O-CG 3.37Å; S479-M483 PolarHBondContact O-N 3.29Å
480E84.5Confident77.9Confident37 Ų3739.3 Ų39.317%0.17320%0.196CC..Hα-helixtrans-65.9-36.6175.7-69.5-66.4131.900111.2F445 F476 I477 V482 M483 F484 R490F445-E480 HydrophobicContact CE2-CB 4.19Å; F445-E480 HydrophobicContact CZ-CB 3.97Å; F476-E480 HydrophobicContact CD1-CG 4.3Å; F476-E480 HydrophobicContact CE1-CG 3.87Å; F476-E480 HydrophobicContact CE2-CG 4.23Å; F476-E480 HydrophobicContact CZ-CG 3.83Å; F476-E480 WeakPolarHBondContact O-CG 3.12Å; F476-E480 PolarHBondContact O-N 3.12Å; I477-E480 PolarHBondContact O-N 2.98Å; E480-V482 VanDerWaalsContact C-N 3.35Å; E480-V482 PolarHBondContact O-N 3.18Å; E480-M483 HydrophobicContact CG-CE 4.12Å; E480-M483 PolarHBondContact O-N 3.24Å; E480-M483 WeakPolarHBondContact OE1-CE 3.08Å; E480-F484 WeakPolarHBondContact O-CB 3.22Å; E480-F484 PolarHBondContact O-N 3.4Å; E480-R490 IonicContact OE1-CZ 2.73Å; E480-R490 IonicContact OE1-NE 3.1Å; E480-R490 PolarHBondContact OE1-NE 3.15Å; E480-R490 IonicContact OE1-NH2 3.62Å
481L86.7Confident76Confident0 Ų041.4 Ų41.40%021%0.208CC..Hα-helixtrans-64.6-36.6173.2-75.9168.7000112.9F445 L453 I477 L478 S479 F484 L485 L513 I518 I600F445-L481 HydrophobicContact CE1-CD2 3.92Å; F445-L481 HydrophobicContact CZ-CD2 4.47Å; L453-L481 HydrophobicContact CD1-CD1 3.95Å; I477-L481 HydrophobicContact CG2-CD1 4.22Å; I477-L481 WeakPolarHBondContact O-CG 3.37Å; I477-L481 PolarHBondContact O-N 3.07Å; L478-L481 HydrophobicContact CD2-CD1 4.45Å; L478-L481 PolarHBondContact O-N 3.17Å; S479-L481 VanDerWaalsContact C-N 3.34Å; S479-L481 PolarHBondContact O-N 3.05Å; L481-F484 WeakPolarHBondContact O-CB 3.46Å; L481-F484 PolarHBondContact O-N 3.24Å; L481-L485 PolarHBondContact O-N 3.38Å; L481-L485 VanDerWaalsContact O-N 3.14Å; L481-L513 HydrophobicContact CD2-CD2 3.87Å; L481-I518 HydrophobicContact CD1-CG2 4.09Å; L481-I518 HydrophobicContact CD2-CD1 4.48Å; L481-I518 HydrophobicContact CD2-CG2 4.43Å; L481-I600 HydrophobicContact CB-CD1 3.74Å; L481-I600 HydrophobicContact CB-CG1 4.16Å; L481-I600 HydrophobicContact CD1-CD1 4.15Å
482V82.1Confident74.1Confident17.5 Ų17.544.1 Ų44.111%0.10623%0.225CC..Hα-helixtrans-64.8-44172.8173.50000110.4L478 S479 E480 F484 L485 N486 L596 R599 I600 L603L478-V482 WeakPolarHBondContact O-CG2 3.42Å; L478-V482 PolarHBondContact O-N 3.32Å; L478-V482 VanDerWaalsContact O-N 3.08Å; S479-V482 PolarHBondContact O-N 2.77Å; E480-V482 VanDerWaalsContact C-N 3.35Å; E480-V482 PolarHBondContact O-N 3.18Å; V482-F484 VanDerWaalsContact C-N 3.31Å; V482-F484 PolarHBondContact O-N 3.11Å; V482-L485 PolarHBondContact O-N 3.15Å; V482-N486 WeakPolarHBondContact O-CB 3.29Å; V482-N486 PolarHBondContact O-N 2.97Å; V482-N486 PolarHBondContact O-ND2 2.74Å; V482-L596 HydrophobicContact CG2-CD2 4.22Å; V482-R599 HydrophobicContact CG1-CG 4.02Å; V482-R599 HydrophobicContact CG2-CB 4.3Å; V482-R599 HydrophobicContact CG2-CG 4.01Å; V482-I600 HydrophobicContact CG2-CD1 4.29Å; V482-I600 HydrophobicContact CG2-CG1 3.53Å; V482-L603 HydrophobicContact CG1-CD1 4.09Å
483M79.9Confident72.1Confident56.5 Ų56.548.8 Ų48.828%0.27825%0.247SC..Hα-helixtrans-64-39.1176.3-69.5-147.6-62.900112.3S479 E480 L485 N486 G487 N488S479-M483 WeakPolarHBondContact O-CG 3.37Å; S479-M483 PolarHBondContact O-N 3.29Å; E480-M483 HydrophobicContact CG-CE 4.12Å; E480-M483 PolarHBondContact O-N 3.24Å; E480-M483 WeakPolarHBondContact OE1-CE 3.08Å; M483-L485 PolarHBondContact O-N 2.96Å; M483-N486 PolarHBondContact O-N 3.18Å; M483-G487 PolarHBondContact O-N 3.32Å; M483-N488 WeakPolarHBondContact CB-O 3.23Å; M483-N488 PolarHBondContact O-N 3.32Å
484F84.1Confident69.8Low0.5 Ų0.553.6 Ų53.60%0.00226%0.263CS..Hα-helixtrans-56.6-47.8175179.5-108.3000112.6D442 F445 E480 L481 V482 G487 T489 R509 L512D442-F484 HydrophobicContact CB-CE2 3.82Å; D442-F484 HydrophobicContact CB-CZ 3.88Å; F445-F484 HydrophobicContact CD1-CB 4.16Å; F445-F484 HydrophobicContact CD1-CD1 4.15Å; F445-F484 AromaticContact CD1-CD2 3.42Å; F445-F484 HydrophobicContact CD1-CD2 3.42Å; F445-F484 VanDerWaalsContact CD1-CD2 3.42Å; F445-F484 HydrophobicContact CD1-CE1 4.39Å; F445-F484 AromaticContact CD1-CE2 3.72Å; F445-F484 HydrophobicContact CD1-CE2 3.72Å; F445-F484 AromaticContact CD1-CG 3.65Å; F445-F484 HydrophobicContact CD1-CG 3.65Å; F445-F484 HydrophobicContact CD1-CZ 4.18Å; F445-F484 HydrophobicContact CE1-CB 3.43Å; F445-F484 VanDerWaalsContact CE1-CB 3.43Å; F445-F484 AromaticContact CE1-CD1 3.98Å; F445-F484 HydrophobicContact CE1-CD1 3.98Å; F445-F484 AromaticContact CE1-CD2 3.63Å; F445-F484 HydrophobicContact CE1-CD2 3.63Å; F445-F484 HydrophobicContact CE1-CE2 4.35Å; F445-F484 AromaticContact CE1-CG 3.41Å; F445-F484 HydrophobicContact CE1-CG 3.41Å; F445-F484 VanDerWaalsContact CE1-CG 3.41Å; F445-F484 HydrophobicContact CG-CD2 4.24Å; F445-F484 HydrophobicContact CG-CE2 4.44Å; F445-F484 HydrophobicContact CZ-CB 4Å; F445-F484 HydrophobicContact CZ-CG 4.39Å; E480-F484 WeakPolarHBondContact O-CB 3.22Å; E480-F484 PolarHBondContact O-N 3.4Å; L481-F484 WeakPolarHBondContact O-CB 3.46Å; L481-F484 PolarHBondContact O-N 3.24Å; V482-F484 VanDerWaalsContact C-N 3.31Å; V482-F484 PolarHBondContact O-N 3.11Å; F484-G487 PolarHBondContact O-N 3.19Å; F484-T489 VanDerWaalsContact CA-CG2 3.45Å; F484-T489 HydrophobicContact CB-CG2 4.25Å; F484-T489 HydrophobicContact CD2-CG2 3.84Å; F484-T489 HydrophobicContact CG-CG2 4.45Å; F484-R509 HydrophobicContact CD1-CB 4.31Å; F484-R509 HydrophobicContact CD1-CG 4.49Å; F484-R509 HydrophobicContact CE1-CB 3.64Å; F484-R509 HydrophobicContact CE1-CG 3.77Å; F484-R509 HydrophobicContact CE2-CG 4.06Å; F484-R509 HydrophobicContact CZ-CB 3.93Å; F484-R509 HydrophobicContact CZ-CG 3.52Å; F484-R509 VanDerWaalsContact O-CD 3.29Å; F484-R509 WeakPolarHBondContact O-CD 2.87Å; F484-R509 PolarHBondContact O-NH1 3.36Å; F484-L512 HydrophobicContact CZ-CD1 4.31Å
485L82.2Confident67.2Low1.5 Ų1.559.1 Ų59.11%0.00830%0.302CS..Hα-helixtrans-70-34.1177-74.5177.8000113.2L481 V482 M483 G487 L506 R509 Q510 L513 I600 L603L481-L485 PolarHBondContact O-N 3.38Å; L481-L485 VanDerWaalsContact O-N 3.14Å; V482-L485 PolarHBondContact O-N 3.15Å; M483-L485 PolarHBondContact O-N 2.96Å; L485-G487 PolarHBondContact O-N 3.18Å; L485-L506 WeakPolarHBondContact O-CD1 3.36Å; L485-R509 HydrophobicContact CD2-CB 4.38Å; L485-Q510 HydrophobicContact CD2-CG 4.07Å; L485-L513 HydrophobicContact CD1-CD1 3.58Å; L485-L513 HydrophobicContact CD2-CD1 3.64Å; L485-L513 HydrophobicContact CD2-CG 4.43Å; L485-L513 HydrophobicContact CG-CD1 3.81Å; L485-I600 HydrophobicContact CD1-CG2 3.95Å; L485-L603 HydrophobicContact CB-CB 4.03Å; L485-L603 HydrophobicContact CB-CD1 4.15Å; L485-L603 HydrophobicContact CD1-CB 3.55Å; L485-L603 HydrophobicContact CG-CB 4.42Å
486N72.2Confident65Low64.5 Ų64.562.2 Ų62.235%0.34532%0.322SS..THydrogen-bonded Turntrans-73.5-2-179.6-77.9-22.5000114.4V482 M483 N488 L603V482-N486 WeakPolarHBondContact O-CB 3.29Å; V482-N486 PolarHBondContact O-N 2.97Å; V482-N486 PolarHBondContact O-ND2 2.74Å; M483-N486 PolarHBondContact O-N 3.18Å; N486-N488 VanDerWaalsContact C-N 3.25Å; N486-N488 PolarHBondContact O-N 2.68Å; N486-N488 VanDerWaalsContact O-N 3.14Å; N486-L603 VanDerWaalsContact OD1-CD1 3.26Å; N486-L603 WeakPolarHBondContact OD1-CD1 3.42Å
487G66.3Low62.6Low12 Ų1263.8 Ų63.812%0.12434%0.335CS..THydrogen-bonded Turntrans84.1-17.6-174.900000114M483 F484 L485 T489 T492M483-G487 PolarHBondContact O-N 3.32Å; F484-G487 PolarHBondContact O-N 3.19Å; L485-G487 PolarHBondContact O-N 3.18Å; G487-T489 PolarHBondContact O-N 3.26Å; G487-T492 PolarHBondContact O-OG1 3.11Å
488N57.4Low60.2Low117 Ų11767.6 Ų67.663%0.62636%0.361SS*.  trans-84.946.4-176.1-64.3-7.9000112.5M483 N486 R490M483-N488 WeakPolarHBondContact CB-O 3.23Å; M483-N488 PolarHBondContact O-N 3.32Å; N486-N488 VanDerWaalsContact C-N 3.25Å; N486-N488 PolarHBondContact O-N 2.68Å; N486-N488 VanDerWaalsContact O-N 3.14Å; N488-R490 PolarHBondContact O-N 3Å
489T52.3Low58.2Low17.5 Ų17.572.5 Ų72.511%0.10739%0.39CS..  trans-70.9137.1169.554.30000108.8F484 G487 L491 T492 R509F484-T489 VanDerWaalsContact CA-CG2 3.45Å; F484-T489 HydrophobicContact CB-CG2 4.25Å; F484-T489 HydrophobicContact CD2-CG2 3.84Å; F484-T489 HydrophobicContact CG-CG2 4.45Å; G487-T489 PolarHBondContact O-N 3.26Å; T489-L491 HydrophobicContact CG2-CD1 4.33Å; T489-L491 PolarHBondContact O-N 3.39Å; T489-T492 PolarHBondContact O-N 3.31Å; T489-T492 PolarHBondContact O-OG1 3.31Å; T489-T492 WeakPolarHBondContact OG1-CG2 3.48Å; T489-T492 PolarHBondContact OG1-OG1 2.64Å; T489-R509 PolarHBondContact OG1-NH1 2.92Å; T489-R509 PolarHBondContact OG1-NH2 3.33Å; T489-R509 VanDerWaalsContact OG1-NH2 3.17Å
490R49.2Very low56.1Low163.5 Ų163.576.7 Ų76.762%0.61741%0.409SS*.THydrogen-bonded Turntrans-56-17.5170.8-57.3-177.7-175.7-160.8-1.1112.4E151 E480 N488 T492E151-R490 VanDerWaalsContact CD-CB 3.47Å; E151-R490 WeakPolarHBondContact OE1-CB 3.34Å; E151-R490 WeakPolarHBondContact OE2-CA 3.2Å; E151-R490 WeakPolarHBondContact OE2-CB 3.47Å; E480-R490 IonicContact OE1-CZ 2.73Å; E480-R490 IonicContact OE1-NE 3.1Å; E480-R490 PolarHBondContact OE1-NE 3.15Å; E480-R490 IonicContact OE1-NH2 3.62Å; N488-R490 PolarHBondContact O-N 3Å; R490-T492 VanDerWaalsContact C-N 3.3Å; R490-T492 PolarHBondContact O-N 2.77Å; R490-T492 VanDerWaalsContact O-N 3.14Å
491L43.6Very low54.1Low77.5 Ų77.580.9 Ų80.941%0.40643%0.428SS..THydrogen-bonded Turntrans-76.7-14.1-179-58.6173.3000115.7T489T489-L491 HydrophobicContact CG2-CD1 4.33Å; T489-L491 PolarHBondContact O-N 3.39Å
492T41.1Very low52.5Low62 Ų6284.1 Ų84.138%0.3845%0.446SS..  trans-109.287.9-17951.50000111G487 T489 R490G487-T492 PolarHBondContact O-OG1 3.11Å; T489-T492 PolarHBondContact O-N 3.31Å; T489-T492 PolarHBondContact O-OG1 3.31Å; T489-T492 WeakPolarHBondContact OG1-CG2 3.48Å; T489-T492 PolarHBondContact OG1-OG1 2.64Å; R490-T492 VanDerWaalsContact C-N 3.3Å; R490-T492 PolarHBondContact O-N 2.77Å; R490-T492 VanDerWaalsContact O-N 3.14Å
493F36.8Very low51.3Low169 Ų16990.3 Ų90.374%0.74147%0.473SS*.  trans-87.416.9168.6-116.6-85.7000112.7I91 S495I91-F493 HydrophobicContact CG2-CE1 4.4Å; F493-S495 PolarHBondContact O-N 3.12Å
494E35.4Very low50.2Low158 Ų15892.9 Ų92.974%0.73849%0.487SS*.  trans-88.1102.8176.7-75.7179.4178.400109.9T496E494-T496 PolarHBondContact O-N 3Å
495S32.8Very low49.2Very low119 Ų11994.2 Ų94.283%0.83250%0.501SS*.  trans-75.958.3-176520000113.2F493F493-S495 PolarHBondContact O-N 3.12Å
496T35.3Very low48.8Very low83.5 Ų83.596.2 Ų96.251%0.51251%0.512SS..  trans-130.8114.1176.852.40000113.1E494 Q501E494-T496 PolarHBondContact O-N 3Å; T496-Q501 PolarHBondContact O-OE1 2.84Å; T496-Q501 PolarHBondContact OG1-OE1 3.37Å
497N35.8Very low49.3Very low130 Ų13099.6 Ų99.670%0.69552%0.52SS*.  trans4191.6163.4-68.3-22.5000117.4T499N497-T499 VanDerWaalsContact C-N 3.27Å; N497-T499 PolarHBondContact O-N 3.22Å; N497-T499 VanDerWaalsContact O-N 3.1Å
498P36.3Very low50Low96 Ų96102.9 Ų102.962%0.62353%0.534SS*.THydrogen-bonded Turntrans-77.311.5-171.732.5-37.1000115.9N502P498-N502 WeakPolarHBondContact CA-ND2 3.47Å; P498-N502 WeakPolarHBondContact CB-ND2 3.46Å; P498-N502 WeakPolarHBondContact O-CB 3.33Å; P498-N502 VanDerWaalsContact O-CG 3.26Å; P498-N502 PolarHBondContact O-ND2 2.8Å
499T45Very low51.4Low101.5 Ų101.598.4 Ų98.462%0.62351%0.509SS*.THydrogen-bonded Turntrans-99.1-62.3-177.551.30000112.1N497 E503N497-T499 VanDerWaalsContact C-N 3.27Å; N497-T499 PolarHBondContact O-N 3.22Å; N497-T499 VanDerWaalsContact O-N 3.1Å; T499-E503 PolarHBondContact O-N 3.49Å
500I38.6Very low53.1Low127 Ų12797.7 Ų97.765%0.65150%0.504SS*.Hα-helixtrans-79.1-42.3-170.9-55.4172.4000112N502I500-N502 VanDerWaalsContact C-N 3.29Å; I500-N502 PolarHBondContact O-N 3.06Å
501Q43.5Very low54.9Low124 Ų12491.3 Ų91.358%0.57948%0.481SS*.Hα-helixtrans-68.5-31.8177.5-74.4-171.8-8.200111.8T496 I504 G505T496-Q501 PolarHBondContact O-OE1 2.84Å; T496-Q501 PolarHBondContact OG1-OE1 3.37Å; Q501-I504 PolarHBondContact O-N 3.04Å; Q501-G505 PolarHBondContact O-N 3.15Å
502N52.2Low57Low68 Ų6888.3 Ų88.336%0.36447%0.465SS..Hα-helixtrans-66.8-38.3178.7-87.7-8.8000112.4P498 I500 L506P498-N502 WeakPolarHBondContact CA-ND2 3.47Å; P498-N502 WeakPolarHBondContact CB-ND2 3.46Å; P498-N502 WeakPolarHBondContact O-CB 3.33Å; P498-N502 VanDerWaalsContact O-CG 3.26Å; P498-N502 PolarHBondContact O-ND2 2.8Å; I500-N502 VanDerWaalsContact C-N 3.29Å; I500-N502 PolarHBondContact O-N 3.06Å; N502-L506 WeakPolarHBondContact O-CA 3.39Å; N502-L506 WeakPolarHBondContact O-CB 3.03Å; N502-L506 PolarHBondContact O-N 3.47Å
503E56.7Low59.3Low147.5 Ų147.585.4 Ų85.469%0.68945%0.447SS*.Hα-helixtrans-65-43178.5-74.5-169.6169.700112.9T499 R507T499-E503 PolarHBondContact O-N 3.49Å; E503-R507 WeakPolarHBondContact O-CB 3.33Å; E503-R507 PolarHBondContact O-N 2.91Å
504I57.1Low61.7Low111 Ų11179.1 Ų79.157%0.56942%0.419SS*.Hα-helixtrans-69.2-47.1179.7-60.4166.9000110Q501 L506 R507 D508Q501-I504 PolarHBondContact O-N 3.04Å; I504-L506 VanDerWaalsContact C-N 3.33Å; I504-L506 PolarHBondContact O-N 3.08Å; I504-R507 WeakPolarHBondContact O-CB 3.32Å; I504-R507 PolarHBondContact O-N 3.31Å; I504-D508 PolarHBondContact O-N 3.13Å; I504-D508 VanDerWaalsContact O-N 3.13Å
505G62.8Low64Low28 Ų2873.1 Ų73.129%0.28939%0.39SS..Hα-helixtrans-60-42.5175.700000112Q501 R507 D508 R509Q501-G505 PolarHBondContact O-N 3.15Å; G505-R507 VanDerWaalsContact C-N 3.35Å; G505-R507 PolarHBondContact O-N 3.03Å; G505-D508 PolarHBondContact O-N 3.05Å; G505-R509 VanDerWaalsContact O-CG 3.3Å; G505-R509 WeakPolarHBondContact O-CG 3.32Å; G505-R509 PolarHBondContact O-N 3.38Å
506L75.2Confident66.5Low44 Ų4468 Ų6823%0.2335%0.354CS..Hα-helixtrans-59.5-44.4175.3-178.2108.4000111L485 N502 I504 D508 R509 Q510L485-L506 WeakPolarHBondContact O-CD1 3.36Å; N502-L506 WeakPolarHBondContact O-CA 3.39Å; N502-L506 WeakPolarHBondContact O-CB 3.03Å; N502-L506 PolarHBondContact O-N 3.47Å; I504-L506 VanDerWaalsContact C-N 3.33Å; I504-L506 PolarHBondContact O-N 3.08Å; L506-D508 VanDerWaalsContact C-N 3.33Å; L506-D508 PolarHBondContact O-N 3.15Å; L506-R509 PolarHBondContact O-N 2.87Å; L506-Q510 HydrophobicContact CD1-CG 4.43Å; L506-Q510 HydrophobicContact CD2-CG 4.16Å; L506-Q510 VanDerWaalsContact CD2-NE2 3.26Å; L506-Q510 HydrophobicContact CG-CG 4.18Å; L506-Q510 WeakPolarHBondContact O-CB 3.26Å; L506-Q510 WeakPolarHBondContact O-CG 3.48Å; L506-Q510 PolarHBondContact O-N 3.26Å
507R81.7Confident68.9Low136 Ų13667.8 Ų67.851%0.51335%0.349SS..Hα-helixtrans-61.4-41.9177.9-178.9177.6-81.9-147-3.7112.4E503 I504 G505 K511 Y608E503-R507 WeakPolarHBondContact O-CB 3.33Å; E503-R507 PolarHBondContact O-N 2.91Å; I504-R507 WeakPolarHBondContact O-CB 3.32Å; I504-R507 PolarHBondContact O-N 3.31Å; G505-R507 VanDerWaalsContact C-N 3.35Å; G505-R507 PolarHBondContact O-N 3.03Å; R507-K511 VanDerWaalsContact O-CB 3.31Å; R507-K511 WeakPolarHBondContact O-CB 3.41Å; R507-K511 PolarHBondContact O-N 2.99Å; R507-Y608 HydrophobicContact CG-CD2 4.38Å; R507-Y608 HydrophobicContact CG-CE2 4.43Å
508D81.7Confident71.4Confident81.5 Ų81.561.6 Ų61.644%0.43632%0.316SS..Hα-helixtrans-67.7-39.3176.9-77.7-22.1000111.5I504 G505 L506 K511 L512I504-D508 PolarHBondContact O-N 3.13Å; I504-D508 VanDerWaalsContact O-N 3.13Å; G505-D508 PolarHBondContact O-N 3.05Å; L506-D508 VanDerWaalsContact C-N 3.33Å; L506-D508 PolarHBondContact O-N 3.15Å; D508-K511 WeakPolarHBondContact O-CB 3.45Å; D508-K511 PolarHBondContact O-N 3.29Å; D508-L512 WeakPolarHBondContact O-CG 3.41Å; D508-L512 PolarHBondContact O-N 3.23Å
509R86.6Confident73.9Confident22 Ų2257.1 Ų57.18%0.08329%0.286CS..Hα-helixtrans-64.8-44.9173.9-68.9-179.9-179.6176.12.3113.1D442 F484 L485 T489 G505 L506 K511 L512 L513D442-R509 IonicContact OD1-NE 3.51Å; D442-R509 IonicContact OD1-NH2 3.34Å; D442-R509 WeakPolarHBondContact OD2-CG 3.38Å; D442-R509 IonicContact OD2-CZ 2.79Å; D442-R509 IonicContact OD2-NE 3.74Å; D442-R509 PolarHBondContact OD2-NE 3.15Å; D442-R509 IonicContact OD2-NH2 2.71Å; D442-R509 PolarHBondContact OD2-NH2 3.12Å; F484-R509 HydrophobicContact CD1-CB 4.31Å; F484-R509 HydrophobicContact CD1-CG 4.49Å; F484-R509 HydrophobicContact CE1-CB 3.64Å; F484-R509 HydrophobicContact CE1-CG 3.77Å; F484-R509 HydrophobicContact CE2-CG 4.06Å; F484-R509 HydrophobicContact CZ-CB 3.93Å; F484-R509 HydrophobicContact CZ-CG 3.52Å; F484-R509 VanDerWaalsContact O-CD 3.29Å; F484-R509 WeakPolarHBondContact O-CD 2.87Å; F484-R509 PolarHBondContact O-NH1 3.36Å; L485-R509 HydrophobicContact CD2-CB 4.38Å; T489-R509 PolarHBondContact OG1-NH1 2.92Å; T489-R509 PolarHBondContact OG1-NH2 3.33Å; T489-R509 VanDerWaalsContact OG1-NH2 3.17Å; G505-R509 VanDerWaalsContact O-CG 3.3Å; G505-R509 WeakPolarHBondContact O-CG 3.32Å; G505-R509 PolarHBondContact O-N 3.38Å; L506-R509 PolarHBondContact O-N 2.87Å; R509-K511 PolarHBondContact O-N 2.97Å; R509-L512 WeakPolarHBondContact O-CB 3.28Å; R509-L512 PolarHBondContact O-N 3.27Å; R509-L512 VanDerWaalsContact O-N 3.12Å; R509-L513 PolarHBondContact O-N 3.04Å; R509-L513 VanDerWaalsContact O-N 3.15Å
510Q88Confident76Confident3 Ų353 Ų531%0.01426%0.263CS..Hα-helixtrans-57.9-39.1173.4-72.3173.8-24.900111.5L485 L506 L603 S604 H606 Y608 N611L485-Q510 HydrophobicContact CD2-CG 4.07Å; L506-Q510 HydrophobicContact CD1-CG 4.43Å; L506-Q510 HydrophobicContact CD2-CG 4.16Å; L506-Q510 VanDerWaalsContact CD2-NE2 3.26Å; L506-Q510 HydrophobicContact CG-CG 4.18Å; L506-Q510 WeakPolarHBondContact O-CB 3.26Å; L506-Q510 WeakPolarHBondContact O-CG 3.48Å; L506-Q510 PolarHBondContact O-N 3.26Å; Q510-L603 PolarHBondContact NE2-O 3.14Å; Q510-S604 WeakPolarHBondContact CG-O 3.26Å; Q510-H606 PolarHBondContact NE2-O 3.47Å; Q510-Y608 HydrophobicContact CB-CD1 3.97Å; Q510-Y608 HydrophobicContact CB-CE1 4.43Å; Q510-N611 PolarHBondContact O-ND2 3.36Å
511K87.6Confident78.3Confident29 Ų2947.5 Ų47.513%0.12624%0.235CC..Hα-helixtrans-65.3-42.5175.1178-175.5178.1179.90111.8K286 R507 D508 R509 L513 R514 E515 Y608K286-K511 PolarHBondContact O-NZ 3.4Å; R507-K511 VanDerWaalsContact O-CB 3.31Å; R507-K511 WeakPolarHBondContact O-CB 3.41Å; R507-K511 PolarHBondContact O-N 2.99Å; D508-K511 WeakPolarHBondContact O-CB 3.45Å; D508-K511 PolarHBondContact O-N 3.29Å; R509-K511 PolarHBondContact O-N 2.97Å; K511-L513 VanDerWaalsContact C-N 3.32Å; K511-L513 PolarHBondContact O-N 3.39Å; K511-R514 PolarHBondContact O-N 3.28Å; K511-E515 VanDerWaalsContact CE-CD 3.46Å; K511-E515 WeakPolarHBondContact CE-OE1 3.35Å; K511-E515 VanDerWaalsContact CE-OE2 3.26Å; K511-E515 WeakPolarHBondContact CE-OE2 3.23Å; K511-E515 HydrophobicContact CG-CG 4.26Å; K511-E515 IonicContact NZ-OE1 3.54Å; K511-E515 PolarHBondContact O-N 3.19Å; K511-Y608 HydrophobicContact CB-CE1 4.1Å
512L86.6Confident80.6Confident14.5 Ų14.541.6 Ų41.68%0.07621%0.207CC..Hα-helixtrans-58-42.8176.9-70.2172.2000111.7D442 L443 A446 F484 D508 R509 R514 E515 H516D442-L512 HydrophobicContact CB-CD1 3.92Å; L443-L512 HydrophobicContact CB-CD2 4.37Å; L443-L512 HydrophobicContact CD1-CD2 4.46Å; A446-L512 HydrophobicContact CB-CB 4.37Å; F484-L512 HydrophobicContact CZ-CD1 4.31Å; D508-L512 WeakPolarHBondContact O-CG 3.41Å; D508-L512 PolarHBondContact O-N 3.23Å; R509-L512 WeakPolarHBondContact O-CB 3.28Å; R509-L512 PolarHBondContact O-N 3.27Å; R509-L512 VanDerWaalsContact O-N 3.12Å; L512-R514 VanDerWaalsContact C-N 3.28Å; L512-R514 PolarHBondContact O-N 3.3Å; L512-E515 PolarHBondContact O-N 3.21Å; L512-H516 VanDerWaalsContact CD2-CE1 3.44Å; L512-H516 WeakPolarHBondContact CD2-CE1 3.35Å; L512-H516 VanDerWaalsContact O-CB 3.29Å; L512-H516 WeakPolarHBondContact O-CB 3.31Å; L512-H516 PolarHBondContact O-N 3.17Å; L512-H516 PolarHBondContact O-ND1 3.32Å
513L88.7Confident82.3Confident0 Ų038.8 Ų38.80%019%0.192CC..Hα-helixtrans-59.9-36.5179.1-64.7-175.2000113.4L481 L485 R509 K511 I518 I519 I600L481-L513 HydrophobicContact CD2-CD2 3.87Å; L485-L513 HydrophobicContact CD1-CD1 3.58Å; L485-L513 HydrophobicContact CD2-CD1 3.64Å; L485-L513 HydrophobicContact CD2-CG 4.43Å; L485-L513 HydrophobicContact CG-CD1 3.81Å; R509-L513 PolarHBondContact O-N 3.04Å; R509-L513 VanDerWaalsContact O-N 3.15Å; K511-L513 VanDerWaalsContact C-N 3.32Å; K511-L513 PolarHBondContact O-N 3.39Å; L513-I518 HydrophobicContact CB-CB 4.46Å; L513-I518 HydrophobicContact CD2-CB 4.05Å; L513-I518 HydrophobicContact CD2-CD1 3.47Å; L513-I518 VanDerWaalsContact CD2-CD1 3.47Å; L513-I518 HydrophobicContact CD2-CG1 4.37Å; L513-I518 HydrophobicContact CD2-CG2 3.95Å; L513-I518 PolarHBondContact O-N 3.3Å; L513-I519 HydrophobicContact CB-CD1 4.3Å; L513-I519 HydrophobicContact CB-CG1 4Å; L513-I519 PolarHBondContact O-N 2.86Å; L513-I600 HydrophobicContact CD1-CG2 4.11Å
514R87.6Confident83.7Confident38.5 Ų38.537.2 Ų37.215%0.14518%0.183CC..Hα-helixtrans-74.7-49.9175.7-172.1-166.963-118.2-2.3111.1K511 L512 H516 N517 I519 Y608 K610 N611 Y614K511-R514 PolarHBondContact O-N 3.28Å; L512-R514 VanDerWaalsContact C-N 3.28Å; L512-R514 PolarHBondContact O-N 3.3Å; R514-H516 VanDerWaalsContact C-N 3.28Å; R514-H516 PolarHBondContact O-N 3.18Å; R514-N517 PolarHBondContact O-N 3.18Å; R514-N517 VanDerWaalsContact O-N 3.12Å; R514-I519 HydrophobicContact CB-CD1 3.9Å; R514-I519 HydrophobicContact CG-CD1 4.5Å; R514-Y608 VanDerWaalsContact NH1-CZ 3.28Å; R514-Y608 PolarHBondContact NH1-OH 3.23Å; R514-Y608 PolarHBondContact NH2-OH 3.39Å; R514-K610 VanDerWaalsContact NH1-CB 3.3Å; R514-N611 WeakPolarHBondContact CB-OD1 3.49Å; R514-N611 VanDerWaalsContact CD-OD1 3.28Å; R514-N611 WeakPolarHBondContact CD-OD1 3.32Å; R514-N611 PolarHBondContact NH1-OD1 2.96Å; R514-Y614 HydrophobicContact CG-CD1 4.35Å; R514-Y614 HydrophobicContact CG-CG 4.38Å
515E84.3Confident85.1Confident30.5 Ų30.532.2 Ų32.214%0.14316%0.157CC..Hα-helixtrans-67-28.6-175.6-70.8-176175.300113.1S287 S288 K511 L512 N517S287-E515 PolarHBondContact OG-OE2 3.06Å; S288-E515 PolarHBondContact N-OE2 2.99Å; S288-E515 PolarHBondContact OG-OE2 2.88Å; K511-E515 VanDerWaalsContact CE-CD 3.46Å; K511-E515 WeakPolarHBondContact CE-OE1 3.35Å; K511-E515 VanDerWaalsContact CE-OE2 3.26Å; K511-E515 WeakPolarHBondContact CE-OE2 3.23Å; K511-E515 HydrophobicContact CG-CG 4.26Å; K511-E515 IonicContact NZ-OE1 3.54Å; K511-E515 PolarHBondContact O-N 3.19Å; L512-E515 PolarHBondContact O-N 3.21Å; E515-N517 VanDerWaalsContact C-N 3.33Å
516H84.6Confident86.1Confident13.5 Ų13.530.9 Ų30.96%0.06314%0.144CC..THydrogen-bonded Turntrans-92.713175.6-64.778.5000113S288 F450 L512 R514 I518S288-H516 PolarHBondContact OG-CE1 2.92Å; F450-H516 WeakPolarHBondContact CD2-O 3.41Å; L512-H516 VanDerWaalsContact CD2-CE1 3.44Å; L512-H516 WeakPolarHBondContact CD2-CE1 3.35Å; L512-H516 VanDerWaalsContact O-CB 3.29Å; L512-H516 WeakPolarHBondContact O-CB 3.31Å; L512-H516 PolarHBondContact O-N 3.17Å; L512-H516 PolarHBondContact O-ND1 3.32Å; R514-H516 VanDerWaalsContact C-N 3.28Å; R514-H516 PolarHBondContact O-N 3.18Å; H516-I518 HydrophobicContact CB-CD1 4.29Å; H516-I518 HydrophobicContact CB-CG1 4.3Å; H516-I518 PolarHBondContact O-N 3.24Å
517N85.9Confident86.6Confident78.5 Ų78.533.9 Ų33.942%0.4216%0.16SC..THydrogen-bonded Turntrans56.120.6177.9-68.6-35.9000114.9F450 R514 E515 I519 A520 Q521F450-N517 HydrophobicContact CD2-CB 4.48Å; F450-N517 HydrophobicContact CE2-CB 3.92Å; R514-N517 PolarHBondContact O-N 3.18Å; R514-N517 VanDerWaalsContact O-N 3.12Å; E515-N517 VanDerWaalsContact C-N 3.33Å; N517-I519 VanDerWaalsContact C-N 3.31Å; N517-I519 PolarHBondContact O-N 3.31Å; N517-A520 HydrophobicContact CB-CB 4.21Å; N517-A520 WeakPolarHBondContact O-CB 3.03Å; N517-A520 PolarHBondContact O-N 3.2Å; N517-Q521 WeakPolarHBondContact O-CG 3.4Å; N517-Q521 PolarHBondContact O-N 3.42Å
518I89.1Confident86.6Confident0 Ų028 Ų280%014%0.139CC..Hα-helixtrans-64.9-41.4175.7-64.9165.4000109.4A446 F450 L453 L481 L513 H516 A520 Q521 I522A446-I518 HydrophobicContact CB-CD1 3.83Å; A446-I518 WeakPolarHBondContact O-CD1 3.13Å; F450-I518 HydrophobicContact CB-CG1 4Å; L453-I518 HydrophobicContact CD1-CG2 4.1Å; L481-I518 HydrophobicContact CD1-CG2 4.09Å; L481-I518 HydrophobicContact CD2-CD1 4.48Å; L481-I518 HydrophobicContact CD2-CG2 4.43Å; L513-I518 HydrophobicContact CB-CB 4.46Å; L513-I518 HydrophobicContact CD2-CB 4.05Å; L513-I518 HydrophobicContact CD2-CD1 3.47Å; L513-I518 VanDerWaalsContact CD2-CD1 3.47Å; L513-I518 HydrophobicContact CD2-CG1 4.37Å; L513-I518 HydrophobicContact CD2-CG2 3.95Å; L513-I518 PolarHBondContact O-N 3.3Å; H516-I518 HydrophobicContact CB-CD1 4.29Å; H516-I518 HydrophobicContact CB-CG1 4.3Å; H516-I518 PolarHBondContact O-N 3.24Å; I518-A520 VanDerWaalsContact C-N 3.28Å; I518-A520 PolarHBondContact O-N 2.94Å; I518-Q521 PolarHBondContact O-N 3.24Å; I518-Q521 VanDerWaalsContact O-N 3.12Å; I518-I522 HydrophobicContact CG2-CD1 3.88Å; I518-I522 HydrophobicContact CG2-CG1 4.33Å; I518-I522 WeakPolarHBondContact O-CG1 3.32Å; I518-I522 PolarHBondContact O-N 3.08Å
519I89.4Confident86.3Confident0.5 Ų0.532 Ų320%0.00315%0.153CC..Hα-helixtrans-57.4-43.9174.3-61.5178.3000110.5L513 R514 N517 Q521 I522 I523 L601 Y614 L615L513-I519 HydrophobicContact CB-CD1 4.3Å; L513-I519 HydrophobicContact CB-CG1 4Å; L513-I519 PolarHBondContact O-N 2.86Å; R514-I519 HydrophobicContact CB-CD1 3.9Å; R514-I519 HydrophobicContact CG-CD1 4.5Å; N517-I519 VanDerWaalsContact C-N 3.31Å; N517-I519 PolarHBondContact O-N 3.31Å; I519-Q521 VanDerWaalsContact C-N 3.34Å; I519-Q521 PolarHBondContact O-N 3.07Å; I519-I522 PolarHBondContact O-N 3.39Å; I519-I523 HydrophobicContact CG2-CD1 3.82Å; I519-I523 WeakPolarHBondContact O-CD1 3.4Å; I519-I523 VanDerWaalsContact O-CG1 3.28Å; I519-I523 WeakPolarHBondContact O-CG1 3.19Å; I519-I523 PolarHBondContact O-N 3.13Å; I519-L601 HydrophobicContact CG2-CD2 4.02Å; I519-Y614 HydrophobicContact CB-CE1 4.24Å; I519-Y614 HydrophobicContact CG2-CD1 4.01Å; I519-Y614 HydrophobicContact CG2-CE1 3.77Å; I519-L615 HydrophobicContact CG2-CD2 3.49Å; I519-L615 VanDerWaalsContact CG2-CD2 3.49Å; I519-L615 HydrophobicContact CG2-CG 4.48Å
520A88Confident85.7Confident15.5 Ų15.532.9 Ų32.913%0.12816%0.159CC..Hα-helixtrans-63.5-38.9177.500000112.2N517 I518 I523 K524N517-A520 HydrophobicContact CB-CB 4.21Å; N517-A520 WeakPolarHBondContact O-CB 3.03Å; N517-A520 PolarHBondContact O-N 3.2Å; I518-A520 VanDerWaalsContact C-N 3.28Å; I518-A520 PolarHBondContact O-N 2.94Å; A520-I523 PolarHBondContact O-N 3.32Å; A520-K524 WeakPolarHBondContact O-CG 3.33Å; A520-K524 PolarHBondContact O-N 3.23Å
521Q87.8Confident85.1Confident12 Ų1232.8 Ų32.86%0.05616%0.158CC..Hα-helixtrans-67.1-40.9174.4-63-59.5-13.200111.9F450 N517 I518 I519 I523 K524 I525F450-Q521 HydrophobicContact CD2-CG 3.71Å; F450-Q521 HydrophobicContact CE2-CG 3.55Å; F450-Q521 VanDerWaalsContact CE2-NE2 3.33Å; N517-Q521 WeakPolarHBondContact O-CG 3.4Å; N517-Q521 PolarHBondContact O-N 3.42Å; I518-Q521 PolarHBondContact O-N 3.24Å; I518-Q521 VanDerWaalsContact O-N 3.12Å; I519-Q521 VanDerWaalsContact C-N 3.34Å; I519-Q521 PolarHBondContact O-N 3.07Å; Q521-I523 VanDerWaalsContact C-N 3.29Å; Q521-I523 PolarHBondContact O-N 3.33Å; Q521-K524 WeakPolarHBondContact O-CB 3.29Å; Q521-K524 PolarHBondContact O-N 3.4Å; Q521-K524 VanDerWaalsContact O-N 3.13Å; Q521-I525 VanDerWaalsContact O-CG1 3.3Å; Q521-I525 WeakPolarHBondContact O-CG1 3.41Å; Q521-I525 PolarHBondContact O-N 3.33Å
522I90Very high84.2Confident0 Ų035.4 Ų35.40%018%0.18CC..Hα-helixtrans-59.6-43174.2-69.4168.9000110.3I518 I519 K524 I525 L526 C597 I600 L601I518-I522 HydrophobicContact CG2-CD1 3.88Å; I518-I522 HydrophobicContact CG2-CG1 4.33Å; I518-I522 WeakPolarHBondContact O-CG1 3.32Å; I518-I522 PolarHBondContact O-N 3.08Å; I519-I522 PolarHBondContact O-N 3.39Å; I522-K524 VanDerWaalsContact C-N 3.34Å; I522-K524 PolarHBondContact O-N 3.17Å; I522-I525 WeakPolarHBondContact O-CB 3.26Å; I522-I525 PolarHBondContact O-N 3.17Å; I522-L526 HydrophobicContact CG2-CD1 4.22Å; I522-L526 HydrophobicContact CG2-CG 4.49Å; I522-L526 WeakPolarHBondContact O-CB 3.23Å; I522-L526 WeakPolarHBondContact O-CG 3.37Å; I522-L526 PolarHBondContact O-N 3.02Å; I522-C597 HydrophobicContact CG2-CB 3.76Å; I522-I600 HydrophobicContact CD1-CB 4.09Å; I522-I600 HydrophobicContact CD1-CD1 4.06Å; I522-I600 HydrophobicContact CD1-CG2 3.51Å; I522-I600 VanDerWaalsContact CD1-CG2 3.48Å; I522-L601 HydrophobicContact CG2-CD1 4.49Å; I522-L601 HydrophobicContact CG2-CD2 4.03Å; I522-L601 HydrophobicContact CG2-CG 4.14Å
523I88.2Confident83.4Confident10 Ų1040 Ų405%0.05121%0.205CC..Hα-helixtrans-64.1-39.2175.7-67.7158.4000111.3I519 A520 Q521 I525 L526 N527 Y614 L615 Y618 L621I519-I523 HydrophobicContact CG2-CD1 3.82Å; I519-I523 WeakPolarHBondContact O-CD1 3.4Å; I519-I523 VanDerWaalsContact O-CG1 3.28Å; I519-I523 WeakPolarHBondContact O-CG1 3.19Å; I519-I523 PolarHBondContact O-N 3.13Å; A520-I523 PolarHBondContact O-N 3.32Å; Q521-I523 VanDerWaalsContact C-N 3.29Å; Q521-I523 PolarHBondContact O-N 3.33Å; I523-I525 VanDerWaalsContact C-N 3.34Å; I523-L526 WeakPolarHBondContact O-CB 3.3Å; I523-L526 PolarHBondContact O-N 3.05Å; I523-N527 WeakPolarHBondContact O-CB 3.13Å; I523-N527 PolarHBondContact O-N 2.82Å; I523-Y614 HydrophobicContact CD1-CE1 4.42Å; I523-L615 HydrophobicContact CD1-CD2 4.29Å; I523-Y618 HydrophobicContact CD1-CD1 4.4Å; I523-Y618 HydrophobicContact CD1-CD2 3.35Å; I523-Y618 VanDerWaalsContact CD1-CD2 3.41Å; I523-Y618 HydrophobicContact CD1-CE1 4.44Å; I523-Y618 HydrophobicContact CD1-CE2 3.39Å; I523-Y618 HydrophobicContact CD1-CG 3.87Å; I523-Y618 HydrophobicContact CG1-CD2 4.36Å; I523-Y618 HydrophobicContact CG1-CE2 4.5Å; I523-Y618 HydrophobicContact CG1-CG 4.41Å; I523-Y618 HydrophobicContact CG2-CD1 3.73Å; I523-Y618 HydrophobicContact CG2-CD2 4.49Å; I523-Y618 HydrophobicContact CG2-CE1 3.92Å; I523-Y618 HydrophobicContact CG2-CG 4.07Å; I523-L621 HydrophobicContact CG2-CD1 3.96Å
524K86.9Confident82.3Confident113.5 Ų113.540.5 Ų40.549%0.49321%0.207SC..Hα-helixtrans-64-38.8173.9-72.7174.3-178.6-178.50112.4L457 A520 Q521 I522 N527 S528L457-K524 HydrophobicContact CD1-CB 4.18Å; L457-K524 HydrophobicContact CD2-CB 3.76Å; L457-K524 HydrophobicContact CD2-CD 3.84Å; L457-K524 HydrophobicContact CD2-CG 4.43Å; A520-K524 WeakPolarHBondContact O-CG 3.33Å; A520-K524 PolarHBondContact O-N 3.23Å; Q521-K524 WeakPolarHBondContact O-CB 3.29Å; Q521-K524 PolarHBondContact O-N 3.4Å; Q521-K524 VanDerWaalsContact O-N 3.13Å; I522-K524 VanDerWaalsContact C-N 3.34Å; I522-K524 PolarHBondContact O-N 3.17Å; K524-N527 PolarHBondContact O-N 2.86Å; K524-S528 PolarHBondContact O-N 3.2Å
525I85.6Confident80.9Confident5.5 Ų5.541.3 Ų41.33%0.02822%0.217CC..Hα-helixtrans-62.4-46.9173.2-66.4163000109.5L453 L457 L474 Q521 I522 I523 N527 S528 I531 W590 V593L453-I525 HydrophobicContact CD2-CD1 3.97Å; L457-I525 HydrophobicContact CD1-CB 4.41Å; L457-I525 HydrophobicContact CD1-CG1 3.83Å; L474-I525 HydrophobicContact CD1-CD1 4.17Å; Q521-I525 VanDerWaalsContact O-CG1 3.3Å; Q521-I525 WeakPolarHBondContact O-CG1 3.41Å; Q521-I525 PolarHBondContact O-N 3.33Å; I522-I525 WeakPolarHBondContact O-CB 3.26Å; I522-I525 PolarHBondContact O-N 3.17Å; I523-I525 VanDerWaalsContact C-N 3.34Å; I525-N527 VanDerWaalsContact C-N 3.3Å; I525-N527 PolarHBondContact O-N 3.41Å; I525-S528 WeakPolarHBondContact O-CB 3.33Å; I525-S528 PolarHBondContact O-N 3.08Å; I525-I531 HydrophobicContact CG2-CD1 4.44Å; I525-I531 WeakPolarHBondContact O-CD1 3.38Å; I525-W590 HydrophobicContact CG2-CZ3 4.38Å; I525-V593 HydrophobicContact CG2-CG1 4.04Å
526L84.7Confident79.6Confident1.5 Ų1.547.6 Ų47.61%0.00824%0.244CC..Hα-helixtrans-59.5-38.6176.2-73.7177.2000112.2I522 I523 S528 I531 C597 Y598 L601 L621 H625I522-L526 HydrophobicContact CG2-CD1 4.22Å; I522-L526 HydrophobicContact CG2-CG 4.49Å; I522-L526 WeakPolarHBondContact O-CB 3.23Å; I522-L526 WeakPolarHBondContact O-CG 3.37Å; I522-L526 PolarHBondContact O-N 3.02Å; I523-L526 WeakPolarHBondContact O-CB 3.3Å; I523-L526 PolarHBondContact O-N 3.05Å; L526-S528 PolarHBondContact O-N 3.44Å; L526-S528 VanDerWaalsContact O-N 3.16Å; L526-I531 HydrophobicContact CD2-CD1 4.07Å; L526-C597 HydrophobicContact CD1-CB 4.32Å; L526-C597 HydrophobicContact CD2-CB 3.79Å; L526-C597 HydrophobicContact CG-CB 4.06Å; L526-Y598 HydrophobicContact CD1-CD2 4.44Å; L526-Y598 HydrophobicContact CD1-CE1 4.42Å; L526-Y598 HydrophobicContact CD1-CE2 4.11Å; L526-Y598 HydrophobicContact CD2-CD2 3.99Å; L526-Y598 HydrophobicContact CD2-CE2 3.66Å; L526-Y598 HydrophobicContact CG-CE2 4.49Å; L526-L601 HydrophobicContact CD1-CD1 3.73Å; L526-L621 HydrophobicContact CB-CD2 4.32Å; L526-H625 PolarHBondContact O-CE1 2.94Å; L526-H625 PolarHBondContact O-NE2 3.15Å
527N84.7Confident78.1Confident106 Ų10651.1 Ų51.157%0.56726%0.261SS*.THydrogen-bonded Turntrans-74.52.7175.7-122.7-1.5000114.4I523 K524 I525 K529 L621I523-N527 WeakPolarHBondContact O-CB 3.13Å; I523-N527 PolarHBondContact O-N 2.82Å; K524-N527 PolarHBondContact O-N 2.86Å; I525-N527 VanDerWaalsContact C-N 3.3Å; I525-N527 PolarHBondContact O-N 3.41Å; N527-K529 PolarHBondContact O-N 3.11Å; N527-L621 HydrophobicContact CB-CD1 3.85Å; N527-L621 VanDerWaalsContact ND2-CD1 3.29Å; N527-L621 WeakPolarHBondContact ND2-CD1 3.31Å; N527-L621 WeakPolarHBondContact OD1-CD1 3.44Å; N527-L621 WeakPolarHBondContact OD1-CG 3.2Å
528S82.7Confident76.2Confident12 Ų1248.7 Ų48.78%0.08425%0.25CC..SBendtrans-61.2140176.1174.50000111.1K524 I525 L526 M530 I531 S532K524-S528 PolarHBondContact O-N 3.2Å; I525-S528 WeakPolarHBondContact O-CB 3.33Å; I525-S528 PolarHBondContact O-N 3.08Å; L526-S528 PolarHBondContact O-N 3.44Å; L526-S528 VanDerWaalsContact O-N 3.16Å; S528-M530 PolarHBondContact O-N 3.18Å; S528-M530 VanDerWaalsContact O-N 3.08Å; S528-M530 PolarHBondContact OG-N 3.39Å; S528-I531 PolarHBondContact O-N 3.17Å; S528-S532 PolarHBondContact O-N 2.77Å; S528-S532 VanDerWaalsContact O-N 3.16Å
529K75.9Confident74.2Confident166 Ų16650.2 Ų50.272%0.72226%0.259SS*.Hα-helixtrans-54-29173.7-117.8178.5-178.1177.90112.3N527 S532 N533N527-K529 PolarHBondContact O-N 3.11Å; K529-S532 PolarHBondContact O-N 3.45Å; K529-N533 VanDerWaalsContact O-CB 3.24Å; K529-N533 WeakPolarHBondContact O-CB 3.32Å; K529-N533 PolarHBondContact O-N 3.48Å; K529-N533 PolarHBondContact O-ND2 3.04Å; K529-N533 PolarHBondContact O-OD1 3.07Å
530M74.3Confident72.1Confident41.5 Ų41.550.2 Ų50.220%0.20426%0.259CS..Hα-helixtrans-67.9-40.6178.4-67.3-58.8-173.500113G464 K465 S528 N533 L534 W590G464-M530 WeakPolarHBondContact O-CE 3.46Å; K465-M530 HydrophobicContact CD-CE 4.43Å; K465-M530 HydrophobicContact CG-CE 3.72Å; K465-M530 VanDerWaalsContact CG-CE 3.49Å; S528-M530 PolarHBondContact O-N 3.18Å; S528-M530 VanDerWaalsContact O-N 3.08Å; S528-M530 PolarHBondContact OG-N 3.39Å; M530-N533 PolarHBondContact O-N 3.1Å; M530-L534 PolarHBondContact O-N 2.89Å; M530-W590 HydrophobicContact CB-CD2 4.04Å; M530-W590 HydrophobicContact CB-CE3 4.45Å; M530-W590 HydrophobicContact CB-CG 4.35Å; M530-W590 HydrophobicContact CB-CH2 4.39Å; M530-W590 HydrophobicContact CB-CZ2 3.93Å; M530-W590 HydrophobicContact CG-CZ2 4.04Å
531I74Confident70.2Confident0 Ų053.7 Ų53.70%028%0.275CS..Hα-helixtrans-71-41176.7-70.3-179.7000109.7I525 L526 S528 N533 L534 W590 L628 I630I525-I531 HydrophobicContact CG2-CD1 4.44Å; I525-I531 WeakPolarHBondContact O-CD1 3.38Å; L526-I531 HydrophobicContact CD2-CD1 4.07Å; S528-I531 PolarHBondContact O-N 3.17Å; I531-N533 PolarHBondContact O-N 2.98Å; I531-L534 HydrophobicContact CB-CD1 4.46Å; I531-L534 HydrophobicContact CG1-CD1 4.48Å; I531-L534 HydrophobicContact CG2-CD1 4.34Å; I531-L534 WeakPolarHBondContact O-CB 3.26Å; I531-L534 PolarHBondContact O-N 3.18Å; I531-W590 HydrophobicContact CD1-CE3 4.05Å; I531-W590 HydrophobicContact CD1-CZ3 4.25Å; I531-W590 HydrophobicContact CG1-CE3 3.77Å; I531-W590 HydrophobicContact CG1-CZ3 4.25Å; I531-L628 HydrophobicContact CG2-CD1 4.39Å; I531-L628 WeakPolarHBondContact O-CD1 3.25Å; I531-I630 HydrophobicContact CG2-CD1 3.9Å
532S68.7Low68.2Low83.5 Ų83.553.5 Ų53.558%0.58427%0.274SS*.Hα-helixtrans-63.3-27.5174.7-175.50000113.7S528 K529S528-S532 PolarHBondContact O-N 2.77Å; S528-S532 VanDerWaalsContact O-N 3.16Å; K529-S532 PolarHBondContact O-N 3.45Å
533N69.2Low66.1Low112.5 Ų112.554 Ų5460%0.60228%0.277SS*.THydrogen-bonded Turntrans-89.9-1.5179.5-73.8-8000113.5K529 M530 I531K529-N533 VanDerWaalsContact O-CB 3.24Å; K529-N533 WeakPolarHBondContact O-CB 3.32Å; K529-N533 PolarHBondContact O-N 3.48Å; K529-N533 PolarHBondContact O-ND2 3.04Å; K529-N533 PolarHBondContact O-OD1 3.07Å; M530-N533 PolarHBondContact O-N 3.1Å; I531-N533 PolarHBondContact O-N 2.98Å
534L66.1Low64.1Low10 Ų1055.7 Ų55.75%0.05229%0.286CS..SBendtrans-57.1138.1174.7-78.8165.1000109.2M530 I531 K536 I587 W590 Q591 L628 I630M530-L534 PolarHBondContact O-N 2.89Å; I531-L534 HydrophobicContact CB-CD1 4.46Å; I531-L534 HydrophobicContact CG1-CD1 4.48Å; I531-L534 HydrophobicContact CG2-CD1 4.34Å; I531-L534 WeakPolarHBondContact O-CB 3.26Å; I531-L534 PolarHBondContact O-N 3.18Å; L534-K536 PolarHBondContact O-N 3.33Å; L534-K536 VanDerWaalsContact O-N 3.15Å; L534-I587 HydrophobicContact CD2-CB 4.41Å; L534-I587 HydrophobicContact CD2-CG2 3.91Å; L534-W590 HydrophobicContact CD1-CB 4.32Å; L534-W590 HydrophobicContact CD2-CB 4.06Å; L534-W590 HydrophobicContact CG-CB 4.49Å; L534-Q591 HydrophobicContact CD1-CG 4.32Å; L534-Q591 HydrophobicContact CD2-CG 4.12Å; L534-L628 HydrophobicContact CB-CB 4.48Å; L534-L628 HydrophobicContact CB-CD2 4.14Å; L534-L628 WeakPolarHBondContact O-CD2 3.38Å; L534-I630 HydrophobicContact CD1-CD1 3.76Å
535P58.9Low62.2Low54 Ų5452.4 Ų52.435%0.35127%0.272SS..  trans-58.9126.6176.824.3-32.1000108.3Q537 I587P535-Q537 VanDerWaalsContact C-N 3.3Å; P535-Q537 HydrophobicContact CB-CG 4.19Å; P535-Q537 HydrophobicContact CG-CG 4.25Å; P535-Q537 PolarHBondContact O-N 3.19Å; P535-I587 HydrophobicContact CG-CD1 4.39Å; P535-I587 HydrophobicContact CG-CG2 4.21Å
536K57.6Low60.2Low164 Ų16452.8 Ų52.871%0.71328%0.275SS*.  trans-62.690.2165.3-72.4-174177.7-172.50107.1L534 L628L534-K536 PolarHBondContact O-N 3.33Å; L534-K536 VanDerWaalsContact O-N 3.15Å; K536-L628 HydrophobicContact CG-CD2 3.87Å
537Q51.9Low58.3Low87 Ų8756.9 Ų56.941%0.40730%0.295SS..  trans-76.4135.9167.6-67.4178.7-0.700105.4P535 T539 G627P535-Q537 VanDerWaalsContact C-N 3.3Å; P535-Q537 HydrophobicContact CB-CG 4.19Å; P535-Q537 HydrophobicContact CG-CG 4.25Å; P535-Q537 PolarHBondContact O-N 3.19Å; Q537-T539 PolarHBondContact O-N 3.41Å; Q537-G627 PolarHBondContact N-O 2.86Å
538S46.1Very low56Low28 Ų2856.1 Ų56.120%0.19629%0.291CS..  trans-59.6109.5163.9-168.20000106.6S540 N543 N544 N666S538-S540 PolarHBondContact O-N 3.31Å; S538-S540 WeakPolarHBondContact OG-CB 3.23Å; S538-S540 PolarHBondContact OG-N 3.16Å; S538-N543 VanDerWaalsContact CB-CB 3.41Å; S538-N543 WeakPolarHBondContact CB-ND2 3.36Å; S538-N543 WeakPolarHBondContact OG-CB 3.3Å; S538-N543 PolarHBondContact OG-ND2 3.22Å; S538-N544 PolarHBondContact O-ND2 3.17Å; S538-N544 VanDerWaalsContact O-ND2 3.16Å; S538-N544 PolarHBondContact O-OD1 3.35Å; S538-N666 PolarHBondContact OG-OD1 3.15Å
539T46.9Very low53.7Low31 Ų3159.5 Ų59.519%0.1932%0.315CS..  trans-68.2-10177.953.10000111.6Q537 I541 N666 E668 R670Q537-T539 PolarHBondContact O-N 3.41Å; T539-I541 PolarHBondContact O-N 3.11Å; T539-N666 PolarHBondContact N-OD1 2.84Å; T539-N666 PolarHBondContact OG1-OD1 3.45Å; T539-E668 VanDerWaalsContact O-OE1 3.1Å; T539-R670 VanDerWaalsContact CB-NH2 3.3Å; T539-R670 PolarHBondContact OG1-NH2 2.83Å; T539-R670 VanDerWaalsContact OG1-NH2 3.08Å
540S45.6Very low51.6Low0 Ų058.2 Ų58.20%032%0.316CS..  trans-67113.4176.2-179.60000109.9S538 V542 N543 N544 I667 E668S538-S540 PolarHBondContact O-N 3.31Å; S538-S540 WeakPolarHBondContact OG-CB 3.23Å; S538-S540 PolarHBondContact OG-N 3.16Å; S540-V542 PolarHBondContact O-N 3.1Å; S540-V542 VanDerWaalsContact OG-CA 3.28Å; S540-V542 WeakPolarHBondContact OG-CA 3.31Å; S540-V542 VanDerWaalsContact OG-CB 3.28Å; S540-V542 WeakPolarHBondContact OG-CB 3.45Å; S540-V542 VanDerWaalsContact OG-CG2 3.23Å; S540-V542 WeakPolarHBondContact OG-CG2 3.38Å; S540-V542 PolarHBondContact OG-N 2.97Å; S540-N543 PolarHBondContact O-N 3.01Å; S540-N543 VanDerWaalsContact O-N 3.1Å; S540-N543 PolarHBondContact OG-N 3.34Å; S540-N544 WeakPolarHBondContact O-CB 3.18Å; S540-N544 PolarHBondContact O-N 3.09Å; S540-N544 PolarHBondContact O-ND2 2.62Å; S540-N544 VanDerWaalsContact O-ND2 3.14Å; S540-I667 PolarHBondContact OG-O 2.93Å; S540-E668 VanDerWaalsContact CA-OE1 3.26Å; S540-E668 WeakPolarHBondContact CA-OE1 3.29Å; S540-E668 WeakPolarHBondContact CB-OE1 3.35Å; S540-E668 VanDerWaalsContact OG-CG 3.31Å; S540-E668 WeakPolarHBondContact OG-CG 3.02Å; S540-E668 PolarHBondContact OG-OE1 3.26Å
541I48.9Very low49.6Very low90 Ų9060.2 Ų60.246%0.46233%0.327SS..Hα-helixtrans-55.1-33.6164.3-66.4166.1000108.6T539 H545 E668 L792T539-I541 PolarHBondContact O-N 3.11Å; I541-H545 VanDerWaalsContact CG2-CD2 3.43Å; I541-H545 WeakPolarHBondContact CG2-CD2 3.37Å; I541-H545 VanDerWaalsContact O-CB 3.28Å; I541-H545 WeakPolarHBondContact O-CB 3.38Å; I541-H545 PolarHBondContact O-CD2 3Å; I541-H545 PolarHBondContact O-N 3.25Å; I541-E668 PolarHBondContact N-OE1 3.01Å; I541-L792 HydrophobicContact CB-CD1 4.16Å; I541-L792 HydrophobicContact CG2-CD1 3.71Å
542V45.5Very low47.3Very low8 Ų867.5 Ų67.55%0.04837%0.365CS..Hα-helixtrans-61.9-55.2172.9-167.40000110.6S540 N544 H545 L546 E668 L789 L792S540-V542 PolarHBondContact O-N 3.1Å; S540-V542 VanDerWaalsContact OG-CA 3.28Å; S540-V542 WeakPolarHBondContact OG-CA 3.31Å; S540-V542 VanDerWaalsContact OG-CB 3.28Å; S540-V542 WeakPolarHBondContact OG-CB 3.45Å; S540-V542 VanDerWaalsContact OG-CG2 3.23Å; S540-V542 WeakPolarHBondContact OG-CG2 3.38Å; S540-V542 PolarHBondContact OG-N 2.97Å; V542-N544 VanDerWaalsContact C-N 3.33Å; V542-N544 PolarHBondContact O-N 3.24Å; V542-H545 CarbonylContact O-C 3.55Å; V542-H545 WeakPolarHBondContact O-CA 3.3Å; V542-H545 WeakPolarHBondContact O-CB 3.47Å; V542-H545 PolarHBondContact O-N 3.15Å; V542-H545 VanDerWaalsContact O-N 3.1Å; V542-L546 HydrophobicContact CB-CD1 4.14Å; V542-L546 HydrophobicContact CG1-CD1 3.48Å; V542-L546 VanDerWaalsContact CG1-CD1 3.43Å; V542-L546 HydrophobicContact CG1-CG 4.13Å; V542-L546 VanDerWaalsContact O-CB 3.29Å; V542-L546 WeakPolarHBondContact O-CB 3.27Å; V542-L546 WeakPolarHBondContact O-CD1 3.5Å; V542-L546 WeakPolarHBondContact O-CG 3.42Å; V542-L546 PolarHBondContact O-N 3.33Å; V542-E668 HydrophobicContact CG2-CG 3.83Å; V542-L789 HydrophobicContact CB-CD1 4.47Å; V542-L789 HydrophobicContact CG1-CD1 3.88Å; V542-L792 HydrophobicContact CB-CD1 4.38Å; V542-L792 HydrophobicContact CG1-CD1 4.39Å; V542-L792 HydrophobicContact CG2-CB 3.8Å; V542-L792 VanDerWaalsContact CG2-CB 3.46Å; V542-L792 HydrophobicContact CG2-CD1 3.65Å; V542-L792 HydrophobicContact CG2-CD2 4.12Å; V542-L792 HydrophobicContact CG2-CG 4.04Å
543N45.5Very low45.3Very low11 Ų1170.6 Ų70.66%0.05937%0.373CS..Hα-helixtrans-64.4-36.9178.6-73.9-9.5000112.3S538 S540 H545 L546 I547 D665S538-N543 VanDerWaalsContact CB-CB 3.41Å; S538-N543 WeakPolarHBondContact CB-ND2 3.36Å; S538-N543 WeakPolarHBondContact OG-CB 3.3Å; S538-N543 PolarHBondContact OG-ND2 3.22Å; S540-N543 PolarHBondContact O-N 3.01Å; S540-N543 VanDerWaalsContact O-N 3.1Å; S540-N543 PolarHBondContact OG-N 3.34Å; N543-H545 VanDerWaalsContact C-N 3.26Å; N543-H545 PolarHBondContact O-N 2.94Å; N543-L546 CarbonylContact O-C 3.54Å; N543-L546 PolarHBondContact O-N 3.16Å; N543-L546 VanDerWaalsContact OD1-CD1 3.32Å; N543-L546 WeakPolarHBondContact OD1-CD1 3.22Å; N543-I547 HydrophobicContact CB-CD1 4.02Å; N543-I547 WeakPolarHBondContact O-CA 3.38Å; N543-I547 VanDerWaalsContact O-CB 3.25Å; N543-I547 WeakPolarHBondContact O-CB 3.44Å; N543-I547 WeakPolarHBondContact O-CD1 3.36Å; N543-I547 VanDerWaalsContact O-CG1 3.28Å; N543-I547 WeakPolarHBondContact O-CG1 3.46Å; N543-I547 PolarHBondContact O-N 3.28Å; N543-D665 PolarHBondContact ND2-O 3.13Å
544N46.2Very low43.3Very low44 Ų4473.5 Ų73.524%0.23538%0.376CS..Hα-helixtrans-64.4-39174.8-74.4-33.4000111.2S538 S540 V542 N548 I551S538-N544 PolarHBondContact O-ND2 3.17Å; S538-N544 VanDerWaalsContact O-ND2 3.16Å; S538-N544 PolarHBondContact O-OD1 3.35Å; S540-N544 WeakPolarHBondContact O-CB 3.18Å; S540-N544 PolarHBondContact O-N 3.09Å; S540-N544 PolarHBondContact O-ND2 2.62Å; S540-N544 VanDerWaalsContact O-ND2 3.14Å; V542-N544 VanDerWaalsContact C-N 3.33Å; V542-N544 PolarHBondContact O-N 3.24Å; N544-N548 CarbonylContact O-C 3.46Å; N544-N548 PolarHBondContact O-N 3.04Å; N544-N548 VanDerWaalsContact O-N 3.1Å; N544-I551 HydrophobicContact CB-CB 4.33Å; N544-I551 HydrophobicContact CB-CD1 3.76Å; N544-I551 HydrophobicContact CB-CG2 4.43Å; N544-I551 VanDerWaalsContact CG-CD1 3.46Å; N544-I551 VanDerWaalsContact OD1-CD1 3.31Å; N544-I551 WeakPolarHBondContact OD1-CD1 3.34Å
545H46.8Very low41.5Very low45.5 Ų45.581.1 Ų81.121%0.21141%0.409CS..Hα-helixtrans-70.9-33.8171.4-79.3-55.6000113.4I541 V542 N543 F740I541-H545 VanDerWaalsContact CG2-CD2 3.43Å; I541-H545 WeakPolarHBondContact CG2-CD2 3.37Å; I541-H545 VanDerWaalsContact O-CB 3.28Å; I541-H545 WeakPolarHBondContact O-CB 3.38Å; I541-H545 PolarHBondContact O-CD2 3Å; I541-H545 PolarHBondContact O-N 3.25Å; V542-H545 CarbonylContact O-C 3.55Å; V542-H545 WeakPolarHBondContact O-CA 3.3Å; V542-H545 WeakPolarHBondContact O-CB 3.47Å; V542-H545 PolarHBondContact O-N 3.15Å; V542-H545 VanDerWaalsContact O-N 3.1Å; N543-H545 VanDerWaalsContact C-N 3.26Å; N543-H545 PolarHBondContact O-N 2.94Å; H545-F740 VanDerWaalsContact O-CE2 3.28Å; H545-F740 WeakPolarHBondContact O-CE2 3.34Å
546L43.9Very low40.1Very low14 Ų1483.8 Ų83.87%0.07343%0.426CS..Hα-helixtrans-73.7-37.3179.1-71.7161.2000112.4V542 N543 I736 F740 W741 L789V542-L546 HydrophobicContact CB-CD1 4.14Å; V542-L546 HydrophobicContact CG1-CD1 3.48Å; V542-L546 VanDerWaalsContact CG1-CD1 3.43Å; V542-L546 HydrophobicContact CG1-CG 4.13Å; V542-L546 VanDerWaalsContact O-CB 3.29Å; V542-L546 WeakPolarHBondContact O-CB 3.27Å; V542-L546 WeakPolarHBondContact O-CD1 3.5Å; V542-L546 WeakPolarHBondContact O-CG 3.42Å; V542-L546 PolarHBondContact O-N 3.33Å; N543-L546 CarbonylContact O-C 3.54Å; N543-L546 PolarHBondContact O-N 3.16Å; N543-L546 VanDerWaalsContact OD1-CD1 3.32Å; N543-L546 WeakPolarHBondContact OD1-CD1 3.22Å; L546-I736 HydrophobicContact CD1-CG1 4.12Å; L546-I736 HydrophobicContact CD2-CD1 4.39Å; L546-I736 HydrophobicContact CD2-CG1 4.1Å; L546-I736 HydrophobicContact CD2-CG2 3.87Å; L546-F740 VanDerWaalsContact CA-CD2 3.44Å; L546-F740 HydrophobicContact CB-CD2 4.44Å; L546-F740 HydrophobicContact CB-CE2 4.34Å; L546-F740 HydrophobicContact CB-CZ 4.31Å; L546-F740 HydrophobicContact CD2-CD1 3.57Å; L546-F740 HydrophobicContact CD2-CD2 4.47Å; L546-F740 HydrophobicContact CD2-CE1 3.3Å; L546-F740 HydrophobicContact CD2-CE2 4.21Å; L546-F740 HydrophobicContact CD2-CG 4.21Å; L546-F740 HydrophobicContact CD2-CZ 3.74Å; L546-F740 VanDerWaalsContact CD2-CZ 3.44Å; L546-F740 HydrophobicContact CG-CD1 4.45Å; L546-F740 HydrophobicContact CG-CE1 3.97Å; L546-F740 HydrophobicContact CG-CE2 4.36Å; L546-F740 HydrophobicContact CG-CZ 3.85Å; L546-F740 VanDerWaalsContact O-CD2 3.27Å; L546-F740 WeakPolarHBondContact O-CD2 3.48Å; L546-W741 HydrophobicContact CD2-CZ2 4.19Å; L546-L789 HydrophobicContact CD2-CD1 4.36Å; L546-L789 HydrophobicContact CD2-CD2 4.19Å; L546-L789 HydrophobicContact CG-CD1 4.35Å
547I45.6Very low39Very low86.5 Ų86.580.6 Ų80.644%0.44442%0.417SS..Hα-helixtrans-97-29.7-173-59.2169.3000111.4N543 L735N543-I547 HydrophobicContact CB-CD1 4.02Å; N543-I547 WeakPolarHBondContact O-CA 3.38Å; N543-I547 VanDerWaalsContact O-CB 3.25Å; N543-I547 WeakPolarHBondContact O-CB 3.44Å; N543-I547 WeakPolarHBondContact O-CD1 3.36Å; N543-I547 VanDerWaalsContact O-CG1 3.28Å; N543-I547 WeakPolarHBondContact O-CG1 3.46Å; N543-I547 PolarHBondContact O-N 3.28Å; I547-L735 HydrophobicContact CD1-CD2 4Å
548N35.2Very low38.1Very low89 Ų8983.8 Ų83.848%0.47644%0.435SS..  trans-146.3122.7-174.3-100.2-42.5000114.6N544 N550 I551N544-N548 CarbonylContact O-C 3.46Å; N544-N548 PolarHBondContact O-N 3.04Å; N544-N548 VanDerWaalsContact O-N 3.1Å; N548-N550 PolarHBondContact O-N 3.05Å; N548-I551 HydrophobicContact CB-CD1 4.02Å; N548-I551 HydrophobicContact CB-CG1 4.28Å
549S35.3Very low37.9Very low85 Ų8585 Ų8559%0.59444%0.444SS*.THydrogen-bonded Turntrans-69.1-5.5178.350.70000115.2K785S549-K785 PolarHBondContact O-NZ 2.86Å
550N30.7Very low37.6Very low137.5 Ų137.584.8 Ų84.874%0.73544%0.441SS*.THydrogen-bonded Turntrans-124.839.2-170.2-74.6-19.4000115.2N548N548-N550 PolarHBondContact O-N 3.05Å
551I32.6Very low37.4Very low83.5 Ų83.589.9 Ų89.943%0.42847%0.468SS..  trans-113.8122.5176.4-59.2177.6000112N544 N548 I553N544-I551 HydrophobicContact CB-CB 4.33Å; N544-I551 HydrophobicContact CB-CD1 3.76Å; N544-I551 HydrophobicContact CB-CG2 4.43Å; N544-I551 VanDerWaalsContact CG-CD1 3.46Å; N544-I551 VanDerWaalsContact OD1-CD1 3.31Å; N544-I551 WeakPolarHBondContact OD1-CD1 3.34Å; N548-I551 HydrophobicContact CB-CD1 4.02Å; N548-I551 HydrophobicContact CB-CG1 4.28Å; I551-I553 PolarHBondContact O-N 2.74Å
552L26.8Very low37.2Very low153.5 Ų153.588.3 Ų88.380%0.80447%0.465SS*.  trans-54127.6177.2-104.278.7000112.3W554L552-W554 PolarHBondContact O-N 3.31Å
553I26.8Very low37.1Very low148.5 Ų148.591.5 Ų91.576%0.76248%0.481SS*.  trans-44.6120.9164.2-62159.6000110.5I551 K555I551-I553 PolarHBondContact O-N 2.74Å; I553-K555 PolarHBondContact O-N 3.05Å
554W27.3Very low36.9Very low173.5 Ų173.591.5 Ų91.566%0.65748%0.481SS*.  trans-59.8109.3166.8-108.153.9000110.1L552 L588L552-W554 PolarHBondContact O-N 3.31Å; W554-L588 HydrophobicContact CH2-CD2 3.38Å; W554-L588 HydrophobicContact CZ2-CD2 3.95Å; W554-L588 HydrophobicContact CZ3-CD2 4.25Å
555K26.3Very low36.8Very low169 Ų16995.6 Ų95.674%0.73550%0.498SS*.  trans-90.1129.6163.6-87.2-175.4174.5-179.60108.7I553 D557I553-K555 PolarHBondContact O-N 3.05Å; K555-D557 PolarHBondContact O-N 2.88Å
556P29.9Very low36.3Very low111 Ų111100.9 Ų100.972%0.72152%0.523SS*.  trans-76.2100.7-177.832.5-33.8000110.9I558P556-I558 PolarHBondContact O-N 2.97Å
557D34.2Very low35.9Very low97.5 Ų97.5104.5 Ų104.552%0.52155%0.546SS..THydrogen-bonded Turntrans-57.453.2169.8-69.9-32.4000116.9K555 S559 R631K555-D557 PolarHBondContact O-N 2.88Å; D557-S559 PolarHBondContact O-N 3.1Å; D557-R631 IonicContact OD2-NH1 3.29Å
558I34.9Very low35.6Very low154.5 Ų154.5107.5 Ų107.579%0.79256%0.558SS**THydrogen-bonded Turntrans-53.534.6163.8-52.9175.4000113.4P556 L560P556-I558 PolarHBondContact O-N 2.97Å; I558-L560 PolarHBondContact O-N 3.46Å
559S40.8Very low35.6Very low53.5 Ų53.5107.5 Ų107.537%0.37457%0.565SS.*Hα-helixtrans-112.3-1.9177.1-130.20000114.6D557 L561 S562 I563D557-S559 PolarHBondContact O-N 3.1Å; S559-L561 PolarHBondContact O-N 2.68Å; S559-S562 VanDerWaalsContact CA-OG 3.26Å; S559-S562 WeakPolarHBondContact CA-OG 3.24Å; S559-S562 WeakPolarHBondContact CB-OG 3.34Å; S559-S562 PolarHBondContact O-N 3.16Å; S559-S562 PolarHBondContact O-OG 2.98Å; S559-S562 PolarHBondContact OG-OG 3.42Å; S559-I563 WeakPolarHBondContact O-CG1 3.39Å; S559-I563 PolarHBondContact O-N 3.14Å
560L41.4Very low35.5Very low26 Ų26110 Ų11014%0.13657%0.572CS.*Hα-helixtrans-71.7-29.9174.8-139.6130.3000111.6I475 I558 S562 I563 L564 L588 A589 T592I475-L560 HydrophobicContact CD1-CD2 4.21Å; I558-L560 PolarHBondContact O-N 3.46Å; L560-S562 VanDerWaalsContact C-N 3.3Å; L560-S562 PolarHBondContact O-N 3.32Å; L560-I563 HydrophobicContact CD1-CD1 4.47Å; L560-I563 PolarHBondContact O-N 2.88Å; L560-L564 HydrophobicContact CD2-CD1 3.79Å; L560-L564 HydrophobicContact CD2-CG 4.04Å; L560-L564 WeakPolarHBondContact O-CB 3.35Å; L560-L564 PolarHBondContact O-N 3.06Å; L560-L588 HydrophobicContact CD1-CB 3.77Å; L560-L588 WeakPolarHBondContact CD1-O 3.16Å; L560-A589 HydrophobicContact CD2-CB 4.03Å; L560-T592 WeakPolarHBondContact CD1-OG1 3.39Å
561L39.9Very low35.7Very low107.5 Ų107.5110 Ų11056%0.56358%0.577SS**Hα-helixtrans-63.3-34.2173.8-137.382.5000111.2I475 S559 H565I475-L561 HydrophobicContact CG2-CD1 4.47Å; S559-L561 PolarHBondContact O-N 2.68Å; L561-H565 WeakPolarHBondContact O-CB 3.17Å; L561-H565 PolarHBondContact O-CD2 3.13Å; L561-H565 VanDerWaalsContact O-CD2 3.29Å; L561-H565 PolarHBondContact O-N 3.41Å
562S46.6Very low35.6Very low56 Ų56114.9 Ų114.939%0.39260%0.6SS.*Hα-helixtrans-73.9-40.917429.60000112.5S559 L560 L564 H565 E566S559-S562 VanDerWaalsContact CA-OG 3.26Å; S559-S562 WeakPolarHBondContact CA-OG 3.24Å; S559-S562 WeakPolarHBondContact CB-OG 3.34Å; S559-S562 PolarHBondContact O-N 3.16Å; S559-S562 PolarHBondContact O-OG 2.98Å; S559-S562 PolarHBondContact OG-OG 3.42Å; L560-S562 VanDerWaalsContact C-N 3.3Å; L560-S562 PolarHBondContact O-N 3.32Å; S562-L564 VanDerWaalsContact C-N 3.34Å; S562-L564 PolarHBondContact O-N 3.15Å; S562-H565 WeakPolarHBondContact O-CA 3.16Å; S562-H565 WeakPolarHBondContact O-CB 3.46Å; S562-H565 PolarHBondContact O-N 3.14Å; S562-E566 PolarHBondContact O-N 3.36Å; S562-E566 VanDerWaalsContact O-N 3.08Å
563I41.9Very low36Very low74 Ų74114.6 Ų114.638%0.37960%0.6SS.*Hα-helixtrans-64.2-40.1177.9-63.7166.1000111.3S559 L560 H565 E566S559-I563 WeakPolarHBondContact O-CG1 3.39Å; S559-I563 PolarHBondContact O-N 3.14Å; L560-I563 HydrophobicContact CD1-CD1 4.47Å; L560-I563 PolarHBondContact O-N 2.88Å; I563-H565 VanDerWaalsContact C-N 3.28Å; I563-H565 PolarHBondContact O-N 3.13Å; I563-E566 PolarHBondContact O-N 3.31Å
564L42.3Very low36.4Very low11.5 Ų11.5113.8 Ų113.86%0.0660%0.602CS.*Hα-helixtrans-71.3-17.5173.3-72.7172.1000113R472 L560 S562 T567 L581R472-L564 HydrophobicContact CG-CD1 4.19Å; R472-L564 PolarHBondContact NH2-O 3.41Å; L560-L564 HydrophobicContact CD2-CD1 3.79Å; L560-L564 HydrophobicContact CD2-CG 4.04Å; L560-L564 WeakPolarHBondContact O-CB 3.35Å; L560-L564 PolarHBondContact O-N 3.06Å; S562-L564 VanDerWaalsContact C-N 3.34Å; S562-L564 PolarHBondContact O-N 3.15Å; L564-T567 PolarHBondContact O-OG1 3.2Å; L564-L581 HydrophobicContact CD2-CD2 3.99Å
565H43.2Very low37Very low130.5 Ų130.5114.2 Ų114.260%0.60461%0.611SS**Hα-helixtrans-83.2-32.8174-102.7-88.5000112.6L561 S562 I563 T567L561-H565 WeakPolarHBondContact O-CB 3.17Å; L561-H565 PolarHBondContact O-CD2 3.13Å; L561-H565 VanDerWaalsContact O-CD2 3.29Å; L561-H565 PolarHBondContact O-N 3.41Å; S562-H565 WeakPolarHBondContact O-CA 3.16Å; S562-H565 WeakPolarHBondContact O-CB 3.46Å; S562-H565 PolarHBondContact O-N 3.14Å; I563-H565 VanDerWaalsContact C-N 3.28Å; I563-H565 PolarHBondContact O-N 3.13Å; H565-T567 PolarHBondContact O-N 3.15Å
566E36.9Very low37.5Very low157.5 Ų157.5114.6 Ų114.674%0.73662%0.615SS**Hα-helixtrans-80.8-20-173.7-76.8-167.4172.300115.2S562 I563 Q568 S569S562-E566 PolarHBondContact O-N 3.36Å; S562-E566 VanDerWaalsContact O-N 3.08Å; I563-E566 PolarHBondContact O-N 3.31Å; E566-Q568 PolarHBondContact O-N 3.11Å; E566-Q568 VanDerWaalsContact O-N 3.15Å; E566-S569 PolarHBondContact O-N 3.12Å; E566-S569 PolarHBondContact O-OG 2.86Å
567T36.3Very low38Very low90 Ų90117.1 Ų117.155%0.55262%0.618SS**G310 helixtrans-75.813.6178.751.80000114.3L564 H565L564-T567 PolarHBondContact O-OG1 3.2Å; H565-T567 PolarHBondContact O-N 3.15Å
568Q39Very low38.3Very low147.5 Ų147.5117.7 Ų117.769%0.68962%0.621SS**G310 helixtrans-93.10.1173.8-73.1-167.3-1100114.6E566 N570E566-Q568 PolarHBondContact O-N 3.11Å; E566-Q568 VanDerWaalsContact O-N 3.15Å; Q568-N570 VanDerWaalsContact C-N 3.31Å; Q568-N570 PolarHBondContact O-N 3.39Å
569S34.4Very low39.2Very low90.5 Ų90.5114.2 Ų114.263%0.63361%0.606SS**G310 helixtrans-84.352.7175.963.20000113E566E566-S569 PolarHBondContact O-N 3.12Å; E566-S569 PolarHBondContact O-OG 2.86Å
570N34.2Very low40.1Very low137 Ų137117.1 Ų117.173%0.73361%0.61SS**SBendtrans160.9107.4172-58.6-32.9000114Q568Q568-N570 VanDerWaalsContact C-N 3.31Å; Q568-N570 PolarHBondContact O-N 3.39Å
571T35.2Very low41Very low138.5 Ų138.5117 Ų11785%0.8561%0.61SS**  trans132.8103.7140.9480000113D573T571-D573 PolarHBondContact O-N 3.44Å
572M30.3Very low42.3Very low184.5 Ų184.5117.5 Ų117.591%0.90961%0.613SS**  trans-71.796.4165.9-73.7-84.6-167.800108.7
573D34.9Very low43.1Very low148.5 Ų148.5122.3 Ų122.379%0.79463%0.629SS**  trans-140.4113.4157.8-91.8-32.7000110.8T571 Q575T571-D573 PolarHBondContact O-N 3.44Å; D573-Q575 VanDerWaalsContact C-N 3.27Å; D573-Q575 PolarHBondContact O-N 3.1Å
574T35.2Very low44.2Very low132 Ų132126.3 Ų126.381%0.8164%0.643SS**THydrogen-bonded Turntrans-7366.9-174.436.20000113.4
575Q38.9Very low45.5Very low181 Ų181127.6 Ų127.685%0.84665%0.651SS**THydrogen-bonded Turntrans-154.380.1166.4-83.8172.828.900113.6D573 Q577D573-Q575 VanDerWaalsContact C-N 3.27Å; D573-Q575 PolarHBondContact O-N 3.1Å; Q575-Q577 PolarHBondContact O-N 2.58Å
576Q38Very low46.9Very low177 Ų177122.9 Ų122.983%0.82763%0.629SS**  trans-89.769.3-174.1-63.8175.1-3.900113.2N578 V579Q576-N578 PolarHBondContact O-N 2.85Å; Q576-V579 HydrophobicContact CB-CG2 3.7Å
577Q39.4Very low48.5Very low164.5 Ų164.5118.1 Ų118.177%0.76961%0.608SS**SBendtrans-80.959.7176.2-121.7162.3-600111.7Q575 V579Q575-Q577 PolarHBondContact O-N 2.58Å; Q577-V579 VanDerWaalsContact C-N 3.33Å; Q577-V579 PolarHBondContact O-N 3.46Å
578N41.8Very low50.2Low109.5 Ų109.5115.8 Ų115.859%0.58659%0.592SS**  trans-8979.1172.4-68.4-30.9000109.6Q576 Y580Q576-N578 PolarHBondContact O-N 2.85Å; N578-Y580 HydrophobicContact CB-CE2 4.17Å; N578-Y580 WeakPolarHBondContact O-CD2 3.46Å; N578-Y580 WeakPolarHBondContact O-CE2 3.06Å; N578-Y580 PolarHBondContact O-N 3.13Å
579V52.1Low51.9Low81 Ų81108.7 Ų108.749%0.49156%0.559SS.*PPolyproline II helixtrans-74.1113173-176.80000107.5E468 Q576 Q577E468-V579 PolarHBondContact N-O 2.95Å; Q576-V579 HydrophobicContact CB-CG2 3.7Å; Q577-V579 VanDerWaalsContact C-N 3.33Å; Q577-V579 PolarHBondContact O-N 3.46Å
580Y59.9Low54.2Low115.5 Ų115.5104.7 Ų104.745%0.45353%0.53SS..PPolyproline II helixtrans-86.5150.8171.6-65.1-79.9000109.2K465 T467 N578K465-Y580 HydrophobicContact CB-CD1 4.37Å; K465-Y580 HydrophobicContact CB-CE1 4.02Å; K465-Y580 HydrophobicContact CD-CD1 4.22Å; K465-Y580 HydrophobicContact CD-CE1 4.24Å; T467-Y580 HydrophobicContact CG2-CE1 4.16Å; N578-Y580 HydrophobicContact CB-CE2 4.17Å; N578-Y580 WeakPolarHBondContact O-CD2 3.46Å; N578-Y580 WeakPolarHBondContact O-CE2 3.06Å; N578-Y580 PolarHBondContact O-N 3.13Å
581L60.7Low56.1Low24 Ų2498.9 Ų98.913%0.12650%0.498CS..PPolyproline II helixtrans-65.2144.1173.8-69.6126.7000109.7E468 M471 L564 N585 E586 A589E468-L581 HydrophobicContact CB-CD1 4.05Å; E468-L581 HydrophobicContact CB-CD2 4.38Å; E468-L581 HydrophobicContact CB-CG 4.43Å; E468-L581 HydrophobicContact CG-CD1 4.21Å; E468-L581 HydrophobicContact CG-CD2 4.02Å; M471-L581 HydrophobicContact CB-CD1 4.39Å; M471-L581 HydrophobicContact CG-CD1 4.15Å; M471-L581 HydrophobicContact SD-CD1 3.93Å; M471-L581 HydrophobicContact SD-CD2 3.99Å; L564-L581 HydrophobicContact CD2-CD2 3.99Å; L581-N585 HydrophobicContact CB-CB 4.24Å; L581-N585 HydrophobicContact CD2-CB 4.05Å; L581-E586 HydrophobicContact CB-CB 4.15Å; L581-A589 HydrophobicContact CD1-CB 4.02Å; L581-A589 HydrophobicContact CD2-CB 4.31Å
582D66.5Low58.1Low117.5 Ų117.593.9 Ų93.963%0.62847%0.467SS*.PPolyproline II helixtrans-58.9149.9164.9-120.6-4.2000110.2K584 N585 E586D582-K584 VanDerWaalsContact C-N 3.25Å; D582-K584 PolarHBondContact O-N 3.06Å; D582-K584 VanDerWaalsContact O-N 3.1Å; D582-N585 PolarHBondContact O-N 3.08Å; D582-E586 PolarHBondContact O-N 3.13Å
583E63.5Low60.6Low157 Ų15785.1 Ų85.173%0.73442%0.424SS*.Hα-helixtrans-51.3-40.9-172-69.5-175.3162.900112.8N585 E586 I587E583-N585 PolarHBondContact O-N 3.27Å; E583-E586 PolarHBondContact O-N 3Å; E583-I587 WeakPolarHBondContact O-CD1 3.32Å; E583-I587 VanDerWaalsContact O-CG1 3.29Å; E583-I587 WeakPolarHBondContact O-CG1 3.29Å; E583-I587 PolarHBondContact O-N 3.26Å
584K65.5Low62.9Low157 Ų15778 Ų7868%0.68339%0.386SS*.Hα-helixtrans-64.3-41.9178.4-174.8-180177.8-177.40112.7D582 L588D582-K584 VanDerWaalsContact C-N 3.25Å; D582-K584 PolarHBondContact O-N 3.06Å; D582-K584 VanDerWaalsContact O-N 3.1Å; K584-L588 HydrophobicContact CG-CD1 4.47Å; K584-L588 WeakPolarHBondContact O-CG 3.16Å; K584-L588 PolarHBondContact O-N 2.89Å
585N69.2Low65.1Low39.5 Ų39.573.5 Ų73.521%0.21136%0.357CS..Hα-helixtrans-74.4-33.3179.7-68.9-24000111L581 D582 E583 L588 A589L581-N585 HydrophobicContact CB-CB 4.24Å; L581-N585 HydrophobicContact CD2-CB 4.05Å; D582-N585 PolarHBondContact O-N 3.08Å; E583-N585 PolarHBondContact O-N 3.27Å; N585-L588 PolarHBondContact O-N 2.98Å; N585-A589 VanDerWaalsContact O-CB 3.27Å; N585-A589 WeakPolarHBondContact O-CB 3.34Å; N585-A589 PolarHBondContact O-N 3.27Å
586E73.3Confident67.1Low30.5 Ų30.566 Ų6614%0.14332%0.323CS..Hα-helixtrans-61.8-46.1173.3-174.3169.1-164.900111.1K465 L581 D582 E583 L588 A589 W590K465-E586 IonicContact NZ-OE1 2.86Å; K465-E586 IonicContact NZ-OE2 2.75Å; K465-E586 PolarHBondContact NZ-OE2 3.35Å; K465-E586 VanDerWaalsContact NZ-OE2 3.1Å; L581-E586 HydrophobicContact CB-CB 4.15Å; D582-E586 PolarHBondContact O-N 3.13Å; E583-E586 PolarHBondContact O-N 3Å; E586-L588 PolarHBondContact O-N 3.34Å; E586-A589 PolarHBondContact O-N 3.1Å; E586-W590 VanDerWaalsContact O-CD1 3.25Å; E586-W590 PolarHBondContact O-N 3.09Å
587I70.7Confident69.5Low58 Ų5857.6 Ų57.630%0.29728%0.283SS..Hα-helixtrans-58.8-49.7176-68.3163.5000111.2L534 P535 E583 A589 W590 Q591L534-I587 HydrophobicContact CD2-CB 4.41Å; L534-I587 HydrophobicContact CD2-CG2 3.91Å; P535-I587 HydrophobicContact CG-CD1 4.39Å; P535-I587 HydrophobicContact CG-CG2 4.21Å; E583-I587 WeakPolarHBondContact O-CD1 3.32Å; E583-I587 VanDerWaalsContact O-CG1 3.29Å; E583-I587 WeakPolarHBondContact O-CG1 3.29Å; E583-I587 PolarHBondContact O-N 3.26Å; I587-A589 VanDerWaalsContact C-N 3.32Å; I587-A589 PolarHBondContact O-N 3.42Å; I587-W590 PolarHBondContact O-N 3.08Å; I587-Q591 WeakPolarHBondContact O-CG 3.12Å; I587-Q591 PolarHBondContact O-N 3.18Å
588L70.7Confident71.7Confident40.5 Ų40.549.7 Ų49.721%0.21225%0.247CC..Hα-helixtrans-62.4-39.1179.6-76.4167.1000112.4W554 L560 K584 N585 E586 Q591 T592W554-L588 HydrophobicContact CH2-CD2 3.38Å; W554-L588 HydrophobicContact CZ2-CD2 3.95Å; W554-L588 HydrophobicContact CZ3-CD2 4.25Å; L560-L588 HydrophobicContact CD1-CB 3.77Å; L560-L588 WeakPolarHBondContact CD1-O 3.16Å; K584-L588 HydrophobicContact CG-CD1 4.47Å; K584-L588 WeakPolarHBondContact O-CG 3.16Å; K584-L588 PolarHBondContact O-N 2.89Å; N585-L588 PolarHBondContact O-N 2.98Å; E586-L588 PolarHBondContact O-N 3.34Å; L588-Q591 PolarHBondContact O-N 3.16Å; L588-T592 PolarHBondContact O-N 3.28Å; L588-T592 PolarHBondContact O-OG1 2.92Å
589A76.4Confident73.6Confident0 Ų048.1 Ų48.10%023%0.232CC..Hα-helixtrans-66-44.717800000111.3M471 L560 L581 N585 E586 I587 Q591 T592 V593M471-A589 HydrophobicContact CE-CB 3.5Å; M471-A589 VanDerWaalsContact CE-CB 3.42Å; M471-A589 WeakPolarHBondContact CE-O 3.5Å; M471-A589 HydrophobicContact CG-CB 3.97Å; M471-A589 HydrophobicContact SD-CB 3.88Å; M471-A589 WeakPolarHBondContact SD-CB 3.48Å; L560-A589 HydrophobicContact CD2-CB 4.03Å; L581-A589 HydrophobicContact CD1-CB 4.02Å; L581-A589 HydrophobicContact CD2-CB 4.31Å; N585-A589 VanDerWaalsContact O-CB 3.27Å; N585-A589 WeakPolarHBondContact O-CB 3.34Å; N585-A589 PolarHBondContact O-N 3.27Å; E586-A589 PolarHBondContact O-N 3.1Å; I587-A589 VanDerWaalsContact C-N 3.32Å; I587-A589 PolarHBondContact O-N 3.42Å; A589-Q591 PolarHBondContact O-N 3.42Å; A589-T592 WeakPolarHBondContact O-CB 3.34Å; A589-T592 PolarHBondContact O-N 3Å; A589-V593 WeakPolarHBondContact O-CG2 3.36Å; A589-V593 PolarHBondContact O-N 3.4Å
590W80.9Confident75.3Confident6.5 Ų6.544.3 Ų44.33%0.02521%0.209CC..Hα-helixtrans-67.3-34.1176.3-80.7113.8000113.4L460 L466 M471 I525 M530 I531 L534 E586 I587 T592 V593 G594L460-W590 HydrophobicContact CD1-CH2 3.67Å; L460-W590 VanDerWaalsContact CD1-CH2 3.45Å; L460-W590 HydrophobicContact CD1-CZ2 3.9Å; L460-W590 HydrophobicContact CD2-CH2 4.04Å; L466-W590 HydrophobicContact CD1-CH2 3.79Å; L466-W590 HydrophobicContact CD1-CZ2 3.76Å; L466-W590 HydrophobicContact CG-CZ2 4.35Å; M471-W590 HydrophobicContact CE-CB 4.42Å; M471-W590 HydrophobicContact CE-CD2 3.85Å; M471-W590 HydrophobicContact CE-CE3 4.15Å; M471-W590 HydrophobicContact CE-CG 3.89Å; M471-W590 HydrophobicContact CE-CZ2 4.25Å; I525-W590 HydrophobicContact CG2-CZ3 4.38Å; M530-W590 HydrophobicContact CB-CD2 4.04Å; M530-W590 HydrophobicContact CB-CE3 4.45Å; M530-W590 HydrophobicContact CB-CG 4.35Å; M530-W590 HydrophobicContact CB-CH2 4.39Å; M530-W590 HydrophobicContact CB-CZ2 3.93Å; M530-W590 HydrophobicContact CG-CZ2 4.04Å; I531-W590 HydrophobicContact CD1-CE3 4.05Å; I531-W590 HydrophobicContact CD1-CZ3 4.25Å; I531-W590 HydrophobicContact CG1-CE3 3.77Å; I531-W590 HydrophobicContact CG1-CZ3 4.25Å; L534-W590 HydrophobicContact CD1-CB 4.32Å; L534-W590 HydrophobicContact CD2-CB 4.06Å; L534-W590 HydrophobicContact CG-CB 4.49Å; E586-W590 VanDerWaalsContact O-CD1 3.25Å; E586-W590 PolarHBondContact O-N 3.09Å; I587-W590 PolarHBondContact O-N 3.08Å; W590-T592 VanDerWaalsContact C-N 3.33Å; W590-V593 HydrophobicContact CE3-CB 4.25Å; W590-V593 HydrophobicContact CE3-CG1 4.04Å; W590-V593 HydrophobicContact CZ3-CG1 4.06Å; W590-V593 PolarHBondContact O-N 3.2Å; W590-G594 PolarHBondContact O-N 3.01Å
591Q75Confident76.6Confident14.5 Ų14.538.8 Ų38.87%0.06819%0.188CC..Hα-helixtrans-62.6-42170.3-75.4179.3-24.700111.7L534 I587 L588 A589 G594 N595 L628L534-Q591 HydrophobicContact CD1-CG 4.32Å; L534-Q591 HydrophobicContact CD2-CG 4.12Å; I587-Q591 WeakPolarHBondContact O-CG 3.12Å; I587-Q591 PolarHBondContact O-N 3.18Å; L588-Q591 PolarHBondContact O-N 3.16Å; A589-Q591 PolarHBondContact O-N 3.42Å; Q591-G594 PolarHBondContact O-N 3Å; Q591-N595 WeakPolarHBondContact O-CB 3.38Å; Q591-N595 VanDerWaalsContact O-CG 3.29Å; Q591-N595 PolarHBondContact O-N 2.97Å; Q591-N595 PolarHBondContact O-ND2 3.19Å; Q591-L628 PolarHBondContact NE2-O 2.79Å
592T77.5Confident77.6Confident33 Ų3338.6 Ų38.620%0.20219%0.187CC..Hα-helixtrans-63.5-46.3176-55.90000111.1I475 L560 L588 A589 W590 G594 N595 L596I475-T592 HydrophobicContact CG2-CG2 4.49Å; L560-T592 WeakPolarHBondContact CD1-OG1 3.39Å; L588-T592 PolarHBondContact O-N 3.28Å; L588-T592 PolarHBondContact O-OG1 2.92Å; A589-T592 WeakPolarHBondContact O-CB 3.34Å; A589-T592 PolarHBondContact O-N 3Å; W590-T592 VanDerWaalsContact C-N 3.33Å; T592-G594 VanDerWaalsContact C-N 3.34Å; T592-G594 PolarHBondContact O-N 3.11Å; T592-N595 PolarHBondContact O-N 2.97Å; T592-L596 HydrophobicContact CG2-CD1 4.3Å; T592-L596 WeakPolarHBondContact O-CG 3.48Å; T592-L596 PolarHBondContact O-N 3.32Å
593V83.2Confident78.4Confident0 Ų033.8 Ų33.80%016%0.161CC..Hα-helixtrans-57-48.8174.1166.60000110.6M471 L474 I475 L478 I525 A589 W590 N595 L596 C597M471-V593 HydrophobicContact CE-CB 4.29Å; M471-V593 HydrophobicContact CE-CG2 3.44Å; M471-V593 VanDerWaalsContact CE-CG2 3.44Å; M471-V593 HydrophobicContact SD-CG2 4.26Å; L474-V593 HydrophobicContact CD2-CG1 3.98Å; L474-V593 HydrophobicContact CD2-CG2 3.95Å; L474-V593 HydrophobicContact CG-CG2 4.24Å; I475-V593 HydrophobicContact CD1-CG2 4.47Å; I475-V593 HydrophobicContact CG1-CG2 3.73Å; L478-V593 HydrophobicContact CD1-CB 4.35Å; L478-V593 HydrophobicContact CD1-CG1 3.82Å; L478-V593 HydrophobicContact CD1-CG2 4.39Å; I525-V593 HydrophobicContact CG2-CG1 4.04Å; A589-V593 WeakPolarHBondContact O-CG2 3.36Å; A589-V593 PolarHBondContact O-N 3.4Å; W590-V593 HydrophobicContact CE3-CB 4.25Å; W590-V593 HydrophobicContact CE3-CG1 4.04Å; W590-V593 HydrophobicContact CZ3-CG1 4.06Å; W590-V593 PolarHBondContact O-N 3.2Å; V593-N595 VanDerWaalsContact C-N 3.35Å; V593-N595 PolarHBondContact O-N 2.84Å; V593-L596 PolarHBondContact O-N 2.92Å; V593-C597 WeakPolarHBondContact O-CB 3.46Å; V593-C597 PolarHBondContact O-N 3.16Å; V593-C597 PolarHBondContact O-SG 3.11Å
594G82.6Confident79.5Confident0 Ų026.3 Ų26.30%013%0.127CC..Hα-helixtrans-56.5-47.7175.700000112.2W590 Q591 T592 L596 C597 Y598 I630W590-G594 PolarHBondContact O-N 3.01Å; Q591-G594 PolarHBondContact O-N 3Å; T592-G594 VanDerWaalsContact C-N 3.34Å; T592-G594 PolarHBondContact O-N 3.11Å; G594-L596 VanDerWaalsContact C-N 3.33Å; G594-L596 PolarHBondContact O-N 2.8Å; G594-C597 WeakPolarHBondContact O-CB 3.33Å; G594-C597 PolarHBondContact O-N 3.08Å; G594-Y598 WeakPolarHBondContact O-CD2 3.36Å; G594-Y598 PolarHBondContact O-N 3.47Å; G594-I630 VanDerWaalsContact O-CG2 3.31Å; G594-I630 WeakPolarHBondContact O-CG2 3.42Å
595N81.2Confident80.4Confident36.5 Ų36.518.8 Ų18.820%0.1959%0.094CC..Hα-helixtrans-61.3-42.5-180-78.2-29.7000112.3Q591 T592 V593 R599 G629 I630 R631Q591-N595 WeakPolarHBondContact O-CB 3.38Å; Q591-N595 VanDerWaalsContact O-CG 3.29Å; Q591-N595 PolarHBondContact O-N 2.97Å; Q591-N595 PolarHBondContact O-ND2 3.19Å; T592-N595 PolarHBondContact O-N 2.97Å; V593-N595 VanDerWaalsContact C-N 3.35Å; V593-N595 PolarHBondContact O-N 2.84Å; N595-R599 VanDerWaalsContact O-CB 3.24Å; N595-R599 WeakPolarHBondContact O-CB 3.37Å; N595-R599 PolarHBondContact O-N 3.04Å; N595-G629 PolarHBondContact ND2-O 2.91Å; N595-G629 PolarHBondContact OD1-O 3.23Å; N595-I630 VanDerWaalsContact OD1-CA 3.27Å; N595-I630 WeakPolarHBondContact OD1-CA 3.4Å; N595-R631 WeakPolarHBondContact OD1-CG 3.29Å; N595-R631 PolarHBondContact OD1-N 2.9Å
596L81.2Confident81Confident24 Ų2422.5 Ų22.513%0.12611%0.11CC..Hα-helixtrans-66.2-44.4174.9-67.5173.4000111.4I475 L478 V482 T592 V593 G594 Y598 R599 I600I475-L596 HydrophobicContact CG2-CD1 4.07Å; L478-L596 HydrophobicContact CB-CB 3.84Å; L478-L596 HydrophobicContact CB-CD1 3.9Å; L478-L596 HydrophobicContact CB-CG 4.49Å; L478-L596 HydrophobicContact CD1-CB 4.31Å; V482-L596 HydrophobicContact CG2-CD2 4.22Å; T592-L596 HydrophobicContact CG2-CD1 4.3Å; T592-L596 WeakPolarHBondContact O-CG 3.48Å; T592-L596 PolarHBondContact O-N 3.32Å; V593-L596 PolarHBondContact O-N 2.92Å; G594-L596 VanDerWaalsContact C-N 3.33Å; G594-L596 PolarHBondContact O-N 2.8Å; L596-Y598 PolarHBondContact O-N 3.3Å; L596-R599 WeakPolarHBondContact O-CB 3.45Å; L596-R599 PolarHBondContact O-N 3.3Å; L596-I600 VanDerWaalsContact O-CG1 3.27Å; L596-I600 WeakPolarHBondContact O-CG1 3.3Å; L596-I600 PolarHBondContact O-N 3.32Å
597C88.9Confident81.1Confident0 Ų023.8 Ų23.80%013%0.131CC..Hα-helixtrans-55.3-52.3176-74.80000111.4I522 L526 V593 G594 R599 I600 L601I522-C597 HydrophobicContact CG2-CB 3.76Å; L526-C597 HydrophobicContact CD1-CB 4.32Å; L526-C597 HydrophobicContact CD2-CB 3.79Å; L526-C597 HydrophobicContact CG-CB 4.06Å; V593-C597 WeakPolarHBondContact O-CB 3.46Å; V593-C597 PolarHBondContact O-N 3.16Å; V593-C597 PolarHBondContact O-SG 3.11Å; G594-C597 WeakPolarHBondContact O-CB 3.33Å; G594-C597 PolarHBondContact O-N 3.08Å; C597-R599 VanDerWaalsContact C-N 3.33Å; C597-R599 PolarHBondContact O-N 3.2Å; C597-I600 WeakPolarHBondContact O-CB 3.29Å; C597-I600 PolarHBondContact O-N 3.22Å; C597-L601 WeakPolarHBondContact O-CG 3.42Å; C597-L601 PolarHBondContact O-N 3.1Å
598Y84.4Confident81.8Confident0 Ų022 Ų220%012%0.121CC..Hα-helixtrans-67.6-32.4178.3-83.3-74.2000113.2L526 G594 L596 I600 L601 T602 M622 H625 I630 A632 T635L526-Y598 HydrophobicContact CD1-CD2 4.44Å; L526-Y598 HydrophobicContact CD1-CE1 4.42Å; L526-Y598 HydrophobicContact CD1-CE2 4.11Å; L526-Y598 HydrophobicContact CD2-CD2 3.99Å; L526-Y598 HydrophobicContact CD2-CE2 3.66Å; L526-Y598 HydrophobicContact CG-CE2 4.49Å; G594-Y598 WeakPolarHBondContact O-CD2 3.36Å; G594-Y598 PolarHBondContact O-N 3.47Å; L596-Y598 PolarHBondContact O-N 3.3Å; Y598-I600 VanDerWaalsContact C-N 3.34Å; Y598-I600 PolarHBondContact O-N 3.12Å; Y598-L601 HydrophobicContact CD1-CD1 4.09Å; Y598-L601 HydrophobicContact CE1-CD1 4.31Å; Y598-L601 PolarHBondContact O-N 3.14Å; Y598-T602 WeakPolarHBondContact O-CB 3.46Å; Y598-T602 PolarHBondContact O-N 3.12Å; Y598-T602 PolarHBondContact O-OG1 3.19Å; Y598-M622 HydrophobicContact CE1-CB 4.2Å; Y598-M622 HydrophobicContact CE1-CG 3.8Å; Y598-M622 HydrophobicContact CE1-SD 4.04Å; Y598-M622 WeakPolarHBondContact OH-CA 3.36Å; Y598-H625 HydrophobicContact CE2-CB 4.31Å; Y598-H625 AromaticContact CE2-ND1 3.92Å; Y598-H625 AromaticContact CZ-ND1 3.86Å; Y598-H625 VanDerWaalsContact OH-CB 3.28Å; Y598-H625 WeakPolarHBondContact OH-CB 3.3Å; Y598-H625 PolarHBondContact OH-ND1 2.84Å; Y598-H625 VanDerWaalsContact OH-ND1 3.09Å; Y598-I630 HydrophobicContact CD2-CB 4.39Å; Y598-I630 HydrophobicContact CD2-CG2 3.17Å; Y598-I630 HydrophobicContact CE2-CB 4.29Å; Y598-I630 HydrophobicContact CE2-CG2 3.54Å; Y598-I630 HydrophobicContact CG-CG2 4.22Å; Y598-A632 HydrophobicContact CD1-CB 4.21Å; Y598-A632 HydrophobicContact CD2-CB 4.3Å; Y598-A632 VanDerWaalsContact CE1-CA 3.47Å; Y598-A632 HydrophobicContact CE1-CB 3.66Å; Y598-A632 HydrophobicContact CE2-CB 3.73Å; Y598-A632 HydrophobicContact CG-CB 4.46Å; Y598-T635 WeakPolarHBondContact CB-OG1 3.47Å; Y598-T635 HydrophobicContact CD1-CG2 4.06Å; Y598-T635 VanDerWaalsContact CD1-OG1 3.32Å; Y598-T635 WeakPolarHBondContact CD1-OG1 3.25Å; Y598-T635 PolarHBondContact O-OG1 3.02Å; Y598-T635 VanDerWaalsContact O-OG1 3.11Å
599R83.1Confident82.3Confident75.5 Ų75.523.7 Ų23.729%0.28513%0.125SC..Hα-helixtrans-61.3-44.4171.5-176.460.3175.8173.64.3111.4V482 N595 L596 C597 T602 L603V482-R599 HydrophobicContact CG1-CG 4.02Å; V482-R599 HydrophobicContact CG2-CB 4.3Å; V482-R599 HydrophobicContact CG2-CG 4.01Å; N595-R599 VanDerWaalsContact O-CB 3.24Å; N595-R599 WeakPolarHBondContact O-CB 3.37Å; N595-R599 PolarHBondContact O-N 3.04Å; L596-R599 WeakPolarHBondContact O-CB 3.45Å; L596-R599 PolarHBondContact O-N 3.3Å; C597-R599 VanDerWaalsContact C-N 3.33Å; C597-R599 PolarHBondContact O-N 3.2Å; R599-T602 PolarHBondContact O-N 3.38Å; R599-L603 HydrophobicContact CG-CD1 4.19Å; R599-L603 WeakPolarHBondContact O-CB 3.48Å; R599-L603 WeakPolarHBondContact O-CG 3.27Å; R599-L603 PolarHBondContact O-N 3.13Å
600I86.4Confident82.6Confident0 Ų029.5 Ų29.50%015%0.15CC..Hα-helixtrans-61.9-45.6174.6-63.3161.2000110L478 L481 V482 L485 L513 I522 L596 C597 Y598 T602 L603 S604L478-I600 HydrophobicContact CB-CD1 4.19Å; L478-I600 HydrophobicContact CD2-CD1 3.63Å; L481-I600 HydrophobicContact CB-CD1 3.74Å; L481-I600 HydrophobicContact CB-CG1 4.16Å; L481-I600 HydrophobicContact CD1-CD1 4.15Å; V482-I600 HydrophobicContact CG2-CD1 4.29Å; V482-I600 HydrophobicContact CG2-CG1 3.53Å; L485-I600 HydrophobicContact CD1-CG2 3.95Å; L513-I600 HydrophobicContact CD1-CG2 4.11Å; I522-I600 HydrophobicContact CD1-CB 4.09Å; I522-I600 HydrophobicContact CD1-CD1 4.06Å; I522-I600 HydrophobicContact CD1-CG2 3.51Å; I522-I600 VanDerWaalsContact CD1-CG2 3.48Å; L596-I600 VanDerWaalsContact O-CG1 3.27Å; L596-I600 WeakPolarHBondContact O-CG1 3.3Å; L596-I600 PolarHBondContact O-N 3.32Å; C597-I600 WeakPolarHBondContact O-CB 3.29Å; C597-I600 PolarHBondContact O-N 3.22Å; Y598-I600 VanDerWaalsContact C-N 3.34Å; Y598-I600 PolarHBondContact O-N 3.12Å; I600-T602 PolarHBondContact O-N 3.06Å; I600-L603 PolarHBondContact O-N 3.16Å; I600-S604 WeakPolarHBondContact O-CB 3.4Å; I600-S604 PolarHBondContact O-N 3.32Å; I600-S604 PolarHBondContact O-OG 3.12Å
601L87.5Confident82.9Confident0.666667 Ų0.66666729.2 Ų29.20%0.00315%0.148CC..Hα-helixtrans-59.5-47.2178.3-67.3-175.3000111.8I519 I522 L526 C597 Y598 L603 S604 Q605 L615 M622 T635I519-L601 HydrophobicContact CG2-CD2 4.02Å; I522-L601 HydrophobicContact CG2-CD1 4.49Å; I522-L601 HydrophobicContact CG2-CD2 4.03Å; I522-L601 HydrophobicContact CG2-CG 4.14Å; L526-L601 HydrophobicContact CD1-CD1 3.73Å; C597-L601 WeakPolarHBondContact O-CG 3.42Å; C597-L601 PolarHBondContact O-N 3.1Å; Y598-L601 HydrophobicContact CD1-CD1 4.09Å; Y598-L601 HydrophobicContact CE1-CD1 4.31Å; Y598-L601 PolarHBondContact O-N 3.14Å; L601-L603 PolarHBondContact O-N 3.18Å; L601-S604 WeakPolarHBondContact CA-OG 3.33Å; L601-S604 PolarHBondContact O-N 3.22Å; L601-S604 VanDerWaalsContact O-N 3.17Å; L601-S604 PolarHBondContact O-OG 2.93Å; L601-Q605 WeakPolarHBondContact O-CG 3.36Å; L601-Q605 PolarHBondContact O-N 3.3Å; L601-Q605 VanDerWaalsContact O-N 3.15Å; L601-L615 HydrophobicContact CD2-CD1 4.41Å; L601-L615 HydrophobicContact CD2-CD2 3.74Å; L601-M622 HydrophobicContact CD1-CE 3.97Å; L601-M622 HydrophobicContact CD1-SD 4.44Å; L601-T635 HydrophobicContact CB-CG2 3.75Å
602T82.8Confident83.4Confident19 Ų1929.3 Ų29.312%0.11715%0.149CC..Hα-helixtrans-58.2-46.2176.8-33.60000111.9Y598 R599 I600 Q605 H606 T635 A638Y598-T602 WeakPolarHBondContact O-CB 3.46Å; Y598-T602 PolarHBondContact O-N 3.12Å; Y598-T602 PolarHBondContact O-OG1 3.19Å; R599-T602 PolarHBondContact O-N 3.38Å; I600-T602 PolarHBondContact O-N 3.06Å; T602-Q605 WeakPolarHBondContact O-CG 3.31Å; T602-H606 PolarHBondContact O-N 3.27Å; T602-T635 VanDerWaalsContact CG2-CA 3.45Å; T602-T635 HydrophobicContact CG2-CG2 4.08Å; T602-T635 WeakPolarHBondContact OG1-CA 3.26Å; T602-T635 WeakPolarHBondContact OG1-CB 3.23Å; T602-T635 PolarHBondContact OG1-OG1 2.83Å; T602-A638 HydrophobicContact CG2-CB 3.96Å
603L83.6Confident83.6Confident17.3333 Ų17.333331.7 Ų31.79%0.09116%0.158CC..Hα-helixtrans-70.8-33.9178.5-69.2172.2000112V482 L485 N486 Q510 R599 I600 L601 Q605V482-L603 HydrophobicContact CG1-CD1 4.09Å; L485-L603 HydrophobicContact CB-CB 4.03Å; L485-L603 HydrophobicContact CB-CD1 4.15Å; L485-L603 HydrophobicContact CD1-CB 3.55Å; L485-L603 HydrophobicContact CG-CB 4.42Å; N486-L603 VanDerWaalsContact OD1-CD1 3.26Å; N486-L603 WeakPolarHBondContact OD1-CD1 3.42Å; Q510-L603 PolarHBondContact NE2-O 3.14Å; R599-L603 HydrophobicContact CG-CD1 4.19Å; R599-L603 WeakPolarHBondContact O-CB 3.48Å; R599-L603 WeakPolarHBondContact O-CG 3.27Å; R599-L603 PolarHBondContact O-N 3.13Å; I600-L603 PolarHBondContact O-N 3.16Å; L601-L603 PolarHBondContact O-N 3.18Å; L603-Q605 VanDerWaalsContact C-N 3.27Å; L603-Q605 PolarHBondContact O-N 3.1Å
604S86.3Confident83.6Confident0 Ų034.4 Ų34.40%017%0.169CC..Hα-helixtrans-68.7-26.2-178.677.20000113.2Q510 I600 L601 N611Q510-S604 WeakPolarHBondContact CG-O 3.26Å; I600-S604 WeakPolarHBondContact O-CB 3.4Å; I600-S604 PolarHBondContact O-N 3.32Å; I600-S604 PolarHBondContact O-OG 3.12Å; L601-S604 WeakPolarHBondContact CA-OG 3.33Å; L601-S604 PolarHBondContact O-N 3.22Å; L601-S604 VanDerWaalsContact O-N 3.17Å; L601-S604 PolarHBondContact O-OG 2.93Å; S604-N611 PolarHBondContact O-ND2 2.95Å
605Q84.5Confident83.7Confident0 Ų034.4 Ų34.40%017%0.169CC..Hα-helixtrans-101.8-12.8-176.375.1-175-1.100113.8L601 T602 L603 G607 Y608 Q612 L615 T635 L639L601-Q605 WeakPolarHBondContact O-CG 3.36Å; L601-Q605 PolarHBondContact O-N 3.3Å; L601-Q605 VanDerWaalsContact O-N 3.15Å; T602-Q605 WeakPolarHBondContact O-CG 3.31Å; L603-Q605 VanDerWaalsContact C-N 3.27Å; L603-Q605 PolarHBondContact O-N 3.1Å; Q605-G607 PolarHBondContact O-N 3.09Å; Q605-Y608 PolarHBondContact O-N 3.08Å; Q605-Q612 HydrophobicContact CB-CG 3.99Å; Q605-Q612 WeakPolarHBondContact O-CG 3.37Å; Q605-Q612 PolarHBondContact O-NE2 3.49Å; Q605-L615 HydrophobicContact CB-CD1 3.72Å; Q605-L615 HydrophobicContact CG-CD1 4.4Å; Q605-L615 VanDerWaalsContact OE1-CD1 3.28Å; Q605-T635 PolarHBondContact NE2-O 3.11Å; Q605-L639 VanDerWaalsContact NE2-N 3.19Å; Q605-L639 VanDerWaalsContact OE1-CB 3.29Å
606H81.4Confident83.6Confident117 Ų11732.8 Ų32.854%0.54216%0.16SC..THydrogen-bonded Turntrans-57.3113.2-173.4-169.239.3000111.1Q510 T602 Y608Q510-H606 PolarHBondContact NE2-O 3.47Å; T602-H606 PolarHBondContact O-N 3.27Å; H606-Y608 PolarHBondContact O-N 3.25Å; H606-Y608 VanDerWaalsContact O-N 3.14Å
607G76Confident83.6Confident58 Ų5836.2 Ų36.260%0.59818%0.175SC*.THydrogen-bonded Turntrans669.5-178.800000115.6Q605Q605-G607 PolarHBondContact O-N 3.09Å
608Y83.6Confident83.4Confident19.6667 Ų19.666739.4 Ų39.48%0.07719%0.188CC..  trans-119.894-174.8-171.2-144.8000113.7R507 Q510 K511 R514 Q605 H606 K610 N611 Q612R507-Y608 HydrophobicContact CG-CD2 4.38Å; R507-Y608 HydrophobicContact CG-CE2 4.43Å; Q510-Y608 HydrophobicContact CB-CD1 3.97Å; Q510-Y608 HydrophobicContact CB-CE1 4.43Å; K511-Y608 HydrophobicContact CB-CE1 4.1Å; R514-Y608 VanDerWaalsContact NH1-CZ 3.28Å; R514-Y608 PolarHBondContact NH1-OH 3.23Å; R514-Y608 PolarHBondContact NH2-OH 3.39Å; Q605-Y608 PolarHBondContact O-N 3.08Å; H606-Y608 PolarHBondContact O-N 3.25Å; H606-Y608 VanDerWaalsContact O-N 3.14Å; Y608-K610 VanDerWaalsContact C-N 3.35Å; Y608-K610 HydrophobicContact CE1-CB 4.49Å; Y608-K610 HydrophobicContact CE2-CB 4.16Å; Y608-K610 HydrophobicContact CE2-CD 4.39Å; Y608-K610 HydrophobicContact CE2-CG 4.39Å; Y608-K610 PolarHBondContact O-N 2.99Å; Y608-N611 HydrophobicContact CD1-CB 3.78Å; Y608-N611 WeakPolarHBondContact CD1-ND2 3.41Å; Y608-N611 HydrophobicContact CE1-CB 4.38Å; Y608-N611 VanDerWaalsContact CE1-CG 3.5Å; Y608-N611 VanDerWaalsContact CE1-OD1 3.28Å; Y608-N611 WeakPolarHBondContact CE1-OD1 3.36Å; Y608-N611 HydrophobicContact CG-CB 4.44Å; Y608-N611 PolarHBondContact O-N 3.15Å; Y608-Q612 PolarHBondContact O-N 3.3Å; Y608-Q612 VanDerWaalsContact O-N 3.15Å
609R82.9Confident83.1Confident76 Ų7639.7 Ų39.729%0.28719%0.19SC..Hα-helixtrans-48.4-46.8-173.4-171.563.8178.1-163.78.9115.3N611 Q612 E613 N643 Q645R609-N611 VanDerWaalsContact C-N 3.29Å; R609-N611 PolarHBondContact O-N 3.01Å; R609-Q612 WeakPolarHBondContact O-CB 3.25Å; R609-Q612 PolarHBondContact O-N 2.99Å; R609-Q612 VanDerWaalsContact O-N 3.16Å; R609-E613 WeakPolarHBondContact CG-OE1 3.17Å; R609-E613 IonicContact CZ-OE1 2.91Å; R609-E613 IonicContact NE-OE1 3.34Å; R609-E613 PolarHBondContact NE-OE1 3.05Å; R609-E613 IonicContact NH2-OE1 2.75Å; R609-E613 PolarHBondContact NH2-OE1 3.43Å; R609-E613 PolarHBondContact O-N 3.42Å; R609-N643 WeakPolarHBondContact CD-ND2 3.13Å; R609-N643 PolarHBondContact NE-ND2 3.28Å; R609-N643 PolarHBondContact NE-OD1 3.29Å; R609-N643 PolarHBondContact NH1-ND2 3.04Å; R609-N643 PolarHBondContact NH1-OD1 3.12Å; R609-N643 VanDerWaalsContact NH1-OD1 3.09Å; R609-N643 PolarHBondContact NH2-OD1 3.18Å; R609-Q645 VanDerWaalsContact NH2-CB 3.25Å; R609-Q645 VanDerWaalsContact NH2-OE1 3.14Å
610K82.3Confident82.9Confident121 Ų12140.3 Ų40.353%0.52620%0.198SC..Hα-helixtrans-63.4-34.8-177.8-66.8-172.5177.5-169.40112.6R514 Y608 Y614R514-K610 VanDerWaalsContact NH1-CB 3.3Å; Y608-K610 VanDerWaalsContact C-N 3.35Å; Y608-K610 HydrophobicContact CE1-CB 4.49Å; Y608-K610 HydrophobicContact CE2-CB 4.16Å; Y608-K610 HydrophobicContact CE2-CD 4.39Å; Y608-K610 HydrophobicContact CE2-CG 4.39Å; Y608-K610 PolarHBondContact O-N 2.99Å; K610-Y614 WeakPolarHBondContact O-CB 3.26Å; K610-Y614 PolarHBondContact O-N 3.06Å; K610-Y614 VanDerWaalsContact O-N 3.16Å
611N86.7Confident82.7Confident0 Ų041.5 Ų41.50%021%0.205CC..Hα-helixtrans-75.2-37.6175.5-77.710.6000111.1Q510 R514 S604 Y608 R609 E613 Y614 L615Q510-N611 PolarHBondContact O-ND2 3.36Å; R514-N611 WeakPolarHBondContact CB-OD1 3.49Å; R514-N611 VanDerWaalsContact CD-OD1 3.28Å; R514-N611 WeakPolarHBondContact CD-OD1 3.32Å; R514-N611 PolarHBondContact NH1-OD1 2.96Å; S604-N611 PolarHBondContact O-ND2 2.95Å; Y608-N611 HydrophobicContact CD1-CB 3.78Å; Y608-N611 WeakPolarHBondContact CD1-ND2 3.41Å; Y608-N611 HydrophobicContact CE1-CB 4.38Å; Y608-N611 VanDerWaalsContact CE1-CG 3.5Å; Y608-N611 VanDerWaalsContact CE1-OD1 3.28Å; Y608-N611 WeakPolarHBondContact CE1-OD1 3.36Å; Y608-N611 HydrophobicContact CG-CB 4.44Å; Y608-N611 PolarHBondContact O-N 3.15Å; R609-N611 VanDerWaalsContact C-N 3.29Å; R609-N611 PolarHBondContact O-N 3.01Å; N611-E613 PolarHBondContact O-N 2.88Å; N611-Y614 PolarHBondContact O-N 3.4Å; N611-L615 WeakPolarHBondContact O-CB 3.4Å; N611-L615 VanDerWaalsContact O-CG 3.28Å; N611-L615 WeakPolarHBondContact O-CG 3.4Å; N611-L615 PolarHBondContact O-N 3.16Å
612Q85.3Confident82.3Confident17.6667 Ų17.666741.6 Ų41.68%0.08321%0.205CC..Hα-helixtrans-59.5-46.2174.4-65.9172.4-26.900111.6Q605 Y608 R609 L615 A616 N643 L646Q605-Q612 HydrophobicContact CB-CG 3.99Å; Q605-Q612 WeakPolarHBondContact O-CG 3.37Å; Q605-Q612 PolarHBondContact O-NE2 3.49Å; Y608-Q612 PolarHBondContact O-N 3.3Å; Y608-Q612 VanDerWaalsContact O-N 3.15Å; R609-Q612 WeakPolarHBondContact O-CB 3.25Å; R609-Q612 PolarHBondContact O-N 2.99Å; R609-Q612 VanDerWaalsContact O-N 3.16Å; Q612-L615 PolarHBondContact O-N 3.24Å; Q612-A616 WeakPolarHBondContact O-CB 3.28Å; Q612-A616 PolarHBondContact O-N 3.15Å; Q612-N643 PolarHBondContact OE1-ND2 3.12Å; Q612-L646 HydrophobicContact CB-CD1 4.23Å
613E81.6Confident81.8Confident83.6667 Ų83.666742 Ų4239%0.39121%0.206SC..Hα-helixtrans-63.7-41.2176.7-73.3170-17100112.4R609 N611 L615 A616 L646R609-E613 WeakPolarHBondContact CG-OE1 3.17Å; R609-E613 IonicContact CZ-OE1 2.91Å; R609-E613 IonicContact NE-OE1 3.34Å; R609-E613 PolarHBondContact NE-OE1 3.05Å; R609-E613 IonicContact NH2-OE1 2.75Å; R609-E613 PolarHBondContact NH2-OE1 3.43Å; R609-E613 PolarHBondContact O-N 3.42Å; N611-E613 PolarHBondContact O-N 2.88Å; E613-L615 PolarHBondContact O-N 3.29Å; E613-A616 WeakPolarHBondContact O-CB 3.34Å; E613-A616 PolarHBondContact O-N 2.99Å; E613-L646 HydrophobicContact CG-CD2 4.3Å
614Y84.1Confident81.4Confident57 Ų5745.6 Ų45.622%0.22423%0.228CC..Hα-helixtrans-63.4-42174.9-176.8-96000112.1R514 I519 I523 K610 N611 A616 Q617 Y618R514-Y614 HydrophobicContact CG-CD1 4.35Å; R514-Y614 HydrophobicContact CG-CG 4.38Å; I519-Y614 HydrophobicContact CB-CE1 4.24Å; I519-Y614 HydrophobicContact CG2-CD1 4.01Å; I519-Y614 HydrophobicContact CG2-CE1 3.77Å; I523-Y614 HydrophobicContact CD1-CE1 4.42Å; K610-Y614 WeakPolarHBondContact O-CB 3.26Å; K610-Y614 PolarHBondContact O-N 3.06Å; K610-Y614 VanDerWaalsContact O-N 3.16Å; N611-Y614 PolarHBondContact O-N 3.4Å; Y614-A616 VanDerWaalsContact C-N 3.33Å; Y614-A616 PolarHBondContact O-N 2.73Å; Y614-Q617 VanDerWaalsContact CD2-NE2 3.34Å; Y614-Q617 VanDerWaalsContact CE2-NE2 3.27Å; Y614-Q617 WeakPolarHBondContact O-CG 3.42Å; Y614-Q617 PolarHBondContact O-NE2 3.23Å; Y614-Y618 HydrophobicContact CE1-CE2 4.23Å
615L84.4Confident80.8Confident0 Ų045.9 Ų45.90%023%0.23CC..Hα-helixtrans-72.8-29.2177.7-71.3175000112.9I519 I523 L601 Q605 N611 Q612 E613 Q617 Y618 M622 L639I519-L615 HydrophobicContact CG2-CD2 3.49Å; I519-L615 VanDerWaalsContact CG2-CD2 3.49Å; I519-L615 HydrophobicContact CG2-CG 4.48Å; I523-L615 HydrophobicContact CD1-CD2 4.29Å; L601-L615 HydrophobicContact CD2-CD1 4.41Å; L601-L615 HydrophobicContact CD2-CD2 3.74Å; Q605-L615 HydrophobicContact CB-CD1 3.72Å; Q605-L615 HydrophobicContact CG-CD1 4.4Å; Q605-L615 VanDerWaalsContact OE1-CD1 3.28Å; N611-L615 WeakPolarHBondContact O-CB 3.4Å; N611-L615 VanDerWaalsContact O-CG 3.28Å; N611-L615 WeakPolarHBondContact O-CG 3.4Å; N611-L615 PolarHBondContact O-N 3.16Å; Q612-L615 PolarHBondContact O-N 3.24Å; E613-L615 PolarHBondContact O-N 3.29Å; L615-Q617 PolarHBondContact O-N 2.99Å; L615-Q617 VanDerWaalsContact O-N 3.12Å; L615-Y618 PolarHBondContact O-N 3.02Å; L615-M622 HydrophobicContact CB-CE 4.24Å; L615-M622 HydrophobicContact CD2-CE 4.11Å; L615-M622 WeakPolarHBondContact O-CE 3.41Å; L615-L639 HydrophobicContact CB-CD1 3.64Å
616A78.4Confident80.1Confident1.33333 Ų1.3333346.4 Ų46.41%0.01123%0.232CC..Hα-helixtrans-55.1-31.1179.200000111.7Q612 E613 Y614 Y618 L619 L639 L646 R650Q612-A616 WeakPolarHBondContact O-CB 3.28Å; Q612-A616 PolarHBondContact O-N 3.15Å; E613-A616 WeakPolarHBondContact O-CB 3.34Å; E613-A616 PolarHBondContact O-N 2.99Å; Y614-A616 VanDerWaalsContact C-N 3.33Å; Y614-A616 PolarHBondContact O-N 2.73Å; A616-Y618 PolarHBondContact O-N 3.31Å; A616-L619 HydrophobicContact CB-CD1 4.16Å; A616-L619 VanDerWaalsContact O-CB 3.26Å; A616-L619 WeakPolarHBondContact O-CB 3.39Å; A616-L619 WeakPolarHBondContact O-CD1 3.36Å; A616-L619 VanDerWaalsContact O-CG 3.29Å; A616-L619 WeakPolarHBondContact O-CG 3.29Å; A616-L619 PolarHBondContact O-N 3.11Å; A616-L639 HydrophobicContact CB-CD2 4.45Å; A616-L646 HydrophobicContact CB-CD1 3.81Å; A616-L646 HydrophobicContact CB-CD2 3.55Å; A616-L646 VanDerWaalsContact CB-CD2 3.46Å; A616-L646 HydrophobicContact CB-CG 4.34Å; A616-R650 PolarHBondContact O-NE 2.97Å; A616-R650 PolarHBondContact O-NH1 3.06Å; A616-R650 VanDerWaalsContact O-NH1 3.08Å; A616-R650 PolarHBondContact O-NH2 3.25Å
617Q82.7Confident79.2Confident96.3333 Ų96.333341.3 Ų41.345%0.4521%0.211SC..THydrogen-bonded Turntrans-62.2-20.6178.457.5-169.6-18.500114.5Y614 L615 R650Y614-Q617 VanDerWaalsContact CD2-NE2 3.34Å; Y614-Q617 VanDerWaalsContact CE2-NE2 3.27Å; Y614-Q617 WeakPolarHBondContact O-CG 3.42Å; Y614-Q617 PolarHBondContact O-NE2 3.23Å; L615-Q617 PolarHBondContact O-N 2.99Å; L615-Q617 VanDerWaalsContact O-N 3.12Å; Q617-R650 VanDerWaalsContact C-NH2 3.33Å; Q617-R650 VanDerWaalsContact CA-NH1 3.27Å; Q617-R650 PolarHBondContact O-NH2 3.05Å; Q617-R650 VanDerWaalsContact O-NH2 3.11Å
618Y83.1Confident78.5Confident67.3333 Ų67.333338.7 Ų38.726%0.26418%0.184SC..THydrogen-bonded Turntrans-10816.5179.8-52.7-76.7000112.6I523 Y614 L615 A616 N620 L621 M622I523-Y618 HydrophobicContact CD1-CD1 4.4Å; I523-Y618 HydrophobicContact CD1-CD2 3.35Å; I523-Y618 VanDerWaalsContact CD1-CD2 3.41Å; I523-Y618 HydrophobicContact CD1-CE1 4.44Å; I523-Y618 HydrophobicContact CD1-CE2 3.39Å; I523-Y618 HydrophobicContact CD1-CG 3.87Å; I523-Y618 HydrophobicContact CG1-CD2 4.36Å; I523-Y618 HydrophobicContact CG1-CE2 4.5Å; I523-Y618 HydrophobicContact CG1-CG 4.41Å; I523-Y618 HydrophobicContact CG2-CD1 3.73Å; I523-Y618 HydrophobicContact CG2-CD2 4.49Å; I523-Y618 HydrophobicContact CG2-CE1 3.92Å; I523-Y618 HydrophobicContact CG2-CG 4.07Å; Y614-Y618 HydrophobicContact CE1-CE2 4.23Å; L615-Y618 PolarHBondContact O-N 3.02Å; A616-Y618 PolarHBondContact O-N 3.31Å; Y618-N620 VanDerWaalsContact C-N 3.28Å; Y618-N620 PolarHBondContact O-N 3.26Å; Y618-L621 HydrophobicContact CD1-CD1 4.43Å; Y618-L621 WeakPolarHBondContact O-CB 3.3Å; Y618-L621 PolarHBondContact O-N 3.14Å; Y618-L621 VanDerWaalsContact O-N 3.09Å; Y618-M622 WeakPolarHBondContact O-CG 3.33Å; Y618-M622 PolarHBondContact O-N 3.15Å
619L79.3Confident77.4Confident6.66667 Ų6.6666739.1 Ų39.14%0.03519%0.194CC..Hα-helixtrans-54.4-42.9178.1-84.8167.4000112.5A616 L621 M622 Q623 I636 L639 L640 R650A616-L619 HydrophobicContact CB-CD1 4.16Å; A616-L619 VanDerWaalsContact O-CB 3.26Å; A616-L619 WeakPolarHBondContact O-CB 3.39Å; A616-L619 WeakPolarHBondContact O-CD1 3.36Å; A616-L619 VanDerWaalsContact O-CG 3.29Å; A616-L619 WeakPolarHBondContact O-CG 3.29Å; A616-L619 PolarHBondContact O-N 3.11Å; L619-L621 VanDerWaalsContact C-N 3.33Å; L619-L621 PolarHBondContact O-N 3.18Å; L619-M622 PolarHBondContact O-N 3.07Å; L619-M622 VanDerWaalsContact O-N 3.12Å; L619-Q623 WeakPolarHBondContact O-CG 3.32Å; L619-Q623 PolarHBondContact O-N 3.18Å; L619-I636 HydrophobicContact CD2-CG1 4.44Å; L619-I636 HydrophobicContact CD2-CG2 4.12Å; L619-L639 HydrophobicContact CD1-CD2 4.41Å; L619-L639 HydrophobicContact CD2-CD1 4.27Å; L619-L639 HydrophobicContact CD2-CD2 4.15Å; L619-L639 HydrophobicContact CG-CD2 4.47Å; L619-L640 HydrophobicContact CD1-CD2 4.39Å; L619-R650 HydrophobicContact CD1-CG 4.17Å
620N78.1Confident76.7Confident86.6667 Ų86.666735.9 Ų35.946%0.46318%0.182SC..Hα-helixtrans-62.1-42.2-179.8-59.812.6000111.2Y618 M622 Q623 T624Y618-N620 VanDerWaalsContact C-N 3.28Å; Y618-N620 PolarHBondContact O-N 3.26Å; N620-M622 PolarHBondContact O-N 3.4Å; N620-Q623 PolarHBondContact O-N 3.11Å; N620-T624 WeakPolarHBondContact O-CG2 3.41Å; N620-T624 PolarHBondContact O-N 3.31Å
621L81.4Confident76.2Confident25.6667 Ų25.666733.5 Ų33.513%0.13417%0.17CC..Hα-helixtrans-61.4-48.5174-177.2168.3000110I523 L526 N527 Y618 L619 Q623 T624 H625I523-L621 HydrophobicContact CG2-CD1 3.96Å; L526-L621 HydrophobicContact CB-CD2 4.32Å; N527-L621 HydrophobicContact CB-CD1 3.85Å; N527-L621 VanDerWaalsContact ND2-CD1 3.29Å; N527-L621 WeakPolarHBondContact ND2-CD1 3.31Å; N527-L621 WeakPolarHBondContact OD1-CD1 3.44Å; N527-L621 WeakPolarHBondContact OD1-CG 3.2Å; Y618-L621 HydrophobicContact CD1-CD1 4.43Å; Y618-L621 WeakPolarHBondContact O-CB 3.3Å; Y618-L621 PolarHBondContact O-N 3.14Å; Y618-L621 VanDerWaalsContact O-N 3.09Å; L619-L621 VanDerWaalsContact C-N 3.33Å; L619-L621 PolarHBondContact O-N 3.18Å; L621-Q623 VanDerWaalsContact C-N 3.27Å; L621-Q623 PolarHBondContact O-N 3.27Å; L621-T624 PolarHBondContact O-N 3.41Å; L621-T624 VanDerWaalsContact O-N 3.13Å; L621-T624 PolarHBondContact O-OG1 2.86Å; L621-H625 VanDerWaalsContact CD2-CE1 3.41Å; L621-H625 WeakPolarHBondContact CD2-CE1 3.46Å; L621-H625 PolarHBondContact O-CD2 3.17Å; L621-H625 PolarHBondContact O-N 3.47Å
622M79.3Confident75.6Confident3 Ų333.6 Ų33.62%0.01517%0.17CC..Hα-helixtrans-62-35.2-179.6-64.4-173.6-122.200112.8Y598 L601 L615 Y618 L619 N620 H625 T635 I636 L639Y598-M622 HydrophobicContact CE1-CB 4.2Å; Y598-M622 HydrophobicContact CE1-CG 3.8Å; Y598-M622 HydrophobicContact CE1-SD 4.04Å; Y598-M622 WeakPolarHBondContact OH-CA 3.36Å; L601-M622 HydrophobicContact CD1-CE 3.97Å; L601-M622 HydrophobicContact CD1-SD 4.44Å; L615-M622 HydrophobicContact CB-CE 4.24Å; L615-M622 HydrophobicContact CD2-CE 4.11Å; L615-M622 WeakPolarHBondContact O-CE 3.41Å; Y618-M622 WeakPolarHBondContact O-CG 3.33Å; Y618-M622 PolarHBondContact O-N 3.15Å; L619-M622 PolarHBondContact O-N 3.07Å; L619-M622 VanDerWaalsContact O-N 3.12Å; N620-M622 PolarHBondContact O-N 3.4Å; M622-H625 PolarHBondContact O-N 3.2Å; M622-T635 HydrophobicContact SD-CG2 4.39Å; M622-I636 HydrophobicContact CB-CD1 3.84Å; M622-I636 HydrophobicContact CB-CG1 3.93Å; M622-I636 HydrophobicContact SD-CG1 4.45Å; M622-L639 HydrophobicContact CE-CD1 4.05Å
623Q73.7Confident74.8Confident27.6667 Ų27.666733.2 Ų33.213%0.12917%0.17CC..Hα-helixtrans-63.3-40.4175.1-75.7170.2-12.400112.1L619 N620 L621 H625 I626 I636 F659L619-Q623 WeakPolarHBondContact O-CG 3.32Å; L619-Q623 PolarHBondContact O-N 3.18Å; N620-Q623 PolarHBondContact O-N 3.11Å; L621-Q623 VanDerWaalsContact C-N 3.27Å; L621-Q623 PolarHBondContact O-N 3.27Å; Q623-H625 PolarHBondContact O-N 3.18Å; Q623-H625 VanDerWaalsContact O-N 3.15Å; Q623-I626 HydrophobicContact CB-CD1 4.44Å; Q623-I626 HydrophobicContact CG-CD1 4.45Å; Q623-I626 WeakPolarHBondContact O-CB 3.4Å; Q623-I626 WeakPolarHBondContact O-CG1 3.22Å; Q623-I626 PolarHBondContact O-N 3.28Å; Q623-I626 VanDerWaalsContact O-N 3.1Å; Q623-I636 HydrophobicContact CG-CD1 4.34Å; Q623-F659 HydrophobicContact CG-CZ 4.25Å
624T73.8Confident74.3Confident92 Ų9232.5 Ų32.556%0.56417%0.166SC*.Hα-helixtrans-63.5-21.3177.763.40000113.5N620 L621 I626N620-T624 WeakPolarHBondContact O-CG2 3.41Å; N620-T624 PolarHBondContact O-N 3.31Å; L621-T624 PolarHBondContact O-N 3.41Å; L621-T624 VanDerWaalsContact O-N 3.13Å; L621-T624 PolarHBondContact O-OG1 2.86Å; T624-I626 VanDerWaalsContact C-N 3.35Å
625H74.8Confident74Confident6.66667 Ų6.6666729.8 Ų29.83%0.03116%0.156CC..THydrogen-bonded Turntrans-88.5-3.8179.5-63.8-175.1000113.5L526 Y598 L621 M622 Q623 G627 L628 A632L526-H625 PolarHBondContact O-CE1 2.94Å; L526-H625 PolarHBondContact O-NE2 3.15Å; Y598-H625 HydrophobicContact CE2-CB 4.31Å; Y598-H625 AromaticContact CE2-ND1 3.92Å; Y598-H625 AromaticContact CZ-ND1 3.86Å; Y598-H625 VanDerWaalsContact OH-CB 3.28Å; Y598-H625 WeakPolarHBondContact OH-CB 3.3Å; Y598-H625 PolarHBondContact OH-ND1 2.84Å; Y598-H625 VanDerWaalsContact OH-ND1 3.09Å; L621-H625 VanDerWaalsContact CD2-CE1 3.41Å; L621-H625 WeakPolarHBondContact CD2-CE1 3.46Å; L621-H625 PolarHBondContact O-CD2 3.17Å; L621-H625 PolarHBondContact O-N 3.47Å; M622-H625 PolarHBondContact O-N 3.2Å; Q623-H625 PolarHBondContact O-N 3.18Å; Q623-H625 VanDerWaalsContact O-N 3.15Å; H625-G627 PolarHBondContact O-N 2.92Å; H625-L628 HydrophobicContact CB-CD1 4.07Å; H625-L628 WeakPolarHBondContact O-CB 3.29Å; H625-L628 PolarHBondContact O-N 3.15Å; H625-A632 HydrophobicContact CB-CB 4.03Å
626I68.9Low73.6Confident10.3333 Ų10.333329.8 Ų29.85%0.05316%0.156CC..THydrogen-bonded Turntrans-66.5131.6174.9-59.3173000108.5Q623 T624 A632 I636 F659 L662 F671Q623-I626 HydrophobicContact CB-CD1 4.44Å; Q623-I626 HydrophobicContact CG-CD1 4.45Å; Q623-I626 WeakPolarHBondContact O-CB 3.4Å; Q623-I626 WeakPolarHBondContact O-CG1 3.22Å; Q623-I626 PolarHBondContact O-N 3.28Å; Q623-I626 VanDerWaalsContact O-N 3.1Å; T624-I626 VanDerWaalsContact C-N 3.35Å; I626-A632 HydrophobicContact CG1-CB 4.36Å; I626-I636 HydrophobicContact CD1-CD1 3.75Å; I626-I636 HydrophobicContact CG1-CD1 4.16Å; I626-F659 HydrophobicContact CD1-CD1 4.39Å; I626-F659 HydrophobicContact CD1-CE1 4.14Å; I626-L662 HydrophobicContact CB-CD1 3.98Å; I626-L662 HydrophobicContact CB-CD2 3.87Å; I626-L662 HydrophobicContact CD1-CD1 3.38Å; I626-L662 HydrophobicContact CG1-CD1 4.25Å; I626-L662 HydrophobicContact CG2-CD1 3.88Å; I626-L662 HydrophobicContact CG2-CD2 3.59Å; I626-L662 HydrophobicContact CG2-CG 4.25Å; I626-F671 HydrophobicContact CG2-CE1 3.7Å; I626-F671 HydrophobicContact CG2-CZ 4.2Å
627G62Low73.2Confident9.66667 Ų9.6666731.6 Ų31.610%0.117%0.167CC..THydrogen-bonded Turntrans92.5-4.8-175.500000114.9Q537 H625 G629Q537-G627 PolarHBondContact N-O 2.86Å; H625-G627 PolarHBondContact O-N 2.92Å; G627-G629 VanDerWaalsContact C-N 3.34Å; G627-G629 PolarHBondContact O-N 3.28Å
628L61.5Low72.7Confident5.33333 Ų5.3333328.6 Ų28.63%0.02816%0.158CC..THydrogen-bonded Turntrans-82.43177.3-61.7179.8000114.2I531 L534 K536 Q591 H625 I630I531-L628 HydrophobicContact CG2-CD1 4.39Å; I531-L628 WeakPolarHBondContact O-CD1 3.25Å; L534-L628 HydrophobicContact CB-CB 4.48Å; L534-L628 HydrophobicContact CB-CD2 4.14Å; L534-L628 WeakPolarHBondContact O-CD2 3.38Å; K536-L628 HydrophobicContact CG-CD2 3.87Å; Q591-L628 PolarHBondContact NE2-O 2.79Å; H625-L628 HydrophobicContact CB-CD1 4.07Å; H625-L628 WeakPolarHBondContact O-CB 3.29Å; H625-L628 PolarHBondContact O-N 3.15Å; L628-I630 VanDerWaalsContact C-N 3.26Å; L628-I630 HydrophobicContact CB-CD1 3.84Å; L628-I630 HydrophobicContact CB-CG1 3.92Å; L628-I630 HydrophobicContact CD1-CD1 4.13Å; L628-I630 WeakPolarHBondContact O-CG1 2.91Å
629G61.2Low72.5Confident27.3333 Ų27.333325.4 Ų25.428%0.28215%0.146SC..THydrogen-bonded Turntrans76.718.1-173.100000113.8N595 G627N595-G629 PolarHBondContact ND2-O 2.91Å; N595-G629 PolarHBondContact OD1-O 3.23Å; G627-G629 VanDerWaalsContact C-N 3.34Å; G627-G629 PolarHBondContact O-N 3.28Å
630I69.1Low72.3Confident8 Ų825.4 Ų25.44%0.04115%0.146CC..SBendtrans-108.6111.4-174.7-49.8176.1000110.6I531 L534 G594 N595 Y598 L628 A632I531-I630 HydrophobicContact CG2-CD1 3.9Å; L534-I630 HydrophobicContact CD1-CD1 3.76Å; G594-I630 VanDerWaalsContact O-CG2 3.31Å; G594-I630 WeakPolarHBondContact O-CG2 3.42Å; N595-I630 VanDerWaalsContact OD1-CA 3.27Å; N595-I630 WeakPolarHBondContact OD1-CA 3.4Å; Y598-I630 HydrophobicContact CD2-CB 4.39Å; Y598-I630 HydrophobicContact CD2-CG2 3.17Å; Y598-I630 HydrophobicContact CE2-CB 4.29Å; Y598-I630 HydrophobicContact CE2-CG2 3.54Å; Y598-I630 HydrophobicContact CG-CG2 4.22Å; L628-I630 VanDerWaalsContact C-N 3.26Å; L628-I630 HydrophobicContact CB-CD1 3.84Å; L628-I630 HydrophobicContact CB-CG1 3.92Å; L628-I630 HydrophobicContact CD1-CD1 4.13Å; L628-I630 WeakPolarHBondContact O-CG1 2.91Å; I630-A632 PolarHBondContact O-N 3.04Å
631R71.1Confident72Confident72 Ų7226.1 Ų26.127%0.27215%0.146SC..THydrogen-bonded Turntrans-31.824.9179.7-62.3176.675.5148.711.8115.9D557 N595 S633 E634 T635D557-R631 IonicContact OD2-NH1 3.29Å; N595-R631 WeakPolarHBondContact OD1-CG 3.29Å; N595-R631 PolarHBondContact OD1-N 2.9Å; R631-S633 VanDerWaalsContact C-N 3.29Å; R631-S633 PolarHBondContact O-N 3.34Å; R631-E634 IonicContact CZ-OE2 3.2Å; R631-E634 IonicContact NE-OE1 2.82Å; R631-E634 IonicContact NE-OE2 3.08Å; R631-E634 PolarHBondContact NE-OE2 3.06Å; R631-E634 IonicContact NH2-OE2 3.16Å; R631-E634 PolarHBondContact NH2-OE2 2.94Å; R631-E634 PolarHBondContact O-N 3.2Å; R631-T635 PolarHBondContact O-N 3.12Å; R631-T635 PolarHBondContact O-OG1 3.11Å
632A74.3Confident71.4Confident0.666667 Ų0.66666728.4 Ų28.41%0.00616%0.159CC..Hα-helixtrans-59.6-42.6-179.500000112.6Y598 H625 I626 I630 T635 I636Y598-A632 HydrophobicContact CD1-CB 4.21Å; Y598-A632 HydrophobicContact CD2-CB 4.3Å; Y598-A632 VanDerWaalsContact CE1-CA 3.47Å; Y598-A632 HydrophobicContact CE1-CB 3.66Å; Y598-A632 HydrophobicContact CE2-CB 3.73Å; Y598-A632 HydrophobicContact CG-CB 4.46Å; H625-A632 HydrophobicContact CB-CB 4.03Å; I626-A632 HydrophobicContact CG1-CB 4.36Å; I630-A632 PolarHBondContact O-N 3.04Å; A632-T635 WeakPolarHBondContact O-CB 3.07Å; A632-T635 PolarHBondContact O-N 2.82Å; A632-I636 VanDerWaalsContact O-CG1 3.23Å; A632-I636 WeakPolarHBondContact O-CG1 3.41Å; A632-I636 PolarHBondContact O-N 3.22Å
633S68.2Low71.1Confident10.3333 Ų10.333328.3 Ų28.37%0.07216%0.158CC..Hα-helixtrans-61-49.9179.957.30000111.6R631 T635 I636 T637 Y674R631-S633 VanDerWaalsContact C-N 3.29Å; R631-S633 PolarHBondContact O-N 3.34Å; S633-T635 VanDerWaalsContact C-N 3.29Å; S633-T635 PolarHBondContact O-N 3.3Å; S633-I636 WeakPolarHBondContact O-CA 3.4Å; S633-I636 WeakPolarHBondContact O-CB 3.35Å; S633-I636 PolarHBondContact O-N 3.28Å; S633-I636 VanDerWaalsContact O-N 3.1Å; S633-T637 PolarHBondContact O-N 3.25Å; S633-T637 PolarHBondContact O-OG1 3.11Å; S633-Y674 VanDerWaalsContact C-CZ 3.47Å; S633-Y674 VanDerWaalsContact CB-OH 3.25Å; S633-Y674 WeakPolarHBondContact CB-OH 3.33Å; S633-Y674 WeakPolarHBondContact O-CE1 3.41Å; S633-Y674 PolarHBondContact O-OH 3.44Å; S633-Y674 VanDerWaalsContact O-OH 3.12Å; S633-Y674 PolarHBondContact OG-OH 3.05Å; S633-Y674 VanDerWaalsContact OG-OH 3.09Å
634E70.2Confident71.2Confident68.6667 Ų68.666731.9 Ų31.932%0.32117%0.17SC..Hα-helixtrans-57.6-40179.7-63.5169.2-162.100112.4R631 T637 A638 Y674R631-E634 IonicContact CZ-OE2 3.2Å; R631-E634 IonicContact NE-OE1 2.82Å; R631-E634 IonicContact NE-OE2 3.08Å; R631-E634 PolarHBondContact NE-OE2 3.06Å; R631-E634 IonicContact NH2-OE2 3.16Å; R631-E634 PolarHBondContact NH2-OE2 2.94Å; R631-E634 PolarHBondContact O-N 3.2Å; E634-T637 WeakPolarHBondContact O-CB 3.24Å; E634-T637 PolarHBondContact O-N 3.2Å; E634-T637 PolarHBondContact O-OG1 3.46Å; E634-A638 WeakPolarHBondContact O-CB 3.24Å; E634-A638 PolarHBondContact O-N 2.95Å; E634-Y674 WeakPolarHBondContact CA-OH 3.34Å; E634-Y674 PolarHBondContact N-OH 3.05Å
635T78.4Confident70.9Confident0 Ų032.5 Ų32.50%017%0.167CC..Hα-helixtrans-65.7-42.2176.8-51.90000111.8Y598 L601 T602 Q605 M622 R631 A632 S633 T637 A638 L639Y598-T635 WeakPolarHBondContact CB-OG1 3.47Å; Y598-T635 HydrophobicContact CD1-CG2 4.06Å; Y598-T635 VanDerWaalsContact CD1-OG1 3.32Å; Y598-T635 WeakPolarHBondContact CD1-OG1 3.25Å; Y598-T635 PolarHBondContact O-OG1 3.02Å; Y598-T635 VanDerWaalsContact O-OG1 3.11Å; L601-T635 HydrophobicContact CB-CG2 3.75Å; T602-T635 VanDerWaalsContact CG2-CA 3.45Å; T602-T635 HydrophobicContact CG2-CG2 4.08Å; T602-T635 WeakPolarHBondContact OG1-CA 3.26Å; T602-T635 WeakPolarHBondContact OG1-CB 3.23Å; T602-T635 PolarHBondContact OG1-OG1 2.83Å; Q605-T635 PolarHBondContact NE2-O 3.11Å; M622-T635 HydrophobicContact SD-CG2 4.39Å; R631-T635 PolarHBondContact O-N 3.12Å; R631-T635 PolarHBondContact O-OG1 3.11Å; A632-T635 WeakPolarHBondContact O-CB 3.07Å; A632-T635 PolarHBondContact O-N 2.82Å; S633-T635 VanDerWaalsContact C-N 3.29Å; S633-T635 PolarHBondContact O-N 3.3Å; T635-T637 VanDerWaalsContact C-N 3.29Å; T635-T637 PolarHBondContact O-N 3.29Å; T635-A638 PolarHBondContact O-N 3.04Å; T635-L639 VanDerWaalsContact O-CB 3.27Å; T635-L639 WeakPolarHBondContact O-CB 3.37Å; T635-L639 PolarHBondContact O-N 3.18Å
636I75.5Confident70.7Confident1 Ų132.9 Ų32.91%0.00517%0.169CC..Hα-helixtrans-64.4-42.3176-64.1163000110.3L619 M622 Q623 I626 A632 S633 A638 L639 L640 F659 Y674L619-I636 HydrophobicContact CD2-CG1 4.44Å; L619-I636 HydrophobicContact CD2-CG2 4.12Å; M622-I636 HydrophobicContact CB-CD1 3.84Å; M622-I636 HydrophobicContact CB-CG1 3.93Å; M622-I636 HydrophobicContact SD-CG1 4.45Å; Q623-I636 HydrophobicContact CG-CD1 4.34Å; I626-I636 HydrophobicContact CD1-CD1 3.75Å; I626-I636 HydrophobicContact CG1-CD1 4.16Å; A632-I636 VanDerWaalsContact O-CG1 3.23Å; A632-I636 WeakPolarHBondContact O-CG1 3.41Å; A632-I636 PolarHBondContact O-N 3.22Å; S633-I636 WeakPolarHBondContact O-CA 3.4Å; S633-I636 WeakPolarHBondContact O-CB 3.35Å; S633-I636 PolarHBondContact O-N 3.28Å; S633-I636 VanDerWaalsContact O-N 3.1Å; I636-A638 VanDerWaalsContact C-N 3.34Å; I636-A638 PolarHBondContact O-N 3.3Å; I636-L639 WeakPolarHBondContact O-CB 3.31Å; I636-L639 PolarHBondContact O-N 3.33Å; I636-L639 VanDerWaalsContact O-N 3.13Å; I636-L640 HydrophobicContact CG2-CD1 3.72Å; I636-L640 HydrophobicContact CG2-CG 4.25Å; I636-L640 WeakPolarHBondContact O-CB 3.42Å; I636-L640 VanDerWaalsContact O-CG 3.32Å; I636-L640 WeakPolarHBondContact O-CG 3.27Å; I636-L640 PolarHBondContact O-N 3.24Å; I636-F659 HydrophobicContact CG2-CE1 4.34Å; I636-F659 HydrophobicContact CG2-CZ 4.09Å; I636-Y674 HydrophobicContact CB-CE2 3.99Å; I636-Y674 HydrophobicContact CG2-CE2 3.63Å; I636-Y674 WeakPolarHBondContact CG2-OH 3.38Å
637T70.8Confident70.8Confident38.6667 Ų38.666732.4 Ų32.424%0.23717%0.166CC..Hα-helixtrans-60.8-47.5176.3-20.10000110.4S633 E634 T635 L639 L640 H641 Y674 A677S633-T637 PolarHBondContact O-N 3.25Å; S633-T637 PolarHBondContact O-OG1 3.11Å; E634-T637 WeakPolarHBondContact O-CB 3.24Å; E634-T637 PolarHBondContact O-N 3.2Å; E634-T637 PolarHBondContact O-OG1 3.46Å; T635-T637 VanDerWaalsContact C-N 3.29Å; T635-T637 PolarHBondContact O-N 3.29Å; T637-L639 VanDerWaalsContact C-N 3.29Å; T637-L639 PolarHBondContact O-N 3.22Å; T637-L640 PolarHBondContact O-N 3.24Å; T637-H641 WeakPolarHBondContact O-CB 3.26Å; T637-H641 PolarHBondContact O-N 3.25Å; T637-Y674 VanDerWaalsContact CB-CD1 3.44Å; T637-Y674 HydrophobicContact CG2-CD1 3.76Å; T637-Y674 HydrophobicContact CG2-CD2 4.07Å; T637-Y674 HydrophobicContact CG2-CE1 4.09Å; T637-Y674 WeakPolarHBondContact OG1-CD1 3.11Å; T637-Y674 VanDerWaalsContact OG1-CD2 3.32Å; T637-Y674 WeakPolarHBondContact OG1-CD2 3.49Å; T637-Y674 WeakPolarHBondContact OG1-CE1 3.39Å; T637-Y674 PolarHBondContact OG1-OH 3.44Å; T637-A677 HydrophobicContact CG2-CB 4.16Å
638A72.9Confident71.1Confident33.3333 Ų33.333335.8 Ų35.828%0.27518%0.18SC..Hα-helixtrans-65.8-25.4177.600000113.4T602 E634 T635 I636T602-A638 HydrophobicContact CG2-CB 3.96Å; E634-A638 WeakPolarHBondContact O-CB 3.24Å; E634-A638 PolarHBondContact O-N 2.95Å; T635-A638 PolarHBondContact O-N 3.04Å; I636-A638 VanDerWaalsContact C-N 3.34Å; I636-A638 PolarHBondContact O-N 3.3Å
639L78.9Confident71.5Confident0 Ų044.3 Ų44.30%022%0.216CC..Hα-helixtrans-74.8-43.8176.9-171.4157.3000110.9Q605 L615 A616 L619 M622 T635 I636 T637 N643 L646Q605-L639 VanDerWaalsContact NE2-N 3.19Å; Q605-L639 VanDerWaalsContact OE1-CB 3.29Å; L615-L639 HydrophobicContact CB-CD1 3.64Å; A616-L639 HydrophobicContact CB-CD2 4.45Å; L619-L639 HydrophobicContact CD1-CD2 4.41Å; L619-L639 HydrophobicContact CD2-CD1 4.27Å; L619-L639 HydrophobicContact CD2-CD2 4.15Å; L619-L639 HydrophobicContact CG-CD2 4.47Å; M622-L639 HydrophobicContact CE-CD1 4.05Å; T635-L639 VanDerWaalsContact O-CB 3.27Å; T635-L639 WeakPolarHBondContact O-CB 3.37Å; T635-L639 PolarHBondContact O-N 3.18Å; I636-L639 WeakPolarHBondContact O-CB 3.31Å; I636-L639 PolarHBondContact O-N 3.33Å; I636-L639 VanDerWaalsContact O-N 3.13Å; T637-L639 VanDerWaalsContact C-N 3.29Å; T637-L639 PolarHBondContact O-N 3.22Å; L639-N643 WeakPolarHBondContact O-CB 3.46Å; L639-N643 PolarHBondContact O-ND2 3.36Å; L639-L646 HydrophobicContact CD2-CD1 3.56Å
640L74.2Confident71.9Confident6 Ų647.3 Ų47.33%0.03122%0.219CC..Hα-helixtrans-85.7-24.1-175.9-62.7178.9000113.1L619 I636 T637 N642 N643 L646 L647 V651 F659 Y674 L678L619-L640 HydrophobicContact CD1-CD2 4.39Å; I636-L640 HydrophobicContact CG2-CD1 3.72Å; I636-L640 HydrophobicContact CG2-CG 4.25Å; I636-L640 WeakPolarHBondContact O-CB 3.42Å; I636-L640 VanDerWaalsContact O-CG 3.32Å; I636-L640 WeakPolarHBondContact O-CG 3.27Å; I636-L640 PolarHBondContact O-N 3.24Å; T637-L640 PolarHBondContact O-N 3.24Å; L640-N642 PolarHBondContact O-N 3.07Å; L640-N643 WeakPolarHBondContact O-CB 3.34Å; L640-N643 PolarHBondContact O-N 3.15Å; L640-N643 VanDerWaalsContact O-N 3.13Å; L640-L646 HydrophobicContact CD2-CB 4.2Å; L640-L647 HydrophobicContact CB-CD2 4.09Å; L640-L647 HydrophobicContact CD1-CD2 4.25Å; L640-L647 HydrophobicContact CD2-CD2 4.21Å; L640-L647 HydrophobicContact CG-CD2 4.42Å; L640-V651 HydrophobicContact CD1-CG2 4.27Å; L640-V651 HydrophobicContact CD2-CG2 4.41Å; L640-F659 HydrophobicContact CD1-CZ 4.38Å; L640-Y674 HydrophobicContact CD1-CE2 4.28Å; L640-Y674 WeakPolarHBondContact CD1-OH 3.49Å; L640-L678 HydrophobicContact CB-CD2 4.48Å; L640-L678 HydrophobicContact CD1-CD2 3.6Å; L640-L678 VanDerWaalsContact CD1-CD2 3.42Å
641H72.2Confident72.1Confident102.667 Ų102.66747.5 Ų47.548%0.47522%0.221SC..THydrogen-bonded Turntrans-58.5126.7179.6-173.467.3000111.4T637 N643T637-H641 WeakPolarHBondContact O-CB 3.26Å; T637-H641 PolarHBondContact O-N 3.25Å; H641-N643 PolarHBondContact O-N 3.41Å; H641-N643 VanDerWaalsContact O-N 3.17Å
642N68.7Low72.1Confident74 Ų7445.3 Ų45.340%0.39622%0.22SC..THydrogen-bonded Turntrans53.730.8-177.6-66-20.9000114.1L640 C682L640-N642 PolarHBondContact O-N 3.07Å; N642-C682 WeakPolarHBondContact OD1-CA 3.36Å; N642-C682 PolarHBondContact OD1-N 3.03Å
643N72.8Confident72Confident0 Ų051.6 Ų51.60%025%0.25CC..  trans-115.968.4-179.3-161.5-34000112.9R609 Q612 L639 L640 H641 Q645 L646 L647R609-N643 WeakPolarHBondContact CD-ND2 3.13Å; R609-N643 PolarHBondContact NE-ND2 3.28Å; R609-N643 PolarHBondContact NE-OD1 3.29Å; R609-N643 PolarHBondContact NH1-ND2 3.04Å; R609-N643 PolarHBondContact NH1-OD1 3.12Å; R609-N643 VanDerWaalsContact NH1-OD1 3.09Å; R609-N643 PolarHBondContact NH2-OD1 3.18Å; Q612-N643 PolarHBondContact OE1-ND2 3.12Å; L639-N643 WeakPolarHBondContact O-CB 3.46Å; L639-N643 PolarHBondContact O-ND2 3.36Å; L640-N643 WeakPolarHBondContact O-CB 3.34Å; L640-N643 PolarHBondContact O-N 3.15Å; L640-N643 VanDerWaalsContact O-N 3.13Å; H641-N643 PolarHBondContact O-N 3.41Å; H641-N643 VanDerWaalsContact O-N 3.17Å; N643-Q645 VanDerWaalsContact C-N 3.32Å; N643-Q645 PolarHBondContact O-N 2.96Å; N643-L646 HydrophobicContact CB-CB 4.33Å; N643-L646 HydrophobicContact CB-CD1 4.41Å; N643-L646 VanDerWaalsContact CG-CG 3.48Å; N643-L646 WeakPolarHBondContact ND2-CD1 3.41Å; N643-L646 WeakPolarHBondContact ND2-CG 3.37Å; N643-L646 PolarHBondContact O-N 3.29Å; N643-L646 VanDerWaalsContact O-N 3.09Å; N643-L646 VanDerWaalsContact OD1-CB 3.24Å; N643-L646 WeakPolarHBondContact OD1-CB 3.33Å; N643-L646 VanDerWaalsContact OD1-CG 3.32Å; N643-L646 WeakPolarHBondContact OD1-CG 3.33Å; N643-L646 PolarHBondContact OD1-N 3.21Å; N643-L647 WeakPolarHBondContact O-CG 3.32Å; N643-L647 PolarHBondContact O-N 3.15Å
644R74.9Confident72.2Confident103.333 Ų103.33358.7 Ų58.739%0.3928%0.282SS..Hα-helixtrans-50.4-46-176.8-171.1171.2175.8135.87.4114.1L646 L647 E648 S681 I686R644-L646 PolarHBondContact O-N 3.2Å; R644-L647 PolarHBondContact O-N 3.27Å; R644-E648 HydrophobicContact CG-CG 4.3Å; R644-E648 IonicContact CZ-OE1 3.53Å; R644-E648 IonicContact NE-OE1 3.07Å; R644-E648 PolarHBondContact NE-OE1 3.04Å; R644-E648 IonicContact NH2-OE1 3.55Å; R644-E648 PolarHBondContact NH2-OE1 3.11Å; R644-E648 VanDerWaalsContact NH2-OE1 3.07Å; R644-E648 WeakPolarHBondContact O-CB 3.46Å; R644-E648 WeakPolarHBondContact O-CG 3.42Å; R644-E648 PolarHBondContact O-N 3.03Å; R644-S681 WeakPolarHBondContact CB-OG 3.4Å; R644-I686 HydrophobicContact CB-CD1 4.44Å; R644-I686 HydrophobicContact CG-CD1 4.17Å; R644-I686 HydrophobicContact CG-CG1 4.36Å
645Q69.2Low72.5Confident104.333 Ų104.33356.8 Ų56.849%0.48827%0.273SS..Hα-helixtrans-70.2-30.9-176.8-51174.9-28.100113.3R609 N643 K649R609-Q645 VanDerWaalsContact NH2-CB 3.25Å; R609-Q645 VanDerWaalsContact NH2-OE1 3.14Å; N643-Q645 VanDerWaalsContact C-N 3.32Å; N643-Q645 PolarHBondContact O-N 2.96Å; Q645-K649 VanDerWaalsContact O-CB 3.29Å; Q645-K649 WeakPolarHBondContact O-CB 3.44Å; Q645-K649 WeakPolarHBondContact O-CG 3.41Å; Q645-K649 PolarHBondContact O-N 3.11Å; Q645-K649 VanDerWaalsContact O-N 3.16Å
646L70.1Confident72.3Confident14.6667 Ų14.666756.8 Ų56.88%0.07727%0.273CS..Hα-helixtrans-72.7-41.1173.6-74-174.3000110.8Q612 E613 A616 L639 L640 N643 R644 K649 R650Q612-L646 HydrophobicContact CB-CD1 4.23Å; E613-L646 HydrophobicContact CG-CD2 4.3Å; A616-L646 HydrophobicContact CB-CD1 3.81Å; A616-L646 HydrophobicContact CB-CD2 3.55Å; A616-L646 VanDerWaalsContact CB-CD2 3.46Å; A616-L646 HydrophobicContact CB-CG 4.34Å; L639-L646 HydrophobicContact CD2-CD1 3.56Å; L640-L646 HydrophobicContact CD2-CB 4.2Å; N643-L646 HydrophobicContact CB-CB 4.33Å; N643-L646 HydrophobicContact CB-CD1 4.41Å; N643-L646 VanDerWaalsContact CG-CG 3.48Å; N643-L646 WeakPolarHBondContact ND2-CD1 3.41Å; N643-L646 WeakPolarHBondContact ND2-CG 3.37Å; N643-L646 PolarHBondContact O-N 3.29Å; N643-L646 VanDerWaalsContact O-N 3.09Å; N643-L646 VanDerWaalsContact OD1-CB 3.24Å; N643-L646 WeakPolarHBondContact OD1-CB 3.33Å; N643-L646 VanDerWaalsContact OD1-CG 3.32Å; N643-L646 WeakPolarHBondContact OD1-CG 3.33Å; N643-L646 PolarHBondContact OD1-N 3.21Å; R644-L646 PolarHBondContact O-N 3.2Å; L646-K649 PolarHBondContact O-N 3.26Å; L646-R650 WeakPolarHBondContact O-CA 3.38Å; L646-R650 VanDerWaalsContact O-CB 3.27Å; L646-R650 WeakPolarHBondContact O-CB 3.38Å; L646-R650 PolarHBondContact O-N 3.14Å
647L70.3Confident72.3Confident0 Ų059.4 Ų59.40%029%0.291CS..Hα-helixtrans-58.6-50.4176-67.9170.3000110.8L640 N643 R644 K649 V651 L678 I686 T689L640-L647 HydrophobicContact CB-CD2 4.09Å; L640-L647 HydrophobicContact CD1-CD2 4.25Å; L640-L647 HydrophobicContact CD2-CD2 4.21Å; L640-L647 HydrophobicContact CG-CD2 4.42Å; N643-L647 WeakPolarHBondContact O-CG 3.32Å; N643-L647 PolarHBondContact O-N 3.15Å; R644-L647 PolarHBondContact O-N 3.27Å; L647-K649 PolarHBondContact O-N 3Å; L647-V651 HydrophobicContact CD2-CG2 3.95Å; L647-V651 WeakPolarHBondContact O-CB 3.37Å; L647-V651 PolarHBondContact O-N 3.22Å; L647-L678 HydrophobicContact CD2-CB 4.45Å; L647-L678 HydrophobicContact CD2-CD2 3.43Å; L647-L678 VanDerWaalsContact CD2-CD2 3.43Å; L647-I686 HydrophobicContact CB-CD1 3.66Å; L647-I686 HydrophobicContact CD1-CD1 3.42Å; L647-I686 VanDerWaalsContact CD1-CD1 3.44Å; L647-I686 HydrophobicContact CG-CD1 4.16Å; L647-T689 HydrophobicContact CB-CG2 4.41Å
648E67.8Low72.4Confident82.3333 Ų82.333359.3 Ų59.339%0.38529%0.294SS..Hα-helixtrans-69.4-33.3-178.4-72.3179.7178.200114.3R644 I686R644-E648 HydrophobicContact CG-CG 4.3Å; R644-E648 IonicContact CZ-OE1 3.53Å; R644-E648 IonicContact NE-OE1 3.07Å; R644-E648 PolarHBondContact NE-OE1 3.04Å; R644-E648 IonicContact NH2-OE1 3.55Å; R644-E648 PolarHBondContact NH2-OE1 3.11Å; R644-E648 VanDerWaalsContact NH2-OE1 3.07Å; R644-E648 WeakPolarHBondContact O-CB 3.46Å; R644-E648 WeakPolarHBondContact O-CG 3.42Å; R644-E648 PolarHBondContact O-N 3.03Å; E648-I686 HydrophobicContact CG-CG2 4.01Å
649K71Confident72.5Confident182.333 Ų182.33358 Ų5879%0.79328%0.282SS*.Hα-helixtrans-93.8-25.8-174.4-70.2-174.2176.1-176.30114.4Q645 L646 L647Q645-K649 VanDerWaalsContact O-CB 3.29Å; Q645-K649 WeakPolarHBondContact O-CB 3.44Å; Q645-K649 WeakPolarHBondContact O-CG 3.41Å; Q645-K649 PolarHBondContact O-N 3.11Å; Q645-K649 VanDerWaalsContact O-N 3.16Å; L646-K649 PolarHBondContact O-N 3.26Å; L647-K649 PolarHBondContact O-N 3Å
650R70Confident72.3Confident91 Ų9158.4 Ų58.434%0.34328%0.284SS..Hα-helixtrans-125.7-21.2-163.9-162.3137.4-173.2165.412.4114.5A616 Q617 L619 L646 G652A616-R650 PolarHBondContact O-NE 2.97Å; A616-R650 PolarHBondContact O-NH1 3.06Å; A616-R650 VanDerWaalsContact O-NH1 3.08Å; A616-R650 PolarHBondContact O-NH2 3.25Å; Q617-R650 VanDerWaalsContact C-NH2 3.33Å; Q617-R650 VanDerWaalsContact CA-NH1 3.27Å; Q617-R650 PolarHBondContact O-NH2 3.05Å; Q617-R650 VanDerWaalsContact O-NH2 3.11Å; L619-R650 HydrophobicContact CD1-CG 4.17Å; L646-R650 WeakPolarHBondContact O-CA 3.38Å; L646-R650 VanDerWaalsContact O-CB 3.27Å; L646-R650 WeakPolarHBondContact O-CB 3.38Å; L646-R650 PolarHBondContact O-N 3.14Å; R650-G652 PolarHBondContact O-N 3.14Å
651V72.3Confident72.3Confident12.3333 Ų12.333360.8 Ų60.88%0.07530%0.302CS..  trans-86.5104.2173.8-178.70000108L640 L647 E655 V656 L678 T689L640-V651 HydrophobicContact CD1-CG2 4.27Å; L640-V651 HydrophobicContact CD2-CG2 4.41Å; L647-V651 HydrophobicContact CD2-CG2 3.95Å; L647-V651 WeakPolarHBondContact O-CB 3.37Å; L647-V651 PolarHBondContact O-N 3.22Å; V651-E655 HydrophobicContact CG1-CB 4.46Å; V651-V656 HydrophobicContact CG1-CG2 3.83Å; V651-L678 HydrophobicContact CG1-CD1 4.43Å; V651-L678 HydrophobicContact CG1-CD2 4.35Å; V651-L678 HydrophobicContact CG2-CD2 4.2Å; V651-T689 HydrophobicContact CB-CG2 4.41Å; V651-T689 HydrophobicContact CG1-CG2 4.45Å
652G72.3Confident72.2Confident25 Ų2556.9 Ų56.926%0.25828%0.284SS..  trans-108.3-171.9173.400000112.3R650 Q654 E655 V656R650-G652 PolarHBondContact O-N 3.14Å; G652-Q654 VanDerWaalsContact C-N 3.29Å; G652-Q654 PolarHBondContact O-N 3.03Å; G652-E655 WeakPolarHBondContact CA-OE2 3.41Å; G652-E655 PolarHBondContact N-OE2 3.18Å; G652-E655 PolarHBondContact O-N 3.32Å; G652-V656 WeakPolarHBondContact O-CG2 3.4Å; G652-V656 PolarHBondContact O-N 3.02Å; G652-V656 VanDerWaalsContact O-N 3.14Å
653E71.9Confident72.5Confident134 Ų13453.4 Ų53.463%0.62627%0.266SS*.Hα-helixtrans-61.2-36.4-178.1-169.5-179176.600112.6S657 L692 Q696E653-S657 VanDerWaalsContact O-CB 3.27Å; E653-S657 WeakPolarHBondContact O-CB 3.3Å; E653-S657 PolarHBondContact O-N 3.05Å; E653-L692 HydrophobicContact CB-CD2 4.16Å; E653-L692 HydrophobicContact CG-CD2 4.48Å; E653-Q696 PolarHBondContact O-NE2 3.1Å
654Q72.6Confident72.5Confident159 Ų15957.5 Ų57.574%0.74328%0.281SS*.Hα-helixtrans-66.9-41.3-179.5-64.9-179.4-0.700111.5G652 S657 A658G652-Q654 VanDerWaalsContact C-N 3.29Å; G652-Q654 PolarHBondContact O-N 3.03Å; Q654-S657 PolarHBondContact O-N 3.18Å; Q654-A658 PolarHBondContact O-N 3.24Å
655E74.8Confident72.1Confident29.6667 Ų29.666757 Ų5714%0.13929%0.286CS..Hα-helixtrans-66.6-46.9178.3-65.676.4-169.700110.9V651 G652 S657 A658 F659V651-E655 HydrophobicContact CG1-CB 4.46Å; G652-E655 WeakPolarHBondContact CA-OE2 3.41Å; G652-E655 PolarHBondContact N-OE2 3.18Å; G652-E655 PolarHBondContact O-N 3.32Å; E655-S657 VanDerWaalsContact C-N 3.28Å; E655-S657 PolarHBondContact O-N 3.17Å; E655-A658 PolarHBondContact O-N 3.38Å; E655-F659 HydrophobicContact CB-CE2 4.37Å; E655-F659 WeakPolarHBondContact O-CD2 3.24Å; E655-F659 PolarHBondContact O-N 3.11Å
656V75.2Confident71.9Confident0 Ų052.4 Ų52.40%027%0.265CS..Hα-helixtrans-61.9-38.4176.6-174.10000110.5V651 G652 A658 F659 V660 L692 I693 Q696V651-V656 HydrophobicContact CG1-CG2 3.83Å; G652-V656 WeakPolarHBondContact O-CG2 3.4Å; G652-V656 PolarHBondContact O-N 3.02Å; G652-V656 VanDerWaalsContact O-N 3.14Å; V656-A658 VanDerWaalsContact C-N 3.34Å; V656-A658 PolarHBondContact O-N 2.94Å; V656-F659 WeakPolarHBondContact O-CA 3.43Å; V656-F659 WeakPolarHBondContact O-CB 3.34Å; V656-F659 PolarHBondContact O-N 3.2Å; V656-V660 HydrophobicContact CG1-CG2 4.43Å; V656-V660 WeakPolarHBondContact O-CG2 3.33Å; V656-V660 PolarHBondContact O-N 2.98Å; V656-L692 HydrophobicContact CG2-CB 4.22Å; V656-I693 HydrophobicContact CG1-CB 4.42Å; V656-I693 HydrophobicContact CG1-CG1 3.68Å; V656-I693 HydrophobicContact CG2-CG1 4.42Å; V656-Q696 VanDerWaalsContact CB-OE1 3.27Å; V656-Q696 PolarHBondContact O-OE1 3.41Å
657S76.2Confident71.8Confident55.3333 Ų55.333352.3 Ų52.339%0.38727%0.265SS..Hα-helixtrans-66.6-39.8-179.2-178.90000111.4E653 Q654 E655 F659 V660 S661E653-S657 VanDerWaalsContact O-CB 3.27Å; E653-S657 WeakPolarHBondContact O-CB 3.3Å; E653-S657 PolarHBondContact O-N 3.05Å; Q654-S657 PolarHBondContact O-N 3.18Å; E655-S657 VanDerWaalsContact C-N 3.28Å; E655-S657 PolarHBondContact O-N 3.17Å; S657-F659 VanDerWaalsContact C-N 3.32Å; S657-F659 PolarHBondContact O-N 3.02Å; S657-V660 PolarHBondContact O-N 3.2Å; S657-S661 WeakPolarHBondContact O-CB 3.27Å; S657-S661 PolarHBondContact O-N 3.34Å; S657-S661 PolarHBondContact O-OG 3.06Å
658A71.8Confident71.7Confident35 Ų3553.3 Ų53.329%0.28927%0.269SS..Hα-helixtrans-61.6-41.9171.800000111.1Q654 E655 V656 S661 L662Q654-A658 PolarHBondContact O-N 3.24Å; E655-A658 PolarHBondContact O-N 3.38Å; V656-A658 VanDerWaalsContact C-N 3.34Å; V656-A658 PolarHBondContact O-N 2.94Å; A658-S661 WeakPolarHBondContact O-CB 3.29Å; A658-S661 PolarHBondContact O-N 3.27Å; A658-L662 VanDerWaalsContact O-CG 3.24Å; A658-L662 WeakPolarHBondContact O-CG 3.22Å; A658-L662 PolarHBondContact O-N 3.36Å
659F74.7Confident72Confident7.66667 Ų7.6666750.3 Ų50.33%0.03426%0.259CS..Hα-helixtrans-65.5-41.4176.5-73.1-63.1000113.5Q623 I626 I636 L640 E655 V656 S657 S661 L662 V663 Y674 L675 L678Q623-F659 HydrophobicContact CG-CZ 4.25Å; I626-F659 HydrophobicContact CD1-CD1 4.39Å; I626-F659 HydrophobicContact CD1-CE1 4.14Å; I636-F659 HydrophobicContact CG2-CE1 4.34Å; I636-F659 HydrophobicContact CG2-CZ 4.09Å; L640-F659 HydrophobicContact CD1-CZ 4.38Å; E655-F659 HydrophobicContact CB-CE2 4.37Å; E655-F659 WeakPolarHBondContact O-CD2 3.24Å; E655-F659 PolarHBondContact O-N 3.11Å; V656-F659 WeakPolarHBondContact O-CA 3.43Å; V656-F659 WeakPolarHBondContact O-CB 3.34Å; V656-F659 PolarHBondContact O-N 3.2Å; S657-F659 VanDerWaalsContact C-N 3.32Å; S657-F659 PolarHBondContact O-N 3.02Å; F659-S661 VanDerWaalsContact C-N 3.29Å; F659-S661 PolarHBondContact O-N 2.89Å; F659-L662 HydrophobicContact CD1-CD1 4.07Å; F659-L662 HydrophobicContact CE1-CD1 4.32Å; F659-L662 WeakPolarHBondContact O-CA 3.44Å; F659-L662 WeakPolarHBondContact O-CB 3.36Å; F659-L662 PolarHBondContact O-N 3.01Å; F659-L662 VanDerWaalsContact O-N 3.1Å; F659-V663 WeakPolarHBondContact O-CG2 3.43Å; F659-V663 PolarHBondContact O-N 3.32Å; F659-Y674 AromaticContact CD1-CD1 3.8Å; F659-Y674 HydrophobicContact CD1-CD1 3.8Å; F659-Y674 AromaticContact CD1-CE1 3.43Å; F659-Y674 HydrophobicContact CD1-CE1 3.43Å; F659-Y674 VanDerWaalsContact CD1-CE1 3.43Å; F659-Y674 HydrophobicContact CD2-CD1 4.48Å; F659-Y674 AromaticContact CD2-CE1 3.64Å; F659-Y674 HydrophobicContact CD2-CE1 3.64Å; F659-Y674 AromaticContact CE1-CD1 3.96Å; F659-Y674 HydrophobicContact CE1-CD1 3.96Å; F659-Y674 AromaticContact CE1-CE1 3.26Å; F659-Y674 HydrophobicContact CE1-CE1 3.26Å; F659-Y674 HydrophobicContact CE1-CE2 4.43Å; F659-Y674 AromaticContact CE1-CZ 3.53Å; F659-Y674 AromaticContact CE2-CE1 3.5Å; F659-Y674 HydrophobicContact CE2-CE1 3.5Å; F659-Y674 VanDerWaalsContact CE2-CE1 3.5Å; F659-Y674 AromaticContact CE2-CZ 3.84Å; F659-Y674 WeakPolarHBondContact CE2-OH 3.16Å; F659-Y674 HydrophobicContact CG-CD1 4.1Å; F659-Y674 AromaticContact CG-CE1 3.65Å; F659-Y674 HydrophobicContact CG-CE1 3.65Å; F659-Y674 HydrophobicContact CZ-CD1 4.42Å; F659-Y674 AromaticContact CZ-CE1 3.33Å; F659-Y674 HydrophobicContact CZ-CE1 3.33Å; F659-Y674 HydrophobicContact CZ-CE2 4.5Å; F659-Y674 AromaticContact CZ-CZ 3.37Å; F659-Y674 WeakPolarHBondContact CZ-OH 3.21Å; F659-L675 HydrophobicContact CB-CD2 3.96Å; F659-L678 HydrophobicContact CD2-CD1 4.13Å; F659-L678 HydrophobicContact CE2-CD1 4.25Å
660V75.9Confident72.2Confident7 Ų745.4 Ų45.44%0.04224%0.235CC..Hα-helixtrans-63.2-39.7175175.70000110.6V656 S657 L662 V663 R664 Q696 N702 L705V656-V660 HydrophobicContact CG1-CG2 4.43Å; V656-V660 WeakPolarHBondContact O-CG2 3.33Å; V656-V660 PolarHBondContact O-N 2.98Å; S657-V660 PolarHBondContact O-N 3.2Å; V660-L662 VanDerWaalsContact C-N 3.27Å; V660-L662 PolarHBondContact O-N 3.14Å; V660-V663 PolarHBondContact O-N 3.44Å; V660-R664 PolarHBondContact O-N 3.18Å; V660-R664 VanDerWaalsContact O-N 3.1Å; V660-Q696 HydrophobicContact CG2-CB 4.2Å; V660-N702 WeakPolarHBondContact CG1-ND2 3.39Å; V660-L705 HydrophobicContact CG1-CD1 4.12Å
661S73.7Confident72.5Confident58 Ų5841.4 Ų41.441%0.40622%0.22SC..Hα-helixtrans-61.5-36.7173-55.20000111.9S657 A658 F659 R664 D665S657-S661 WeakPolarHBondContact O-CB 3.27Å; S657-S661 PolarHBondContact O-N 3.34Å; S657-S661 PolarHBondContact O-OG 3.06Å; A658-S661 WeakPolarHBondContact O-CB 3.29Å; A658-S661 PolarHBondContact O-N 3.27Å; F659-S661 VanDerWaalsContact C-N 3.29Å; F659-S661 PolarHBondContact O-N 2.89Å; S661-R664 WeakPolarHBondContact O-CB 3.25Å; S661-R664 PolarHBondContact O-N 3.14Å; S661-D665 PolarHBondContact O-N 3.22Å
662L70.8Confident72.9Confident19.6667 Ų19.666740.8 Ų40.810%0.10322%0.217CC..Hα-helixtrans-70.3-34.5176.7-71.2166000113.6I626 A658 F659 V660 R664 D665 N666 F671I626-L662 HydrophobicContact CB-CD1 3.98Å; I626-L662 HydrophobicContact CB-CD2 3.87Å; I626-L662 HydrophobicContact CD1-CD1 3.38Å; I626-L662 HydrophobicContact CG1-CD1 4.25Å; I626-L662 HydrophobicContact CG2-CD1 3.88Å; I626-L662 HydrophobicContact CG2-CD2 3.59Å; I626-L662 HydrophobicContact CG2-CG 4.25Å; A658-L662 VanDerWaalsContact O-CG 3.24Å; A658-L662 WeakPolarHBondContact O-CG 3.22Å; A658-L662 PolarHBondContact O-N 3.36Å; F659-L662 HydrophobicContact CD1-CD1 4.07Å; F659-L662 HydrophobicContact CE1-CD1 4.32Å; F659-L662 WeakPolarHBondContact O-CA 3.44Å; F659-L662 WeakPolarHBondContact O-CB 3.36Å; F659-L662 PolarHBondContact O-N 3.01Å; F659-L662 VanDerWaalsContact O-N 3.1Å; V660-L662 VanDerWaalsContact C-N 3.27Å; V660-L662 PolarHBondContact O-N 3.14Å; L662-R664 VanDerWaalsContact C-N 3.27Å; L662-D665 PolarHBondContact O-N 3.18Å; L662-N666 PolarHBondContact O-N 3.05Å; L662-F671 HydrophobicContact CB-CD1 4.37Å
663V74.7Confident73.1Confident1 Ų143.2 Ų43.21%0.00622%0.223CC..Hα-helixtrans-62.4-39.5170.9175.30000110F659 V660 N666 I667 F671 L672 L675 L705F659-V663 WeakPolarHBondContact O-CG2 3.43Å; F659-V663 PolarHBondContact O-N 3.32Å; V660-V663 PolarHBondContact O-N 3.44Å; V663-N666 CarbonylContact O-C 3.54Å; V663-N666 VanDerWaalsContact O-C 3.25Å; V663-N666 VanDerWaalsContact O-O 3.13Å; V663-I667 PolarHBondContact O-N 2.95Å; V663-F671 HydrophobicContact CG2-CB 3.69Å; V663-L672 HydrophobicContact CG1-CD2 4.07Å; V663-L672 HydrophobicContact CG2-CD2 4.36Å; V663-L675 HydrophobicContact CG2-CD1 4.1Å; V663-L705 HydrophobicContact CG1-CD1 4.38Å
664R72.9Confident73.3Confident85 Ų8537.6 Ų37.632%0.32120%0.197SC..Hα-helixtrans-66.2-43.2175.9-175.5175.4-74.4-120.1-2112.4V660 S661 L662 N701 N702 D704 L705V660-R664 PolarHBondContact O-N 3.18Å; V660-R664 VanDerWaalsContact O-N 3.1Å; S661-R664 WeakPolarHBondContact O-CB 3.25Å; S661-R664 PolarHBondContact O-N 3.14Å; L662-R664 VanDerWaalsContact C-N 3.27Å; R664-N701 PolarHBondContact NH2-O 2.87Å; R664-N702 PolarHBondContact NH2-OD1 3.08Å; R664-D704 IonicContact CZ-OD1 3.3Å; R664-D704 IonicContact CZ-OD2 3.15Å; R664-D704 IonicContact NE-OD2 2.76Å; R664-D704 IonicContact NH1-OD1 2.95Å; R664-D704 IonicContact NH1-OD2 3.33Å; R664-D704 PolarHBondContact NH1-OD2 3.42Å; R664-D704 IonicContact NH2-OD1 3.18Å; R664-D704 PolarHBondContact NH2-OD1 3.13Å; R664-D704 IonicContact NH2-OD2 2.73Å; R664-D704 PolarHBondContact NH2-OD2 3.22Å; R664-L705 HydrophobicContact CB-CD1 4.32Å; R664-L705 HydrophobicContact CB-CD2 3.82Å; R664-L705 HydrophobicContact CG-CD2 4.09Å
665D65.8Low73.6Confident93 Ų9330 Ų3050%0.49716%0.161SC..Hα-helixtrans-71-33.6179-72.6-11.7000112.6N543 S661 L662N543-D665 PolarHBondContact ND2-O 3.13Å; S661-D665 PolarHBondContact O-N 3.22Å; L662-D665 PolarHBondContact O-N 3.18Å
666N64.5Low74Confident7.66667 Ų7.6666729.2 Ų29.24%0.04116%0.159CC..SBendtrans-134.195.7-177.5-57.4-80.9000110.2S538 T539 L662 V663 E668 F671S538-N666 PolarHBondContact OG-OD1 3.15Å; T539-N666 PolarHBondContact N-OD1 2.84Å; T539-N666 PolarHBondContact OG1-OD1 3.45Å; L662-N666 PolarHBondContact O-N 3.05Å; V663-N666 CarbonylContact O-C 3.54Å; V663-N666 VanDerWaalsContact O-C 3.25Å; V663-N666 VanDerWaalsContact O-O 3.13Å; N666-E668 VanDerWaalsContact C-N 3.33Å; N666-E668 PolarHBondContact O-N 3.31Å; N666-F671 HydrophobicContact CB-CD2 3.95Å; N666-F671 HydrophobicContact CB-CE2 3.3Å; N666-F671 HydrophobicContact CB-CZ 3.91Å; N666-F671 VanDerWaalsContact O-CD2 3.26Å; N666-F671 WeakPolarHBondContact O-CD2 3.2Å
667I69.3Low74Confident14 Ų1429.9 Ų29.97%0.07217%0.165CC..  trans-74.487.9-179.9-54.2165.9000110.1S540 V663 W730 Q732 L735 I736 Y796S540-I667 PolarHBondContact OG-O 2.93Å; V663-I667 PolarHBondContact O-N 2.95Å; I667-W730 HydrophobicContact CD1-CH2 4.29Å; I667-W730 HydrophobicContact CD1-CZ2 4.04Å; I667-W730 HydrophobicContact CG2-CH2 3.6Å; I667-W730 HydrophobicContact CG2-CZ2 3.61Å; I667-Q732 HydrophobicContact CD1-CG 4.42Å; I667-Q732 VanDerWaalsContact CD1-NE2 3.3Å; I667-L735 HydrophobicContact CD1-CD1 3.94Å; I667-L735 HydrophobicContact CG1-CD1 4.25Å; I667-I736 HydrophobicContact CD1-CD1 3.96Å; I667-I736 HydrophobicContact CD1-CG1 4.49Å; I667-Y796 HydrophobicContact CG2-CD2 3.87Å; I667-Y796 HydrophobicContact CG2-CE1 4.36Å; I667-Y796 HydrophobicContact CG2-CE2 3.58Å; I667-Y796 HydrophobicContact CG2-CG 4.38Å
668E67.4Low74.1Confident20.3333 Ų20.333327.3 Ų27.310%0.09515%0.147CC..  trans-144.4144-179.9-63.4179.7162.900112.7T539 S540 I541 V542 N666 R670 F671T539-E668 VanDerWaalsContact O-OE1 3.1Å; S540-E668 VanDerWaalsContact CA-OE1 3.26Å; S540-E668 WeakPolarHBondContact CA-OE1 3.29Å; S540-E668 WeakPolarHBondContact CB-OE1 3.35Å; S540-E668 VanDerWaalsContact OG-CG 3.31Å; S540-E668 WeakPolarHBondContact OG-CG 3.02Å; S540-E668 PolarHBondContact OG-OE1 3.26Å; I541-E668 PolarHBondContact N-OE1 3.01Å; V542-E668 HydrophobicContact CG2-CG 3.83Å; N666-E668 VanDerWaalsContact C-N 3.33Å; N666-E668 PolarHBondContact O-N 3.31Å; E668-R670 HydrophobicContact CB-CG 3.99Å; E668-R670 VanDerWaalsContact CD-NH2 3.29Å; E668-R670 PolarHBondContact O-N 3.14Å; E668-R670 VanDerWaalsContact O-N 3.07Å; E668-R670 IonicContact OE1-CZ 2.7Å; E668-R670 IonicContact OE1-NE 3.65Å; E668-R670 PolarHBondContact OE1-NE 3.23Å; E668-R670 IonicContact OE1-NH2 3.46Å; E668-R670 PolarHBondContact OE1-NH2 3.42Å; E668-R670 WeakPolarHBondContact OE2-CD 3.23Å; E668-R670 IonicContact OE2-CZ 3.4Å; E668-R670 IonicContact OE2-NE 3.05Å; E668-R670 PolarHBondContact OE2-NE 3.08Å; E668-R670 IonicContact OE2-NH1 3.28Å; E668-R670 IonicContact OE2-NH2 3.32Å; E668-R670 PolarHBondContact OE2-NH2 3.09Å; E668-R670 VanDerWaalsContact OE2-NH2 3.11Å; E668-F671 HydrophobicContact CB-CD2 3.95Å; E668-F671 HydrophobicContact CB-CE2 4.18Å; E668-F671 HydrophobicContact CG-CE2 4.47Å; E668-F671 PolarHBondContact O-N 3.37Å; E668-F671 VanDerWaalsContact O-N 3.13Å; E668-F671 VanDerWaalsContact OE2-CE2 3.28Å; E668-F671 WeakPolarHBondContact OE2-CE2 3.4Å
669A75.3Confident74.3Confident19.6667 Ų19.666725.7 Ų25.716%0.16313%0.133CC..Hα-helixtrans-52.6-34-179.800000112.9F671 L672 N673 D795 A799A669-F671 VanDerWaalsContact C-N 3.31Å; A669-F671 PolarHBondContact O-N 3.22Å; A669-L672 PolarHBondContact O-N 2.93Å; A669-N673 WeakPolarHBondContact O-CB 3.28Å; A669-N673 VanDerWaalsContact O-CG 3.27Å; A669-N673 PolarHBondContact O-N 3.35Å; A669-N673 PolarHBondContact O-ND2 3.41Å; A669-D795 VanDerWaalsContact CB-C 3.5Å; A669-D795 HydrophobicContact CB-CB 4.18Å; A669-D795 WeakPolarHBondContact CB-O 3.39Å; A669-A799 HydrophobicContact CB-CB 3.94Å
670R74.8Confident74.2Confident79 Ų7926.4 Ų26.430%0.29814%0.139SC..Hα-helixtrans-59.5-37.2-179.666.6-179.9177179.3-7.5113T539 E668 L672 N673 Y674T539-R670 VanDerWaalsContact CB-NH2 3.3Å; T539-R670 PolarHBondContact OG1-NH2 2.83Å; T539-R670 VanDerWaalsContact OG1-NH2 3.08Å; E668-R670 HydrophobicContact CB-CG 3.99Å; E668-R670 VanDerWaalsContact CD-NH2 3.29Å; E668-R670 PolarHBondContact O-N 3.14Å; E668-R670 VanDerWaalsContact O-N 3.07Å; E668-R670 IonicContact OE1-CZ 2.7Å; E668-R670 IonicContact OE1-NE 3.65Å; E668-R670 PolarHBondContact OE1-NE 3.23Å; E668-R670 IonicContact OE1-NH2 3.46Å; E668-R670 PolarHBondContact OE1-NH2 3.42Å; E668-R670 WeakPolarHBondContact OE2-CD 3.23Å; E668-R670 IonicContact OE2-CZ 3.4Å; E668-R670 IonicContact OE2-NE 3.05Å; E668-R670 PolarHBondContact OE2-NE 3.08Å; E668-R670 IonicContact OE2-NH1 3.28Å; E668-R670 IonicContact OE2-NH2 3.32Å; E668-R670 PolarHBondContact OE2-NH2 3.09Å; E668-R670 VanDerWaalsContact OE2-NH2 3.11Å; R670-L672 PolarHBondContact O-N 2.7Å; R670-N673 WeakPolarHBondContact O-CA 3.36Å; R670-N673 VanDerWaalsContact O-CB 3.31Å; R670-N673 WeakPolarHBondContact O-CB 3.24Å; R670-N673 PolarHBondContact O-N 3.16Å; R670-N673 VanDerWaalsContact O-N 3.08Å; R670-Y674 HydrophobicContact CB-CE2 4.25Å; R670-Y674 HydrophobicContact CG-CE2 4.45Å; R670-Y674 WeakPolarHBondContact O-CD1 3.48Å; R670-Y674 VanDerWaalsContact O-CD2 3.29Å; R670-Y674 WeakPolarHBondContact O-CD2 3.39Å; R670-Y674 WeakPolarHBondContact O-CE1 3.44Å; R670-Y674 WeakPolarHBondContact O-CE2 3.45Å; R670-Y674 PolarHBondContact O-N 3.14Å; R670-Y674 VanDerWaalsContact O-N 3.09Å
671F75.6Confident73.6Confident6.33333 Ų6.3333326.3 Ų26.33%0.02814%0.139CC..Hα-helixtrans-73.4-35.3-179.8-62.8-72.5000112.1I626 L662 V663 N666 E668 A669 N673 Y674 L675I626-F671 HydrophobicContact CG2-CE1 3.7Å; I626-F671 HydrophobicContact CG2-CZ 4.2Å; L662-F671 HydrophobicContact CB-CD1 4.37Å; V663-F671 HydrophobicContact CG2-CB 3.69Å; N666-F671 HydrophobicContact CB-CD2 3.95Å; N666-F671 HydrophobicContact CB-CE2 3.3Å; N666-F671 HydrophobicContact CB-CZ 3.91Å; N666-F671 VanDerWaalsContact O-CD2 3.26Å; N666-F671 WeakPolarHBondContact O-CD2 3.2Å; E668-F671 HydrophobicContact CB-CD2 3.95Å; E668-F671 HydrophobicContact CB-CE2 4.18Å; E668-F671 HydrophobicContact CG-CE2 4.47Å; E668-F671 PolarHBondContact O-N 3.37Å; E668-F671 VanDerWaalsContact O-N 3.13Å; E668-F671 VanDerWaalsContact OE2-CE2 3.28Å; E668-F671 WeakPolarHBondContact OE2-CE2 3.4Å; A669-F671 VanDerWaalsContact C-N 3.31Å; A669-F671 PolarHBondContact O-N 3.22Å; F671-N673 VanDerWaalsContact C-N 3.32Å; F671-Y674 HydrophobicContact CB-CD2 4.34Å; F671-Y674 AromaticContact CD1-CD2 3.66Å; F671-Y674 HydrophobicContact CD1-CD2 4.04Å; F671-Y674 AromaticContact CD1-CE2 3.61Å; F671-Y674 HydrophobicContact CD1-CE2 3.61Å; F671-Y674 HydrophobicContact CE1-CD2 4.38Å; F671-Y674 AromaticContact CE1-CE2 3.94Å; F671-Y674 HydrophobicContact CE1-CE2 3.94Å; F671-Y674 HydrophobicContact CG-CD2 4.31Å; F671-Y674 HydrophobicContact CG-CE2 4.32Å; F671-Y674 WeakPolarHBondContact O-CB 3.17Å; F671-Y674 PolarHBondContact O-N 3.15Å; F671-Y674 VanDerWaalsContact O-N 3.12Å; F671-L675 PolarHBondContact O-N 3.45Å; F671-L675 VanDerWaalsContact O-N 3.1Å
672L79.9Confident72.9Confident1.33333 Ų1.3333328.1 Ų28.11%0.00715%0.15CC..Hα-helixtrans-65.8-40.7169.5-65.3-178000111.4V663 A669 R670 Y674 L675 S676 Y796 A799 Q800 L803V663-L672 HydrophobicContact CG1-CD2 4.07Å; V663-L672 HydrophobicContact CG2-CD2 4.36Å; A669-L672 PolarHBondContact O-N 2.93Å; R670-L672 PolarHBondContact O-N 2.7Å; L672-Y674 PolarHBondContact O-N 2.96Å; L672-L675 HydrophobicContact CD2-CD1 4.33Å; L672-L675 WeakPolarHBondContact O-CB 3.28Å; L672-L675 PolarHBondContact O-N 2.98Å; L672-S676 WeakPolarHBondContact O-CB 3.48Å; L672-S676 PolarHBondContact O-N 3.26Å; L672-S676 PolarHBondContact O-OG 3.33Å; L672-S676 VanDerWaalsContact O-OG 3.1Å; L672-Y796 HydrophobicContact CD1-CD1 4.22Å; L672-Y796 HydrophobicContact CD1-CD2 3.88Å; L672-Y796 HydrophobicContact CD1-CE1 3.92Å; L672-Y796 HydrophobicContact CD1-CE2 3.55Å; L672-Y796 HydrophobicContact CD1-CG 4.2Å; L672-Y796 HydrophobicContact CG-CD2 4.46Å; L672-Y796 HydrophobicContact CG-CE2 3.93Å; L672-A799 HydrophobicContact CB-CB 3.9Å; L672-A799 HydrophobicContact CD1-CB 4.28Å; L672-Q800 HydrophobicContact CD1-CB 3.88Å; L672-L803 HydrophobicContact CD2-CD2 3.98Å
673N76.9Confident72.6Confident74.3333 Ų74.333329.6 Ų29.640%0.39817%0.171SC..Hα-helixtrans-61.5-26.2173.3-67.2-24.6000112.7A669 R670 F671 S676 A677 A799A669-N673 WeakPolarHBondContact O-CB 3.28Å; A669-N673 VanDerWaalsContact O-CG 3.27Å; A669-N673 PolarHBondContact O-N 3.35Å; A669-N673 PolarHBondContact O-ND2 3.41Å; R670-N673 WeakPolarHBondContact O-CA 3.36Å; R670-N673 VanDerWaalsContact O-CB 3.31Å; R670-N673 WeakPolarHBondContact O-CB 3.24Å; R670-N673 PolarHBondContact O-N 3.16Å; R670-N673 VanDerWaalsContact O-N 3.08Å; F671-N673 VanDerWaalsContact C-N 3.32Å; N673-S676 VanDerWaalsContact CA-OG 3.27Å; N673-S676 WeakPolarHBondContact CA-OG 3.46Å; N673-S676 WeakPolarHBondContact O-CB 3.32Å; N673-S676 PolarHBondContact O-OG 2.86Å; N673-A677 WeakPolarHBondContact O-CB 3.43Å; N673-A677 PolarHBondContact O-N 3.28Å; N673-A677 VanDerWaalsContact O-N 3.12Å; N673-A799 VanDerWaalsContact OD1-CB 3.3Å; N673-A799 WeakPolarHBondContact OD1-CB 3.39Å
674Y76Confident72.5Confident16.3333 Ų16.333332.5 Ų32.56%0.06419%0.188CC..Hα-helixtrans-71.2-48171.6-93.3-73.1000111.4S633 E634 I636 T637 L640 F659 R670 F671 L672 S676 A677 L678S633-Y674 VanDerWaalsContact C-CZ 3.47Å; S633-Y674 VanDerWaalsContact CB-OH 3.25Å; S633-Y674 WeakPolarHBondContact CB-OH 3.33Å; S633-Y674 WeakPolarHBondContact O-CE1 3.41Å; S633-Y674 PolarHBondContact O-OH 3.44Å; S633-Y674 VanDerWaalsContact O-OH 3.12Å; S633-Y674 PolarHBondContact OG-OH 3.05Å; S633-Y674 VanDerWaalsContact OG-OH 3.09Å; E634-Y674 WeakPolarHBondContact CA-OH 3.34Å; E634-Y674 PolarHBondContact N-OH 3.05Å; I636-Y674 HydrophobicContact CB-CE2 3.99Å; I636-Y674 HydrophobicContact CG2-CE2 3.63Å; I636-Y674 WeakPolarHBondContact CG2-OH 3.38Å; T637-Y674 VanDerWaalsContact CB-CD1 3.44Å; T637-Y674 HydrophobicContact CG2-CD1 3.76Å; T637-Y674 HydrophobicContact CG2-CD2 4.07Å; T637-Y674 HydrophobicContact CG2-CE1 4.09Å; T637-Y674 WeakPolarHBondContact OG1-CD1 3.11Å; T637-Y674 VanDerWaalsContact OG1-CD2 3.32Å; T637-Y674 WeakPolarHBondContact OG1-CD2 3.49Å; T637-Y674 WeakPolarHBondContact OG1-CE1 3.39Å; T637-Y674 PolarHBondContact OG1-OH 3.44Å; L640-Y674 HydrophobicContact CD1-CE2 4.28Å; L640-Y674 WeakPolarHBondContact CD1-OH 3.49Å; F659-Y674 AromaticContact CD1-CD1 3.8Å; F659-Y674 HydrophobicContact CD1-CD1 3.8Å; F659-Y674 AromaticContact CD1-CE1 3.43Å; F659-Y674 HydrophobicContact CD1-CE1 3.43Å; F659-Y674 VanDerWaalsContact CD1-CE1 3.43Å; F659-Y674 HydrophobicContact CD2-CD1 4.48Å; F659-Y674 AromaticContact CD2-CE1 3.64Å; F659-Y674 HydrophobicContact CD2-CE1 3.64Å; F659-Y674 AromaticContact CE1-CD1 3.96Å; F659-Y674 HydrophobicContact CE1-CD1 3.96Å; F659-Y674 AromaticContact CE1-CE1 3.26Å; F659-Y674 HydrophobicContact CE1-CE1 3.26Å; F659-Y674 HydrophobicContact CE1-CE2 4.43Å; F659-Y674 AromaticContact CE1-CZ 3.53Å; F659-Y674 AromaticContact CE2-CE1 3.5Å; F659-Y674 HydrophobicContact CE2-CE1 3.5Å; F659-Y674 VanDerWaalsContact CE2-CE1 3.5Å; F659-Y674 AromaticContact CE2-CZ 3.84Å; F659-Y674 WeakPolarHBondContact CE2-OH 3.16Å; F659-Y674 HydrophobicContact CG-CD1 4.1Å; F659-Y674 AromaticContact CG-CE1 3.65Å; F659-Y674 HydrophobicContact CG-CE1 3.65Å; F659-Y674 HydrophobicContact CZ-CD1 4.42Å; F659-Y674 AromaticContact CZ-CE1 3.33Å; F659-Y674 HydrophobicContact CZ-CE1 3.33Å; F659-Y674 HydrophobicContact CZ-CE2 4.5Å; F659-Y674 AromaticContact CZ-CZ 3.37Å; F659-Y674 WeakPolarHBondContact CZ-OH 3.21Å; R670-Y674 HydrophobicContact CB-CE2 4.25Å; R670-Y674 HydrophobicContact CG-CE2 4.45Å; R670-Y674 WeakPolarHBondContact O-CD1 3.48Å; R670-Y674 VanDerWaalsContact O-CD2 3.29Å; R670-Y674 WeakPolarHBondContact O-CD2 3.39Å; R670-Y674 WeakPolarHBondContact O-CE1 3.44Å; R670-Y674 WeakPolarHBondContact O-CE2 3.45Å; R670-Y674 PolarHBondContact O-N 3.14Å; R670-Y674 VanDerWaalsContact O-N 3.09Å; F671-Y674 HydrophobicContact CB-CD2 4.34Å; F671-Y674 AromaticContact CD1-CD2 3.66Å; F671-Y674 HydrophobicContact CD1-CD2 4.04Å; F671-Y674 AromaticContact CD1-CE2 3.61Å; F671-Y674 HydrophobicContact CD1-CE2 3.61Å; F671-Y674 HydrophobicContact CE1-CD2 4.38Å; F671-Y674 AromaticContact CE1-CE2 3.94Å; F671-Y674 HydrophobicContact CE1-CE2 3.94Å; F671-Y674 HydrophobicContact CG-CD2 4.31Å; F671-Y674 HydrophobicContact CG-CE2 4.32Å; F671-Y674 WeakPolarHBondContact O-CB 3.17Å; F671-Y674 PolarHBondContact O-N 3.15Å; F671-Y674 VanDerWaalsContact O-N 3.12Å; L672-Y674 PolarHBondContact O-N 2.96Å; Y674-S676 PolarHBondContact O-N 2.98Å; Y674-A677 CarbonylContact O-C 3.49Å; Y674-A677 WeakPolarHBondContact O-CA 3.44Å; Y674-A677 WeakPolarHBondContact O-CB 3.31Å; Y674-A677 PolarHBondContact O-N 3.31Å; Y674-A677 VanDerWaalsContact O-N 3.14Å; Y674-L678 HydrophobicContact CD1-CD1 4.2Å; Y674-L678 HydrophobicContact CD1-CG 4.29Å; Y674-L678 HydrophobicContact CE1-CD1 3.74Å; Y674-L678 HydrophobicContact CE1-CD2 4.05Å; Y674-L678 HydrophobicContact CE1-CG 3.92Å; Y674-L678 WeakPolarHBondContact O-CG 3.42Å; Y674-L678 PolarHBondContact O-N 2.94Å; Y674-L678 VanDerWaalsContact O-N 3.07Å
675L80.3Confident72.5Confident0.333333 Ų0.33333328.5 Ų28.50%0.00217%0.173CC..Hα-helixtrans-56.8-39.2173.7-66.9178.3000110.6F659 V663 F671 L672 A677 L678 C679 I693 L697 L803F659-L675 HydrophobicContact CB-CD2 3.96Å; V663-L675 HydrophobicContact CG2-CD1 4.1Å; F671-L675 PolarHBondContact O-N 3.45Å; F671-L675 VanDerWaalsContact O-N 3.1Å; L672-L675 HydrophobicContact CD2-CD1 4.33Å; L672-L675 WeakPolarHBondContact O-CB 3.28Å; L672-L675 PolarHBondContact O-N 2.98Å; L675-A677 VanDerWaalsContact C-N 3.33Å; L675-A677 PolarHBondContact O-N 3.12Å; L675-L678 HydrophobicContact CD2-CD1 4.14Å; L675-L678 WeakPolarHBondContact O-CB 3.33Å; L675-L678 PolarHBondContact O-N 2.89Å; L675-L678 VanDerWaalsContact O-N 3.11Å; L675-C679 PolarHBondContact O-N 3.3Å; L675-C679 PolarHBondContact O-SG 3.27Å; L675-I693 HydrophobicContact CD2-CG1 4.47Å; L675-L697 HydrophobicContact CD1-CD2 4.38Å; L675-L803 HydrophobicContact CB-CD1 3.82Å; L675-L803 HydrophobicContact CB-CD2 4.02Å; L675-L803 HydrophobicContact CD1-CD2 4.14Å
676S81.3Confident73Confident12 Ų1224.1 Ų24.18%0.08415%0.15CC..Hα-helixtrans-62.3-40.6175.5-36.40000112.3L672 N673 Y674 L678 C679 L803L672-S676 WeakPolarHBondContact O-CB 3.48Å; L672-S676 PolarHBondContact O-N 3.26Å; L672-S676 PolarHBondContact O-OG 3.33Å; L672-S676 VanDerWaalsContact O-OG 3.1Å; N673-S676 VanDerWaalsContact CA-OG 3.27Å; N673-S676 WeakPolarHBondContact CA-OG 3.46Å; N673-S676 WeakPolarHBondContact O-CB 3.32Å; N673-S676 PolarHBondContact O-OG 2.86Å; Y674-S676 PolarHBondContact O-N 2.98Å; S676-L678 VanDerWaalsContact C-N 3.28Å; S676-L678 PolarHBondContact O-N 2.98Å; S676-C679 PolarHBondContact O-N 3.1Å; S676-L803 WeakPolarHBondContact OG-CA 3.4Å; S676-L803 WeakPolarHBondContact OG-CB 3.36Å
677A75.7Confident73.5Confident15 Ų1526.4 Ų26.412%0.12417%0.165CC..Hα-helixtrans-69.9-20.5175.200000113.8T637 N673 Y674 L675 S680T637-A677 HydrophobicContact CG2-CB 4.16Å; N673-A677 WeakPolarHBondContact O-CB 3.43Å; N673-A677 PolarHBondContact O-N 3.28Å; N673-A677 VanDerWaalsContact O-N 3.12Å; Y674-A677 CarbonylContact O-C 3.49Å; Y674-A677 WeakPolarHBondContact O-CA 3.44Å; Y674-A677 WeakPolarHBondContact O-CB 3.31Å; Y674-A677 PolarHBondContact O-N 3.31Å; Y674-A677 VanDerWaalsContact O-N 3.14Å; L675-A677 VanDerWaalsContact C-N 3.33Å; L675-A677 PolarHBondContact O-N 3.12Å; A677-S680 VanDerWaalsContact O-O 3.12Å
678L78.1Confident73.8Confident1.66667 Ų1.6666729.4 Ų29.41%0.00918%0.184CC..Hα-helixtrans-78.3-28.4172.1-64.7178000112.3L640 L647 V651 F659 Y674 L675 S676 T689 I693L640-L678 HydrophobicContact CB-CD2 4.48Å; L640-L678 HydrophobicContact CD1-CD2 3.6Å; L640-L678 VanDerWaalsContact CD1-CD2 3.42Å; L647-L678 HydrophobicContact CD2-CB 4.45Å; L647-L678 HydrophobicContact CD2-CD2 3.43Å; L647-L678 VanDerWaalsContact CD2-CD2 3.43Å; V651-L678 HydrophobicContact CG1-CD1 4.43Å; V651-L678 HydrophobicContact CG1-CD2 4.35Å; V651-L678 HydrophobicContact CG2-CD2 4.2Å; F659-L678 HydrophobicContact CD2-CD1 4.13Å; F659-L678 HydrophobicContact CE2-CD1 4.25Å; Y674-L678 HydrophobicContact CD1-CD1 4.2Å; Y674-L678 HydrophobicContact CD1-CG 4.29Å; Y674-L678 HydrophobicContact CE1-CD1 3.74Å; Y674-L678 HydrophobicContact CE1-CD2 4.05Å; Y674-L678 HydrophobicContact CE1-CG 3.92Å; Y674-L678 WeakPolarHBondContact O-CG 3.42Å; Y674-L678 PolarHBondContact O-N 2.94Å; Y674-L678 VanDerWaalsContact O-N 3.07Å; L675-L678 HydrophobicContact CD2-CD1 4.14Å; L675-L678 WeakPolarHBondContact O-CB 3.33Å; L675-L678 PolarHBondContact O-N 2.89Å; L675-L678 VanDerWaalsContact O-N 3.11Å; S676-L678 VanDerWaalsContact C-N 3.28Å; S676-L678 PolarHBondContact O-N 2.98Å; L678-T689 WeakPolarHBondContact O-CB 3.18Å; L678-T689 PolarHBondContact O-OG1 3.1Å; L678-I693 HydrophobicContact CB-CD1 3.87Å; L678-I693 HydrophobicContact CD1-CD1 4.43Å
679C75.8Confident74.3Confident0 Ų028.4 Ų28.40%018%0.179CC..Hα-helixtrans-74.1-27.6-177.8-63.60000113.1L675 S676 A685 I686 Q690 I693 L806 L807L675-C679 PolarHBondContact O-N 3.3Å; L675-C679 PolarHBondContact O-SG 3.27Å; S676-C679 PolarHBondContact O-N 3.1Å; C679-A685 WeakPolarHBondContact O-CA 3.39Å; C679-I686 PolarHBondContact O-N 2.94Å; C679-Q690 HydrophobicContact CB-CG 4.05Å; C679-I693 WeakPolarHBondContact SG-CD1 3.44Å; C679-L806 HydrophobicContact CB-CB 4.16Å; C679-L807 VanDerWaalsContact SG-CD2 3.52Å; C679-L807 WeakPolarHBondContact SG-CD2 3.34Å
680S73.4Confident74.7Confident22.3333 Ų22.333327.6 Ų27.616%0.15617%0.172CC..EExtended strand (participates in β ladder)trans-136.4147.4-173.766.20000113.3A677 V684A677-S680 VanDerWaalsContact O-O 3.12Å; S680-V684 CarbonylContact C-O 3.4Å; S680-V684 WeakPolarHBondContact CA-O 3.44Å
681S64.3Low74.8Confident5.33333 Ų5.3333325.3 Ų25.34%0.03717%0.165CC..EExtended strand (participates in β ladder)trans-131.6123.1171.1640000109.6R644 G683 V684R644-S681 WeakPolarHBondContact CB-OG 3.4Å; S681-G683 PolarHBondContact O-N 3.27Å; S681-G683 VanDerWaalsContact O-N 3.16Å; S681-V684 PolarHBondContact N-O 3.09Å; S681-V684 PolarHBondContact O-N 3Å
682C57.3Low75Confident95 Ų9526.9 Ų26.964%0.64217%0.173SC*.THydrogen-bonded Turntrans53.234.7-177.4-56.60000113.7N642 V684N642-C682 WeakPolarHBondContact OD1-CA 3.36Å; N642-C682 PolarHBondContact OD1-N 3.03Å; C682-V684 VanDerWaalsContact C-N 3.25Å; C682-V684 PolarHBondContact O-N 3.04Å
683G66.1Low75.1Confident52.6667 Ų52.666726.8 Ų26.854%0.54317%0.173SC..THydrogen-bonded Turntrans79.4-4.2-178.200000115.3S681 Q809S681-G683 PolarHBondContact O-N 3.27Å; S681-G683 VanDerWaalsContact O-N 3.16Å; G683-Q809 PolarHBondContact O-NE2 3.32Å
684V72.1Confident75.4Confident62 Ų6223.4 Ų23.438%0.37616%0.155SC..EExtended strand (participates in β ladder)trans-97.2133.3174.3-177.40000109.1S680 S681 C682 E810S680-V684 CarbonylContact C-O 3.4Å; S680-V684 WeakPolarHBondContact CA-O 3.44Å; S681-V684 PolarHBondContact N-O 3.09Å; S681-V684 PolarHBondContact O-N 3Å; C682-V684 VanDerWaalsContact C-N 3.25Å; C682-V684 PolarHBondContact O-N 3.04Å; V684-E810 WeakPolarHBondContact CG1-OE1 3.16Å
685A73.3Confident75.5Confident0 Ų028.3 Ų28.30%018%0.178CC..EExtended strand (participates in β ladder)trans-70.1154.4179.200000111.6C679 P687 Q809 E810C679-A685 WeakPolarHBondContact O-CA 3.39Å; A685-P687 WeakPolarHBondContact O-CD 3.47Å; A685-Q809 HydrophobicContact CB-CB 4.42Å; A685-Q809 HydrophobicContact CB-CG 4.26Å; A685-E810 HydrophobicContact CB-CB 4.11Å; A685-E810 HydrophobicContact CB-CG 4.08Å; A685-E810 PolarHBondContact N-OE1 3.29Å
686I75.2Confident75.4Confident0.666667 Ų0.66666729.5 Ų29.50%0.00318%0.183CC..  trans-113.999.2171.4-58.2175.8000107R644 L647 E648 C679 V688 T689 Q690R644-I686 HydrophobicContact CB-CD1 4.44Å; R644-I686 HydrophobicContact CG-CD1 4.17Å; R644-I686 HydrophobicContact CG-CG1 4.36Å; L647-I686 HydrophobicContact CB-CD1 3.66Å; L647-I686 HydrophobicContact CD1-CD1 3.42Å; L647-I686 VanDerWaalsContact CD1-CD1 3.44Å; L647-I686 HydrophobicContact CG-CD1 4.16Å; E648-I686 HydrophobicContact CG-CG2 4.01Å; C679-I686 PolarHBondContact O-N 2.94Å; I686-V688 VanDerWaalsContact C-N 3.27Å; I686-V688 PolarHBondContact O-N 2.93Å; I686-T689 WeakPolarHBondContact CB-OG1 3.16Å; I686-T689 HydrophobicContact CG2-CG2 4.02Å; I686-T689 WeakPolarHBondContact CG2-OG1 3.24Å; I686-T689 PolarHBondContact O-N 3.23Å; I686-T689 VanDerWaalsContact O-N 3.14Å; I686-T689 PolarHBondContact O-OG1 3.31Å; I686-Q690 PolarHBondContact O-N 3.14Å; I686-Q690 VanDerWaalsContact O-N 3.09Å
687P74.7Confident75.5Confident56 Ų5628.9 Ų28.936%0.36418%0.18SC..Hα-helixtrans-53.9-42.7-173.6-30.535.9000113.4A685 T689 Q690 E691A685-P687 WeakPolarHBondContact O-CD 3.47Å; P687-T689 PolarHBondContact O-N 3.34Å; P687-Q690 PolarHBondContact O-N 3.36Å; P687-E691 VanDerWaalsContact O-CG 3.32Å; P687-E691 WeakPolarHBondContact O-CG 3.32Å; P687-E691 PolarHBondContact O-N 2.97Å
688V75.5Confident75.7Confident76.3333 Ų76.333328.9 Ų28.946%0.46318%0.177SC..Hα-helixtrans-60.8-41.5-178.1-178.20000112.5I686 L692I686-V688 VanDerWaalsContact C-N 3.27Å; I686-V688 PolarHBondContact O-N 2.93Å; V688-L692 WeakPolarHBondContact O-CG 3.2Å; V688-L692 PolarHBondContact O-N 3.34Å
689T78.2Confident75.6Confident1 Ų130.6 Ų30.61%0.00619%0.189CC..Hα-helixtrans-77.8-36.318054.60000111.2L647 V651 L678 I686 P687 E691 L692 I693L647-T689 HydrophobicContact CB-CG2 4.41Å; V651-T689 HydrophobicContact CB-CG2 4.41Å; V651-T689 HydrophobicContact CG1-CG2 4.45Å; L678-T689 WeakPolarHBondContact O-CB 3.18Å; L678-T689 PolarHBondContact O-OG1 3.1Å; I686-T689 WeakPolarHBondContact CB-OG1 3.16Å; I686-T689 HydrophobicContact CG2-CG2 4.02Å; I686-T689 WeakPolarHBondContact CG2-OG1 3.24Å; I686-T689 PolarHBondContact O-N 3.23Å; I686-T689 VanDerWaalsContact O-N 3.14Å; I686-T689 PolarHBondContact O-OG1 3.31Å; P687-T689 PolarHBondContact O-N 3.34Å; T689-E691 VanDerWaalsContact C-N 3.34Å; T689-E691 PolarHBondContact O-N 3.37Å; T689-L692 PolarHBondContact O-N 3.29Å; T689-I693 WeakPolarHBondContact O-CD1 3.37Å; T689-I693 VanDerWaalsContact O-CG1 3.23Å; T689-I693 WeakPolarHBondContact O-CG1 3.34Å; T689-I693 PolarHBondContact O-N 3.02Å
690Q83.7Confident75.1Confident2.33333 Ų2.3333338.8 Ų38.81%0.01123%0.227CC..Hα-helixtrans-57.6-46.8171.7-71173.2-46.200111C679 I686 P687 L692 I693 C694 L806 L807 Q809 Q812C679-Q690 HydrophobicContact CB-CG 4.05Å; I686-Q690 PolarHBondContact O-N 3.14Å; I686-Q690 VanDerWaalsContact O-N 3.09Å; P687-Q690 PolarHBondContact O-N 3.36Å; Q690-L692 PolarHBondContact O-N 3.4Å; Q690-I693 PolarHBondContact O-N 3.28Å; Q690-C694 WeakPolarHBondContact O-CB 3.37Å; Q690-C694 PolarHBondContact O-N 3.25Å; Q690-C694 PolarHBondContact O-SG 3.17Å; Q690-L806 PolarHBondContact NE2-O 3.09Å; Q690-L807 HydrophobicContact CB-CD2 4.44Å; Q690-Q809 PolarHBondContact NE2-O 3.22Å; Q690-Q809 VanDerWaalsContact NE2-O 3.12Å; Q690-Q812 HydrophobicContact CB-CG 4.29Å
691E78.1Confident74.9Confident30 Ų3044.2 Ų44.214%0.1425%0.254CS..Hα-helixtrans-56.7-51177-74.2174.1-166.300111.3P687 T689 I693 C694 H695 Q812 I814 H1175P687-E691 VanDerWaalsContact O-CG 3.32Å; P687-E691 WeakPolarHBondContact O-CG 3.32Å; P687-E691 PolarHBondContact O-N 2.97Å; T689-E691 VanDerWaalsContact C-N 3.34Å; T689-E691 PolarHBondContact O-N 3.37Å; E691-I693 VanDerWaalsContact C-N 3.31Å; E691-I693 PolarHBondContact O-N 3.27Å; E691-C694 PolarHBondContact O-N 3.04Å; E691-H695 PolarHBondContact O-N 3.13Å; E691-H695 PolarHBondContact O-ND1 3.1Å; E691-Q812 VanDerWaalsContact CG-NE2 3.28Å; E691-I814 HydrophobicContact CG-CD1 4.19Å; E691-H1175 IonicContact OE2-CE1 3.23Å; E691-H1175 IonicContact OE2-NE2 2.62Å
692L79.1Confident75.4Confident39.6667 Ų39.666744.8 Ų44.821%0.20826%0.257CS..Hα-helixtrans-59.7-41.6179.8-71.2172.2000112.1E653 V656 V688 T689 Q690 Q696E653-L692 HydrophobicContact CB-CD2 4.16Å; E653-L692 HydrophobicContact CG-CD2 4.48Å; V656-L692 HydrophobicContact CG2-CB 4.22Å; V688-L692 WeakPolarHBondContact O-CG 3.2Å; V688-L692 PolarHBondContact O-N 3.34Å; T689-L692 PolarHBondContact O-N 3.29Å; Q690-L692 PolarHBondContact O-N 3.4Å; L692-Q696 WeakPolarHBondContact O-CG 3.3Å; L692-Q696 PolarHBondContact O-N 3.26Å
693I82.4Confident75.9Confident0 Ų042.8 Ų42.80%024%0.238CC..Hα-helixtrans-68-41.2177.8-64.8163.3000110.5V656 L675 L678 C679 T689 Q690 E691 Q696 L697 L807V656-I693 HydrophobicContact CG1-CB 4.42Å; V656-I693 HydrophobicContact CG1-CG1 3.68Å; V656-I693 HydrophobicContact CG2-CG1 4.42Å; L675-I693 HydrophobicContact CD2-CG1 4.47Å; L678-I693 HydrophobicContact CB-CD1 3.87Å; L678-I693 HydrophobicContact CD1-CD1 4.43Å; C679-I693 WeakPolarHBondContact SG-CD1 3.44Å; T689-I693 WeakPolarHBondContact O-CD1 3.37Å; T689-I693 VanDerWaalsContact O-CG1 3.23Å; T689-I693 WeakPolarHBondContact O-CG1 3.34Å; T689-I693 PolarHBondContact O-N 3.02Å; Q690-I693 PolarHBondContact O-N 3.28Å; E691-I693 VanDerWaalsContact C-N 3.31Å; E691-I693 PolarHBondContact O-N 3.27Å; I693-Q696 PolarHBondContact O-N 3.2Å; I693-L697 HydrophobicContact CG2-CB 4.25Å; I693-L697 HydrophobicContact CG2-CD2 4.35Å; I693-L697 WeakPolarHBondContact O-CB 3.19Å; I693-L697 PolarHBondContact O-N 2.93Å; I693-L807 HydrophobicContact CB-CD2 3.98Å; I693-L807 HydrophobicContact CG2-CD1 4.31Å; I693-L807 HydrophobicContact CG2-CD2 3.74Å
694C82.7Confident76Confident2.33333 Ų2.3333341.5 Ų41.52%0.01622%0.219CC..Hα-helixtrans-59.7-49.5177-71.10000111.7Q690 E691 Q696 L698 I814Q690-C694 WeakPolarHBondContact O-CB 3.37Å; Q690-C694 PolarHBondContact O-N 3.25Å; Q690-C694 PolarHBondContact O-SG 3.17Å; E691-C694 PolarHBondContact O-N 3.04Å; C694-Q696 VanDerWaalsContact C-N 3.27Å; C694-Q696 PolarHBondContact O-N 3.13Å; C694-L698 HydrophobicContact CB-CD1 4.18Å; C694-L698 VanDerWaalsContact O-CB 3.26Å; C694-L698 WeakPolarHBondContact O-CB 3.26Å; C694-L698 PolarHBondContact O-N 3.19Å; C694-L698 VanDerWaalsContact O-N 3.07Å; C694-I814 HydrophobicContact CB-CB 4.26Å; C694-I814 HydrophobicContact CB-CG2 3.71Å
695H78.9Confident76.1Confident120 Ų12038.7 Ų38.756%0.55620%0.202SC*.Hα-helixtrans-62.3-34.4-178.8-72.793.3000112.7E691E691-H695 PolarHBondContact O-N 3.13Å; E691-H695 PolarHBondContact O-ND1 3.1Å
696Q78.4Confident76.4Confident24.6667 Ų24.666739.2 Ų39.212%0.11521%0.205CC..Hα-helixtrans-86.9-51.6-179-67.3-172.4-6.300112.8E653 V656 V660 L692 I693 C694 S699 N702E653-Q696 PolarHBondContact O-NE2 3.1Å; V656-Q696 VanDerWaalsContact CB-OE1 3.27Å; V656-Q696 PolarHBondContact O-OE1 3.41Å; V660-Q696 HydrophobicContact CG2-CB 4.2Å; L692-Q696 WeakPolarHBondContact O-CG 3.3Å; L692-Q696 PolarHBondContact O-N 3.26Å; I693-Q696 PolarHBondContact O-N 3.2Å; C694-Q696 VanDerWaalsContact C-N 3.27Å; C694-Q696 PolarHBondContact O-N 3.13Å; Q696-S699 PolarHBondContact O-OG 3.17Å; Q696-N702 PolarHBondContact O-ND2 3.06Å
697L82.3Confident76.6Confident0.333333 Ų0.33333339.5 Ų39.50%0.00221%0.206CC..Hα-helixtrans-73-40-174-175.267.2000112.8L675 I693 S699 N702 L706 L803 L807L675-L697 HydrophobicContact CD1-CD2 4.38Å; I693-L697 HydrophobicContact CG2-CB 4.25Å; I693-L697 HydrophobicContact CG2-CD2 4.35Å; I693-L697 WeakPolarHBondContact O-CB 3.19Å; I693-L697 PolarHBondContact O-N 2.93Å; L697-S699 PolarHBondContact O-N 3.23Å; L697-N702 WeakPolarHBondContact O-CB 3.08Å; L697-L706 HydrophobicContact CD1-CD2 4.38Å; L697-L706 HydrophobicContact CG-CD2 4.35Å; L697-L803 HydrophobicContact CD2-CD2 3.6Å; L697-L807 HydrophobicContact CD2-CD1 4.45Å
698L79.5Confident76.7Confident14.6667 Ų14.666739.2 Ų39.28%0.07720%0.2CC..THydrogen-bonded Turntrans-869.7-177.2-52.5177.4000113.1C694 L706 F804 A815 Y818C694-L698 HydrophobicContact CB-CD1 4.18Å; C694-L698 VanDerWaalsContact O-CB 3.26Å; C694-L698 WeakPolarHBondContact O-CB 3.26Å; C694-L698 PolarHBondContact O-N 3.19Å; C694-L698 VanDerWaalsContact O-N 3.07Å; L698-L706 HydrophobicContact CD2-CD1 4.25Å; L698-F804 HydrophobicContact CD2-CE1 4.4Å; L698-A815 HydrophobicContact CD1-CB 4.43Å; L698-Y818 HydrophobicContact CB-CD1 4.2Å; L698-Y818 HydrophobicContact CB-CD2 4.48Å; L698-Y818 HydrophobicContact CB-CE1 4.27Å; L698-Y818 HydrophobicContact CB-CE2 4.49Å; L698-Y818 HydrophobicContact CB-CG 4.33Å; L698-Y818 HydrophobicContact CD1-CD1 4.08Å; L698-Y818 HydrophobicContact CD1-CG 4.25Å; L698-Y818 HydrophobicContact CD2-CD1 3.92Å; L698-Y818 HydrophobicContact CD2-CE1 3.94Å; L698-Y818 HydrophobicContact CG-CD1 4.29Å
699S76.1Confident77Confident36.3333 Ų36.333336.1 Ų36.125%0.25418%0.182SC..SBendtrans-71.8150.5175.4650000111.8Q696 L697 N701 N702Q696-S699 PolarHBondContact O-OG 3.17Å; L697-S699 PolarHBondContact O-N 3.23Å; S699-N701 PolarHBondContact O-N 3.29Å; S699-N701 VanDerWaalsContact O-N 3.08Å; S699-N702 PolarHBondContact O-N 3.09Å; S699-N702 PolarHBondContact OG-ND2 2.77Å
700E66.7Low77Confident173 Ų17337.5 Ų37.581%0.80819%0.191SC*.G310 helixtrans-56.7-28.4-178.4-64.5-175.5168.200113.2N702 E703E700-N702 PolarHBondContact O-N 3.31Å; E700-E703 PolarHBondContact O-N 3.17Å
701N68.8Low76.5Confident135 Ų13539.9 Ų39.972%0.72220%0.204SC*.G310 helixtrans-67.8-19.6178.9-64.9-23.5000113.4R664 S699R664-N701 PolarHBondContact NH2-O 2.87Å; S699-N701 PolarHBondContact O-N 3.29Å; S699-N701 VanDerWaalsContact O-N 3.08Å
702N73.8Confident76.1Confident19 Ų1941.9 Ų41.910%0.10221%0.212CC..G310 helixtrans-113.312-172.9-69.6-33.3000113.3V660 R664 Q696 L697 S699 E700 D704 L705V660-N702 WeakPolarHBondContact CG1-ND2 3.39Å; R664-N702 PolarHBondContact NH2-OD1 3.08Å; Q696-N702 PolarHBondContact O-ND2 3.06Å; L697-N702 WeakPolarHBondContact O-CB 3.08Å; S699-N702 PolarHBondContact O-N 3.09Å; S699-N702 PolarHBondContact OG-ND2 2.77Å; E700-N702 PolarHBondContact O-N 3.31Å; N702-D704 WeakPolarHBondContact CA-OD1 3.35Å; N702-D704 PolarHBondContact O-N 3.18Å; N702-D704 VanDerWaalsContact O-N 3.14Å; N702-L705 HydrophobicContact CB-CD1 4.14Å; N702-L705 WeakPolarHBondContact O-CB 3.48Å; N702-L705 PolarHBondContact O-N 3.03Å; N702-L705 VanDerWaalsContact O-N 3.09Å
703E68.1Low75.4Confident52 Ų5244.5 Ų44.524%0.24323%0.23CC..G310 helixtrans-60.4-25177.4-69.5-151.6144.500113.4E700 L705 L706 K731 Y818 K822E700-E703 PolarHBondContact O-N 3.17Å; E703-L705 VanDerWaalsContact C-N 3.27Å; E703-L705 PolarHBondContact O-N 3.06Å; E703-L706 PolarHBondContact O-N 3.2Å; E703-K731 HydrophobicContact CB-CD 4.44Å; E703-K731 IonicContact OE2-NZ 3.3Å; E703-K731 PolarHBondContact OE2-NZ 2.89Å; E703-K731 VanDerWaalsContact OE2-NZ 3.1Å; E703-Y818 PolarHBondContact OE1-OH 3.17Å; E703-K822 IonicContact OE1-NZ 3.27Å; E703-K822 PolarHBondContact OE1-NZ 3.07Å
704D68.5Low74.3Confident25.3333 Ų25.333348.9 Ų48.914%0.13525%0.249CC..G310 helixtrans-66.7-25.8176.762.5-38.5000113.3R664 N702 L706 W730 K731 Q732 T733R664-D704 IonicContact CZ-OD1 3.3Å; R664-D704 IonicContact CZ-OD2 3.15Å; R664-D704 IonicContact NE-OD2 2.76Å; R664-D704 IonicContact NH1-OD1 2.95Å; R664-D704 IonicContact NH1-OD2 3.33Å; R664-D704 PolarHBondContact NH1-OD2 3.42Å; R664-D704 IonicContact NH2-OD1 3.18Å; R664-D704 PolarHBondContact NH2-OD1 3.13Å; R664-D704 IonicContact NH2-OD2 2.73Å; R664-D704 PolarHBondContact NH2-OD2 3.22Å; N702-D704 WeakPolarHBondContact CA-OD1 3.35Å; N702-D704 PolarHBondContact O-N 3.18Å; N702-D704 VanDerWaalsContact O-N 3.14Å; D704-L706 VanDerWaalsContact C-N 3.28Å; D704-L706 PolarHBondContact O-N 3.09Å; D704-W730 PolarHBondContact O-NE1 3.2Å; D704-K731 WeakPolarHBondContact CA-O 3.42Å; D704-K731 WeakPolarHBondContact CB-O 3.32Å; D704-Q732 PolarHBondContact O-OE1 3.38Å; D704-T733 HydrophobicContact CB-CG2 3.28Å; D704-T733 VanDerWaalsContact CG-CG2 3.47Å; D704-T733 WeakPolarHBondContact OD2-CB 3.33Å; D704-T733 WeakPolarHBondContact OD2-CG2 3.37Å; D704-T733 PolarHBondContact OD2-OG1 2.84Å
705L74.1Confident73Confident4.33333 Ų4.3333354.5 Ų54.52%0.02328%0.278CS..G310 helixtrans-75.9-19176.5-56-178.7000112.5V660 V663 R664 N702 E703 Y796V660-L705 HydrophobicContact CG1-CD1 4.12Å; V663-L705 HydrophobicContact CG1-CD1 4.38Å; R664-L705 HydrophobicContact CB-CD1 4.32Å; R664-L705 HydrophobicContact CB-CD2 3.82Å; R664-L705 HydrophobicContact CG-CD2 4.09Å; N702-L705 HydrophobicContact CB-CD1 4.14Å; N702-L705 WeakPolarHBondContact O-CB 3.48Å; N702-L705 PolarHBondContact O-N 3.03Å; N702-L705 VanDerWaalsContact O-N 3.09Å; E703-L705 VanDerWaalsContact C-N 3.27Å; E703-L705 PolarHBondContact O-N 3.06Å; L705-Y796 PolarHBondContact O-OH 3.13Å
706L80.2Confident71.7Confident10.6667 Ų10.666752.2 Ų52.26%0.05627%0.27CS..SBendtrans-100.6133-172.4-56.4179.3000111.1L697 L698 E703 D704 Q800 F804L697-L706 HydrophobicContact CD1-CD2 4.38Å; L697-L706 HydrophobicContact CG-CD2 4.35Å; L698-L706 HydrophobicContact CD2-CD1 4.25Å; E703-L706 PolarHBondContact O-N 3.2Å; D704-L706 VanDerWaalsContact C-N 3.28Å; D704-L706 PolarHBondContact O-N 3.09Å; L706-Q800 HydrophobicContact CD2-CG 4.46Å; L706-F804 HydrophobicContact CD1-CZ 4.39Å; L706-F804 HydrophobicContact CD2-CE1 4.1Å; L706-F804 HydrophobicContact CD2-CZ 3.98Å
707V77.9Confident70.6Confident5.66667 Ų5.6666756.1 Ų56.13%0.03430%0.299CS..EExtended strand (participates in β ladder)trans-88116.2171.5-177.40000108.7L728 W730 Y796 Y797 Q800V707-L728 HydrophobicContact CG1-CB 3.85Å; V707-L728 HydrophobicContact CG1-CD1 4.32Å; V707-L728 HydrophobicContact CG1-CD2 4.31Å; V707-L728 HydrophobicContact CG1-CG 4.4Å; V707-W730 HydrophobicContact CG1-CB 4.48Å; V707-W730 HydrophobicContact CG2-CB 4.32Å; V707-W730 HydrophobicContact CG2-CD2 4.02Å; V707-W730 HydrophobicContact CG2-CG 3.9Å; V707-Y796 HydrophobicContact CG2-CD1 4.29Å; V707-Y796 HydrophobicContact CG2-CE1 4.31Å; V707-Y797 HydrophobicContact CB-CD2 3.86Å; V707-Y797 HydrophobicContact CB-CE2 4.36Å; V707-Y797 HydrophobicContact CG1-CD2 3.78Å; V707-Y797 HydrophobicContact CG1-CE2 4.12Å; V707-Q800 PolarHBondContact O-NE2 3.02Å
708E78.4Confident69.4Low49.6667 Ų49.666763.5 Ų63.523%0.23234%0.339CS..EExtended strand (participates in β ladder)trans-80.8138.1177.3-65.8-177.6165.300110.6L728 I729 K731 K822E708-L728 CarbonylContact O-C 3.53Å; E708-L728 WeakPolarHBondContact O-CA 3.24Å; E708-I729 HydrophobicContact CB-CB 4.34Å; E708-I729 PolarHBondContact N-O 3.26Å; E708-I729 PolarHBondContact O-N 3.22Å; E708-K731 WeakPolarHBondContact OE1-CE 3.43Å; E708-K731 IonicContact OE1-NZ 3.12Å; E708-K731 PolarHBondContact OE1-NZ 3.12Å; E708-K731 WeakPolarHBondContact OE2-CE 3.35Å; E708-K731 IonicContact OE2-NZ 3.35Å; E708-K822 IonicContact OE1-NZ 3.79Å; E708-K822 PolarHBondContact OE1-NZ 2.83Å; E708-K822 VanDerWaalsContact OE1-NZ 3.12Å
709T81.8Confident68.3Low12 Ų1265 Ų657%0.07435%0.351CS..EExtended strand (participates in β ladder)trans-106.5124.3177.8-390000108.4I726 L728 Y797 L827T709-I726 HydrophobicContact CG2-CG2 4.1Å; T709-L728 HydrophobicContact CG2-CD2 4.07Å; T709-Y797 VanDerWaalsContact CG2-OH 3.28Å; T709-Y797 WeakPolarHBondContact CG2-OH 3.39Å; T709-Y797 WeakPolarHBondContact OG1-CE2 3.35Å; T709-Y797 PolarHBondContact OG1-OH 3.2Å; T709-L827 HydrophobicContact CG2-CD1 4.47Å; T709-L827 HydrophobicContact CG2-CD2 4.24Å; T709-L827 HydrophobicContact CG2-CG 4.45Å; T709-L827 VanDerWaalsContact O-CD2 3.31Å; T709-L827 WeakPolarHBondContact O-CD2 3.44Å
710C77Confident67.3Low30.6667 Ų30.666770.3 Ų70.321%0.20738%0.376CS..EExtended strand (participates in β ladder)trans-139.3151.6178.864.60000112.3T727 I729C710-T727 PolarHBondContact N-O 3.17Å; C710-T727 PolarHBondContact O-N 3.24Å; C710-T727 VanDerWaalsContact O-O 3.1Å; C710-T727 PolarHBondContact O-OG1 3.26Å; C710-T727 PolarHBondContact SG-O 2.91Å; C710-T727 VanDerWaalsContact SG-O 3.37Å; C710-T727 PolarHBondContact SG-OG1 3.33Å; C710-I729 WeakPolarHBondContact SG-CD1 3.42Å
711N74.4Confident66.4Low52.6667 Ų52.666770.3 Ų70.328%0.28237%0.37SS..EExtended strand (participates in β ladder)trans-93.2124.6170.7-177.728.1000108.9D724 L827 K830N711-D724 PolarHBondContact ND2-OD2 3.11Å; N711-L827 HydrophobicContact CB-CD1 3.96Å; N711-K830 PolarHBondContact ND2-NZ 3.07Å
712K69.7Low65.5Low72 Ų7267.7 Ų67.731%0.31336%0.363SS..EExtended strand (participates in β ladder)trans-122.4133.6173.2-75-173.7-179.8-175.80110.4F714 I725 T727K712-F714 PolarHBondContact O-N 3.07Å; K712-I725 PolarHBondContact N-O 3.09Å; K712-I725 PolarHBondContact O-N 3.18Å; K712-T727 HydrophobicContact CB-CG2 4.41Å
713T63Low64.6Low95 Ų9569.8 Ų69.858%0.58338%0.376SS*.EExtended strand (participates in β ladder)trans-76.9115.9170.348.30000109D724T713-D724 WeakPolarHBondContact CG2-OD1 3.33Å
714F59.6Low64.4Low91 Ų9170.7 Ų70.740%0.39938%0.382SS..EExtended strand (participates in β ladder)trans-95.4123.8169-142.2-94.8000109.1K712 D716 S722 T723 I725 I749K712-F714 PolarHBondContact O-N 3.07Å; F714-D716 VanDerWaalsContact CE1-OD1 3.25Å; F714-D716 WeakPolarHBondContact CE1-OD1 3.49Å; F714-S722 CarbonylContact O-C 3.56Å; F714-S722 VanDerWaalsContact O-CA 3.28Å; F714-S722 WeakPolarHBondContact O-CA 3.38Å; F714-T723 PolarHBondContact N-O 3.01Å; F714-T723 PolarHBondContact O-N 3.07Å; F714-I725 HydrophobicContact CB-CD1 3.88Å; F714-I725 HydrophobicContact CB-CG1 4.35Å; F714-I725 HydrophobicContact CD2-CD1 4.06Å; F714-I725 HydrophobicContact CG-CD1 4.23Å; F714-I749 HydrophobicContact CE1-CD1 4.25Å; F714-I749 HydrophobicContact CZ-CD1 3.64Å
715I56.4Low64.4Low119.667 Ų119.66770.8 Ų70.861%0.61438%0.383SS*.EExtended strand (participates in β ladder)trans-96.4109.5174.1-55.8170.1000106.2S717I715-S717 PolarHBondContact O-N 3.22Å
716D51.3Low64.4Low72.6667 Ų72.666771 Ų7139%0.38938%0.384SS..  trans-66.3120.6171.7-103.9-15.5000108.7F714 D718 S719 N720 Y721F714-D716 VanDerWaalsContact CE1-OD1 3.25Å; F714-D716 WeakPolarHBondContact CE1-OD1 3.49Å; D716-D718 PolarHBondContact O-N 3.34Å; D716-S719 VanDerWaalsContact CB-O 3.31Å; D716-S719 WeakPolarHBondContact CB-O 3.2Å; D716-S719 WeakPolarHBondContact CB-OG 3.38Å; D716-S719 CarbonylContact O-C 3.43Å; D716-S719 PolarHBondContact O-N 2.9Å; D716-S719 PolarHBondContact OD2-OG 2.99Å; D716-N720 PolarHBondContact O-N 3.22Å; D716-N720 VanDerWaalsContact O-N 3.11Å; D716-Y721 PolarHBondContact N-O 3.09Å
717S55.9Low64.1Low105.667 Ų105.66770.8 Ų70.874%0.73938%0.383SS*.THydrogen-bonded Turntrans-61.3-27.9177.353.80000112.6I715I715-S717 PolarHBondContact O-N 3.22Å
718D56.6Low64.1Low155.667 Ų155.66770.6 Ų70.683%0.83238%0.382SS*.THydrogen-bonded Turntrans-89.3-24.6-172-66.3-4.8000112.7D716D716-D718 PolarHBondContact O-N 3.34Å
719S55.7Low63.8Low46.6667 Ų46.666769.3 Ų69.333%0.32638%0.376SS..THydrogen-bonded Turntrans-128.825.8-175.673.10000112.3D716 Y721D716-S719 VanDerWaalsContact CB-O 3.31Å; D716-S719 WeakPolarHBondContact CB-O 3.2Å; D716-S719 WeakPolarHBondContact CB-OG 3.38Å; D716-S719 CarbonylContact O-C 3.43Å; D716-S719 PolarHBondContact O-N 2.9Å; D716-S719 PolarHBondContact OD2-OG 2.99Å; S719-Y721 WeakPolarHBondContact O-CD2 3.35Å; S719-Y721 WeakPolarHBondContact O-CE2 3.37Å; S719-Y721 PolarHBondContact O-N 3.21Å; S719-Y721 WeakPolarHBondContact OG-CD2 3.42Å
720N54.8Low63.4Low148 Ų14869.3 Ų69.379%0.79138%0.375SS*.  trans25.714.3-176.2-80.5-23000115.2D716D716-N720 PolarHBondContact O-N 3.22Å; D716-N720 VanDerWaalsContact O-N 3.11Å
721Y48.2Very low63Low172.333 Ų172.33369.9 Ų69.968%0.67637%0.374SS*.  trans-86.1126.3173.9-63.7-70.2000109.8D716 S719 T723D716-Y721 PolarHBondContact N-O 3.09Å; S719-Y721 WeakPolarHBondContact O-CD2 3.35Å; S719-Y721 WeakPolarHBondContact O-CE2 3.37Å; S719-Y721 PolarHBondContact O-N 3.21Å; S719-Y721 WeakPolarHBondContact OG-CD2 3.42Å; Y721-T723 PolarHBondContact O-N 2.94Å
722S49.7Very low62.4Low80.6667 Ų80.666768.2 Ų68.256%0.56437%0.365SS*.EExtended strand (participates in β ladder)trans-81.3114.2166.655.50000108.9F714F714-S722 CarbonylContact O-C 3.56Å; F714-S722 VanDerWaalsContact O-CA 3.28Å; F714-S722 WeakPolarHBondContact O-CA 3.38Å
723T55.4Low61.5Low63.6667 Ų63.666768.1 Ų68.139%0.39137%0.37SS..EExtended strand (participates in β ladder)trans-100.4124.9170.355.20000109.7F714 Y721 I725F714-T723 PolarHBondContact N-O 3.01Å; F714-T723 PolarHBondContact O-N 3.07Å; Y721-T723 PolarHBondContact O-N 2.94Å; T723-I725 PolarHBondContact O-N 3.01Å
724D62.9Low60.9Low69.6667 Ų69.666769 Ų6937%0.37338%0.379SS..EExtended strand (participates in β ladder)trans-78.8118.7173.3-88.717.5000109.5N711 T713 K830N711-D724 PolarHBondContact ND2-OD2 3.11Å; T713-D724 WeakPolarHBondContact CG2-OD1 3.33Å; D724-K830 IonicContact OD2-NZ 2.91Å; D724-K830 PolarHBondContact OD2-NZ 3.09Å
725I70.2Confident60.4Low28.3333 Ų28.333368.2 Ų68.215%0.14538%0.378CS..EExtended strand (participates in β ladder)trans-118.5132.5-176.6-60.2178.6000109.2K712 F714 T723 T727 N765K712-I725 PolarHBondContact N-O 3.09Å; K712-I725 PolarHBondContact O-N 3.18Å; F714-I725 HydrophobicContact CB-CD1 3.88Å; F714-I725 HydrophobicContact CB-CG1 4.35Å; F714-I725 HydrophobicContact CD2-CD1 4.06Å; F714-I725 HydrophobicContact CG-CD1 4.23Å; T723-I725 PolarHBondContact O-N 3.01Å; I725-T727 HydrophobicContact CG2-CG2 4.06Å; I725-T727 PolarHBondContact O-N 3.26Å; I725-N765 HydrophobicContact CG2-CB 4.21Å; I725-N765 WeakPolarHBondContact CG2-ND2 3.37Å; I725-N765 WeakPolarHBondContact CG2-OD1 3.39Å
726I73.7Confident60.1Low9.66667 Ų9.6666763.6 Ų63.65%0.0536%0.355CS..EExtended strand (participates in β ladder)trans-76.3115.6171.9-56.9165.8000107.9T709 L766 K830T709-I726 HydrophobicContact CG2-CG2 4.1Å; I726-L766 HydrophobicContact CB-CB 4.38Å; I726-L766 HydrophobicContact CB-CD2 4.44Å; I726-L766 HydrophobicContact CG2-CB 4.21Å; I726-L766 HydrophobicContact CG2-CD2 3.83Å; I726-L766 WeakPolarHBondContact O-CB 3.37Å; I726-L766 PolarHBondContact O-N 3.15Å; I726-K830 HydrophobicContact CD1-CB 4.29Å
727T74.1Confident60Low5.66667 Ų5.6666764.6 Ų64.64%0.03536%0.36CS..EExtended strand (participates in β ladder)trans-115.3131.7-179.253.60000110.8C710 K712 I725 Q763 F764C710-T727 PolarHBondContact N-O 3.17Å; C710-T727 PolarHBondContact O-N 3.24Å; C710-T727 VanDerWaalsContact O-O 3.1Å; C710-T727 PolarHBondContact O-OG1 3.26Å; C710-T727 PolarHBondContact SG-O 2.91Å; C710-T727 VanDerWaalsContact SG-O 3.37Å; C710-T727 PolarHBondContact SG-OG1 3.33Å; K712-T727 HydrophobicContact CB-CG2 4.41Å; I725-T727 HydrophobicContact CG2-CG2 4.06Å; I725-T727 PolarHBondContact O-N 3.26Å; T727-Q763 HydrophobicContact CG2-CG 4.39Å; T727-F764 CarbonylContact C-O 3.41Å; T727-F764 VanDerWaalsContact CA-O 3.25Å; T727-F764 WeakPolarHBondContact CA-O 3.34Å
728L76.8Confident59.8Low0.666667 Ų0.66666763.9 Ų63.90%0.00335%0.348CS..EExtended strand (participates in β ladder)trans-89.7128.3170.5-57.2-177.6000108.6V707 E708 T709 Q763 F764 L766 Y797V707-L728 HydrophobicContact CG1-CB 3.85Å; V707-L728 HydrophobicContact CG1-CD1 4.32Å; V707-L728 HydrophobicContact CG1-CD2 4.31Å; V707-L728 HydrophobicContact CG1-CG 4.4Å; E708-L728 CarbonylContact O-C 3.53Å; E708-L728 WeakPolarHBondContact O-CA 3.24Å; T709-L728 HydrophobicContact CG2-CD2 4.07Å; L728-Q763 CarbonylContact O-C 3.35Å; L728-Q763 VanDerWaalsContact O-CA 3.28Å; L728-Q763 WeakPolarHBondContact O-CA 3.32Å; L728-F764 HydrophobicContact CB-CB 4.26Å; L728-F764 HydrophobicContact CB-CD2 4.44Å; L728-F764 PolarHBondContact N-O 3.23Å; L728-F764 PolarHBondContact O-N 3.06Å; L728-L766 HydrophobicContact CD1-CD1 3.73Å; L728-L766 HydrophobicContact CD2-CD1 4.37Å; L728-L766 HydrophobicContact CG-CB 4.43Å; L728-L766 HydrophobicContact CG-CD1 4.09Å; L728-Y797 HydrophobicContact CD1-CD1 4.19Å; L728-Y797 HydrophobicContact CD1-CD2 4.38Å; L728-Y797 HydrophobicContact CD1-CE1 4.44Å; L728-Y797 HydrophobicContact CD1-CG 4.15Å; L728-Y797 HydrophobicContact CD2-CD1 4.4Å; L728-Y797 HydrophobicContact CD2-CD2 4.2Å; L728-Y797 HydrophobicContact CD2-CE1 3.87Å; L728-Y797 HydrophobicContact CD2-CE2 3.64Å; L728-Y797 VanDerWaalsContact CD2-CZ 3.45Å
729I73.7Confident59.5Low22.6667 Ų22.666761.1 Ų61.112%0.11633%0.333CS..EExtended strand (participates in β ladder)trans-112123.7174.2-61.5176000107.7E708 C710 Y761 L762 Q763E708-I729 HydrophobicContact CB-CB 4.34Å; E708-I729 PolarHBondContact N-O 3.26Å; E708-I729 PolarHBondContact O-N 3.22Å; C710-I729 WeakPolarHBondContact SG-CD1 3.42Å; I729-Y761 HydrophobicContact CG2-CD2 3.9Å; I729-Y761 HydrophobicContact CG2-CE2 4.45Å; I729-Y761 HydrophobicContact CG2-CG 4.15Å; I729-L762 CarbonylContact C-O 3.56Å; I729-L762 VanDerWaalsContact CA-O 3.3Å; I729-L762 WeakPolarHBondContact CA-O 3.41Å; I729-Q763 HydrophobicContact CG1-CG 4.3Å
730W73.3Confident59.2Low11.3333 Ų11.333360.9 Ų60.94%0.04333%0.326CS..EExtended strand (participates in β ladder)trans-121.2112.8176.1-168.512000109.8I667 D704 V707 Q732 W741 Y761 L762 F764 I793I667-W730 HydrophobicContact CD1-CH2 4.29Å; I667-W730 HydrophobicContact CD1-CZ2 4.04Å; I667-W730 HydrophobicContact CG2-CH2 3.6Å; I667-W730 HydrophobicContact CG2-CZ2 3.61Å; D704-W730 PolarHBondContact O-NE1 3.2Å; V707-W730 HydrophobicContact CG1-CB 4.48Å; V707-W730 HydrophobicContact CG2-CB 4.32Å; V707-W730 HydrophobicContact CG2-CD2 4.02Å; V707-W730 HydrophobicContact CG2-CG 3.9Å; W730-Q732 VanDerWaalsContact C-N 3.28Å; W730-Q732 HydrophobicContact CD2-CB 4.12Å; W730-Q732 HydrophobicContact CG-CB 4.19Å; W730-Q732 HydrophobicContact CZ2-CB 4.34Å; W730-Q732 HydrophobicContact CZ2-CG 4.24Å; W730-Q732 PolarHBondContact O-N 3.23Å; W730-W741 HydrophobicContact CE3-CH2 4.32Å; W730-W741 AromaticContact CZ3-CH2 3.9Å; W730-W741 HydrophobicContact CZ3-CH2 3.9Å; W730-W741 HydrophobicContact CZ3-CZ2 4.2Å; W730-Y761 CarbonylContact O-C 3.55Å; W730-Y761 WeakPolarHBondContact O-CA 3.33Å; W730-L762 HydrophobicContact CB-CB 4.38Å; W730-L762 HydrophobicContact CE3-CD1 4.26Å; W730-L762 PolarHBondContact N-O 3.06Å; W730-L762 PolarHBondContact O-N 3.01Å; W730-F764 HydrophobicContact CB-CE2 4.28Å; W730-F764 HydrophobicContact CE3-CE2 4.43Å; W730-I793 HydrophobicContact CZ3-CG1 4.39Å
731K68.4Low58.9Low44.6667 Ų44.666755.5 Ų55.519%0.19430%0.295CS..  trans-74.375.7-178.5-66.6169.3174.2162.70110.9E703 D704 E708E703-K731 HydrophobicContact CB-CD 4.44Å; E703-K731 IonicContact OE2-NZ 3.3Å; E703-K731 PolarHBondContact OE2-NZ 2.89Å; E703-K731 VanDerWaalsContact OE2-NZ 3.1Å; D704-K731 WeakPolarHBondContact CA-O 3.42Å; D704-K731 WeakPolarHBondContact CB-O 3.32Å; E708-K731 WeakPolarHBondContact OE1-CE 3.43Å; E708-K731 IonicContact OE1-NZ 3.12Å; E708-K731 PolarHBondContact OE1-NZ 3.12Å; E708-K731 WeakPolarHBondContact OE2-CE 3.35Å; E708-K731 IonicContact OE2-NZ 3.35Å
732Q61.4Low59Low17.3333 Ų17.333354.5 Ų54.58%0.08129%0.294CS..  trans-85126.8-176.6-169.7141-4.300111.4I667 D704 W730 I736 D738 K760 L762I667-Q732 HydrophobicContact CD1-CG 4.42Å; I667-Q732 VanDerWaalsContact CD1-NE2 3.3Å; D704-Q732 PolarHBondContact O-OE1 3.38Å; W730-Q732 VanDerWaalsContact C-N 3.28Å; W730-Q732 HydrophobicContact CD2-CB 4.12Å; W730-Q732 HydrophobicContact CG-CB 4.19Å; W730-Q732 HydrophobicContact CZ2-CB 4.34Å; W730-Q732 HydrophobicContact CZ2-CG 4.24Å; W730-Q732 PolarHBondContact O-N 3.23Å; Q732-I736 HydrophobicContact CG-CD1 4.46Å; Q732-I736 PolarHBondContact NE2-O 2.92Å; Q732-D738 PolarHBondContact NE2-OD1 3.27Å; Q732-K760 HydrophobicContact CB-CB 4.18Å; Q732-K760 WeakPolarHBondContact CB-O 3.34Å; Q732-K760 PolarHBondContact N-O 3.42Å; Q732-L762 HydrophobicContact CB-CD1 4.29Å
733T51.5Low59Low70 Ų7056.4 Ų56.443%0.42930%0.298SS..  trans-106.2-34.1177.347.90000114.6D704 L735 I736 K760D704-T733 HydrophobicContact CB-CG2 3.28Å; D704-T733 VanDerWaalsContact CG-CG2 3.47Å; D704-T733 WeakPolarHBondContact OD2-CB 3.33Å; D704-T733 WeakPolarHBondContact OD2-CG2 3.37Å; D704-T733 PolarHBondContact OD2-OG1 2.84Å; T733-L735 PolarHBondContact O-N 3.26Å; T733-I736 PolarHBondContact O-N 3.46Å; T733-K760 HydrophobicContact CG2-CB 4.48Å
734C49.3Very low58.8Low114 Ų11454.5 Ų54.577%0.7729%0.285SS*.SBendtrans-98.9-3.3-159.8-55.30000118.2
735L49.1Very low58.2Low72.6667 Ų72.666754.9 Ų54.938%0.3829%0.287SS..SBendtrans-118.5-0.6-169.4-80.9165.1000116.4I547 I667 T733I547-L735 HydrophobicContact CD1-CD2 4Å; I667-L735 HydrophobicContact CD1-CD1 3.94Å; I667-L735 HydrophobicContact CG1-CD1 4.25Å; T733-L735 PolarHBondContact O-N 3.26Å
736I49.4Very low57.2Low24.3333 Ų24.333358.5 Ų58.513%0.12532%0.315CS..  trans-110.8120.4-175.1-46.9177.5000110.2L546 I667 Q732 T733 D738 F740 W741 L762L546-I736 HydrophobicContact CD1-CG1 4.12Å; L546-I736 HydrophobicContact CD2-CD1 4.39Å; L546-I736 HydrophobicContact CD2-CG1 4.1Å; L546-I736 HydrophobicContact CD2-CG2 3.87Å; I667-I736 HydrophobicContact CD1-CD1 3.96Å; I667-I736 HydrophobicContact CD1-CG1 4.49Å; Q732-I736 HydrophobicContact CG-CD1 4.46Å; Q732-I736 PolarHBondContact NE2-O 2.92Å; T733-I736 PolarHBondContact O-N 3.46Å; I736-D738 PolarHBondContact O-N 3.36Å; I736-F740 HydrophobicContact CG2-CB 4.27Å; I736-F740 HydrophobicContact CG2-CD1 4.21Å; I736-F740 HydrophobicContact CG2-CG 4.47Å; I736-W741 HydrophobicContact CB-CZ2 3.79Å; I736-W741 HydrophobicContact CD1-CH2 4.09Å; I736-W741 HydrophobicContact CD1-CZ2 3.84Å; I736-W741 HydrophobicContact CG1-CZ2 4.32Å; I736-W741 HydrophobicContact CG2-CD2 4.21Å; I736-W741 HydrophobicContact CG2-CG 4.21Å; I736-W741 HydrophobicContact CG2-CZ2 4.02Å; I736-W741 PolarHBondContact O-NE1 3.11Å; I736-W741 VanDerWaalsContact O-NE1 3.13Å; I736-L762 HydrophobicContact CD1-CD1 3.71Å
737D50.9Low56Low92.6667 Ų92.666763.3 Ų63.350%0.49634%0.341SS..  trans-63135.6-177.8-149.3-0.1000111.7D739 F740 W741D737-D739 PolarHBondContact O-N 3.23Å; D737-D739 VanDerWaalsContact O-N 3.11Å; D737-F740 HydrophobicContact CB-CB 4.34Å; D737-F740 WeakPolarHBondContact O-CB 3.39Å; D737-F740 PolarHBondContact O-N 2.9Å; D737-W741 PolarHBondContact O-N 3.17Å
738D50.4Low55Low91.6667 Ų91.666764.2 Ų64.249%0.4935%0.345SS..Hα-helixtrans-57.4-29.7-176.8-86.3-22.1000112.3Q732 I736 W741 K742 K760Q732-D738 PolarHBondContact NE2-OD1 3.27Å; I736-D738 PolarHBondContact O-N 3.36Å; D738-W741 VanDerWaalsContact CA-CD1 3.42Å; D738-W741 WeakPolarHBondContact O-CB 3.43Å; D738-K742 WeakPolarHBondContact O-CG 3.5Å; D738-K742 PolarHBondContact O-N 3.15Å; D738-K760 IonicContact OD1-NZ 3.39Å; D738-K760 PolarHBondContact OD1-NZ 2.9Å; D738-K760 IonicContact OD2-NZ 3.03Å; D738-K760 PolarHBondContact OD2-NZ 3.46Å
739D50.8Low53.7Low97.3333 Ų97.333367.7 Ų67.752%0.5236%0.363SS..Hα-helixtrans-78.6-24.5178.1-77.5-19.6000113.5D737 W741 K742 N743D737-D739 PolarHBondContact O-N 3.23Å; D737-D739 VanDerWaalsContact O-N 3.11Å; D739-W741 VanDerWaalsContact C-N 3.32Å; D739-K742 PolarHBondContact O-N 3.21Å; D739-K742 IonicContact OD1-NZ 3.24Å; D739-K742 PolarHBondContact OD1-NZ 3.06Å; D739-K742 VanDerWaalsContact OD1-NZ 3.12Å; D739-N743 PolarHBondContact O-N 2.83Å; D739-N743 PolarHBondContact O-ND2 2.95Å
740F48.6Very low52.3Low41.6667 Ų41.666770.2 Ų70.218%0.18338%0.376CS..Hα-helixtrans-68.4-39.7173.1-169.8-90.9000111.1H545 L546 I736 D737 K742 N743 L744 L789H545-F740 VanDerWaalsContact O-CE2 3.28Å; H545-F740 WeakPolarHBondContact O-CE2 3.34Å; L546-F740 VanDerWaalsContact CA-CD2 3.44Å; L546-F740 HydrophobicContact CB-CD2 4.44Å; L546-F740 HydrophobicContact CB-CE2 4.34Å; L546-F740 HydrophobicContact CB-CZ 4.31Å; L546-F740 HydrophobicContact CD2-CD1 3.57Å; L546-F740 HydrophobicContact CD2-CD2 4.47Å; L546-F740 HydrophobicContact CD2-CE1 3.3Å; L546-F740 HydrophobicContact CD2-CE2 4.21Å; L546-F740 HydrophobicContact CD2-CG 4.21Å; L546-F740 HydrophobicContact CD2-CZ 3.74Å; L546-F740 VanDerWaalsContact CD2-CZ 3.44Å; L546-F740 HydrophobicContact CG-CD1 4.45Å; L546-F740 HydrophobicContact CG-CE1 3.97Å; L546-F740 HydrophobicContact CG-CE2 4.36Å; L546-F740 HydrophobicContact CG-CZ 3.85Å; L546-F740 VanDerWaalsContact O-CD2 3.27Å; L546-F740 WeakPolarHBondContact O-CD2 3.48Å; I736-F740 HydrophobicContact CG2-CB 4.27Å; I736-F740 HydrophobicContact CG2-CD1 4.21Å; I736-F740 HydrophobicContact CG2-CG 4.47Å; D737-F740 HydrophobicContact CB-CB 4.34Å; D737-F740 WeakPolarHBondContact O-CB 3.39Å; D737-F740 PolarHBondContact O-N 2.9Å; F740-K742 VanDerWaalsContact C-N 3.3Å; F740-K742 PolarHBondContact O-N 3.3Å; F740-N743 PolarHBondContact O-N 3.14Å; F740-N743 VanDerWaalsContact O-N 3.13Å; F740-L744 HydrophobicContact CD1-CD1 4.05Å; F740-L744 HydrophobicContact CD1-CD2 4.46Å; F740-L744 HydrophobicContact CD1-CG 4.2Å; F740-L744 HydrophobicContact CE1-CD1 4.1Å; F740-L744 HydrophobicContact CE1-CD2 3.89Å; F740-L744 HydrophobicContact CE1-CG 3.95Å; F740-L744 HydrophobicContact CZ-CD2 4.45Å; F740-L744 PolarHBondContact O-N 3.34Å; F740-L789 HydrophobicContact CE1-CD1 4.39Å; F740-L789 HydrophobicContact CE1-CD2 3.74Å; F740-L789 HydrophobicContact CE2-CD2 4.32Å; F740-L789 HydrophobicContact CZ-CD1 3.81Å; F740-L789 HydrophobicContact CZ-CD2 3.51Å; F740-L789 HydrophobicContact CZ-CG 4.2Å
741W48.9Very low51.1Low35.3333 Ų35.333373.2 Ų73.213%0.13439%0.394CS..Hα-helixtrans-62.3-29.7177.4-67.9101.6000113.2L546 W730 I736 D737 D738 D739 N743 L744 L750 L762 F764 I793L546-W741 HydrophobicContact CD2-CZ2 4.19Å; W730-W741 HydrophobicContact CE3-CH2 4.32Å; W730-W741 AromaticContact CZ3-CH2 3.9Å; W730-W741 HydrophobicContact CZ3-CH2 3.9Å; W730-W741 HydrophobicContact CZ3-CZ2 4.2Å; I736-W741 HydrophobicContact CB-CZ2 3.79Å; I736-W741 HydrophobicContact CD1-CH2 4.09Å; I736-W741 HydrophobicContact CD1-CZ2 3.84Å; I736-W741 HydrophobicContact CG1-CZ2 4.32Å; I736-W741 HydrophobicContact CG2-CD2 4.21Å; I736-W741 HydrophobicContact CG2-CG 4.21Å; I736-W741 HydrophobicContact CG2-CZ2 4.02Å; I736-W741 PolarHBondContact O-NE1 3.11Å; I736-W741 VanDerWaalsContact O-NE1 3.13Å; D737-W741 PolarHBondContact O-N 3.17Å; D738-W741 VanDerWaalsContact CA-CD1 3.42Å; D738-W741 WeakPolarHBondContact O-CB 3.43Å; D739-W741 VanDerWaalsContact C-N 3.32Å; W741-N743 VanDerWaalsContact C-N 3.33Å; W741-L744 HydrophobicContact CD2-CD1 4.29Å; W741-L744 HydrophobicContact CE3-CD1 3.75Å; W741-L744 HydrophobicContact CZ3-CD1 3.31Å; W741-L744 WeakPolarHBondContact O-CB 3.21Å; W741-L744 PolarHBondContact O-N 3.09Å; W741-L750 HydrophobicContact CB-CD1 4.23Å; W741-L750 HydrophobicContact CD2-CD1 4.45Å; W741-L750 HydrophobicContact CE3-CD1 3.59Å; W741-L750 HydrophobicContact CH2-CD1 3.81Å; W741-L750 HydrophobicContact CZ3-CD1 3.2Å; W741-L762 HydrophobicContact CB-CD2 4.04Å; W741-L762 HydrophobicContact CD2-CD1 3.29Å; W741-L762 HydrophobicContact CD2-CD2 4.17Å; W741-L762 HydrophobicContact CD2-CG 4.37Å; W741-L762 HydrophobicContact CE3-CD1 3.62Å; W741-L762 HydrophobicContact CE3-CD2 4.27Å; W741-L762 HydrophobicContact CG-CD1 3.71Å; W741-L762 HydrophobicContact CG-CD2 4.07Å; W741-L762 HydrophobicContact CH2-CD1 4.28Å; W741-L762 HydrophobicContact CH2-CD2 3.61Å; W741-L762 HydrophobicContact CH2-CG 3.91Å; W741-L762 HydrophobicContact CZ2-CD1 3.82Å; W741-L762 HydrophobicContact CZ3-CD1 4.06Å; W741-L762 HydrophobicContact CZ3-CD2 3.35Å; W741-L762 HydrophobicContact CZ3-CG 4.14Å; W741-F764 HydrophobicContact CE3-CZ 4.33Å; W741-F764 HydrophobicContact CH2-CZ 4.34Å; W741-F764 HydrophobicContact CZ3-CE1 4.2Å; W741-F764 AromaticContact CZ3-CZ 3.75Å; W741-F764 HydrophobicContact CZ3-CZ 3.75Å; W741-I793 HydrophobicContact CH2-CD1 4.16Å; W741-I793 HydrophobicContact CZ3-CD1 4.15Å
742K51.2Low49.7Very low151 Ų15177.5 Ų77.566%0.65741%0.414SS*.Hα-helixtrans-73.2-25176.8-70.1175.1-166.61530113.6D738 D739 F740 L744D738-K742 WeakPolarHBondContact O-CG 3.5Å; D738-K742 PolarHBondContact O-N 3.15Å; D739-K742 PolarHBondContact O-N 3.21Å; D739-K742 IonicContact OD1-NZ 3.24Å; D739-K742 PolarHBondContact OD1-NZ 3.06Å; D739-K742 VanDerWaalsContact OD1-NZ 3.12Å; F740-K742 VanDerWaalsContact C-N 3.3Å; F740-K742 PolarHBondContact O-N 3.3Å; K742-L744 PolarHBondContact O-N 3.34Å
743N49.7Very low48.7Very low119.667 Ų119.66779 Ų7964%0.6443%0.426SS*.THydrogen-bonded Turntrans-92.7-3.7-175.1-77.7-30.2000114D739 F740 W741 Q786D739-N743 PolarHBondContact O-N 2.83Å; D739-N743 PolarHBondContact O-ND2 2.95Å; F740-N743 PolarHBondContact O-N 3.14Å; F740-N743 VanDerWaalsContact O-N 3.13Å; W741-N743 VanDerWaalsContact C-N 3.33Å; N743-Q786 PolarHBondContact O-NE2 3.38Å
744L50.8Low48.1Very low23.3333 Ų23.333383.9 Ų83.912%0.12245%0.445CS..SBendtrans-77.2137.4174.3-85.8165.8000109.8F740 W741 K742 S746 L748 I749 L789 Y790F740-L744 HydrophobicContact CD1-CD1 4.05Å; F740-L744 HydrophobicContact CD1-CD2 4.46Å; F740-L744 HydrophobicContact CD1-CG 4.2Å; F740-L744 HydrophobicContact CE1-CD1 4.1Å; F740-L744 HydrophobicContact CE1-CD2 3.89Å; F740-L744 HydrophobicContact CE1-CG 3.95Å; F740-L744 HydrophobicContact CZ-CD2 4.45Å; F740-L744 PolarHBondContact O-N 3.34Å; W741-L744 HydrophobicContact CD2-CD1 4.29Å; W741-L744 HydrophobicContact CE3-CD1 3.75Å; W741-L744 HydrophobicContact CZ3-CD1 3.31Å; W741-L744 WeakPolarHBondContact O-CB 3.21Å; W741-L744 PolarHBondContact O-N 3.09Å; K742-L744 PolarHBondContact O-N 3.34Å; L744-S746 PolarHBondContact O-N 3.09Å; L744-L748 HydrophobicContact CB-CD1 3.57Å; L744-L748 VanDerWaalsContact CB-CD1 3.47Å; L744-L748 HydrophobicContact CD1-CD1 4.28Å; L744-L748 HydrophobicContact CD2-CD1 3.5Å; L744-L748 HydrophobicContact CG-CD1 3.96Å; L744-I749 HydrophobicContact CB-CD1 4.26Å; L744-L789 HydrophobicContact CD1-CD2 3.84Å; L744-L789 HydrophobicContact CD2-CD2 4.02Å; L744-L789 HydrophobicContact CG-CD2 4.1Å; L744-Y790 HydrophobicContact CD2-CD1 4.45Å; L744-Y790 HydrophobicContact CD2-CE1 3.77Å; L744-Y790 HydrophobicContact CD2-CE2 4.32Å; L744-Y790 VanDerWaalsContact CD2-CZ 3.47Å; L744-Y790 VanDerWaalsContact CD2-OH 3.3Å; L744-Y790 WeakPolarHBondContact CD2-OH 3.33Å
745N50.3Low47.8Very low78.3333 Ų78.333387.6 Ų87.642%0.41945%0.448SS..  trans-50.6144.6-177.1-95.8-22.6000112.7N747 L748N745-N747 PolarHBondContact O-N 2.98Å; N745-L748 HydrophobicContact CB-CD1 4.34Å; N745-L748 WeakPolarHBondContact O-CB 3.37Å; N745-L748 PolarHBondContact O-N 3.09Å
746S49Very low47.3Very low105.333 Ų105.33390 Ų9074%0.73746%0.461SS*.THydrogen-bonded Turntrans-55.7-17.1176.555.10000114.9L744 L748 I749L744-S746 PolarHBondContact O-N 3.09Å; S746-L748 PolarHBondContact O-N 3.08Å; S746-L748 VanDerWaalsContact O-N 3.14Å; S746-I749 PolarHBondContact O-N 2.88Å
747N49.5Very low47.1Very low110 Ų11098.2 Ų98.259%0.58850%0.499SS*.THydrogen-bonded Turntrans-73.7-8.8175.6-63.5-5.8000113.2N745 V768N745-N747 PolarHBondContact O-N 2.98Å; N747-V768 HydrophobicContact CB-CG1 4.46Å
748L51.3Low46.9Very low23.6667 Ų23.666799.7 Ų99.712%0.12451%0.511CS..SBendtrans-99.478.6174.1-67.3162000109.9L744 N745 S746 L750 F764 V768 I772 Y790L744-L748 HydrophobicContact CB-CD1 3.57Å; L744-L748 VanDerWaalsContact CB-CD1 3.47Å; L744-L748 HydrophobicContact CD1-CD1 4.28Å; L744-L748 HydrophobicContact CD2-CD1 3.5Å; L744-L748 HydrophobicContact CG-CD1 3.96Å; N745-L748 HydrophobicContact CB-CD1 4.34Å; N745-L748 WeakPolarHBondContact O-CB 3.37Å; N745-L748 PolarHBondContact O-N 3.09Å; S746-L748 PolarHBondContact O-N 3.08Å; S746-L748 VanDerWaalsContact O-N 3.14Å; L748-L750 PolarHBondContact O-N 3.11Å; L748-L750 VanDerWaalsContact O-N 3.12Å; L748-F764 HydrophobicContact CB-CD1 4.36Å; L748-F764 HydrophobicContact CD2-CD1 3.52Å; L748-F764 HydrophobicContact CD2-CE1 3.41Å; L748-F764 HydrophobicContact CD2-CG 4.19Å; L748-F764 HydrophobicContact CD2-CZ 4.21Å; L748-V768 HydrophobicContact CD2-CG1 4.35Å; L748-I772 HydrophobicContact CD1-CD1 4.33Å; L748-Y790 HydrophobicContact CD1-CD1 4.22Å; L748-Y790 HydrophobicContact CD1-CE1 3.94Å; L748-Y790 HydrophobicContact CD1-CE2 4.05Å; L748-Y790 WeakPolarHBondContact CD1-OH 3.27Å
749I50.7Low46.8Very low74.3333 Ų74.3333100.9 Ų100.938%0.38151%0.514SS..EExtended strand (participates in β ladder)trans-91.3100178.6-54.6173.5000107.4F714 L744 S746 N751F714-I749 HydrophobicContact CE1-CD1 4.25Å; F714-I749 HydrophobicContact CZ-CD1 3.64Å; L744-I749 HydrophobicContact CB-CD1 4.26Å; S746-I749 PolarHBondContact O-N 2.88Å; I749-N751 VanDerWaalsContact C-N 3.28Å; I749-N751 WeakPolarHBondContact CG2-OD1 3.09Å; I749-N751 PolarHBondContact O-N 3.2Å
750L42.9Very low46.9Very low75 Ų75100.6 Ų100.639%0.39351%0.508SS..  trans-82.198.1165-155.6106.9000108W741 L748 Q752 L762 Q763W741-L750 HydrophobicContact CB-CD1 4.23Å; W741-L750 HydrophobicContact CD2-CD1 4.45Å; W741-L750 HydrophobicContact CE3-CD1 3.59Å; W741-L750 HydrophobicContact CH2-CD1 3.81Å; W741-L750 HydrophobicContact CZ3-CD1 3.2Å; L748-L750 PolarHBondContact O-N 3.11Å; L748-L750 VanDerWaalsContact O-N 3.12Å; L750-Q752 HydrophobicContact CD2-CG 4.12Å; L750-Q752 PolarHBondContact O-N 3.42Å; L750-L762 HydrophobicContact CD1-CD2 3.63Å; L750-L762 HydrophobicContact CG-CD2 3.98Å; L750-Q763 HydrophobicContact CB-CB 4.43Å; L750-Q763 HydrophobicContact CB-CG 4.4Å
751N48.2Very low47.5Very low75.3333 Ų75.3333101 Ų10140%0.40351%0.509SS..  trans-78.1112.9168.5-70.8-26.8000111.6I749 S753 Y761 Q763I749-N751 VanDerWaalsContact C-N 3.28Å; I749-N751 WeakPolarHBondContact CG2-OD1 3.09Å; I749-N751 PolarHBondContact O-N 3.2Å; N751-S753 PolarHBondContact O-N 3.25Å; N751-Y761 HydrophobicContact CB-CE1 4.14Å; N751-Y761 HydrophobicContact CB-CE2 3.83Å; N751-Y761 VanDerWaalsContact CB-CZ 3.44Å; N751-Y761 WeakPolarHBondContact CB-OH 3.37Å; N751-Y761 WeakPolarHBondContact O-CE2 3.27Å; N751-Y761 PolarHBondContact O-OH 3.28Å; N751-Q763 PolarHBondContact ND2-OE1 3.28Å
752Q39.4Very low48.2Very low133.667 Ų133.66799.9 Ų99.963%0.62551%0.506SS*.  trans-76.9110.5153.3-76.1178.9-9.500106.8L750 E754L750-Q752 HydrophobicContact CD2-CG 4.12Å; L750-Q752 PolarHBondContact O-N 3.42Å; Q752-E754 PolarHBondContact O-N 3.05Å; Q752-E754 VanDerWaalsContact O-N 3.13Å
753S40.3Very low49Very low48.6667 Ų48.666793.4 Ų93.434%0.3448%0.478SS..  trans-70.7111.4168.863.70000108.7N751 F755 N756 Y761N751-S753 PolarHBondContact O-N 3.25Å; S753-F755 PolarHBondContact O-N 3.03Å; S753-F755 VanDerWaalsContact O-N 3.11Å; S753-N756 PolarHBondContact OG-O 3.42Å; S753-Y761 VanDerWaalsContact OG-CE1 3.29Å; S753-Y761 WeakPolarHBondContact OG-CE1 3.42Å
754E39.9Very low50Low173.333 Ų173.33388.1 Ų88.181%0.8145%0.449SS*.THydrogen-bonded Turntrans-67.2-11.3177.7-67.9-175.7157.600113.5Q752 N756Q752-E754 PolarHBondContact O-N 3.05Å; Q752-E754 VanDerWaalsContact O-N 3.13Å; E754-N756 VanDerWaalsContact C-N 3.35Å; E754-N756 PolarHBondContact O-N 3.27Å
755F43.4Very low51Low192.333 Ų192.33388.7 Ų88.784%0.84445%0.453SS*.THydrogen-bonded Turntrans-77.8-14.1-169.7-83.6-78.8000115.8S753S753-F755 PolarHBondContact O-N 3.03Å; S753-F755 VanDerWaalsContact O-N 3.11Å
756N38.4Very low52.2Low122 Ų12285 Ų8565%0.65243%0.433SS*.SBendtrans-144.1115.1167-76.3-40.1000107.5S753 E754 T758S753-N756 PolarHBondContact OG-O 3.42Å; E754-N756 VanDerWaalsContact C-N 3.35Å; E754-N756 PolarHBondContact O-N 3.27Å; N756-T758 PolarHBondContact O-N 3.07Å
757Q44.5Very low53.2Low198 Ų19881.3 Ų81.393%0.92541%0.405SS*.THydrogen-bonded Turntrans-63.718.5-172.5-74.6179.4-19.900115.8
758T45.5Very low54.1Low123 Ų12378.2 Ų78.276%0.75539%0.39SS*.THydrogen-bonded Turntrans-126.8-5-169.651.20000116.9N756N756-T758 PolarHBondContact O-N 3.07Å
759Q48.9Very low54.9Low117.333 Ų117.33377.2 Ų77.255%0.54838%0.384SS..  trans-128105.1179.3-71.3-175.7-15.300112.9
760K54.4Low55.8Low90.3333 Ų90.333373.7 Ų73.739%0.39337%0.366SS..  trans-80.4132.5163.6-67.8-179.4178.1179.50108.1Q732 T733 D738Q732-K760 HydrophobicContact CB-CB 4.18Å; Q732-K760 WeakPolarHBondContact CB-O 3.34Å; Q732-K760 PolarHBondContact N-O 3.42Å; T733-K760 HydrophobicContact CG2-CB 4.48Å; D738-K760 IonicContact OD1-NZ 3.39Å; D738-K760 PolarHBondContact OD1-NZ 2.9Å; D738-K760 IonicContact OD2-NZ 3.03Å; D738-K760 PolarHBondContact OD2-NZ 3.46Å
761Y60.9Low57Low50.3333 Ų50.333372.1 Ų72.120%0.19736%0.358CS..EExtended strand (participates in β ladder)trans-134.4153.6172.661.9-96.1000111I729 W730 N751 S753 Q763I729-Y761 HydrophobicContact CG2-CD2 3.9Å; I729-Y761 HydrophobicContact CG2-CE2 4.45Å; I729-Y761 HydrophobicContact CG2-CG 4.15Å; W730-Y761 CarbonylContact O-C 3.55Å; W730-Y761 WeakPolarHBondContact O-CA 3.33Å; N751-Y761 HydrophobicContact CB-CE1 4.14Å; N751-Y761 HydrophobicContact CB-CE2 3.83Å; N751-Y761 VanDerWaalsContact CB-CZ 3.44Å; N751-Y761 WeakPolarHBondContact CB-OH 3.37Å; N751-Y761 WeakPolarHBondContact O-CE2 3.27Å; N751-Y761 PolarHBondContact O-OH 3.28Å; S753-Y761 VanDerWaalsContact OG-CE1 3.29Å; S753-Y761 WeakPolarHBondContact OG-CE1 3.42Å; Y761-Q763 HydrophobicContact CD2-CB 4.46Å; Y761-Q763 HydrophobicContact CE2-CB 4.39Å
762L63.6Low57.9Low13 Ų1370.3 Ų70.37%0.06835%0.348CS..EExtended strand (participates in β ladder)trans-99.6134.8174.2-70.5159.4000109.3I729 W730 Q732 I736 W741 L750 F764I729-L762 CarbonylContact C-O 3.56Å; I729-L762 VanDerWaalsContact CA-O 3.3Å; I729-L762 WeakPolarHBondContact CA-O 3.41Å; W730-L762 HydrophobicContact CB-CB 4.38Å; W730-L762 HydrophobicContact CE3-CD1 4.26Å; W730-L762 PolarHBondContact N-O 3.06Å; W730-L762 PolarHBondContact O-N 3.01Å; Q732-L762 HydrophobicContact CB-CD1 4.29Å; I736-L762 HydrophobicContact CD1-CD1 3.71Å; W741-L762 HydrophobicContact CB-CD2 4.04Å; W741-L762 HydrophobicContact CD2-CD1 3.29Å; W741-L762 HydrophobicContact CD2-CD2 4.17Å; W741-L762 HydrophobicContact CD2-CG 4.37Å; W741-L762 HydrophobicContact CE3-CD1 3.62Å; W741-L762 HydrophobicContact CE3-CD2 4.27Å; W741-L762 HydrophobicContact CG-CD1 3.71Å; W741-L762 HydrophobicContact CG-CD2 4.07Å; W741-L762 HydrophobicContact CH2-CD1 4.28Å; W741-L762 HydrophobicContact CH2-CD2 3.61Å; W741-L762 HydrophobicContact CH2-CG 3.91Å; W741-L762 HydrophobicContact CZ2-CD1 3.82Å; W741-L762 HydrophobicContact CZ3-CD1 4.06Å; W741-L762 HydrophobicContact CZ3-CD2 3.35Å; W741-L762 HydrophobicContact CZ3-CG 4.14Å; L750-L762 HydrophobicContact CD1-CD2 3.63Å; L750-L762 HydrophobicContact CG-CD2 3.98Å; L762-F764 HydrophobicContact CB-CD2 4.4Å; L762-F764 HydrophobicContact CB-CE2 3.53Å; L762-F764 VanDerWaalsContact CB-CE2 3.47Å; L762-F764 HydrophobicContact CB-CZ 3.82Å; L762-F764 HydrophobicContact CD1-CE2 4.26Å; L762-F764 HydrophobicContact CD1-CZ 4.13Å; L762-F764 HydrophobicContact CD2-CZ 4.19Å; L762-F764 HydrophobicContact CG-CE2 4.39Å; L762-F764 HydrophobicContact CG-CZ 4.23Å
763Q67.4Low59.1Low15.3333 Ų15.333364.3 Ų64.37%0.07232%0.32CS..EExtended strand (participates in β ladder)trans-120.1117176.5-171.5-179.5-38.600110.6T727 L728 I729 L750 N751 Y761T727-Q763 HydrophobicContact CG2-CG 4.39Å; L728-Q763 CarbonylContact O-C 3.35Å; L728-Q763 VanDerWaalsContact O-CA 3.28Å; L728-Q763 WeakPolarHBondContact O-CA 3.32Å; I729-Q763 HydrophobicContact CG1-CG 4.3Å; L750-Q763 HydrophobicContact CB-CB 4.43Å; L750-Q763 HydrophobicContact CB-CG 4.4Å; N751-Q763 PolarHBondContact ND2-OE1 3.28Å; Y761-Q763 HydrophobicContact CD2-CB 4.46Å; Y761-Q763 HydrophobicContact CE2-CB 4.39Å
764F70.3Confident60.3Low6.66667 Ų6.6666765.3 Ų65.33%0.02932%0.321CS..EExtended strand (participates in β ladder)trans-109.9134.4179.1-52.5-90.6000110.5T727 L728 W730 W741 L748 L762 L766 L769 I793T727-F764 CarbonylContact C-O 3.41Å; T727-F764 VanDerWaalsContact CA-O 3.25Å; T727-F764 WeakPolarHBondContact CA-O 3.34Å; L728-F764 HydrophobicContact CB-CB 4.26Å; L728-F764 HydrophobicContact CB-CD2 4.44Å; L728-F764 PolarHBondContact N-O 3.23Å; L728-F764 PolarHBondContact O-N 3.06Å; W730-F764 HydrophobicContact CB-CE2 4.28Å; W730-F764 HydrophobicContact CE3-CE2 4.43Å; W741-F764 HydrophobicContact CE3-CZ 4.33Å; W741-F764 HydrophobicContact CH2-CZ 4.34Å; W741-F764 HydrophobicContact CZ3-CE1 4.2Å; W741-F764 AromaticContact CZ3-CZ 3.75Å; W741-F764 HydrophobicContact CZ3-CZ 3.75Å; L748-F764 HydrophobicContact CB-CD1 4.36Å; L748-F764 HydrophobicContact CD2-CD1 3.52Å; L748-F764 HydrophobicContact CD2-CE1 3.41Å; L748-F764 HydrophobicContact CD2-CG 4.19Å; L748-F764 HydrophobicContact CD2-CZ 4.21Å; L762-F764 HydrophobicContact CB-CD2 4.4Å; L762-F764 HydrophobicContact CB-CE2 3.53Å; L762-F764 VanDerWaalsContact CB-CE2 3.47Å; L762-F764 HydrophobicContact CB-CZ 3.82Å; L762-F764 HydrophobicContact CD1-CE2 4.26Å; L762-F764 HydrophobicContact CD1-CZ 4.13Å; L762-F764 HydrophobicContact CD2-CZ 4.19Å; L762-F764 HydrophobicContact CG-CE2 4.39Å; L762-F764 HydrophobicContact CG-CZ 4.23Å; F764-L766 PolarHBondContact O-N 3.17Å; F764-L769 HydrophobicContact CB-CD1 4.11Å; F764-L769 HydrophobicContact CD1-CD1 3.87Å; F764-L769 HydrophobicContact CE1-CD1 4.44Å; F764-L769 HydrophobicContact CG-CD1 4.17Å; F764-I793 HydrophobicContact CE1-CD1 4.23Å; F764-I793 HydrophobicContact CZ-CD1 4.07Å
765N72.7Confident61.3Low37.6667 Ų37.666763.7 Ų63.720%0.20131%0.314CS..EExtended strand (participates in β ladder)trans-78.3116.3163.9178.8-24000108.6I725 N767 V768 L769I725-N765 HydrophobicContact CG2-CB 4.21Å; I725-N765 WeakPolarHBondContact CG2-ND2 3.37Å; I725-N765 WeakPolarHBondContact CG2-OD1 3.39Å; N765-N767 VanDerWaalsContact C-N 3.26Å; N765-N767 PolarHBondContact O-N 3.23Å; N765-N767 WeakPolarHBondContact OD1-CB 3.48Å; N765-N767 PolarHBondContact OD1-N 3.27Å; N765-V768 HydrophobicContact CB-CB 4.04Å; N765-V768 HydrophobicContact CB-CG2 3.95Å; N765-V768 WeakPolarHBondContact ND2-CG2 3.33Å; N765-V768 PolarHBondContact O-N 2.87Å; N765-V768 PolarHBondContact OD1-N 3.32Å; N765-L769 WeakPolarHBondContact O-CB 3.4Å; N765-L769 PolarHBondContact O-N 2.93Å
766L74.1Confident61.8Low0 Ų055.6 Ų55.60%028%0.281CS..Hα-helixtrans-61.4-35.5-174.4-176.167.2000112.3I726 L728 F764 N770 L794 Y797 L837I726-L766 HydrophobicContact CB-CB 4.38Å; I726-L766 HydrophobicContact CB-CD2 4.44Å; I726-L766 HydrophobicContact CG2-CB 4.21Å; I726-L766 HydrophobicContact CG2-CD2 3.83Å; I726-L766 WeakPolarHBondContact O-CB 3.37Å; I726-L766 PolarHBondContact O-N 3.15Å; L728-L766 HydrophobicContact CD1-CD1 3.73Å; L728-L766 HydrophobicContact CD2-CD1 4.37Å; L728-L766 HydrophobicContact CG-CB 4.43Å; L728-L766 HydrophobicContact CG-CD1 4.09Å; F764-L766 PolarHBondContact O-N 3.17Å; L766-N770 PolarHBondContact O-N 3.03Å; L766-L794 HydrophobicContact CD1-CD1 4.03Å; L766-L794 HydrophobicContact CD1-CD2 3.85Å; L766-Y797 HydrophobicContact CD1-CE1 4.47Å; L766-L837 HydrophobicContact CD1-CD2 4.49Å; L766-L837 HydrophobicContact CD2-CD1 3.87Å; L766-L837 HydrophobicContact CD2-CD2 3.79Å; L766-L837 HydrophobicContact CD2-CG 4.48Å; L766-L837 HydrophobicContact CG-CD2 3.73Å
767N70.9Confident62.5Low28 Ų2858.5 Ų58.515%0.1529%0.288CS..Hα-helixtrans-68.6-48.6179.2-67.4-15.1000111.1N765 L769 N770 D771 N834N765-N767 VanDerWaalsContact C-N 3.26Å; N765-N767 PolarHBondContact O-N 3.23Å; N765-N767 WeakPolarHBondContact OD1-CB 3.48Å; N765-N767 PolarHBondContact OD1-N 3.27Å; N767-L769 VanDerWaalsContact C-N 3.27Å; N767-L769 PolarHBondContact O-N 3.02Å; N767-N770 PolarHBondContact O-N 3.16Å; N767-D771 VanDerWaalsContact O-CB 3.31Å; N767-D771 WeakPolarHBondContact O-CB 3.42Å; N767-D771 PolarHBondContact O-N 3.04Å; N767-N834 PolarHBondContact OD1-ND2 3.25Å
768V68.6Low62.8Low44.6667 Ų44.666757.6 Ų57.627%0.27128%0.284SS..Hα-helixtrans-60.6-41.9178.3174.60000110.3N747 L748 N765 N770 D771 I772N747-V768 HydrophobicContact CB-CG1 4.46Å; L748-V768 HydrophobicContact CD2-CG1 4.35Å; N765-V768 HydrophobicContact CB-CB 4.04Å; N765-V768 HydrophobicContact CB-CG2 3.95Å; N765-V768 WeakPolarHBondContact ND2-CG2 3.33Å; N765-V768 PolarHBondContact O-N 2.87Å; N765-V768 PolarHBondContact OD1-N 3.32Å; V768-N770 VanDerWaalsContact C-N 3.33Å; V768-N770 PolarHBondContact O-N 3.29Å; V768-D771 PolarHBondContact O-N 3.01Å; V768-I772 HydrophobicContact CG1-CD1 3.77Å; V768-I772 HydrophobicContact CG1-CG1 4.34Å; V768-I772 WeakPolarHBondContact O-CB 3.45Å; V768-I772 WeakPolarHBondContact O-CD1 3.36Å; V768-I772 WeakPolarHBondContact O-CG1 3.4Å; V768-I772 PolarHBondContact O-N 3.29Å
769L67.4Low62.8Low2.66667 Ų2.6666757.1 Ų57.11%0.01427%0.273CS..Hα-helixtrans-62.2-43.1178.5-166.3141.4000111.3F764 N765 N767 I773 Y790 L794F764-L769 HydrophobicContact CB-CD1 4.11Å; F764-L769 HydrophobicContact CD1-CD1 3.87Å; F764-L769 HydrophobicContact CE1-CD1 4.44Å; F764-L769 HydrophobicContact CG-CD1 4.17Å; N765-L769 WeakPolarHBondContact O-CB 3.4Å; N765-L769 PolarHBondContact O-N 2.93Å; N767-L769 VanDerWaalsContact C-N 3.27Å; N767-L769 PolarHBondContact O-N 3.02Å; L769-I773 HydrophobicContact CD2-CD1 3.85Å; L769-I773 HydrophobicContact CG-CD1 4.48Å; L769-I773 VanDerWaalsContact O-CD1 3.31Å; L769-I773 WeakPolarHBondContact O-CD1 3.42Å; L769-I773 VanDerWaalsContact O-CG1 3.26Å; L769-I773 WeakPolarHBondContact O-CG1 3.41Å; L769-I773 PolarHBondContact O-N 3.15Å; L769-Y790 HydrophobicContact CD1-CD1 4Å; L769-Y790 HydrophobicContact CD1-CE1 4.36Å; L769-Y790 HydrophobicContact CD1-CG 4.36Å; L769-Y790 HydrophobicContact CG-CD1 4.05Å; L769-Y790 HydrophobicContact CG-CG 4.35Å; L769-L794 HydrophobicContact CD2-CB 3.83Å; L769-L794 HydrophobicContact CD2-CD1 3.64Å; L769-L794 VanDerWaalsContact CD2-CD1 3.47Å; L769-L794 HydrophobicContact CD2-CD2 3.92Å; L769-L794 HydrophobicContact CD2-CG 3.88Å
770N69.7Low62.5Low1 Ų159.6 Ų59.61%0.00529%0.29CS..Hα-helixtrans-74-34.7177.6-155.143.7000113.2L766 N767 V768 I773 N774 L794 R836 L837 R838L766-N770 PolarHBondContact O-N 3.03Å; N767-N770 PolarHBondContact O-N 3.16Å; V768-N770 VanDerWaalsContact C-N 3.33Å; V768-N770 PolarHBondContact O-N 3.29Å; N770-I773 PolarHBondContact O-N 3.11Å; N770-N774 WeakPolarHBondContact O-CB 3.33Å; N770-N774 VanDerWaalsContact O-CG 3.29Å; N770-N774 PolarHBondContact O-N 3.31Å; N770-N774 PolarHBondContact O-ND2 3.07Å; N770-L794 HydrophobicContact CB-CD1 4.38Å; N770-L794 WeakPolarHBondContact OD1-CD2 3.42Å; N770-R836 PolarHBondContact ND2-O 3Å; N770-L837 HydrophobicContact CB-CD2 4.39Å; N770-L837 WeakPolarHBondContact ND2-CA 3.43Å; N770-R838 PolarHBondContact ND2-N 3.06Å; N770-R838 PolarHBondContact OD1-NE 3.04Å
771D68.5Low62.1Low41 Ų4161.6 Ų61.622%0.21931%0.305CS..Hα-helixtrans-63.7-43.9176-72.6-22.5000110.8N767 V768 I773 N774 Q775 R836N767-D771 VanDerWaalsContact O-CB 3.31Å; N767-D771 WeakPolarHBondContact O-CB 3.42Å; N767-D771 PolarHBondContact O-N 3.04Å; V768-D771 PolarHBondContact O-N 3.01Å; D771-I773 VanDerWaalsContact C-N 3.27Å; D771-I773 PolarHBondContact O-N 3.21Å; D771-N774 PolarHBondContact O-N 3.22Å; D771-Q775 WeakPolarHBondContact O-CB 3.33Å; D771-Q775 VanDerWaalsContact O-CG 3.29Å; D771-Q775 WeakPolarHBondContact O-CG 3.4Å; D771-Q775 PolarHBondContact O-N 3.08Å; D771-R836 IonicContact OD2-NH1 3.37Å; D771-R836 PolarHBondContact OD2-NH1 3.21Å
772I66.5Low61.5Low38.3333 Ų38.333367.4 Ų67.420%0.19733%0.333CS..Hα-helixtrans-57.2-43.5174.4-70.6165.4000110.5L748 V768 S776 I787 Y790L748-I772 HydrophobicContact CD1-CD1 4.33Å; V768-I772 HydrophobicContact CG1-CD1 3.77Å; V768-I772 HydrophobicContact CG1-CG1 4.34Å; V768-I772 WeakPolarHBondContact O-CB 3.45Å; V768-I772 WeakPolarHBondContact O-CD1 3.36Å; V768-I772 WeakPolarHBondContact O-CG1 3.4Å; V768-I772 PolarHBondContact O-N 3.29Å; I772-S776 VanDerWaalsContact O-CB 3.24Å; I772-S776 WeakPolarHBondContact O-CB 3.32Å; I772-S776 PolarHBondContact O-N 3.25Å; I772-S776 VanDerWaalsContact O-N 3.1Å; I772-S776 PolarHBondContact O-OG 2.76Å; I772-I787 HydrophobicContact CG2-CG1 4.35Å; I772-Y790 HydrophobicContact CD1-CE2 4.22Å; I772-Y790 HydrophobicContact CG2-CD2 3.8Å; I772-Y790 HydrophobicContact CG2-CE2 4.05Å
773I65.5Low60.9Low7 Ų772.2 Ų72.24%0.03635%0.354CS..Hα-helixtrans-70-40.3-179.4-62162.4000111.3L769 N770 D771 S776 C791 L794L769-I773 HydrophobicContact CD2-CD1 3.85Å; L769-I773 HydrophobicContact CG-CD1 4.48Å; L769-I773 VanDerWaalsContact O-CD1 3.31Å; L769-I773 WeakPolarHBondContact O-CD1 3.42Å; L769-I773 VanDerWaalsContact O-CG1 3.26Å; L769-I773 WeakPolarHBondContact O-CG1 3.41Å; L769-I773 PolarHBondContact O-N 3.15Å; N770-I773 PolarHBondContact O-N 3.11Å; D771-I773 VanDerWaalsContact C-N 3.27Å; D771-I773 PolarHBondContact O-N 3.21Å; I773-S776 PolarHBondContact O-N 3.2Å; I773-S776 PolarHBondContact O-OG 2.93Å; I773-C791 VanDerWaalsContact CG2-SG 3.54Å; I773-C791 WeakPolarHBondContact CG2-SG 3.46Å; I773-L794 HydrophobicContact CD1-CB 4.23Å; I773-L794 HydrophobicContact CD1-CD1 3.66Å; I773-L794 HydrophobicContact CD1-CD2 3.73Å; I773-L794 HydrophobicContact CD1-CG 3.96Å
774N66.1Low60.3Low68.3333 Ų68.333374.3 Ų74.337%0.36537%0.37SS..Hα-helixtrans-67.5-44.6178.4-73.2-24.2000112.3N770 D771 S776 K777N770-N774 WeakPolarHBondContact O-CB 3.33Å; N770-N774 VanDerWaalsContact O-CG 3.29Å; N770-N774 PolarHBondContact O-N 3.31Å; N770-N774 PolarHBondContact O-ND2 3.07Å; D771-N774 PolarHBondContact O-N 3.22Å; N774-S776 VanDerWaalsContact C-N 3.3Å; N774-S776 PolarHBondContact O-N 2.9Å; N774-K777 PolarHBondContact O-N 3.18Å
775Q59.9Low59.7Low140.333 Ų140.33379.1 Ų79.166%0.65639%0.391SS*.Hα-helixtrans-63.4-36.5177.6-72.3176.43.200111.8D771 K777 Q778D771-Q775 WeakPolarHBondContact O-CB 3.33Å; D771-Q775 VanDerWaalsContact O-CG 3.29Å; D771-Q775 WeakPolarHBondContact O-CG 3.4Å; D771-Q775 PolarHBondContact O-N 3.08Å; Q775-K777 VanDerWaalsContact C-N 3.3Å; Q775-K777 PolarHBondContact O-N 3.19Å; Q775-Q778 PolarHBondContact O-N 3.2Å
776S53.7Low59.1Low22.3333 Ų22.333379.9 Ų79.916%0.15639%0.394CS..Hα-helixtrans-74.8-12.2-175.164.50000116.2I772 I773 N774 Q778 E779 I787I772-S776 VanDerWaalsContact O-CB 3.24Å; I772-S776 WeakPolarHBondContact O-CB 3.32Å; I772-S776 PolarHBondContact O-N 3.25Å; I772-S776 VanDerWaalsContact O-N 3.1Å; I772-S776 PolarHBondContact O-OG 2.76Å; I773-S776 PolarHBondContact O-N 3.2Å; I773-S776 PolarHBondContact O-OG 2.93Å; N774-S776 VanDerWaalsContact C-N 3.3Å; N774-S776 PolarHBondContact O-N 2.9Å; S776-Q778 PolarHBondContact O-N 3.01Å; S776-E779 PolarHBondContact O-N 2.93Å; S776-E779 VanDerWaalsContact O-N 3.14Å; S776-I787 VanDerWaalsContact OG-CG2 3.27Å; S776-I787 WeakPolarHBondContact OG-CG2 3.3Å
777K54.4Low58.5Low183.333 Ų183.33381.1 Ų81.180%0.79740%0.4SS*.THydrogen-bonded Turntrans-55.1-14167.1-79.4-175.4176.6178.30112.4N774 Q775N774-K777 PolarHBondContact O-N 3.18Å; Q775-K777 VanDerWaalsContact C-N 3.3Å; Q775-K777 PolarHBondContact O-N 3.19Å
778Q50.6Low58.1Low178 Ų17882.6 Ų82.683%0.83241%0.41SS*.THydrogen-bonded Turntrans-105.7-13.1180-63.6-179.1-1200115.3Q775 S776Q775-Q778 PolarHBondContact O-N 3.2Å; S776-Q778 PolarHBondContact O-N 3.01Å
779E45.7Very low57.9Low112.667 Ų112.66780.8 Ų80.853%0.52640%0.399SS..  trans-123.1112.4-174.7-71-169.2171.300113.7S776 K783S776-E779 PolarHBondContact O-N 2.93Å; S776-E779 VanDerWaalsContact O-N 3.14Å; E779-K783 IonicContact OE2-NZ 3.08Å; E779-K783 PolarHBondContact OE2-NZ 3.11Å
780L42.3Very low58Low171 Ų17181 Ų8190%0.89540%0.399SS*.  trans-96.585.4177.3-73.9157.9000111
781N45.6Very low58.2Low132.667 Ų132.66782.4 Ų82.471%0.70941%0.409SS*.SBendtrans-152.1179.8169.2-93.3-25.9000110.2K783 S784N781-K783 CarbonylContact O-C 3.54Å; N781-K783 WeakPolarHBondContact O-CA 3.15Å; N781-K783 PolarHBondContact O-N 3.03Å; N781-S784 VanDerWaalsContact O-CB 3.26Å; N781-S784 WeakPolarHBondContact O-CB 3.29Å; N781-S784 PolarHBondContact O-N 3.17Å; N781-S784 PolarHBondContact O-OG 3.27Å
782E48.5Very low58.2Low171.333 Ų171.33382.5 Ų82.580%0.80141%0.409SS*.THydrogen-bonded Turntrans-39.2-25.7-176-78.3-136.1141.400117S784 K785E782-S784 PolarHBondContact O-N 3.25Å; E782-K785 PolarHBondContact O-N 3.06Å
783K50.2Low58.6Low114 Ų11481.3 Ų81.350%0.49640%0.403SS..Hα-helixtrans-47-24.3163.4-64.1-177.3-176.2172.50112.9E779 N781 K785 Q786 I787E779-K783 IonicContact OE2-NZ 3.08Å; E779-K783 PolarHBondContact OE2-NZ 3.11Å; N781-K783 CarbonylContact O-C 3.54Å; N781-K783 WeakPolarHBondContact O-CA 3.15Å; N781-K783 PolarHBondContact O-N 3.03Å; K783-K785 VanDerWaalsContact C-N 3.3Å; K783-K785 PolarHBondContact O-N 2.88Å; K783-Q786 PolarHBondContact O-N 3.12Å; K783-Q786 VanDerWaalsContact O-N 3.1Å; K783-I787 HydrophobicContact CB-CD1 3.74Å; K783-I787 HydrophobicContact CB-CG1 4.44Å; K783-I787 WeakPolarHBondContact O-CB 3.43Å; K783-I787 VanDerWaalsContact O-CD1 3.27Å; K783-I787 WeakPolarHBondContact O-CD1 3.46Å; K783-I787 VanDerWaalsContact O-CG1 3.26Å; K783-I787 WeakPolarHBondContact O-CG1 3.22Å; K783-I787 PolarHBondContact O-N 3.34Å
784S55.2Low59.2Low59.6667 Ų59.666781.1 Ų81.142%0.41740%0.402SS..Hα-helixtrans-54.2-39.9-178.161.70000112.8N781 E782 I787 T788N781-S784 VanDerWaalsContact O-CB 3.26Å; N781-S784 WeakPolarHBondContact O-CB 3.29Å; N781-S784 PolarHBondContact O-N 3.17Å; N781-S784 PolarHBondContact O-OG 3.27Å; E782-S784 PolarHBondContact O-N 3.25Å; S784-I787 PolarHBondContact O-N 3.41Å; S784-T788 WeakPolarHBondContact O-CB 3.37Å; S784-T788 PolarHBondContact O-N 3.29Å; S784-T788 PolarHBondContact O-OG1 3.3Å
785K56.9Low59.9Low106.333 Ų106.33380.9 Ų80.946%0.46240%0.401SS..Hα-helixtrans-64.3-47.4176.7-70.3-176.9-179.4175.90111.5S549 E782 K783 T788 L789S549-K785 PolarHBondContact O-NZ 2.86Å; E782-K785 PolarHBondContact O-N 3.06Å; K783-K785 VanDerWaalsContact C-N 3.3Å; K783-K785 PolarHBondContact O-N 2.88Å; K785-T788 PolarHBondContact O-N 3.12Å; K785-L789 PolarHBondContact O-N 2.87Å; K785-L789 VanDerWaalsContact O-N 3.1Å
786Q59.8Low60.9Low56 Ų5674.5 Ų74.526%0.26237%0.371SS..Hα-helixtrans-65.8-41.4178.5-67.3-178.6-8.600111.7N743 K783 L789 Y790N743-Q786 PolarHBondContact O-NE2 3.38Å; K783-Q786 PolarHBondContact O-N 3.12Å; K783-Q786 VanDerWaalsContact O-N 3.1Å; Q786-L789 WeakPolarHBondContact O-CB 3.4Å; Q786-L789 PolarHBondContact O-N 3.13Å; Q786-Y790 HydrophobicContact CB-CE2 4.15Å; Q786-Y790 WeakPolarHBondContact O-CD2 3.49Å; Q786-Y790 PolarHBondContact O-N 3.14Å
787I62.1Low62.5Low24 Ų2473.4 Ų73.412%0.12336%0.363CS..Hα-helixtrans-61.8-45.7176.2-67.3154.7000110.8I772 S776 K783 S784 L789 Y790 C791I772-I787 HydrophobicContact CG2-CG1 4.35Å; S776-I787 VanDerWaalsContact OG-CG2 3.27Å; S776-I787 WeakPolarHBondContact OG-CG2 3.3Å; K783-I787 HydrophobicContact CB-CD1 3.74Å; K783-I787 HydrophobicContact CB-CG1 4.44Å; K783-I787 WeakPolarHBondContact O-CB 3.43Å; K783-I787 VanDerWaalsContact O-CD1 3.27Å; K783-I787 WeakPolarHBondContact O-CD1 3.46Å; K783-I787 VanDerWaalsContact O-CG1 3.26Å; K783-I787 WeakPolarHBondContact O-CG1 3.22Å; K783-I787 PolarHBondContact O-N 3.34Å; S784-I787 PolarHBondContact O-N 3.41Å; I787-L789 VanDerWaalsContact C-N 3.27Å; I787-L789 PolarHBondContact O-N 2.99Å; I787-Y790 PolarHBondContact O-N 3.1Å; I787-C791 PolarHBondContact O-N 3.07Å; I787-C791 PolarHBondContact O-SG 3.22Å; I787-C791 VanDerWaalsContact O-SG 3.35Å
788T63.4Low64.1Low60.3333 Ų60.333366.5 Ų66.537%0.3733%0.334SS..Hα-helixtrans-58.2-41.3176.8-57.70000110.4S784 K785 C791 L792S784-T788 WeakPolarHBondContact O-CB 3.37Å; S784-T788 PolarHBondContact O-N 3.29Å; S784-T788 PolarHBondContact O-OG1 3.3Å; K785-T788 PolarHBondContact O-N 3.12Å; T788-C791 WeakPolarHBondContact O-CB 3.49Å; T788-C791 PolarHBondContact O-N 3.28Å; T788-L792 HydrophobicContact CG2-CD1 4.06Å; T788-L792 WeakPolarHBondContact O-CD1 3.43Å; T788-L792 VanDerWaalsContact O-CG 3.23Å; T788-L792 WeakPolarHBondContact O-CG 3.35Å; T788-L792 PolarHBondContact O-N 3.18Å
789L64.4Low65.7Low7 Ų758.2 Ų58.24%0.03730%0.295CS..Hα-helixtrans-63.4-46.9174.9-175.168.8000112.6V542 L546 F740 L744 K785 Q786 I787 C791 L792 I793V542-L789 HydrophobicContact CB-CD1 4.47Å; V542-L789 HydrophobicContact CG1-CD1 3.88Å; L546-L789 HydrophobicContact CD2-CD1 4.36Å; L546-L789 HydrophobicContact CD2-CD2 4.19Å; L546-L789 HydrophobicContact CG-CD1 4.35Å; F740-L789 HydrophobicContact CE1-CD1 4.39Å; F740-L789 HydrophobicContact CE1-CD2 3.74Å; F740-L789 HydrophobicContact CE2-CD2 4.32Å; F740-L789 HydrophobicContact CZ-CD1 3.81Å; F740-L789 HydrophobicContact CZ-CD2 3.51Å; F740-L789 HydrophobicContact CZ-CG 4.2Å; L744-L789 HydrophobicContact CD1-CD2 3.84Å; L744-L789 HydrophobicContact CD2-CD2 4.02Å; L744-L789 HydrophobicContact CG-CD2 4.1Å; K785-L789 PolarHBondContact O-N 2.87Å; K785-L789 VanDerWaalsContact O-N 3.1Å; Q786-L789 WeakPolarHBondContact O-CB 3.4Å; Q786-L789 PolarHBondContact O-N 3.13Å; I787-L789 VanDerWaalsContact C-N 3.27Å; I787-L789 PolarHBondContact O-N 2.99Å; L789-C791 VanDerWaalsContact C-N 3.31Å; L789-C791 PolarHBondContact O-N 3.03Å; L789-L792 WeakPolarHBondContact O-CB 3.31Å; L789-L792 PolarHBondContact O-N 3.17Å; L789-L792 VanDerWaalsContact O-N 3.13Å; L789-I793 HydrophobicContact CD1-CD1 4.43Å; L789-I793 HydrophobicContact CG-CD1 4.13Å; L789-I793 WeakPolarHBondContact O-CG1 3.4Å; L789-I793 PolarHBondContact O-N 3.33Å
790Y70Confident67.9Low6.33333 Ų6.3333352.9 Ų52.93%0.02527%0.271CS..Hα-helixtrans-61.6-39177.2-64.4-48.6000112.3L744 L748 L769 I772 Q786 I787 I793 L794L744-Y790 HydrophobicContact CD2-CD1 4.45Å; L744-Y790 HydrophobicContact CD2-CE1 3.77Å; L744-Y790 HydrophobicContact CD2-CE2 4.32Å; L744-Y790 VanDerWaalsContact CD2-CZ 3.47Å; L744-Y790 VanDerWaalsContact CD2-OH 3.3Å; L744-Y790 WeakPolarHBondContact CD2-OH 3.33Å; L748-Y790 HydrophobicContact CD1-CD1 4.22Å; L748-Y790 HydrophobicContact CD1-CE1 3.94Å; L748-Y790 HydrophobicContact CD1-CE2 4.05Å; L748-Y790 WeakPolarHBondContact CD1-OH 3.27Å; L769-Y790 HydrophobicContact CD1-CD1 4Å; L769-Y790 HydrophobicContact CD1-CE1 4.36Å; L769-Y790 HydrophobicContact CD1-CG 4.36Å; L769-Y790 HydrophobicContact CG-CD1 4.05Å; L769-Y790 HydrophobicContact CG-CG 4.35Å; I772-Y790 HydrophobicContact CD1-CE2 4.22Å; I772-Y790 HydrophobicContact CG2-CD2 3.8Å; I772-Y790 HydrophobicContact CG2-CE2 4.05Å; Q786-Y790 HydrophobicContact CB-CE2 4.15Å; Q786-Y790 WeakPolarHBondContact O-CD2 3.49Å; Q786-Y790 PolarHBondContact O-N 3.14Å; I787-Y790 PolarHBondContact O-N 3.1Å; Y790-I793 PolarHBondContact O-N 3.28Å; Y790-L794 WeakPolarHBondContact O-CB 3.43Å; Y790-L794 PolarHBondContact O-N 2.71Å
791C72.1Confident70.2Confident31 Ų3144.7 Ų44.721%0.20923%0.228CC..Hα-helixtrans-58.6-47.6172.2-710000111.3I773 I787 T788 L789 I793 L794 D795I773-C791 VanDerWaalsContact CG2-SG 3.54Å; I773-C791 WeakPolarHBondContact CG2-SG 3.46Å; I787-C791 PolarHBondContact O-N 3.07Å; I787-C791 PolarHBondContact O-SG 3.22Å; I787-C791 VanDerWaalsContact O-SG 3.35Å; T788-C791 WeakPolarHBondContact O-CB 3.49Å; T788-C791 PolarHBondContact O-N 3.28Å; L789-C791 VanDerWaalsContact C-N 3.31Å; L789-C791 PolarHBondContact O-N 3.03Å; C791-I793 VanDerWaalsContact C-N 3.34Å; C791-I793 PolarHBondContact O-N 3.07Å; C791-L794 PolarHBondContact O-N 2.93Å; C791-D795 WeakPolarHBondContact O-CB 3.16Å; C791-D795 PolarHBondContact O-N 3.13Å
792L70.1Confident72.3Confident42 Ų4239.6 Ų39.622%0.2220%0.201CC..Hα-helixtrans-63.3-39.5-179.5-70.2162.1000112.5I541 V542 T788 L789 D795 Y796I541-L792 HydrophobicContact CB-CD1 4.16Å; I541-L792 HydrophobicContact CG2-CD1 3.71Å; V542-L792 HydrophobicContact CB-CD1 4.38Å; V542-L792 HydrophobicContact CG1-CD1 4.39Å; V542-L792 HydrophobicContact CG2-CB 3.8Å; V542-L792 VanDerWaalsContact CG2-CB 3.46Å; V542-L792 HydrophobicContact CG2-CD1 3.65Å; V542-L792 HydrophobicContact CG2-CD2 4.12Å; V542-L792 HydrophobicContact CG2-CG 4.04Å; T788-L792 HydrophobicContact CG2-CD1 4.06Å; T788-L792 WeakPolarHBondContact O-CD1 3.43Å; T788-L792 VanDerWaalsContact O-CG 3.23Å; T788-L792 WeakPolarHBondContact O-CG 3.35Å; T788-L792 PolarHBondContact O-N 3.18Å; L789-L792 WeakPolarHBondContact O-CB 3.31Å; L789-L792 PolarHBondContact O-N 3.17Å; L789-L792 VanDerWaalsContact O-N 3.13Å; L792-D795 PolarHBondContact O-N 3.08Å; L792-Y796 WeakPolarHBondContact O-CB 3.34Å; L792-Y796 PolarHBondContact O-N 3.15Å
793I74.6Confident74.2Confident12.6667 Ų12.666731.5 Ų31.57%0.06516%0.163CC..Hα-helixtrans-64.6-44175.2-66.1169000110.4W730 W741 F764 L789 Y790 C791 Y796 Y797W730-I793 HydrophobicContact CZ3-CG1 4.39Å; W741-I793 HydrophobicContact CH2-CD1 4.16Å; W741-I793 HydrophobicContact CZ3-CD1 4.15Å; F764-I793 HydrophobicContact CE1-CD1 4.23Å; F764-I793 HydrophobicContact CZ-CD1 4.07Å; L789-I793 HydrophobicContact CD1-CD1 4.43Å; L789-I793 HydrophobicContact CG-CD1 4.13Å; L789-I793 WeakPolarHBondContact O-CG1 3.4Å; L789-I793 PolarHBondContact O-N 3.33Å; Y790-I793 PolarHBondContact O-N 3.28Å; C791-I793 VanDerWaalsContact C-N 3.34Å; C791-I793 PolarHBondContact O-N 3.07Å; I793-Y796 WeakPolarHBondContact O-CB 3.46Å; I793-Y796 PolarHBondContact O-N 3.33Å; I793-Y797 WeakPolarHBondContact O-CB 3.41Å; I793-Y797 PolarHBondContact O-N 3.09Å
794L78.2Confident76.2Confident3 Ų326.5 Ų26.52%0.01614%0.141CC..Hα-helixtrans-66.4-39.2177.7-141.7134.8000112.2L766 L769 N770 I773 Y790 C791 Y796 Y797 Q798 L841L766-L794 HydrophobicContact CD1-CD1 4.03Å; L766-L794 HydrophobicContact CD1-CD2 3.85Å; L769-L794 HydrophobicContact CD2-CB 3.83Å; L769-L794 HydrophobicContact CD2-CD1 3.64Å; L769-L794 VanDerWaalsContact CD2-CD1 3.47Å; L769-L794 HydrophobicContact CD2-CD2 3.92Å; L769-L794 HydrophobicContact CD2-CG 3.88Å; N770-L794 HydrophobicContact CB-CD1 4.38Å; N770-L794 WeakPolarHBondContact OD1-CD2 3.42Å; I773-L794 HydrophobicContact CD1-CB 4.23Å; I773-L794 HydrophobicContact CD1-CD1 3.66Å; I773-L794 HydrophobicContact CD1-CD2 3.73Å; I773-L794 HydrophobicContact CD1-CG 3.96Å; Y790-L794 WeakPolarHBondContact O-CB 3.43Å; Y790-L794 PolarHBondContact O-N 2.71Å; C791-L794 PolarHBondContact O-N 2.93Å; L794-Y796 VanDerWaalsContact C-N 3.3Å; L794-Y797 PolarHBondContact O-N 3.38Å; L794-Q798 WeakPolarHBondContact O-CB 3.33Å; L794-Q798 PolarHBondContact O-N 3Å; L794-L841 HydrophobicContact CD1-CD2 4.03Å
795D80.4Confident77.8Confident64.6667 Ų64.666723.6 Ų23.635%0.34612%0.121SC..Hα-helixtrans-67.6-37.9177.8-65.7-17000110.6A669 C791 L792 Q798 A799 R838A669-D795 VanDerWaalsContact CB-C 3.5Å; A669-D795 HydrophobicContact CB-CB 4.18Å; A669-D795 WeakPolarHBondContact CB-O 3.39Å; C791-D795 WeakPolarHBondContact O-CB 3.16Å; C791-D795 PolarHBondContact O-N 3.13Å; L792-D795 PolarHBondContact O-N 3.08Å; D795-Q798 PolarHBondContact O-N 3.03Å; D795-A799 WeakPolarHBondContact O-CB 3.15Å; D795-A799 PolarHBondContact O-N 3.17Å; D795-R838 IonicContact OD1-NH1 3.71Å; D795-R838 PolarHBondContact OD1-NH1 2.98Å
796Y81.5Confident79.3Confident5.33333 Ų5.3333319.9 Ų19.92%0.02111%0.106CC..Hα-helixtrans-61.6-48.3172-176-91.6000111.3I667 L672 L705 V707 L792 I793 L794 Q798 A799 Q800I667-Y796 HydrophobicContact CG2-CD2 3.87Å; I667-Y796 HydrophobicContact CG2-CE1 4.36Å; I667-Y796 HydrophobicContact CG2-CE2 3.58Å; I667-Y796 HydrophobicContact CG2-CG 4.38Å; L672-Y796 HydrophobicContact CD1-CD1 4.22Å; L672-Y796 HydrophobicContact CD1-CD2 3.88Å; L672-Y796 HydrophobicContact CD1-CE1 3.92Å; L672-Y796 HydrophobicContact CD1-CE2 3.55Å; L672-Y796 HydrophobicContact CD1-CG 4.2Å; L672-Y796 HydrophobicContact CG-CD2 4.46Å; L672-Y796 HydrophobicContact CG-CE2 3.93Å; L705-Y796 PolarHBondContact O-OH 3.13Å; V707-Y796 HydrophobicContact CG2-CD1 4.29Å; V707-Y796 HydrophobicContact CG2-CE1 4.31Å; L792-Y796 WeakPolarHBondContact O-CB 3.34Å; L792-Y796 PolarHBondContact O-N 3.15Å; I793-Y796 WeakPolarHBondContact O-CB 3.46Å; I793-Y796 PolarHBondContact O-N 3.33Å; L794-Y796 VanDerWaalsContact C-N 3.3Å; Y796-Q798 PolarHBondContact O-N 3.33Å; Y796-A799 PolarHBondContact O-N 3.09Å; Y796-Q800 PolarHBondContact O-N 3.08Å
797Y87Confident80.6Confident0.333333 Ų0.33333317.2 Ų17.20%0.0019%0.094CC..Hα-helixtrans-62.4-43.3177.8178.9-111.2000112.2V707 T709 L728 L766 I793 L794 A799 Q800 I801 L841 F845V707-Y797 HydrophobicContact CB-CD2 3.86Å; V707-Y797 HydrophobicContact CB-CE2 4.36Å; V707-Y797 HydrophobicContact CG1-CD2 3.78Å; V707-Y797 HydrophobicContact CG1-CE2 4.12Å; T709-Y797 VanDerWaalsContact CG2-OH 3.28Å; T709-Y797 WeakPolarHBondContact CG2-OH 3.39Å; T709-Y797 WeakPolarHBondContact OG1-CE2 3.35Å; T709-Y797 PolarHBondContact OG1-OH 3.2Å; L728-Y797 HydrophobicContact CD1-CD1 4.19Å; L728-Y797 HydrophobicContact CD1-CD2 4.38Å; L728-Y797 HydrophobicContact CD1-CE1 4.44Å; L728-Y797 HydrophobicContact CD1-CG 4.15Å; L728-Y797 HydrophobicContact CD2-CD1 4.4Å; L728-Y797 HydrophobicContact CD2-CD2 4.2Å; L728-Y797 HydrophobicContact CD2-CE1 3.87Å; L728-Y797 HydrophobicContact CD2-CE2 3.64Å; L728-Y797 VanDerWaalsContact CD2-CZ 3.45Å; L766-Y797 HydrophobicContact CD1-CE1 4.47Å; I793-Y797 WeakPolarHBondContact O-CB 3.41Å; I793-Y797 PolarHBondContact O-N 3.09Å; L794-Y797 PolarHBondContact O-N 3.38Å; Y797-A799 VanDerWaalsContact C-N 3.34Å; Y797-A799 PolarHBondContact O-N 3.24Å; Y797-Q800 WeakPolarHBondContact O-CB 3.36Å; Y797-Q800 PolarHBondContact O-N 3.11Å; Y797-Q800 VanDerWaalsContact O-N 3.16Å; Y797-I801 HydrophobicContact CE1-CG1 4.1Å; Y797-I801 HydrophobicContact CE2-CD1 3.99Å; Y797-I801 HydrophobicContact CE2-CG1 4.12Å; Y797-I801 WeakPolarHBondContact O-CG1 3.41Å; Y797-I801 PolarHBondContact O-N 3.39Å; Y797-L841 HydrophobicContact CD1-CD1 4.18Å; Y797-L841 HydrophobicContact CE1-CD1 4.21Å; Y797-F845 HydrophobicContact CE1-CE2 4.48Å; Y797-F845 AromaticContact CE1-CZ 3.77Å; Y797-F845 HydrophobicContact CE1-CZ 3.77Å; Y797-F845 AromaticContact CZ-CZ 3.95Å; Y797-F845 VanDerWaalsContact OH-CZ 3.29Å; Y797-F845 WeakPolarHBondContact OH-CZ 3.2Å
798Q87.1Confident81.8Confident38 Ų3816.1 Ų16.118%0.1789%0.088CC..Hα-helixtrans-60.2-45.2175.4-168.7-173.3-50.500110.9L794 D795 Y796 Q800 I801 D802 S840 L841L794-Q798 WeakPolarHBondContact O-CB 3.33Å; L794-Q798 PolarHBondContact O-N 3Å; D795-Q798 PolarHBondContact O-N 3.03Å; Y796-Q798 PolarHBondContact O-N 3.33Å; Q798-Q800 VanDerWaalsContact C-N 3.29Å; Q798-Q800 PolarHBondContact O-N 3.19Å; Q798-I801 PolarHBondContact O-N 3.04Å; Q798-D802 PolarHBondContact O-N 3.4Å; Q798-S840 PolarHBondContact OE1-OG 3.32Å; Q798-S840 VanDerWaalsContact OE1-OG 3.09Å; Q798-L841 HydrophobicContact CB-CD1 3.98Å; Q798-L841 HydrophobicContact CG-CD1 3.9Å
799A85Confident82.9Confident3 Ų315 Ų153%0.0258%0.078CC..Hα-helixtrans-62.3-34.4176.400000112.8A669 L672 N673 D795 Y796 Y797 L803A669-A799 HydrophobicContact CB-CB 3.94Å; L672-A799 HydrophobicContact CB-CB 3.9Å; L672-A799 HydrophobicContact CD1-CB 4.28Å; N673-A799 VanDerWaalsContact OD1-CB 3.3Å; N673-A799 WeakPolarHBondContact OD1-CB 3.39Å; D795-A799 WeakPolarHBondContact O-CB 3.15Å; D795-A799 PolarHBondContact O-N 3.17Å; Y796-A799 PolarHBondContact O-N 3.09Å; Y797-A799 VanDerWaalsContact C-N 3.34Å; Y797-A799 PolarHBondContact O-N 3.24Å; A799-L803 VanDerWaalsContact O-CB 3.31Å; A799-L803 WeakPolarHBondContact O-CB 3.34Å; A799-L803 PolarHBondContact O-N 3.37Å
800Q90.8Very high83.8Confident1.66667 Ų1.6666719.2 Ų19.21%0.00810%0.098CC..Hα-helixtrans-64.6-45173.1-173.3-169.3-64.400111.7L672 L706 V707 Y796 Y797 Q798 L803 F804L672-Q800 HydrophobicContact CD1-CB 3.88Å; L706-Q800 HydrophobicContact CD2-CG 4.46Å; V707-Q800 PolarHBondContact O-NE2 3.02Å; Y796-Q800 PolarHBondContact O-N 3.08Å; Y797-Q800 WeakPolarHBondContact O-CB 3.36Å; Y797-Q800 PolarHBondContact O-N 3.11Å; Y797-Q800 VanDerWaalsContact O-N 3.16Å; Q798-Q800 VanDerWaalsContact C-N 3.29Å; Q798-Q800 PolarHBondContact O-N 3.19Å; Q800-L803 WeakPolarHBondContact O-CB 3.43Å; Q800-L803 PolarHBondContact O-N 3.07Å; Q800-F804 HydrophobicContact CG-CD1 4.44Å; Q800-F804 HydrophobicContact CG-CD2 4.4Å; Q800-F804 HydrophobicContact CG-CE1 3.94Å; Q800-F804 HydrophobicContact CG-CE2 3.9Å; Q800-F804 HydrophobicContact CG-CZ 3.65Å; Q800-F804 VanDerWaalsContact NE2-CE2 3.31Å; Q800-F804 WeakPolarHBondContact O-CD1 3.35Å; Q800-F804 VanDerWaalsContact O-CG 3.29Å; Q800-F804 WeakPolarHBondContact O-CG 3.24Å; Q800-F804 PolarHBondContact O-N 3.13Å
801I90.9Very high84.5Confident0 Ų020.2 Ų20.20%010%0.102CC..Hα-helixtrans-64.7-41.9177.3-62.6-56.9000110.9Y797 Q798 L803 F804 A805 F845 L848Y797-I801 HydrophobicContact CE1-CG1 4.1Å; Y797-I801 HydrophobicContact CE2-CD1 3.99Å; Y797-I801 HydrophobicContact CE2-CG1 4.12Å; Y797-I801 WeakPolarHBondContact O-CG1 3.41Å; Y797-I801 PolarHBondContact O-N 3.39Å; Q798-I801 PolarHBondContact O-N 3.04Å; I801-L803 VanDerWaalsContact C-N 3.34Å; I801-F804 HydrophobicContact CD1-CD2 4.39Å; I801-F804 PolarHBondContact O-N 3.18Å; I801-A805 PolarHBondContact O-N 3.18Å; I801-F845 HydrophobicContact CD1-CD1 4.5Å; I801-F845 HydrophobicContact CD1-CE1 3.91Å; I801-F845 HydrophobicContact CG1-CE1 4.02Å; I801-F845 HydrophobicContact CG1-CZ 4.43Å; I801-F845 HydrophobicContact CG2-CD1 4.01Å; I801-F845 HydrophobicContact CG2-CE1 4.3Å; I801-L848 HydrophobicContact CD1-CD2 4.18Å; I801-L848 HydrophobicContact CG2-CB 4.23Å; I801-L848 HydrophobicContact CG2-CD2 4Å
802D90.3Very high84.9Confident25.5 Ų25.519 Ų1914%0.1369%0.093CC..Hα-helixtrans-62.5-41.2174.8-77.5-39000111.5Q798 A805 L806 S844 R847Q798-D802 PolarHBondContact O-N 3.4Å; D802-A805 PolarHBondContact O-N 3.09Å; D802-L806 WeakPolarHBondContact O-CG 3.2Å; D802-L806 PolarHBondContact O-N 2.84Å; D802-L806 VanDerWaalsContact O-N 3.08Å; D802-S844 VanDerWaalsContact CG-OG 3.26Å; D802-S844 VanDerWaalsContact OD1-CB 3.23Å; D802-S844 WeakPolarHBondContact OD1-CB 3.43Å; D802-S844 PolarHBondContact OD1-OG 3.06Å; D802-S844 PolarHBondContact OD2-OG 2.89Å; D802-R847 IonicContact OD1-CZ 3.94Å; D802-R847 IonicContact OD1-NH1 3.54Å; D802-R847 PolarHBondContact OD1-NH1 3.32Å
803L89.3Confident85.4Confident0.75 Ų0.7517.3 Ų17.30%0.0048%0.084CC..Hα-helixtrans-61.8-46.1173.7177.261.3000111.5L672 L675 S676 L697 A799 Q800 I801 A805 L806 L807L672-L803 HydrophobicContact CD2-CD2 3.98Å; L675-L803 HydrophobicContact CB-CD1 3.82Å; L675-L803 HydrophobicContact CB-CD2 4.02Å; L675-L803 HydrophobicContact CD1-CD2 4.14Å; S676-L803 WeakPolarHBondContact OG-CA 3.4Å; S676-L803 WeakPolarHBondContact OG-CB 3.36Å; L697-L803 HydrophobicContact CD2-CD2 3.6Å; A799-L803 VanDerWaalsContact O-CB 3.31Å; A799-L803 WeakPolarHBondContact O-CB 3.34Å; A799-L803 PolarHBondContact O-N 3.37Å; Q800-L803 WeakPolarHBondContact O-CB 3.43Å; Q800-L803 PolarHBondContact O-N 3.07Å; I801-L803 VanDerWaalsContact C-N 3.34Å; L803-A805 VanDerWaalsContact C-N 3.32Å; L803-A805 PolarHBondContact O-N 3.29Å; L803-L806 CarbonylContact O-C 3.54Å; L803-L806 PolarHBondContact O-N 3.27Å; L803-L807 HydrophobicContact CD1-CD1 4.22Å; L803-L807 HydrophobicContact CD1-CG 4.08Å; L803-L807 HydrophobicContact CG-CD1 3.96Å; L803-L807 HydrophobicContact CG-CG 4.27Å; L803-L807 WeakPolarHBondContact O-CB 3.35Å; L803-L807 VanDerWaalsContact O-CG 3.31Å; L803-L807 WeakPolarHBondContact O-CG 3.28Å; L803-L807 PolarHBondContact O-N 3.09Å
804F91.7Very high85.6Confident8.5 Ų8.518.9 Ų18.94%0.0379%0.092CC..Hα-helixtrans-60.4-41.7177.2-71.6-7.6000112.1L698 L706 Q800 I801 L806 L807 C808 L819 L823 L848L698-F804 HydrophobicContact CD2-CE1 4.4Å; L706-F804 HydrophobicContact CD1-CZ 4.39Å; L706-F804 HydrophobicContact CD2-CE1 4.1Å; L706-F804 HydrophobicContact CD2-CZ 3.98Å; Q800-F804 HydrophobicContact CG-CD1 4.44Å; Q800-F804 HydrophobicContact CG-CD2 4.4Å; Q800-F804 HydrophobicContact CG-CE1 3.94Å; Q800-F804 HydrophobicContact CG-CE2 3.9Å; Q800-F804 HydrophobicContact CG-CZ 3.65Å; Q800-F804 VanDerWaalsContact NE2-CE2 3.31Å; Q800-F804 WeakPolarHBondContact O-CD1 3.35Å; Q800-F804 VanDerWaalsContact O-CG 3.29Å; Q800-F804 WeakPolarHBondContact O-CG 3.24Å; Q800-F804 PolarHBondContact O-N 3.13Å; I801-F804 HydrophobicContact CD1-CD2 4.39Å; I801-F804 PolarHBondContact O-N 3.18Å; F804-L806 VanDerWaalsContact C-N 3.31Å; F804-L806 PolarHBondContact O-N 3.12Å; F804-L807 HydrophobicContact CD1-CD1 4.42Å; F804-L807 PolarHBondContact O-N 3.07Å; F804-C808 PolarHBondContact O-N 3.11Å; F804-C808 PolarHBondContact O-SG 3.17Å; F804-C808 VanDerWaalsContact O-SG 3.39Å; F804-L819 HydrophobicContact CB-CD1 3.78Å; F804-L819 HydrophobicContact CD1-CD1 4.02Å; F804-L819 HydrophobicContact CD1-CD2 4.37Å; F804-L819 HydrophobicContact CD2-CD1 4.09Å; F804-L819 HydrophobicContact CD2-CD2 3.88Å; F804-L819 HydrophobicContact CE1-CD2 4.23Å; F804-L819 HydrophobicContact CE2-CD2 3.72Å; F804-L819 HydrophobicContact CG-CD1 3.72Å; F804-L819 HydrophobicContact CG-CD2 4.2Å; F804-L819 HydrophobicContact CZ-CD2 3.9Å; F804-L823 HydrophobicContact CD2-CD1 4.37Å; F804-L848 HydrophobicContact CB-CD1 3.77Å; F804-L848 HydrophobicContact CB-CD2 4.42Å
805A89.2Confident85.9Confident0 Ų018.8 Ų18.80%09%0.091CC..Hα-helixtrans-61.7-41.5176.800000111.3I801 D802 L803 C808 Q809 R847 L848 N851I801-A805 PolarHBondContact O-N 3.18Å; D802-A805 PolarHBondContact O-N 3.09Å; L803-A805 VanDerWaalsContact C-N 3.32Å; L803-A805 PolarHBondContact O-N 3.29Å; A805-C808 PolarHBondContact O-N 3.04Å; A805-Q809 PolarHBondContact O-N 2.89Å; A805-R847 HydrophobicContact CB-CB 4.24Å; A805-R847 HydrophobicContact CB-CG 4.03Å; A805-L848 HydrophobicContact CB-CB 4.1Å; A805-L848 HydrophobicContact CB-CD1 4.34Å; A805-N851 PolarHBondContact O-ND2 3.4Å
806L87.4Confident86.1Confident27.75 Ų27.7515.7 Ų15.715%0.1458%0.075CC..Hα-helixtrans-73.3-30.7177-70.1168.4000113.1C679 Q690 D802 L803 F804 C808 Q809C679-L806 HydrophobicContact CB-CB 4.16Å; Q690-L806 PolarHBondContact NE2-O 3.09Å; D802-L806 WeakPolarHBondContact O-CG 3.2Å; D802-L806 PolarHBondContact O-N 2.84Å; D802-L806 VanDerWaalsContact O-N 3.08Å; L803-L806 CarbonylContact O-C 3.54Å; L803-L806 PolarHBondContact O-N 3.27Å; F804-L806 VanDerWaalsContact C-N 3.31Å; F804-L806 PolarHBondContact O-N 3.12Å; L806-C808 VanDerWaalsContact C-N 3.33Å; L806-Q809 VanDerWaalsContact CD2-OE1 3.26Å; L806-Q809 WeakPolarHBondContact O-CB 3.4Å; L806-Q809 PolarHBondContact O-N 3.23Å
807L86.8Confident86.3Confident0 Ų018.8 Ų18.80%09%0.092CC..Hα-helixtrans-69.7-31.3174.6-75.5174.2000112.2C679 Q690 I693 L697 L803 F804 Q812 A815C679-L807 VanDerWaalsContact SG-CD2 3.52Å; C679-L807 WeakPolarHBondContact SG-CD2 3.34Å; Q690-L807 HydrophobicContact CB-CD2 4.44Å; I693-L807 HydrophobicContact CB-CD2 3.98Å; I693-L807 HydrophobicContact CG2-CD1 4.31Å; I693-L807 HydrophobicContact CG2-CD2 3.74Å; L697-L807 HydrophobicContact CD2-CD1 4.45Å; L803-L807 HydrophobicContact CD1-CD1 4.22Å; L803-L807 HydrophobicContact CD1-CG 4.08Å; L803-L807 HydrophobicContact CG-CD1 3.96Å; L803-L807 HydrophobicContact CG-CG 4.27Å; L803-L807 WeakPolarHBondContact O-CB 3.35Å; L803-L807 VanDerWaalsContact O-CG 3.31Å; L803-L807 WeakPolarHBondContact O-CG 3.28Å; L803-L807 PolarHBondContact O-N 3.09Å; F804-L807 HydrophobicContact CD1-CD1 4.42Å; F804-L807 PolarHBondContact O-N 3.07Å; L807-Q812 WeakPolarHBondContact O-CB 3.21Å; L807-Q812 VanDerWaalsContact O-CG 3.3Å; L807-Q812 WeakPolarHBondContact O-CG 3.37Å; L807-A815 HydrophobicContact CB-CB 3.99Å
808C87.7Confident86.1Confident0 Ų021.4 Ų21.40%010%0.102CC..SBendtrans-86.9-6.7175.3-59.80000113.3F804 A805 L806 R811 I816 N851F804-C808 PolarHBondContact O-N 3.11Å; F804-C808 PolarHBondContact O-SG 3.17Å; F804-C808 VanDerWaalsContact O-SG 3.39Å; A805-C808 PolarHBondContact O-N 3.04Å; L806-C808 VanDerWaalsContact C-N 3.33Å; C808-R811 PolarHBondContact O-N 3.31Å; C808-I816 HydrophobicContact CB-CD1 4.47Å; C808-I816 HydrophobicContact CB-CG1 3.81Å; C808-N851 HydrophobicContact CB-CB 3.89Å; C808-N851 WeakPolarHBondContact CB-O 3.41Å
809Q87.3Confident86.1Confident36.75 Ų36.7519.8 Ų19.817%0.17210%0.095CC..THydrogen-bonded Turntrans-62.7142.4-177.6-173.5178.3-1.500111.1G683 A685 Q690 A805 L806 R811G683-Q809 PolarHBondContact O-NE2 3.32Å; A685-Q809 HydrophobicContact CB-CB 4.42Å; A685-Q809 HydrophobicContact CB-CG 4.26Å; Q690-Q809 PolarHBondContact NE2-O 3.22Å; Q690-Q809 VanDerWaalsContact NE2-O 3.12Å; A805-Q809 PolarHBondContact O-N 2.89Å; L806-Q809 VanDerWaalsContact CD2-OE1 3.26Å; L806-Q809 WeakPolarHBondContact O-CB 3.4Å; L806-Q809 PolarHBondContact O-N 3.23Å; Q809-R811 VanDerWaalsContact C-N 3.3Å; Q809-R811 PolarHBondContact O-N 3.13Å
810E82.6Confident86.2Confident95.25 Ų95.2520.9 Ų20.945%0.44510%0.102SC..THydrogen-bonded Turntrans58.839.6-177.5-68.3172.5-153.200112.6V684 A685 Q812V684-E810 WeakPolarHBondContact CG1-OE1 3.16Å; A685-E810 HydrophobicContact CB-CB 4.11Å; A685-E810 HydrophobicContact CB-CG 4.08Å; A685-E810 PolarHBondContact N-OE1 3.29Å; E810-Q812 PolarHBondContact O-N 3.25Å
811R83.9Confident85.8Confident27.5 Ų27.528.2 Ų28.210%0.10414%0.14CC..  trans59.937.8171.5-57.2-177-179.3-168.3-2.3115.5C808 Q809 Y813 D855 D857 Q859 E860 E1168C808-R811 PolarHBondContact O-N 3.31Å; Q809-R811 VanDerWaalsContact C-N 3.3Å; Q809-R811 PolarHBondContact O-N 3.13Å; R811-Y813 HydrophobicContact CB-CE2 4.03Å; R811-Y813 WeakPolarHBondContact O-CD2 3.36Å; R811-Y813 WeakPolarHBondContact O-CE2 3.4Å; R811-Y813 PolarHBondContact O-N 3.27Å; R811-D855 IonicContact CZ-OD1 3.31Å; R811-D855 VanDerWaalsContact CZ-OD1 3.3Å; R811-D855 IonicContact NE-OD1 3.28Å; R811-D855 PolarHBondContact NE-OD1 3.3Å; R811-D855 IonicContact NH2-OD1 2.95Å; R811-D855 PolarHBondContact NH2-OD1 3.25Å; R811-D855 VanDerWaalsContact NH2-OD1 3.09Å; R811-D857 IonicContact NH1-OD1 3.66Å; R811-Q859 VanDerWaalsContact CZ-O 3.27Å; R811-Q859 PolarHBondContact NH1-O 3.32Å; R811-Q859 PolarHBondContact NH2-O 3.07Å; R811-E860 IonicContact CZ-OE1 3.35Å; R811-E860 IonicContact NH1-OE1 2.88Å; R811-E860 PolarHBondContact NH1-OE1 3.21Å; R811-E1168 WeakPolarHBondContact CD-OE2 3.31Å; R811-E1168 IonicContact CZ-OE1 3.06Å; R811-E1168 IonicContact CZ-OE2 3.31Å; R811-E1168 IonicContact NE-OE2 3.53Å; R811-E1168 VanDerWaalsContact NH1-CD 3.29Å; R811-E1168 IonicContact NH1-OE1 3.41Å; R811-E1168 PolarHBondContact NH1-OE1 3.28Å; R811-E1168 IonicContact NH1-OE2 3.08Å; R811-E1168 PolarHBondContact NH1-OE2 3.14Å
812Q81.9Confident85.5Confident7.25 Ų7.2532 Ų323%0.03416%0.157CC..  trans-67.996.9174.1175.852.7-91.100111.6Q690 E691 L807 E810 I814 A815 I816Q690-Q812 HydrophobicContact CB-CG 4.29Å; E691-Q812 VanDerWaalsContact CG-NE2 3.28Å; L807-Q812 WeakPolarHBondContact O-CB 3.21Å; L807-Q812 VanDerWaalsContact O-CG 3.3Å; L807-Q812 WeakPolarHBondContact O-CG 3.37Å; E810-Q812 PolarHBondContact O-N 3.25Å; Q812-I814 VanDerWaalsContact C-N 3.29Å; Q812-I814 PolarHBondContact O-N 3.09Å; Q812-A815 HydrophobicContact CG-CB 4.42Å; Q812-A815 PolarHBondContact O-N 3.18Å; Q812-I816 VanDerWaalsContact O-CG1 3.32Å; Q812-I816 WeakPolarHBondContact O-CG1 3.4Å; Q812-I816 PolarHBondContact O-N 3.24Å; Q812-I816 VanDerWaalsContact O-N 3.17Å
813Y80.8Confident85.4Confident6.25 Ų6.2531.1 Ų31.13%0.02515%0.152CC..Hα-helixtrans-68.3-22.5-169.7-75.5-76000114.5R811 I816 N817 R856 D857 E1168 K1169 E1171R811-Y813 HydrophobicContact CB-CE2 4.03Å; R811-Y813 WeakPolarHBondContact O-CD2 3.36Å; R811-Y813 WeakPolarHBondContact O-CE2 3.4Å; R811-Y813 PolarHBondContact O-N 3.27Å; Y813-I816 PolarHBondContact O-N 3.41Å; Y813-N817 VanDerWaalsContact O-CB 3.22Å; Y813-N817 WeakPolarHBondContact O-CB 3.37Å; Y813-N817 PolarHBondContact O-N 3.3Å; Y813-N817 PolarHBondContact O-ND2 3.21Å; Y813-N817 VanDerWaalsContact O-ND2 3.16Å; Y813-R856 HydrophobicContact CD1-CG 4.44Å; Y813-R856 HydrophobicContact CE1-CG 3.76Å; Y813-D857 HydrophobicContact CE1-CB 4.36Å; Y813-D857 VanDerWaalsContact OH-CB 3.25Å; Y813-D857 WeakPolarHBondContact OH-CB 3.35Å; Y813-D857 PolarHBondContact OH-N 3.24Å; Y813-D857 VanDerWaalsContact OH-N 3.11Å; Y813-D857 PolarHBondContact OH-OD1 2.87Å; Y813-E1168 HydrophobicContact CE2-CB 4.5Å; Y813-K1169 HydrophobicContact CD2-CG 4.08Å; Y813-K1169 HydrophobicContact CE2-CG 3.89Å; Y813-E1171 WeakPolarHBondContact CD2-OE1 3.4Å
814I78.6Confident85.4Confident45.25 Ų45.2533.9 Ų33.923%0.23217%0.171CC..Hα-helixtrans-62.4-48.4176.6-57.7171000110E691 C694 Q812 Y818 L1172E691-I814 HydrophobicContact CG-CD1 4.19Å; C694-I814 HydrophobicContact CB-CB 4.26Å; C694-I814 HydrophobicContact CB-CG2 3.71Å; Q812-I814 VanDerWaalsContact C-N 3.29Å; Q812-I814 PolarHBondContact O-N 3.09Å; I814-Y818 PolarHBondContact O-N 3.22Å; I814-L1172 HydrophobicContact CG1-CD2 4.47Å
815A83.4Confident85.1Confident0 Ų034.4 Ų34.40%017%0.174CC..Hα-helixtrans-68.1-45.5176.700000111.4L698 L807 Q812 N817 Y818 L819L698-A815 HydrophobicContact CD1-CB 4.43Å; L807-A815 HydrophobicContact CB-CB 3.99Å; Q812-A815 HydrophobicContact CG-CB 4.42Å; Q812-A815 PolarHBondContact O-N 3.18Å; A815-N817 PolarHBondContact O-N 2.86Å; A815-Y818 PolarHBondContact O-N 3.33Å; A815-L819 WeakPolarHBondContact O-CB 3.35Å; A815-L819 WeakPolarHBondContact O-CG 3.46Å; A815-L819 PolarHBondContact O-N 3.05Å
816I84.7Confident85Confident0 Ų039.8 Ų39.80%020%0.196CC..Hα-helixtrans-61.2-46.6-176.6-66.8167.4000110.9C808 Q812 Y813 Y818 L819 S820 L852 R856C808-I816 HydrophobicContact CB-CD1 4.47Å; C808-I816 HydrophobicContact CB-CG1 3.81Å; Q812-I816 VanDerWaalsContact O-CG1 3.32Å; Q812-I816 WeakPolarHBondContact O-CG1 3.4Å; Q812-I816 PolarHBondContact O-N 3.24Å; Q812-I816 VanDerWaalsContact O-N 3.17Å; Y813-I816 PolarHBondContact O-N 3.41Å; I816-Y818 VanDerWaalsContact C-N 3.33Å; I816-Y818 PolarHBondContact O-N 3.28Å; I816-L819 PolarHBondContact O-N 3.12Å; I816-S820 WeakPolarHBondContact O-CB 3.38Å; I816-S820 PolarHBondContact O-N 3.2Å; I816-S820 PolarHBondContact O-OG 3.25Å; I816-L852 HydrophobicContact CB-CD1 4.35Å; I816-L852 HydrophobicContact CG1-CD1 4.41Å; I816-L852 HydrophobicContact CG2-CD1 4.27Å; I816-R856 HydrophobicContact CG2-CG 4.26Å
817N85.2Confident85Confident71.25 Ų71.2538.9 Ų38.938%0.38119%0.191SC..Hα-helixtrans-65.2-36.5-179.3-71.4-25.2000112.2Y813 A815 R856Y813-N817 VanDerWaalsContact O-CB 3.22Å; Y813-N817 WeakPolarHBondContact O-CB 3.37Å; Y813-N817 PolarHBondContact O-N 3.3Å; Y813-N817 PolarHBondContact O-ND2 3.21Å; Y813-N817 VanDerWaalsContact O-ND2 3.16Å; A815-N817 PolarHBondContact O-N 2.86Å; N817-R856 PolarHBondContact OD1-NH2 2.88Å
818Y84Confident85.2Confident55.75 Ų55.7538.9 Ų38.922%0.21919%0.191CC..Hα-helixtrans-71.5-47.8176.6-177.3-91.6000112.3L698 E703 I814 A815 I816 K822L698-Y818 HydrophobicContact CB-CD1 4.2Å; L698-Y818 HydrophobicContact CB-CD2 4.48Å; L698-Y818 HydrophobicContact CB-CE1 4.27Å; L698-Y818 HydrophobicContact CB-CE2 4.49Å; L698-Y818 HydrophobicContact CB-CG 4.33Å; L698-Y818 HydrophobicContact CD1-CD1 4.08Å; L698-Y818 HydrophobicContact CD1-CG 4.25Å; L698-Y818 HydrophobicContact CD2-CD1 3.92Å; L698-Y818 HydrophobicContact CD2-CE1 3.94Å; L698-Y818 HydrophobicContact CG-CD1 4.29Å; E703-Y818 PolarHBondContact OE1-OH 3.17Å; I814-Y818 PolarHBondContact O-N 3.22Å; A815-Y818 PolarHBondContact O-N 3.33Å; I816-Y818 VanDerWaalsContact C-N 3.33Å; I816-Y818 PolarHBondContact O-N 3.28Å; Y818-K822 HydrophobicContact CE1-CD 4.27Å; Y818-K822 PolarHBondContact OH-NZ 3.17Å
819L87.1Confident85.2Confident3.75 Ų3.7539 Ų392%0.0219%0.191CC..Hα-helixtrans-79.8-31.9-172.6-68.7174.7000113.4F804 A815 I816 L821 K822 L823 L852F804-L819 HydrophobicContact CB-CD1 3.78Å; F804-L819 HydrophobicContact CD1-CD1 4.02Å; F804-L819 HydrophobicContact CD1-CD2 4.37Å; F804-L819 HydrophobicContact CD2-CD1 4.09Å; F804-L819 HydrophobicContact CD2-CD2 3.88Å; F804-L819 HydrophobicContact CE1-CD2 4.23Å; F804-L819 HydrophobicContact CE2-CD2 3.72Å; F804-L819 HydrophobicContact CG-CD1 3.72Å; F804-L819 HydrophobicContact CG-CD2 4.2Å; F804-L819 HydrophobicContact CZ-CD2 3.9Å; A815-L819 WeakPolarHBondContact O-CB 3.35Å; A815-L819 WeakPolarHBondContact O-CG 3.46Å; A815-L819 PolarHBondContact O-N 3.05Å; I816-L819 PolarHBondContact O-N 3.12Å; L819-L821 PolarHBondContact O-N 3.21Å; L819-K822 PolarHBondContact O-N 3.15Å; L819-L823 PolarHBondContact O-N 3.19Å; L819-L852 HydrophobicContact CB-CD1 3.74Å; L819-L852 HydrophobicContact CB-CD2 4.22Å
820S85.8Confident85.2Confident24.75 Ų24.7539.4 Ų39.417%0.17319%0.192CC..Hα-helixtrans-63.4-27.8-178.858.10000112.9I816 R856I816-S820 WeakPolarHBondContact O-CB 3.38Å; I816-S820 PolarHBondContact O-N 3.2Å; I816-S820 PolarHBondContact O-OG 3.25Å; S820-R856 PolarHBondContact OG-NH1 3.35Å
821L84.2Confident85.4Confident156 Ų15634.9 Ų34.982%0.81717%0.171SC*.Hα-helixtrans-71.7-31.3174.1-64.7175000112.9L819L819-L821 PolarHBondContact O-N 3.21Å
822K84.3Confident85.7Confident80.5 Ų80.533.6 Ų33.635%0.3517%0.166SC..Hα-helixtrans-90.8-35.5-178.1-64.9-170.3176.5-168.90112.4E703 E708 Y818 L819E703-K822 IonicContact OE1-NZ 3.27Å; E703-K822 PolarHBondContact OE1-NZ 3.07Å; E708-K822 IonicContact OE1-NZ 3.79Å; E708-K822 PolarHBondContact OE1-NZ 2.83Å; E708-K822 VanDerWaalsContact OE1-NZ 3.12Å; Y818-K822 HydrophobicContact CE1-CD 4.27Å; Y818-K822 PolarHBondContact OH-NZ 3.17Å; L819-K822 PolarHBondContact O-N 3.15Å
823L87.9Confident85.9Confident6.75 Ų6.7538.4 Ų38.44%0.03518%0.184CC..SBendtrans-117.695.1-173.8-63.4174.3000110.5F804 L819 L827 L848 L852 H853F804-L823 HydrophobicContact CD2-CD1 4.37Å; L819-L823 PolarHBondContact O-N 3.19Å; L823-L827 HydrophobicContact CD2-CD2 3.95Å; L823-L848 HydrophobicContact CD1-CD2 3.8Å; L823-L852 HydrophobicContact CB-CD2 4.08Å; L823-H853 PolarHBondContact O-CE1 3.1Å; L823-H853 VanDerWaalsContact O-CE1 3.26Å; L823-H853 PolarHBondContact O-NE2 3.2Å
824S88.3Confident86.1Confident58.5 Ų58.539.3 Ų39.341%0.40919%0.19SC..  trans-75.6158.2177.165.40000113Y826 L827 L828S824-Y826 VanDerWaalsContact C-N 3.27Å; S824-Y826 PolarHBondContact O-N 3.08Å; S824-L827 PolarHBondContact O-N 2.96Å; S824-L827 VanDerWaalsContact O-N 3.12Å; S824-L827 PolarHBondContact OG-N 3.19Å; S824-L828 PolarHBondContact O-N 3.41Å; S824-L828 VanDerWaalsContact O-N 3.11Å
825I86.5Confident86.3Confident20 Ų2043.1 Ų43.110%0.10321%0.206CC..Hα-helixtrans-53.9-46.1175.3-65.7172.2000110.8L827 L828 L829 L849 H853 D899 I903I825-L827 VanDerWaalsContact C-N 3.32Å; I825-L827 PolarHBondContact O-N 3.06Å; I825-L828 PolarHBondContact O-N 3.13Å; I825-L829 HydrophobicContact CG2-CD1 3.81Å; I825-L829 HydrophobicContact CG2-CG 4.2Å; I825-L829 WeakPolarHBondContact O-CB 3.32Å; I825-L829 WeakPolarHBondContact O-CG 3.28Å; I825-L829 PolarHBondContact O-N 3.1Å; I825-L849 HydrophobicContact CB-CD1 4.45Å; I825-L849 HydrophobicContact CG1-CD1 4.32Å; I825-L849 HydrophobicContact CG2-CD1 4.19Å; I825-H853 HydrophobicContact CD1-CB 3.98Å; I825-H853 HydrophobicContact CG1-CB 3.73Å; I825-H853 VanDerWaalsContact CG1-CG 3.48Å; I825-D899 HydrophobicContact CD1-CB 3.73Å; I825-D899 HydrophobicContact CG2-CB 4.44Å; I825-I903 HydrophobicContact CG2-CD1 4.02Å; I825-I903 HydrophobicContact CG2-CG1 4.09Å
826Y87.2Confident86.2Confident113 Ų11350.1 Ų50.144%0.44323%0.233SC..Hα-helixtrans-56.5-43.3177.8178.3-104.4000113S824 K830S824-Y826 VanDerWaalsContact C-N 3.27Å; S824-Y826 PolarHBondContact O-N 3.08Å; Y826-K830 HydrophobicContact CD1-CD 4.3Å; Y826-K830 HydrophobicContact CE1-CD 3.77Å; Y826-K830 VanDerWaalsContact CE1-CE 3.44Å; Y826-K830 VanDerWaalsContact CE1-NZ 3.27Å; Y826-K830 HydrophobicContact CE2-CD 4.48Å; Y826-K830 VanDerWaalsContact CZ-NZ 3.3Å; Y826-K830 WeakPolarHBondContact O-CG 3.3Å; Y826-K830 PolarHBondContact O-N 3.39Å; Y826-K830 VanDerWaalsContact O-N 3.08Å; Y826-K830 WeakPolarHBondContact OH-CE 3.35Å; Y826-K830 PolarHBondContact OH-NZ 3.14Å
827L87.7Confident86.2Confident8 Ų850.3 Ų50.34%0.04223%0.234CC..Hα-helixtrans-66.2-44.6178.9-179.765.2000111.5T709 N711 L823 S824 I825 K830 C831T709-L827 HydrophobicContact CG2-CD1 4.47Å; T709-L827 HydrophobicContact CG2-CD2 4.24Å; T709-L827 HydrophobicContact CG2-CG 4.45Å; T709-L827 VanDerWaalsContact O-CD2 3.31Å; T709-L827 WeakPolarHBondContact O-CD2 3.44Å; N711-L827 HydrophobicContact CB-CD1 3.96Å; L823-L827 HydrophobicContact CD2-CD2 3.95Å; S824-L827 PolarHBondContact O-N 2.96Å; S824-L827 VanDerWaalsContact O-N 3.12Å; S824-L827 PolarHBondContact OG-N 3.19Å; I825-L827 VanDerWaalsContact C-N 3.32Å; I825-L827 PolarHBondContact O-N 3.06Å; L827-K830 WeakPolarHBondContact O-CB 3.3Å; L827-K830 PolarHBondContact O-N 3.25Å; L827-C831 PolarHBondContact O-N 3.3Å; L827-C831 VanDerWaalsContact O-N 3.12Å; L827-C831 PolarHBondContact O-SG 3.31Å; L827-C831 VanDerWaalsContact O-SG 3.37Å
828L89.8Confident86.2Confident0.75 Ų0.7549.5 Ų49.50%0.00423%0.225CC..Hα-helixtrans-65.8-42.9179-67.3174.5000111.9S824 I825 K830 C831 M832 F845 L848 L849 L852S824-L828 PolarHBondContact O-N 3.41Å; S824-L828 VanDerWaalsContact O-N 3.11Å; I825-L828 PolarHBondContact O-N 3.13Å; L828-K830 VanDerWaalsContact C-N 3.31Å; L828-K830 PolarHBondContact O-N 3.06Å; L828-C831 WeakPolarHBondContact O-CB 3.37Å; L828-C831 PolarHBondContact O-N 3.13Å; L828-C831 VanDerWaalsContact O-N 3.12Å; L828-M832 VanDerWaalsContact O-CG 3.3Å; L828-M832 WeakPolarHBondContact O-CG 3.36Å; L828-M832 PolarHBondContact O-N 3.16Å; L828-F845 HydrophobicContact CD2-CD1 3.72Å; L828-F845 HydrophobicContact CD2-CE1 4.28Å; L828-L848 HydrophobicContact CD2-CD2 4.05Å; L828-L849 HydrophobicContact CB-CB 4.47Å; L828-L849 HydrophobicContact CB-CD1 4.02Å; L828-L849 HydrophobicContact CD1-CB 4.14Å; L828-L849 HydrophobicContact CD1-CD1 3.86Å; L828-L852 HydrophobicContact CD1-CD2 4.35Å
829L88.6Confident86.2Confident1.25 Ų1.2548 Ų481%0.00722%0.222CC..Hα-helixtrans-61.6-38.3175.6-76.5178000112.2I825 C831 M832 R833 L849 E902 I903 F906I825-L829 HydrophobicContact CG2-CD1 3.81Å; I825-L829 HydrophobicContact CG2-CG 4.2Å; I825-L829 WeakPolarHBondContact O-CB 3.32Å; I825-L829 WeakPolarHBondContact O-CG 3.28Å; I825-L829 PolarHBondContact O-N 3.1Å; L829-C831 VanDerWaalsContact C-N 3.34Å; L829-C831 PolarHBondContact O-N 3.46Å; L829-M832 HydrophobicContact CD2-CE 4.39Å; L829-M832 HydrophobicContact CD2-SD 4.41Å; L829-M832 PolarHBondContact O-N 3.08Å; L829-R833 WeakPolarHBondContact O-CB 3.38Å; L829-R833 WeakPolarHBondContact O-CG 3.41Å; L829-R833 PolarHBondContact O-N 3.24Å; L829-L849 HydrophobicContact CD2-CD2 4.02Å; L829-E902 HydrophobicContact CD1-CB 3.7Å; L829-I903 HydrophobicContact CD1-CG1 4.01Å; L829-I903 HydrophobicContact CD2-CG1 4.17Å; L829-I903 HydrophobicContact CG-CG1 4.42Å; L829-F906 HydrophobicContact CD2-CB 4.05Å; L829-F906 HydrophobicContact CD2-CD1 4.48Å; L829-F906 HydrophobicContact CD2-CG 4.18Å
830K86.3Confident86.2Confident45.75 Ų45.7549.5 Ų49.520%0.19923%0.233CC..Hα-helixtrans-60.9-43.9172-84.6-176.2163.8178.50112.2N711 D724 I726 Y826 L827 L828 M832 R833 N834N711-K830 PolarHBondContact ND2-NZ 3.07Å; D724-K830 IonicContact OD2-NZ 2.91Å; D724-K830 PolarHBondContact OD2-NZ 3.09Å; I726-K830 HydrophobicContact CD1-CB 4.29Å; Y826-K830 HydrophobicContact CD1-CD 4.3Å; Y826-K830 HydrophobicContact CE1-CD 3.77Å; Y826-K830 VanDerWaalsContact CE1-CE 3.44Å; Y826-K830 VanDerWaalsContact CE1-NZ 3.27Å; Y826-K830 HydrophobicContact CE2-CD 4.48Å; Y826-K830 VanDerWaalsContact CZ-NZ 3.3Å; Y826-K830 WeakPolarHBondContact O-CG 3.3Å; Y826-K830 PolarHBondContact O-N 3.39Å; Y826-K830 VanDerWaalsContact O-N 3.08Å; Y826-K830 WeakPolarHBondContact OH-CE 3.35Å; Y826-K830 PolarHBondContact OH-NZ 3.14Å; L827-K830 WeakPolarHBondContact O-CB 3.3Å; L827-K830 PolarHBondContact O-N 3.25Å; L828-K830 VanDerWaalsContact C-N 3.31Å; L828-K830 PolarHBondContact O-N 3.06Å; K830-M832 VanDerWaalsContact C-N 3.32Å; K830-M832 PolarHBondContact O-N 3.13Å; K830-R833 PolarHBondContact O-N 3.28Å; K830-N834 WeakPolarHBondContact O-CB 3.4Å; K830-N834 PolarHBondContact O-N 2.95Å
831C87.5Confident86.3Confident0.25 Ų0.2548.4 Ų48.40%0.00223%0.225CC..Hα-helixtrans-62.2-41.3174.9-64.40000111.6L827 L828 L829 N834 L837 F845L827-C831 PolarHBondContact O-N 3.3Å; L827-C831 VanDerWaalsContact O-N 3.12Å; L827-C831 PolarHBondContact O-SG 3.31Å; L827-C831 VanDerWaalsContact O-SG 3.37Å; L828-C831 WeakPolarHBondContact O-CB 3.37Å; L828-C831 PolarHBondContact O-N 3.13Å; L828-C831 VanDerWaalsContact O-N 3.12Å; L829-C831 VanDerWaalsContact C-N 3.34Å; L829-C831 PolarHBondContact O-N 3.46Å; C831-N834 PolarHBondContact O-N 3.05Å; C831-L837 WeakPolarHBondContact O-CD1 3.4Å; C831-F845 HydrophobicContact CB-CB 4.49Å; C831-F845 HydrophobicContact CB-CD1 4.14Å; C831-F845 HydrophobicContact CB-CD2 3.55Å; C831-F845 HydrophobicContact CB-CE1 4.17Å; C831-F845 HydrophobicContact CB-CE2 3.57Å; C831-F845 HydrophobicContact CB-CG 3.83Å; C831-F845 HydrophobicContact CB-CZ 3.87Å
832M89.3Confident86.7Confident0 Ų041.5 Ų41.50%019%0.189CC..Hα-helixtrans-69.4-36.5-179.8-69.9166.456.700113.5L828 L829 K830 N834 R842 F845 T846 L849 F906 L936L828-M832 VanDerWaalsContact O-CG 3.3Å; L828-M832 WeakPolarHBondContact O-CG 3.36Å; L828-M832 PolarHBondContact O-N 3.16Å; L829-M832 HydrophobicContact CD2-CE 4.39Å; L829-M832 HydrophobicContact CD2-SD 4.41Å; L829-M832 PolarHBondContact O-N 3.08Å; K830-M832 VanDerWaalsContact C-N 3.32Å; K830-M832 PolarHBondContact O-N 3.13Å; M832-N834 VanDerWaalsContact C-N 3.29Å; M832-N834 PolarHBondContact O-N 3.32Å; M832-R842 VanDerWaalsContact O-CZ 3.27Å; M832-R842 PolarHBondContact O-NE 3.21Å; M832-R842 PolarHBondContact O-NH2 3.05Å; M832-F845 HydrophobicContact CG-CB 3.83Å; M832-T846 HydrophobicContact CE-CG2 3.91Å; M832-T846 WeakPolarHBondContact CE-OG1 3.41Å; M832-L849 HydrophobicContact CE-CD2 3.9Å; M832-L849 HydrophobicContact SD-CB 4.07Å; M832-L849 HydrophobicContact SD-CD2 3.62Å; M832-L849 VanDerWaalsContact SD-CD2 3.59Å; M832-L849 HydrophobicContact SD-CG 4.44Å; M832-F906 HydrophobicContact CB-CE1 4.4Å; M832-F906 HydrophobicContact CB-CE2 3.96Å; M832-F906 HydrophobicContact CB-CZ 3.81Å; M832-F906 HydrophobicContact CE-CD1 3.66Å; M832-F906 HydrophobicContact CE-CE1 3.22Å; M832-F906 HydrophobicContact CE-CG 4.48Å; M832-F906 HydrophobicContact CE-CZ 3.76Å; M832-L936 HydrophobicContact CE-CD2 4.17Å
833R87.1Confident87Confident109.25 Ų109.2537.8 Ų37.841%0.41217%0.173SC..Hα-helixtrans-73.7-18.1176.8-76.6179.7176.3153.64.5113.7L829 K830 E835 E902 F906L829-R833 WeakPolarHBondContact O-CB 3.38Å; L829-R833 WeakPolarHBondContact O-CG 3.41Å; L829-R833 PolarHBondContact O-N 3.24Å; K830-R833 PolarHBondContact O-N 3.28Å; R833-E835 PolarHBondContact O-N 3.22Å; R833-E902 PolarHBondContact NH2-O 3.13Å; R833-F906 HydrophobicContact CG-CD2 3.51Å; R833-F906 VanDerWaalsContact CG-CD2 3.47Å; R833-F906 HydrophobicContact CG-CE2 3.87Å
834N84.2Confident87.1Confident25 Ų2537.7 Ų37.713%0.13417%0.173CC..  trans-75.799-174-171.8-8.7000112.1N767 K830 C831 M832 R836 L837N767-N834 PolarHBondContact OD1-ND2 3.25Å; K830-N834 WeakPolarHBondContact O-CB 3.4Å; K830-N834 PolarHBondContact O-N 2.95Å; C831-N834 PolarHBondContact O-N 3.05Å; M832-N834 VanDerWaalsContact C-N 3.29Å; M832-N834 PolarHBondContact O-N 3.32Å; N834-R836 PolarHBondContact O-N 3.31Å; N834-R836 WeakPolarHBondContact OD1-CB 3.37Å; N834-R836 PolarHBondContact OD1-N 2.85Å; N834-R836 VanDerWaalsContact OD1-N 3.1Å; N834-L837 HydrophobicContact CB-CD1 4Å; N834-L837 HydrophobicContact CB-CG 3.97Å; N834-L837 WeakPolarHBondContact O-CB 3.29Å; N834-L837 PolarHBondContact O-N 3.22Å; N834-L837 VanDerWaalsContact O-N 3.09Å
835E82.6Confident87.3Confident125.25 Ų125.2534.9 Ų34.959%0.58515%0.153SC*.THydrogen-bonded Turntrans-65.9-16.8179.5-61.9-172160.400114R833 L837R833-E835 PolarHBondContact O-N 3.22Å; E835-L837 PolarHBondContact O-N 3.07Å
836R81.6Confident87.7Confident145.75 Ų145.7534 Ų3455%0.5515%0.148SC*.THydrogen-bonded Turntrans-70.4-23.4173.5-59.7-168.6-174.3176.95.8112N770 D771 N834N770-R836 PolarHBondContact ND2-O 3Å; D771-R836 IonicContact OD2-NH1 3.37Å; D771-R836 PolarHBondContact OD2-NH1 3.21Å; N834-R836 PolarHBondContact O-N 3.31Å; N834-R836 WeakPolarHBondContact OD1-CB 3.37Å; N834-R836 PolarHBondContact OD1-N 2.85Å; N834-R836 VanDerWaalsContact OD1-N 3.1Å
837L84.8Confident87.9Confident4.25 Ų4.2531.8 Ų31.82%0.02214%0.14CC..SBendtrans-76.6148.9179-59.5-176.8000111.6L766 N770 C831 N834 E835 L841 R842 F845L766-L837 HydrophobicContact CD1-CD2 4.49Å; L766-L837 HydrophobicContact CD2-CD1 3.87Å; L766-L837 HydrophobicContact CD2-CD2 3.79Å; L766-L837 HydrophobicContact CD2-CG 4.48Å; L766-L837 HydrophobicContact CG-CD2 3.73Å; N770-L837 HydrophobicContact CB-CD2 4.39Å; N770-L837 WeakPolarHBondContact ND2-CA 3.43Å; C831-L837 WeakPolarHBondContact O-CD1 3.4Å; N834-L837 HydrophobicContact CB-CD1 4Å; N834-L837 HydrophobicContact CB-CG 3.97Å; N834-L837 WeakPolarHBondContact O-CB 3.29Å; N834-L837 PolarHBondContact O-N 3.22Å; N834-L837 VanDerWaalsContact O-N 3.09Å; E835-L837 PolarHBondContact O-N 3.07Å; L837-L841 HydrophobicContact CD1-CD2 4.4Å; L837-L841 HydrophobicContact CD2-CD2 4.44Å; L837-R842 HydrophobicContact CB-CG 3.97Å; L837-F845 HydrophobicContact CD1-CE2 4.39Å
838R85.9Confident88.2Confident54.25 Ų54.2531.5 Ų31.521%0.20514%0.138CC..  trans-59.7141.6175.7-59.2-177.8-166166.11.7110.4N770 D795 S840 L841 R842N770-R838 PolarHBondContact ND2-N 3.06Å; N770-R838 PolarHBondContact OD1-NE 3.04Å; D795-R838 IonicContact OD1-NH1 3.71Å; D795-R838 PolarHBondContact OD1-NH1 2.98Å; R838-S840 PolarHBondContact O-N 2.99Å; R838-S840 VanDerWaalsContact O-N 3.16Å; R838-L841 PolarHBondContact O-N 3.21Å; R838-L841 VanDerWaalsContact O-N 3.12Å; R838-R842 PolarHBondContact O-N 3.14Å; R838-R842 VanDerWaalsContact O-N 3.15Å
839P83.7Confident88.4Confident24.5 Ų24.531.4 Ų31.416%0.15914%0.137CC..Hα-helixtrans-56-33.2177.4-2835.6000114R842 A843 G925 Y926 L929P839-R842 PolarHBondContact O-N 3.27Å; P839-A843 WeakPolarHBondContact O-CB 3.32Å; P839-A843 PolarHBondContact O-N 3.09Å; P839-G925 VanDerWaalsContact CB-C 3.47Å; P839-G925 VanDerWaalsContact CB-O 3.3Å; P839-G925 WeakPolarHBondContact CB-O 3.29Å; P839-Y926 HydrophobicContact CB-CD1 4.28Å; P839-Y926 HydrophobicContact CB-CE1 4.43Å; P839-Y926 HydrophobicContact CB-CG 4.34Å; P839-Y926 HydrophobicContact CG-CD1 4.1Å; P839-Y926 HydrophobicContact CG-CD2 3.92Å; P839-Y926 HydrophobicContact CG-CE1 3.88Å; P839-Y926 HydrophobicContact CG-CE2 3.71Å; P839-Y926 HydrophobicContact CG-CG 4.12Å; P839-L929 HydrophobicContact CB-CB 4.43Å; P839-L929 HydrophobicContact CB-CD2 4.44Å
840S86.5Confident88.5Confident35.25 Ų35.2531.6 Ų31.625%0.24714%0.138CC..Hα-helixtrans-61.9-45.9176.657.80000112.7Q798 R838 A843 S844Q798-S840 PolarHBondContact OE1-OG 3.32Å; Q798-S840 VanDerWaalsContact OE1-OG 3.09Å; R838-S840 PolarHBondContact O-N 2.99Å; R838-S840 VanDerWaalsContact O-N 3.16Å; S840-A843 WeakPolarHBondContact O-CB 3.33Å; S840-A843 PolarHBondContact O-N 3.22Å; S840-S844 PolarHBondContact O-N 3.17Å; S840-S844 PolarHBondContact O-OG 3.17Å
841L89Confident88.7Confident1.75 Ų1.7530.1 Ų30.11%0.00913%0.132CC..Hα-helixtrans-68.1-39.6179.4-178.663.2000111.1L794 Y797 Q798 L837 R838 A843 S844 F845L794-L841 HydrophobicContact CD1-CD2 4.03Å; Y797-L841 HydrophobicContact CD1-CD1 4.18Å; Y797-L841 HydrophobicContact CE1-CD1 4.21Å; Q798-L841 HydrophobicContact CB-CD1 3.98Å; Q798-L841 HydrophobicContact CG-CD1 3.9Å; L837-L841 HydrophobicContact CD1-CD2 4.4Å; L837-L841 HydrophobicContact CD2-CD2 4.44Å; R838-L841 PolarHBondContact O-N 3.21Å; R838-L841 VanDerWaalsContact O-N 3.12Å; L841-A843 VanDerWaalsContact C-N 3.27Å; L841-A843 PolarHBondContact O-N 3.19Å; L841-S844 WeakPolarHBondContact O-CB 3.36Å; L841-S844 PolarHBondContact O-N 3.03Å; L841-S844 VanDerWaalsContact O-N 3.17Å; L841-F845 HydrophobicContact CD1-CD2 4.37Å; L841-F845 HydrophobicContact CD1-CE2 3.89Å; L841-F845 HydrophobicContact CD1-CZ 4.4Å; L841-F845 HydrophobicContact CD2-CE2 4.09Å; L841-F845 HydrophobicContact CG-CD2 4.05Å; L841-F845 HydrophobicContact CG-CE2 3.64Å; L841-F845 WeakPolarHBondContact O-CD2 3.41Å; L841-F845 PolarHBondContact O-N 3.25Å
842R91.9Very high88.8Confident11.75 Ų11.7530.1 Ų30.14%0.04413%0.132CC..Hα-helixtrans-60.4-39.3172.9-65.5171.766.6-171.82.1111.3M832 L837 R838 P839 F845 T846 L929M832-R842 VanDerWaalsContact O-CZ 3.27Å; M832-R842 PolarHBondContact O-NE 3.21Å; M832-R842 PolarHBondContact O-NH2 3.05Å; L837-R842 HydrophobicContact CB-CG 3.97Å; R838-R842 PolarHBondContact O-N 3.14Å; R838-R842 VanDerWaalsContact O-N 3.15Å; P839-R842 PolarHBondContact O-N 3.27Å; R842-F845 PolarHBondContact O-N 3.41Å; R842-T846 PolarHBondContact O-N 3.12Å; R842-T846 PolarHBondContact O-OG1 3.09Å; R842-L929 HydrophobicContact CB-CD1 3.66Å; R842-L929 HydrophobicContact CB-CD2 4.19Å
843A90Very high88.7Confident3.5 Ų3.531.1 Ų31.13%0.02914%0.137CC..Hα-helixtrans-64.2-43.4176.400000111.1P839 S840 L841 F845 T846 R847 L929 E932P839-A843 WeakPolarHBondContact O-CB 3.32Å; P839-A843 PolarHBondContact O-N 3.09Å; S840-A843 WeakPolarHBondContact O-CB 3.33Å; S840-A843 PolarHBondContact O-N 3.22Å; L841-A843 VanDerWaalsContact C-N 3.27Å; L841-A843 PolarHBondContact O-N 3.19Å; A843-F845 VanDerWaalsContact C-N 3.34Å; A843-F845 PolarHBondContact O-N 3.18Å; A843-T846 WeakPolarHBondContact O-CB 3.35Å; A843-T846 PolarHBondContact O-N 2.96Å; A843-T846 VanDerWaalsContact O-N 3.13Å; A843-R847 PolarHBondContact O-N 3.35Å; A843-L929 HydrophobicContact CB-CB 4.32Å; A843-L929 HydrophobicContact CB-CD1 4.16Å; A843-E932 HydrophobicContact CB-CB 4.49Å; A843-E932 HydrophobicContact CB-CG 3.94Å
844S90.3Very high88.6Confident3 Ų325.9 Ų25.92%0.02112%0.117CC..Hα-helixtrans-58.9-43.1174.4-54.50000111.9D802 S840 L841 T846 R847 L848D802-S844 VanDerWaalsContact CG-OG 3.26Å; D802-S844 VanDerWaalsContact OD1-CB 3.23Å; D802-S844 WeakPolarHBondContact OD1-CB 3.43Å; D802-S844 PolarHBondContact OD1-OG 3.06Å; D802-S844 PolarHBondContact OD2-OG 2.89Å; S840-S844 PolarHBondContact O-N 3.17Å; S840-S844 PolarHBondContact O-OG 3.17Å; L841-S844 WeakPolarHBondContact O-CB 3.36Å; L841-S844 PolarHBondContact O-N 3.03Å; L841-S844 VanDerWaalsContact O-N 3.17Å; S844-T846 PolarHBondContact O-N 3.43Å; S844-R847 PolarHBondContact O-N 3.16Å; S844-L848 WeakPolarHBondContact O-CB 3.34Å; S844-L848 PolarHBondContact O-N 3.07Å
845F93.7Very high88.7Confident0.25 Ų0.2526 Ų260%0.00112%0.118CC..Hα-helixtrans-65.8-38174.3-74.4-60.1000113.4Y797 I801 L828 C831 M832 L837 L841 R842 A843 R847 L848 L849Y797-F845 HydrophobicContact CE1-CE2 4.48Å; Y797-F845 AromaticContact CE1-CZ 3.77Å; Y797-F845 HydrophobicContact CE1-CZ 3.77Å; Y797-F845 AromaticContact CZ-CZ 3.95Å; Y797-F845 VanDerWaalsContact OH-CZ 3.29Å; Y797-F845 WeakPolarHBondContact OH-CZ 3.2Å; I801-F845 HydrophobicContact CD1-CD1 4.5Å; I801-F845 HydrophobicContact CD1-CE1 3.91Å; I801-F845 HydrophobicContact CG1-CE1 4.02Å; I801-F845 HydrophobicContact CG1-CZ 4.43Å; I801-F845 HydrophobicContact CG2-CD1 4.01Å; I801-F845 HydrophobicContact CG2-CE1 4.3Å; L828-F845 HydrophobicContact CD2-CD1 3.72Å; L828-F845 HydrophobicContact CD2-CE1 4.28Å; C831-F845 HydrophobicContact CB-CB 4.49Å; C831-F845 HydrophobicContact CB-CD1 4.14Å; C831-F845 HydrophobicContact CB-CD2 3.55Å; C831-F845 HydrophobicContact CB-CE1 4.17Å; C831-F845 HydrophobicContact CB-CE2 3.57Å; C831-F845 HydrophobicContact CB-CG 3.83Å; C831-F845 HydrophobicContact CB-CZ 3.87Å; M832-F845 HydrophobicContact CG-CB 3.83Å; L837-F845 HydrophobicContact CD1-CE2 4.39Å; L841-F845 HydrophobicContact CD1-CD2 4.37Å; L841-F845 HydrophobicContact CD1-CE2 3.89Å; L841-F845 HydrophobicContact CD1-CZ 4.4Å; L841-F845 HydrophobicContact CD2-CE2 4.09Å; L841-F845 HydrophobicContact CG-CD2 4.05Å; L841-F845 HydrophobicContact CG-CE2 3.64Å; L841-F845 WeakPolarHBondContact O-CD2 3.41Å; L841-F845 PolarHBondContact O-N 3.25Å; R842-F845 PolarHBondContact O-N 3.41Å; A843-F845 VanDerWaalsContact C-N 3.34Å; A843-F845 PolarHBondContact O-N 3.18Å; F845-R847 VanDerWaalsContact C-N 3.33Å; F845-R847 PolarHBondContact O-N 3.24Å; F845-L848 PolarHBondContact O-N 3.29Å; F845-L849 WeakPolarHBondContact O-CB 3.4Å; F845-L849 PolarHBondContact O-N 3.24Å
846T93.5Very high88.7Confident0.5 Ų0.523 Ų230%0.00310%0.102CC..Hα-helixtrans-62-44.4176-54.20000110.7M832 R842 A843 S844 L849 L850 E932 V933 L936M832-T846 HydrophobicContact CE-CG2 3.91Å; M832-T846 WeakPolarHBondContact CE-OG1 3.41Å; R842-T846 PolarHBondContact O-N 3.12Å; R842-T846 PolarHBondContact O-OG1 3.09Å; A843-T846 WeakPolarHBondContact O-CB 3.35Å; A843-T846 PolarHBondContact O-N 2.96Å; A843-T846 VanDerWaalsContact O-N 3.13Å; S844-T846 PolarHBondContact O-N 3.43Å; T846-L849 PolarHBondContact O-N 3.19Å; T846-L850 PolarHBondContact O-N 3.27Å; T846-L850 VanDerWaalsContact O-N 3.08Å; T846-E932 HydrophobicContact CG2-CB 3.96Å; T846-V933 HydrophobicContact CG2-CG2 4.1Å; T846-L936 HydrophobicContact CG2-CB 4.15Å; T846-L936 HydrophobicContact CG2-CD2 3.93Å
847R92.7Very high88.2Confident68.25 Ų68.2518.3 Ų18.326%0.2589%0.087SC..Hα-helixtrans-64.2-41.3176-164-175.6-59.3134.92.8112.1D802 A805 A843 S844 F845 L850 N851 E932D802-R847 IonicContact OD1-CZ 3.94Å; D802-R847 IonicContact OD1-NH1 3.54Å; D802-R847 PolarHBondContact OD1-NH1 3.32Å; A805-R847 HydrophobicContact CB-CB 4.24Å; A805-R847 HydrophobicContact CB-CG 4.03Å; A843-R847 PolarHBondContact O-N 3.35Å; S844-R847 PolarHBondContact O-N 3.16Å; F845-R847 VanDerWaalsContact C-N 3.33Å; F845-R847 PolarHBondContact O-N 3.24Å; R847-L850 PolarHBondContact O-N 3.18Å; R847-N851 PolarHBondContact O-N 2.95Å; R847-N851 VanDerWaalsContact O-N 3.12Å; R847-E932 WeakPolarHBondContact CB-OE2 3.41Å; R847-E932 IonicContact CZ-OE1 3.38Å; R847-E932 VanDerWaalsContact CZ-OE1 3.29Å; R847-E932 IonicContact CZ-OE2 2.83Å; R847-E932 VanDerWaalsContact NE-CD 3.34Å; R847-E932 IonicContact NE-OE1 3.21Å; R847-E932 PolarHBondContact NE-OE1 3.17Å; R847-E932 VanDerWaalsContact NE-OE1 3.16Å; R847-E932 IonicContact NE-OE2 3.4Å; R847-E932 PolarHBondContact NE-OE2 3.35Å; R847-E932 VanDerWaalsContact NE-OE2 3.16Å; R847-E932 IonicContact NH2-OE1 2.69Å; R847-E932 PolarHBondContact NH2-OE1 3.18Å; R847-E932 IonicContact NH2-OE2 2.99Å
848L93.4Very high87.6Confident0 Ų021.8 Ų21.80%011%0.11CC..Hα-helixtrans-64.5-46.2175.8-18060.8000111.6I801 F804 A805 L823 L828 S844 F845 L850 N851 L852I801-L848 HydrophobicContact CD1-CD2 4.18Å; I801-L848 HydrophobicContact CG2-CB 4.23Å; I801-L848 HydrophobicContact CG2-CD2 4Å; F804-L848 HydrophobicContact CB-CD1 3.77Å; F804-L848 HydrophobicContact CB-CD2 4.42Å; A805-L848 HydrophobicContact CB-CB 4.1Å; A805-L848 HydrophobicContact CB-CD1 4.34Å; L823-L848 HydrophobicContact CD1-CD2 3.8Å; L828-L848 HydrophobicContact CD2-CD2 4.05Å; S844-L848 WeakPolarHBondContact O-CB 3.34Å; S844-L848 PolarHBondContact O-N 3.07Å; F845-L848 PolarHBondContact O-N 3.29Å; L848-L850 VanDerWaalsContact C-N 3.26Å; L848-L850 PolarHBondContact O-N 3.25Å; L848-N851 PolarHBondContact O-N 3.22Å; L848-L852 HydrophobicContact CD1-CB 4.17Å; L848-L852 HydrophobicContact CD1-CD2 4.31Å; L848-L852 HydrophobicContact CG-CD2 4.42Å; L848-L852 WeakPolarHBondContact O-CB 3.38Å; L848-L852 PolarHBondContact O-N 3.1Å
849L93.8Very high87.2Confident0 Ų020 Ų200%010%0.104CC..Hα-helixtrans-55.8-45.1177.117873.5000110.8I825 L828 L829 M832 F845 T846 H853 V854 I903 L936I825-L849 HydrophobicContact CB-CD1 4.45Å; I825-L849 HydrophobicContact CG1-CD1 4.32Å; I825-L849 HydrophobicContact CG2-CD1 4.19Å; L828-L849 HydrophobicContact CB-CB 4.47Å; L828-L849 HydrophobicContact CB-CD1 4.02Å; L828-L849 HydrophobicContact CD1-CB 4.14Å; L828-L849 HydrophobicContact CD1-CD1 3.86Å; L829-L849 HydrophobicContact CD2-CD2 4.02Å; M832-L849 HydrophobicContact CE-CD2 3.9Å; M832-L849 HydrophobicContact SD-CB 4.07Å; M832-L849 HydrophobicContact SD-CD2 3.62Å; M832-L849 VanDerWaalsContact SD-CD2 3.59Å; M832-L849 HydrophobicContact SD-CG 4.44Å; F845-L849 WeakPolarHBondContact O-CB 3.4Å; F845-L849 PolarHBondContact O-N 3.24Å; T846-L849 PolarHBondContact O-N 3.19Å; L849-H853 HydrophobicContact CD1-CB 4.33Å; L849-H853 PolarHBondContact O-N 3.21Å; L849-V854 HydrophobicContact CG-CG2 4.48Å; L849-V854 PolarHBondContact O-N 3.07Å; L849-I903 HydrophobicContact CD1-CD1 4.41Å; L849-I903 HydrophobicContact CD2-CD1 4.23Å; L849-I903 HydrophobicContact CD2-CG1 4.2Å; L849-I903 HydrophobicContact CD2-CG2 4.27Å; L849-I903 HydrophobicContact CG-CD1 4.49Å; L849-L936 HydrophobicContact CD2-CD2 4.24Å
850L91.2Very high86.7Confident5.5 Ų5.521.2 Ų21.23%0.02911%0.107CC..Iπ-helixtrans-57.4-58.5177.8173.467.4000111.3T846 R847 L848 L852 V854 D855 I935 L936 N939T846-L850 PolarHBondContact O-N 3.27Å; T846-L850 VanDerWaalsContact O-N 3.08Å; R847-L850 PolarHBondContact O-N 3.18Å; L848-L850 VanDerWaalsContact C-N 3.26Å; L848-L850 PolarHBondContact O-N 3.25Å; L850-L852 VanDerWaalsContact C-N 3.33Å; L850-L852 PolarHBondContact O-N 3.19Å; L850-V854 HydrophobicContact CD1-CB 4.09Å; L850-V854 HydrophobicContact CD1-CG1 4.11Å; L850-V854 CarbonylContact O-C 3.58Å; L850-V854 WeakPolarHBondContact O-CA 3.29Å; L850-V854 WeakPolarHBondContact O-CB 3.41Å; L850-V854 PolarHBondContact O-N 3.11Å; L850-V854 VanDerWaalsContact O-N 3.09Å; L850-D855 PolarHBondContact O-N 2.87Å; L850-I935 HydrophobicContact CD2-CG2 3.59Å; L850-L936 HydrophobicContact CB-CD1 4.14Å; L850-L936 HydrophobicContact CD1-CD1 3.99Å; L850-N939 HydrophobicContact CD1-CB 3.59Å; L850-N939 WeakPolarHBondContact CD1-ND2 3.41Å; L850-N939 VanDerWaalsContact CD2-ND2 3.31Å; L850-N939 WeakPolarHBondContact CD2-ND2 3.3Å
851N89.6Confident86.3Confident13.5 Ų13.524.9 Ų24.97%0.07212%0.124CC..Iπ-helixtrans-74.7-22.8-173-63.8-9.9000113.2A805 C808 R847 L848A805-N851 PolarHBondContact O-ND2 3.4Å; C808-N851 HydrophobicContact CB-CB 3.89Å; C808-N851 WeakPolarHBondContact CB-O 3.41Å; R847-N851 PolarHBondContact O-N 2.95Å; R847-N851 VanDerWaalsContact O-N 3.12Å; L848-N851 PolarHBondContact O-N 3.22Å
852L89.1Confident85.6Confident0 Ų027.8 Ų27.80%014%0.137CC..Iπ-helixtrans-89.6-39.6-177.1-175.961.7000113.2I816 L819 L823 L828 L848 L850 R856I816-L852 HydrophobicContact CB-CD1 4.35Å; I816-L852 HydrophobicContact CG1-CD1 4.41Å; I816-L852 HydrophobicContact CG2-CD1 4.27Å; L819-L852 HydrophobicContact CB-CD1 3.74Å; L819-L852 HydrophobicContact CB-CD2 4.22Å; L823-L852 HydrophobicContact CB-CD2 4.08Å; L828-L852 HydrophobicContact CD1-CD2 4.35Å; L848-L852 HydrophobicContact CD1-CB 4.17Å; L848-L852 HydrophobicContact CD1-CD2 4.31Å; L848-L852 HydrophobicContact CG-CD2 4.42Å; L848-L852 WeakPolarHBondContact O-CB 3.38Å; L848-L852 PolarHBondContact O-N 3.1Å; L850-L852 VanDerWaalsContact C-N 3.33Å; L850-L852 PolarHBondContact O-N 3.19Å; L852-R856 WeakPolarHBondContact O-CD 3.39Å
853H88.4Confident84.8Confident21.5 Ų21.531.7 Ų31.710%0.116%0.156CC..Iπ-helixtrans-123.8-21.6-169.2-68.1-69000114.9L823 I825 L849L823-H853 PolarHBondContact O-CE1 3.1Å; L823-H853 VanDerWaalsContact O-CE1 3.26Å; L823-H853 PolarHBondContact O-NE2 3.2Å; I825-H853 HydrophobicContact CD1-CB 3.98Å; I825-H853 HydrophobicContact CG1-CB 3.73Å; I825-H853 VanDerWaalsContact CG1-CG 3.48Å; L849-H853 HydrophobicContact CD1-CB 4.33Å; L849-H853 PolarHBondContact O-N 3.21Å
854V85.5Confident84.2Confident0 Ų032.7 Ų32.70%016%0.162CC..Iπ-helixtrans-100.2-47.9-176-176.90000111.4L849 L850 R856 Q859 F900 I903 L936 L940 F943L849-V854 HydrophobicContact CG-CG2 4.48Å; L849-V854 PolarHBondContact O-N 3.07Å; L850-V854 HydrophobicContact CD1-CB 4.09Å; L850-V854 HydrophobicContact CD1-CG1 4.11Å; L850-V854 CarbonylContact O-C 3.58Å; L850-V854 WeakPolarHBondContact O-CA 3.29Å; L850-V854 WeakPolarHBondContact O-CB 3.41Å; L850-V854 PolarHBondContact O-N 3.11Å; L850-V854 VanDerWaalsContact O-N 3.09Å; V854-R856 PolarHBondContact O-N 3.01Å; V854-Q859 WeakPolarHBondContact O-CB 3.4Å; V854-Q859 WeakPolarHBondContact O-CG 3.39Å; V854-F900 HydrophobicContact CB-CE1 4.49Å; V854-F900 HydrophobicContact CG1-CE1 4.4Å; V854-F900 HydrophobicContact CG2-CE1 4.31Å; V854-I903 HydrophobicContact CG2-CD1 4.07Å; V854-L936 HydrophobicContact CB-CD1 4.49Å; V854-L936 HydrophobicContact CG1-CD1 4.47Å; V854-L936 HydrophobicContact CG2-CD1 3.93Å; V854-L940 HydrophobicContact CG1-CD2 3.55Å; V854-L940 HydrophobicContact CG1-CG 4.21Å; V854-L940 HydrophobicContact CG2-CD2 4.45Å; V854-F943 HydrophobicContact CG1-CD2 4.01Å; V854-F943 HydrophobicContact CG1-CE2 3.99Å; V854-F943 WeakPolarHBondContact O-CE2 3.33Å
855D86.2Confident83.6Confident28.25 Ų28.2532.8 Ų32.815%0.15116%0.162CC..SBendtrans-89.874.6175.8-173.122.4000110.7R811 L850 F943R811-D855 IonicContact CZ-OD1 3.31Å; R811-D855 VanDerWaalsContact CZ-OD1 3.3Å; R811-D855 IonicContact NE-OD1 3.28Å; R811-D855 PolarHBondContact NE-OD1 3.3Å; R811-D855 IonicContact NH2-OD1 2.95Å; R811-D855 PolarHBondContact NH2-OD1 3.25Å; R811-D855 VanDerWaalsContact NH2-OD1 3.09Å; L850-D855 PolarHBondContact O-N 2.87Å; D855-F943 HydrophobicContact CB-CE2 4.21Å; D855-F943 HydrophobicContact CB-CZ 4.07Å; D855-F943 WeakPolarHBondContact OD1-CZ 3.35Å
856R81.3Confident82.8Confident62.25 Ų62.2534.4 Ų34.424%0.23517%0.17CC..SBendtrans-148.7157.7178.9172.8-176.5169.1164.71.8109.4Y813 I816 N817 S820 L852 V854 Q859Y813-R856 HydrophobicContact CD1-CG 4.44Å; Y813-R856 HydrophobicContact CE1-CG 3.76Å; I816-R856 HydrophobicContact CG2-CG 4.26Å; N817-R856 PolarHBondContact OD1-NH2 2.88Å; S820-R856 PolarHBondContact OG-NH1 3.35Å; L852-R856 WeakPolarHBondContact O-CD 3.39Å; V854-R856 PolarHBondContact O-N 3.01Å; R856-Q859 WeakPolarHBondContact O-CA 3.34Å; R856-Q859 WeakPolarHBondContact O-CB 3.3Å; R856-Q859 PolarHBondContact O-N 3.3Å; R856-Q859 PolarHBondContact O-OE1 2.97Å
857D72.7Confident82.2Confident47 Ų4735.8 Ų35.825%0.25118%0.175SC..THydrogen-bonded Turntrans-52.7130.6165-163.736.3000110.8R811 Y813 K1169R811-D857 IonicContact NH1-OD1 3.66Å; Y813-D857 HydrophobicContact CE1-CB 4.36Å; Y813-D857 VanDerWaalsContact OH-CB 3.25Å; Y813-D857 WeakPolarHBondContact OH-CB 3.35Å; Y813-D857 PolarHBondContact OH-N 3.24Å; Y813-D857 VanDerWaalsContact OH-N 3.11Å; Y813-D857 PolarHBondContact OH-OD1 2.87Å; D857-K1169 WeakPolarHBondContact OD2-CE 3.42Å; D857-K1169 IonicContact OD2-NZ 3.83Å; D857-K1169 PolarHBondContact OD2-NZ 3.02Å
858P70.2Confident81.6Confident76.5 Ų76.533 Ų3350%0.49717%0.167SC..THydrogen-bonded Turncis-98.414.613.139.7-37.5000116.4E860P858-E860 PolarHBondContact O-N 3.04Å
859Q78.8Confident81Confident17.25 Ų17.2533.5 Ų33.58%0.08117%0.168CC..  trans-70.9122.4179.4-71.970.250.300110.2R811 V854 R856 F900 F943R811-Q859 VanDerWaalsContact CZ-O 3.27Å; R811-Q859 PolarHBondContact NH1-O 3.32Å; R811-Q859 PolarHBondContact NH2-O 3.07Å; V854-Q859 WeakPolarHBondContact O-CB 3.4Å; V854-Q859 WeakPolarHBondContact O-CG 3.39Å; R856-Q859 WeakPolarHBondContact O-CA 3.34Å; R856-Q859 WeakPolarHBondContact O-CB 3.3Å; R856-Q859 PolarHBondContact O-N 3.3Å; R856-Q859 PolarHBondContact O-OE1 2.97Å; Q859-F900 HydrophobicContact CG-CZ 4.17Å; Q859-F900 VanDerWaalsContact NE2-CE2 3.35Å; Q859-F943 HydrophobicContact CB-CB 4.26Å; Q859-F943 HydrophobicContact CB-CD1 4.16Å; Q859-F943 HydrophobicContact CB-CD2 3.92Å; Q859-F943 HydrophobicContact CB-CE1 4.46Å; Q859-F943 HydrophobicContact CB-CE2 4.28Å; Q859-F943 HydrophobicContact CB-CG 3.87Å; Q859-F943 HydrophobicContact CG-CB 4.43Å; Q859-F943 HydrophobicContact CG-CD2 4.24Å; Q859-F943 HydrophobicContact CG-CG 4.39Å
860E73.5Confident80.3Confident49 Ų4934.7 Ų34.723%0.22918%0.175CC..  trans-126152.5179.3-77.4-8214200110.3R811 P858 H862 F943 R1164 E1168R811-E860 IonicContact CZ-OE1 3.35Å; R811-E860 IonicContact NH1-OE1 2.88Å; R811-E860 PolarHBondContact NH1-OE1 3.21Å; P858-E860 PolarHBondContact O-N 3.04Å; E860-H862 PolarHBondContact O-N 3.14Å; E860-F943 WeakPolarHBondContact O-CA 3.36Å; E860-F943 WeakPolarHBondContact O-CD1 3.36Å; E860-R1164 WeakPolarHBondContact OE1-CD 3.33Å; E860-R1164 WeakPolarHBondContact OE2-CD 3.39Å; E860-R1164 IonicContact OE2-CZ 3.2Å; E860-R1164 IonicContact OE2-NE 3.01Å; E860-R1164 IonicContact OE2-NH1 3.33Å; E860-R1164 PolarHBondContact OE2-NH1 2.99Å; E860-R1164 VanDerWaalsContact OE2-NH1 3.15Å; E860-E1168 VanDerWaalsContact OE1-OE1 3.1Å
861L76.9Confident79.5Confident113.25 Ų113.2536.2 Ų36.259%0.59318%0.18SC*.  trans-61.1111.5175.2-67.8176.3000109.5Q863 F942 F943L861-Q863 PolarHBondContact O-N 3.19Å; L861-F942 HydrophobicContact CD2-CB 3.85Å; L861-F942 HydrophobicContact CD2-CD2 4.27Å; L861-F943 HydrophobicContact CD2-CD1 4.28Å; L861-F943 HydrophobicContact CD2-CE1 3.98Å; L861-F943 HydrophobicContact CG-CE1 4.48Å
862H75.3Confident78.6Confident62.25 Ų62.2538.7 Ų38.729%0.28820%0.198SC..  trans-74.2122177.9177.7-96.6000109.3E860 P864 Q866 F942 Y1009E860-H862 PolarHBondContact O-N 3.14Å; H862-P864 VanDerWaalsContact O-CD 3.28Å; H862-P864 WeakPolarHBondContact O-CD 3.21Å; H862-Q866 PolarHBondContact NE2-NE2 3.21Å; H862-F942 WeakPolarHBondContact CB-O 3.23Å; H862-F942 PolarHBondContact N-O 2.99Å; H862-Y1009 PolarHBondContact ND1-OH 3.21Å; H862-Y1009 PolarHBondContact O-OH 3.29Å
863Q74.4Confident77.6Confident93.75 Ų93.7541.5 Ų41.544%0.43822%0.216SC..  trans-69.6113.6170.1-118.3-179.89.700108.6L861 I865 H1262L861-Q863 PolarHBondContact O-N 3.19Å; Q863-I865 VanDerWaalsContact C-N 3.26Å; Q863-I865 WeakPolarHBondContact CG-O 3.37Å; Q863-I865 PolarHBondContact O-N 3.02Å; Q863-H1262 PolarHBondContact OE1-O 3.3Å
864P77.5Confident76.7Confident24.25 Ų24.2540.7 Ų40.716%0.15721%0.212CC..SBendtrans-65.3-30.3-170.525.6-34.6000112.8H862 Y1009 D1012 V1013 D1016H862-P864 VanDerWaalsContact O-CD 3.28Å; H862-P864 WeakPolarHBondContact O-CD 3.21Å; P864-Y1009 HydrophobicContact CB-CD2 4.08Å; P864-Y1009 HydrophobicContact CB-CE1 4.35Å; P864-Y1009 HydrophobicContact CB-CE2 3.74Å; P864-Y1009 HydrophobicContact CG-CD2 4.14Å; P864-Y1009 HydrophobicContact CG-CE2 4.03Å; P864-D1012 HydrophobicContact CB-CB 3.51Å; P864-D1012 VanDerWaalsContact CB-CB 3.48Å; P864-D1012 HydrophobicContact CG-CB 3.43Å; P864-D1012 VanDerWaalsContact CG-CB 3.43Å; P864-V1013 HydrophobicContact CB-CG2 4Å; P864-D1016 WeakPolarHBondContact O-CB 3.24Å
865I78.6Confident75.7Confident5.75 Ų5.7541.7 Ų41.73%0.02922%0.223CC..SBendtrans-104.1117.1176.4-56.4173.6000109.4Q863 Y867 D1012 V1015 D1016 I1019 K1137Q863-I865 VanDerWaalsContact C-N 3.26Å; Q863-I865 WeakPolarHBondContact CG-O 3.37Å; Q863-I865 PolarHBondContact O-N 3.02Å; I865-Y867 HydrophobicContact CB-CE2 4.43Å; I865-Y867 HydrophobicContact CG2-CD1 4.24Å; I865-Y867 HydrophobicContact CG2-CE1 3.88Å; I865-Y867 HydrophobicContact CG2-CE2 4.35Å; I865-Y867 PolarHBondContact O-N 3.21Å; I865-D1012 HydrophobicContact CD1-CB 4.37Å; I865-D1012 WeakPolarHBondContact CD1-OD1 3.43Å; I865-D1012 HydrophobicContact CG1-CB 4.19Å; I865-V1015 HydrophobicContact CD1-CB 4.45Å; I865-V1015 HydrophobicContact CD1-CG1 4.31Å; I865-D1016 WeakPolarHBondContact CA-OD1 3.43Å; I865-D1016 HydrophobicContact CG1-CB 4.34Å; I865-I1019 HydrophobicContact CG2-CD1 4.21Å; I865-K1137 HydrophobicContact CD1-CD 3.96Å; I865-K1137 HydrophobicContact CD1-CG 4.24Å
866Q76.4Confident74.5Confident34.25 Ų34.2544.4 Ų44.416%0.1624%0.24CC..  trans-92100.7177.8-63.2-169.54.900110.5H862 R869 N887 D1016H862-Q866 PolarHBondContact NE2-NE2 3.21Å; Q866-R869 PolarHBondContact O-NE 3.3Å; Q866-R869 VanDerWaalsContact O-NE 3.13Å; Q866-N887 PolarHBondContact OE1-OD1 3.15Å; Q866-N887 VanDerWaalsContact OE1-OD1 3.12Å; Q866-D1016 PolarHBondContact N-OD1 3.14Å
867Y80.6Confident73.6Confident29.25 Ų29.2547.9 Ų47.912%0.11526%0.257CS..  trans-74.8-31179-61.5-74.9000113.4I865 K1137 Q1140 V1141 Q1142I865-Y867 HydrophobicContact CB-CE2 4.43Å; I865-Y867 HydrophobicContact CG2-CD1 4.24Å; I865-Y867 HydrophobicContact CG2-CE1 3.88Å; I865-Y867 HydrophobicContact CG2-CE2 4.35Å; I865-Y867 PolarHBondContact O-N 3.21Å; Y867-K1137 HydrophobicContact CE1-CB 4.49Å; Y867-K1137 HydrophobicContact CE1-CD 3.97Å; Y867-K1137 VanDerWaalsContact OH-CD 3.24Å; Y867-K1137 WeakPolarHBondContact OH-CD 3.4Å; Y867-K1137 PolarHBondContact OH-NZ 3.15Å; Y867-Q1140 HydrophobicContact CD1-CB 3.66Å; Y867-Q1140 HydrophobicContact CE1-CB 3.77Å; Y867-Q1140 VanDerWaalsContact CE1-OE1 3.24Å; Y867-Q1140 PolarHBondContact OH-OE1 3.23Å; Y867-V1141 HydrophobicContact CD1-CG2 4.42Å; Y867-V1141 CarbonylContact O-C 3.56Å; Y867-V1141 VanDerWaalsContact O-CA 3.31Å; Y867-V1141 WeakPolarHBondContact O-CA 3.37Å; Y867-V1141 WeakPolarHBondContact O-CG1 3.48Å; Y867-Q1142 PolarHBondContact O-N 3.08Å
868A80.5Confident73.1Confident9 Ų946.8 Ų46.87%0.07425%0.253CS..EExtended strand (participates in β ladder)trans-93.8115.7175.900000109.9Y1153 L1259A868-Y1153 HydrophobicContact CB-CD2 4.21Å; A868-Y1153 HydrophobicContact CB-CE2 3.7Å; A868-L1259 HydrophobicContact CB-CD1 3.72Å; A868-L1259 HydrophobicContact CB-CD2 3.9Å
869R81.1Confident72.9Confident10.25 Ų10.2546.3 Ų46.34%0.03925%0.246CC..EExtended strand (participates in β ladder)trans-124.9137.8-177.7-66.4-172.8178.2-155.54.2112.1Q866 D1016 F1020 Q1142 L1143 L1144Q866-R869 PolarHBondContact O-NE 3.3Å; Q866-R869 VanDerWaalsContact O-NE 3.13Å; R869-D1016 IonicContact CZ-OD1 3.27Å; R869-D1016 PolarHBondContact NH2-O 2.98Å; R869-D1016 IonicContact NH2-OD1 3.29Å; R869-D1016 PolarHBondContact NH2-OD1 3.26Å; R869-D1016 IonicContact NH2-OD2 3.21Å; R869-D1016 PolarHBondContact NH2-OD2 3.09Å; R869-D1016 VanDerWaalsContact NH2-OD2 3.09Å; R869-F1020 VanDerWaalsContact NH1-CB 3.28Å; R869-F1020 VanDerWaalsContact NH1-N 3.11Å; R869-Q1142 PolarHBondContact N-O 2.99Å; R869-L1143 HydrophobicContact CB-CD1 4.34Å; R869-L1144 PolarHBondContact O-N 3.01Å
870L78.3Confident72.2Confident25 Ų2546.2 Ų46.213%0.13125%0.247CC..EExtended strand (participates in β ladder)trans-83.6121.4177.4-64.1168.9000109.1S872 T873 L1144 I1150 Y1153L870-S872 PolarHBondContact O-N 3.19Å; L870-T873 HydrophobicContact CB-CG2 3.96Å; L870-T873 HydrophobicContact CD1-CG2 4.03Å; L870-T873 PolarHBondContact O-N 3.09Å; L870-T873 PolarHBondContact O-OG1 3.24Å; L870-L1144 HydrophobicContact CD2-CB 4.38Å; L870-L1144 HydrophobicContact CD2-CD1 4.15Å; L870-I1150 HydrophobicContact CD2-CB 4.09Å; L870-I1150 HydrophobicContact CD2-CD1 4.44Å; L870-I1150 HydrophobicContact CD2-CG1 3.69Å; L870-I1150 HydrophobicContact CD2-CG2 3.75Å; L870-Y1153 HydrophobicContact CD1-CE1 4.33Å; L870-Y1153 HydrophobicContact CD2-CD1 3.99Å; L870-Y1153 HydrophobicContact CD2-CE1 4.36Å; L870-Y1153 HydrophobicContact CG-CD1 4.35Å; L870-Y1153 HydrophobicContact CG-CE1 4.32Å
871W74.3Confident71.6Confident38.75 Ų38.7550 Ų5015%0.14726%0.263CS..G310 helixtrans-55.1-41.7177.2179.4-109.9000111.1T873 L874 L1026 R1027 Q1031 L1143 L1144 V1145 I1709W871-T873 VanDerWaalsContact C-N 3.29Å; W871-T873 PolarHBondContact O-N 3.08Å; W871-L874 HydrophobicContact CE3-CD1 3.93Å; W871-L874 HydrophobicContact CZ3-CD1 4.32Å; W871-L874 PolarHBondContact O-N 3.28Å; W871-L1026 HydrophobicContact CH2-CD2 3.44Å; W871-L1026 VanDerWaalsContact CH2-CD2 3.44Å; W871-L1026 HydrophobicContact CZ3-CD2 3.48Å; W871-R1027 HydrophobicContact CH2-CB 3.82Å; W871-R1027 HydrophobicContact CH2-CG 4.07Å; W871-R1027 HydrophobicContact CZ2-CB 4.21Å; W871-R1027 HydrophobicContact CZ2-CG 3.92Å; W871-R1027 HydrophobicContact CZ3-CB 4.25Å; W871-R1027 HydrophobicContact CZ3-CG 4.5Å; W871-R1027 PolarHBondContact O-NH1 3.19Å; W871-Q1031 VanDerWaalsContact CZ2-NE2 3.31Å; W871-L1143 HydrophobicContact CB-CD1 4.38Å; W871-L1143 HydrophobicContact CB-CG 4.43Å; W871-L1143 HydrophobicContact CD2-CD2 4.22Å; W871-L1143 HydrophobicContact CE3-CD1 3.93Å; W871-L1143 HydrophobicContact CE3-CD2 3.51Å; W871-L1143 VanDerWaalsContact CE3-CD2 3.4Å; W871-L1143 HydrophobicContact CE3-CG 4.02Å; W871-L1143 HydrophobicContact CZ3-CD1 4.3Å; W871-L1143 HydrophobicContact CZ3-CD2 3.77Å; W871-L1143 HydrophobicContact CZ3-CG 4.5Å; W871-L1144 WeakPolarHBondContact CB-O 3.24Å; W871-L1144 PolarHBondContact N-O 3.25Å; W871-V1145 HydrophobicContact CB-CB 4.4Å; W871-V1145 HydrophobicContact CB-CG2 4.07Å; W871-V1145 HydrophobicContact CG-CG1 4.4Å; W871-V1145 HydrophobicContact CG-CG2 4.28Å; W871-I1709 HydrophobicContact CD2-CD1 4.13Å; W871-I1709 HydrophobicContact CE3-CG2 4.13Å; W871-I1709 HydrophobicContact CH2-CG2 4.36Å; W871-I1709 HydrophobicContact CZ2-CD1 3.95Å; W871-I1709 HydrophobicContact CZ2-CG1 4.4Å; W871-I1709 HydrophobicContact CZ3-CG2 4.04Å
872S70.7Confident71Confident64.75 Ų64.7546.4 Ų46.445%0.45324%0.244SC..G310 helixtrans-59.2-31.5-177.3580000114.6L870 R1027L870-S872 PolarHBondContact O-N 3.19Å; S872-R1027 VanDerWaalsContact C-NH1 3.32Å; S872-R1027 PolarHBondContact O-NH1 2.99Å; S872-R1027 VanDerWaalsContact O-NH1 3.11Å
873T69.1Low70.8Confident59.75 Ų59.7544 Ų4437%0.36723%0.232SC..G310 helixtrans-82.5-15.9-176.158.70000113.7L870 W871 G875L870-T873 HydrophobicContact CB-CG2 3.96Å; L870-T873 HydrophobicContact CD1-CG2 4.03Å; L870-T873 PolarHBondContact O-N 3.09Å; L870-T873 PolarHBondContact O-OG1 3.24Å; W871-T873 VanDerWaalsContact C-N 3.29Å; W871-T873 PolarHBondContact O-N 3.08Å; T873-G875 PolarHBondContact O-N 3.04Å
874L68Low70.6Confident4.75 Ų4.7542 Ų423%0.02522%0.223CC..  trans-70.5127.1-179.7-61.9172000111.5W871 F1020 L1023 R1027 L1143W871-L874 HydrophobicContact CE3-CD1 3.93Å; W871-L874 HydrophobicContact CZ3-CD1 4.32Å; W871-L874 PolarHBondContact O-N 3.28Å; L874-F1020 HydrophobicContact CD2-CD2 3.82Å; L874-F1020 HydrophobicContact CD2-CE2 3.72Å; L874-L1023 HydrophobicContact CD1-CB 4.07Å; L874-L1023 HydrophobicContact CD1-CD1 4.46Å; L874-L1023 HydrophobicContact CD2-CB 4.4Å; L874-R1027 VanDerWaalsContact O-CD 3.27Å; L874-R1027 WeakPolarHBondContact O-CD 3.37Å; L874-R1027 PolarHBondContact O-NE 3.12Å; L874-R1027 PolarHBondContact O-NH1 3.19Å; L874-L1143 HydrophobicContact CD1-CD1 3.96Å
875G66.2Low70.1Confident21 Ų2146.9 Ų46.922%0.21624%0.242CC..  trans-77.8173.9171.400000112.7T873 T1024T873-G875 PolarHBondContact O-N 3.04Å; G875-T1024 WeakPolarHBondContact O-CG2 3.44Å
876T60.9Low68.9Low84.25 Ų84.2547.4 Ų47.452%0.51725%0.247SC..SBendtrans-87-10.816752.40000113.1
877K61Low68.3Low136.75 Ų136.7547.1 Ų47.160%0.59525%0.246SC*.SBendtrans-108.9126.1179.9-64.9-177.2179.3-177.80111.1D879 N882K877-D879 VanDerWaalsContact C-N 3.28Å; K877-D879 PolarHBondContact O-N 3.24Å; K877-N882 PolarHBondContact O-ND2 3.17Å
878S62.3Low67.2Low23 Ų2349.4 Ų49.416%0.16127%0.267CS..  trans-77.772.4173.5-20.90000111T1024 Q1059S878-T1024 PolarHBondContact OG-OG1 3Å; S878-T1024 VanDerWaalsContact OG-OG1 3.11Å; S878-Q1059 PolarHBondContact OG-NE2 3.21Å; S878-Q1059 PolarHBondContact OG-OE1 2.91Å
879D65.8Low65.8Low65.75 Ų65.7552.3 Ų52.335%0.35229%0.287SS..  trans-119.1145.8175.9-61.7-36.3000110.2K877 F881 N882 Y883 K1087K877-D879 VanDerWaalsContact C-N 3.28Å; K877-D879 PolarHBondContact O-N 3.24Å; D879-F881 PolarHBondContact O-N 3.29Å; D879-F881 VanDerWaalsContact O-N 3.13Å; D879-N882 WeakPolarHBondContact O-CB 3.39Å; D879-N882 PolarHBondContact O-N 3.24Å; D879-Y883 PolarHBondContact O-N 2.95Å; D879-K1087 IonicContact OD1-NZ 3.81Å
880V64.2Low64Low15.75 Ų15.7557.3 Ų57.310%0.09532%0.319CS..Hα-helixtrans-50.6-38.4177.7178.90000112.2N882 Y883 E884 I948 Y1017 I1090V880-N882 VanDerWaalsContact C-N 3.33Å; V880-N882 PolarHBondContact O-N 3.1Å; V880-Y883 WeakPolarHBondContact O-CB 3.22Å; V880-Y883 PolarHBondContact O-N 3.19Å; V880-E884 HydrophobicContact CG1-CG 4.44Å; V880-E884 WeakPolarHBondContact O-CG 3.42Å; V880-E884 PolarHBondContact O-N 2.99Å; V880-I948 HydrophobicContact CG1-CB 3.97Å; V880-I948 HydrophobicContact CG1-CD1 3.93Å; V880-I948 HydrophobicContact CG1-CG1 4.45Å; V880-I948 HydrophobicContact CG1-CG2 4.28Å; V880-Y1017 HydrophobicContact CB-CE2 4.48Å; V880-Y1017 HydrophobicContact CG2-CE2 4.07Å; V880-I1090 HydrophobicContact CG2-CD1 4.22Å; V880-I1090 HydrophobicContact CG2-CG2 3.6Å; V880-I1090 VanDerWaalsContact CG2-CG2 3.48Å
881F60.9Low62.2Low129.5 Ų129.563 Ų6357%0.56835%0.349SS*.Hα-helixtrans-63.4-35.9178-176.5-106.7000113.4D879 K885D879-F881 PolarHBondContact O-N 3.29Å; D879-F881 VanDerWaalsContact O-N 3.13Å; F881-K885 HydrophobicContact CD1-CD 4.21Å; F881-K885 HydrophobicContact CE1-CD 3.86Å; F881-K885 HydrophobicContact CZ-CD 4.21Å; F881-K885 WeakPolarHBondContact O-CB 3.41Å; F881-K885 WeakPolarHBondContact O-CG 3.31Å; F881-K885 PolarHBondContact O-N 3.01Å; F881-K885 VanDerWaalsContact O-N 3.13Å
882N65.2Low60.8Low37.5 Ų37.569.8 Ų69.820%0.20138%0.382CS..Hα-helixtrans-75.5-32.3177.9-67.7-26.9000111.6K877 D879 V880 K885 A886 F1020K877-N882 PolarHBondContact O-ND2 3.17Å; D879-N882 WeakPolarHBondContact O-CB 3.39Å; D879-N882 PolarHBondContact O-N 3.24Å; V880-N882 VanDerWaalsContact C-N 3.33Å; V880-N882 PolarHBondContact O-N 3.1Å; N882-K885 PolarHBondContact O-N 3.31Å; N882-A886 WeakPolarHBondContact O-CB 3.28Å; N882-A886 PolarHBondContact O-N 3.12Å; N882-F1020 VanDerWaalsContact C-CZ 3.44Å; N882-F1020 HydrophobicContact CB-CE1 4.26Å; N882-F1020 HydrophobicContact CB-CZ 3.88Å; N882-F1020 WeakPolarHBondContact O-CZ 3.44Å
883Y71.3Confident59.6Low10.25 Ų10.2572 Ų724%0.0439%0.386CS..Hα-helixtrans-62.2-50.8171.8171-91.5000111.2D879 V880 K885 A886 N887 I948 D1016 Y1017 F1020D879-Y883 PolarHBondContact O-N 2.95Å; V880-Y883 WeakPolarHBondContact O-CB 3.22Å; V880-Y883 PolarHBondContact O-N 3.19Å; Y883-K885 VanDerWaalsContact C-N 3.29Å; Y883-K885 PolarHBondContact O-N 3.18Å; Y883-A886 WeakPolarHBondContact O-CB 3.44Å; Y883-A886 PolarHBondContact O-N 3.04Å; Y883-A886 VanDerWaalsContact O-N 3.08Å; Y883-N887 WeakPolarHBondContact CE1-ND2 3.36Å; Y883-N887 VanDerWaalsContact CE2-ND2 3.34Å; Y883-N887 WeakPolarHBondContact CE2-ND2 3.34Å; Y883-N887 PolarHBondContact O-N 3.09Å; Y883-N887 VanDerWaalsContact O-N 3.08Å; Y883-N887 PolarHBondContact OH-ND2 3.22Å; Y883-N887 VanDerWaalsContact OH-ND2 3.11Å; Y883-I948 HydrophobicContact CD1-CD1 3.21Å; Y883-I948 HydrophobicContact CD1-CG1 4.29Å; Y883-I948 HydrophobicContact CE1-CD1 3.31Å; Y883-I948 HydrophobicContact CE1-CG1 4.07Å; Y883-I948 HydrophobicContact CG-CD1 4.11Å; Y883-D1016 HydrophobicContact CE2-CB 4.46Å; Y883-D1016 WeakPolarHBondContact CE2-OD2 3.3Å; Y883-D1016 VanDerWaalsContact CZ-OD2 3.23Å; Y883-D1016 PolarHBondContact OH-OD2 3.33Å; Y883-Y1017 HydrophobicContact CD1-CD2 4.21Å; Y883-Y1017 AromaticContact CD2-CD2 3.77Å; Y883-Y1017 HydrophobicContact CD2-CD2 3.77Å; Y883-Y1017 HydrophobicContact CD2-CE2 4.49Å; Y883-Y1017 HydrophobicContact CD2-CG 4.48Å; Y883-Y1017 HydrophobicContact CE2-CD2 4.3Å; Y883-Y1017 AromaticContact CG-CD2 3.68Å; Y883-Y1017 HydrophobicContact CG-CD2 3.68Å; Y883-Y1017 HydrophobicContact CG-CE2 4.25Å; Y883-F1020 HydrophobicContact CD2-CB 3.56Å; Y883-F1020 AromaticContact CD2-CD1 3.99Å; Y883-F1020 HydrophobicContact CD2-CD1 4Å; Y883-F1020 AromaticContact CD2-CD2 4Å; Y883-F1020 HydrophobicContact CD2-CD2 4.03Å; Y883-F1020 AromaticContact CD2-CG 3.61Å; Y883-F1020 HydrophobicContact CD2-CG 3.61Å; Y883-F1020 HydrophobicContact CE2-CB 4.11Å; Y883-F1020 HydrophobicContact CG-CD1 4.4Å; Y883-F1020 HydrophobicContact CG-CG 4.37Å; Y883-F1020 VanDerWaalsContact N-CZ 3.34Å
884E69.4Low58.3Low53.5 Ų53.571.4 Ų71.425%0.2539%0.392CS..Hα-helixtrans-61.9-39.1180-71.3178.3169.600111.3V880 A886 N887 S888 N947 I948V880-E884 HydrophobicContact CG1-CG 4.44Å; V880-E884 WeakPolarHBondContact O-CG 3.42Å; V880-E884 PolarHBondContact O-N 2.99Å; E884-A886 VanDerWaalsContact C-N 3.32Å; E884-A886 PolarHBondContact O-N 3.35Å; E884-N887 PolarHBondContact O-N 2.97Å; E884-S888 VanDerWaalsContact O-CB 3.25Å; E884-S888 WeakPolarHBondContact O-CB 3.25Å; E884-S888 PolarHBondContact O-N 3.29Å; E884-S888 PolarHBondContact O-OG 3.04Å; E884-N947 WeakPolarHBondContact OE1-CB 3.36Å; E884-N947 PolarHBondContact OE1-ND2 2.56Å; E884-N947 PolarHBondContact OE2-ND2 3.21Å; E884-I948 PolarHBondContact OE1-N 3.15Å; E884-I948 VanDerWaalsContact OE1-N 3.13Å
885K66.4Low57.1Low126.5 Ų126.578.3 Ų78.355%0.5543%0.428SS*.Hα-helixtrans-64.8-35.9173-99.5-178172.6-177.90113.9F881 N882 Y883 N887 S888F881-K885 HydrophobicContact CD1-CD 4.21Å; F881-K885 HydrophobicContact CE1-CD 3.86Å; F881-K885 HydrophobicContact CZ-CD 4.21Å; F881-K885 WeakPolarHBondContact O-CB 3.41Å; F881-K885 WeakPolarHBondContact O-CG 3.31Å; F881-K885 PolarHBondContact O-N 3.01Å; F881-K885 VanDerWaalsContact O-N 3.13Å; N882-K885 PolarHBondContact O-N 3.31Å; Y883-K885 VanDerWaalsContact C-N 3.29Å; Y883-K885 PolarHBondContact O-N 3.18Å; K885-N887 VanDerWaalsContact C-N 3.31Å; K885-S888 WeakPolarHBondContact CA-OG 3.36Å; K885-S888 PolarHBondContact O-OG 3.25Å; K885-S888 VanDerWaalsContact O-OG 3.13Å
886A54.3Low56.4Low15.75 Ų15.7581.6 Ų81.613%0.1344%0.437CS..Hα-helixtrans-69.9-32.8178.700000111.7N882 Y883 E884 F1020N882-A886 WeakPolarHBondContact O-CB 3.28Å; N882-A886 PolarHBondContact O-N 3.12Å; Y883-A886 WeakPolarHBondContact O-CB 3.44Å; Y883-A886 PolarHBondContact O-N 3.04Å; Y883-A886 VanDerWaalsContact O-N 3.08Å; E884-A886 VanDerWaalsContact C-N 3.32Å; E884-A886 PolarHBondContact O-N 3.35Å; A886-F1020 HydrophobicContact CB-CD2 4.38Å; A886-F1020 HydrophobicContact CB-CE2 3.71Å; A886-F1020 HydrophobicContact CB-CZ 4.46Å
887N63.3Low56.6Low28.25 Ų28.2580.2 Ų80.215%0.15143%0.428CS..Hα-helixtrans-91.1-25.4-178.9-69.20.7000113.2Q866 Y883 E884 K885 S889 D1016Q866-N887 PolarHBondContact OE1-OD1 3.15Å; Q866-N887 VanDerWaalsContact OE1-OD1 3.12Å; Y883-N887 WeakPolarHBondContact CE1-ND2 3.36Å; Y883-N887 VanDerWaalsContact CE2-ND2 3.34Å; Y883-N887 WeakPolarHBondContact CE2-ND2 3.34Å; Y883-N887 PolarHBondContact O-N 3.09Å; Y883-N887 VanDerWaalsContact O-N 3.08Å; Y883-N887 PolarHBondContact OH-ND2 3.22Å; Y883-N887 VanDerWaalsContact OH-ND2 3.11Å; E884-N887 PolarHBondContact O-N 2.97Å; K885-N887 VanDerWaalsContact C-N 3.31Å; N887-S889 PolarHBondContact O-N 3.21Å; N887-S889 PolarHBondContact O-OG 2.86Å; N887-D1016 PolarHBondContact ND2-OD2 3.18Å
888S57.9Low57.2Low77.75 Ų77.7577.4 Ų77.454%0.54442%0.423SS..  trans-71.6105.2177.457.30000111.1E884 K885E884-S888 VanDerWaalsContact O-CB 3.25Å; E884-S888 WeakPolarHBondContact O-CB 3.25Å; E884-S888 PolarHBondContact O-N 3.29Å; E884-S888 PolarHBondContact O-OG 3.04Å; K885-S888 WeakPolarHBondContact CA-OG 3.36Å; K885-S888 PolarHBondContact O-OG 3.25Å; K885-S888 VanDerWaalsContact O-OG 3.13Å
889S51.2Low58.1Low70 Ų7079.3 Ų79.349%0.4943%0.431SS..  trans-86.278.3171.45.70000111.3N887 N891 K1157N887-S889 PolarHBondContact O-N 3.21Å; N887-S889 PolarHBondContact O-OG 2.86Å; S889-N891 PolarHBondContact O-N 3.21Å; S889-K1157 PolarHBondContact OG-NZ 3.06Å
890T42.4Very low59Low115.75 Ų115.7576.7 Ų76.771%0.7142%0.417SS*.  trans-107.472.8177.246.90000113E892T890-E892 PolarHBondContact O-N 3.16Å
891N40.8Very low60Low143 Ų14380.4 Ų80.477%0.76543%0.434SS*.G310 helixtrans-90.461.6-177.6-74.3-14.9000112.4S889 Q893S889-N891 PolarHBondContact O-N 3.21Å; N891-Q893 VanDerWaalsContact C-N 3.27Å; N891-Q893 PolarHBondContact O-N 3.17Å
892E44.5Very low61.3Low181.75 Ų181.7577.6 Ų77.685%0.84942%0.423SS*.G310 helixtrans-34.69.6166.2-60.3-168164.300118T890 G894T890-E892 PolarHBondContact O-N 3.16Å; E892-G894 PolarHBondContact O-N 3.37Å; E892-G894 VanDerWaalsContact O-N 3.12Å
893Q45.6Very low62.5Low111.5 Ų111.575.9 Ų75.952%0.52141%0.413SS..G310 helixtrans-73.5-4.2176.8-68.6-177.1-9.600113.7N891 N895 F896 T897N891-Q893 VanDerWaalsContact C-N 3.27Å; N891-Q893 PolarHBondContact O-N 3.17Å; Q893-N895 VanDerWaalsContact C-N 3.32Å; Q893-N895 PolarHBondContact O-N 3.06Å; Q893-N895 VanDerWaalsContact O-N 3.15Å; Q893-F896 PolarHBondContact O-N 3.03Å; Q893-F896 VanDerWaalsContact O-N 3.16Å; Q893-T897 HydrophobicContact CB-CG2 4.11Å; Q893-T897 WeakPolarHBondContact O-CG2 3.4Å; Q893-T897 PolarHBondContact O-N 3.15Å; Q893-T897 VanDerWaalsContact O-N 3.1Å
894G41.8Very low63.3Low48 Ų4876.2 Ų76.250%0.49542%0.415SS..G310 helixtrans-49.4-46.7-170.800000114.5E892 T897E892-G894 PolarHBondContact O-N 3.37Å; E892-G894 VanDerWaalsContact O-N 3.12Å; G894-T897 PolarHBondContact O-N 3.14Å; G894-T897 PolarHBondContact O-OG1 3.12Å
895N44.7Very low64.3Low147.75 Ų147.7577.7 Ų77.779%0.7943%0.425SS*.G310 helixtrans-78.6-29.1-177.4-70.7-6.9000113.4Q893 T897 T898Q893-N895 VanDerWaalsContact C-N 3.32Å; Q893-N895 PolarHBondContact O-N 3.06Å; Q893-N895 VanDerWaalsContact O-N 3.15Å; N895-T897 VanDerWaalsContact C-N 3.3Å; N895-T897 PolarHBondContact O-N 3.42Å; N895-T898 PolarHBondContact O-OG1 3.01Å
896F51Low65.6Low91.25 Ų91.2572 Ų7240%0.440%0.4SS..THydrogen-bonded Turntrans-80.7-19.3178.2-69.4-75000112.9Q893 T898 D899 F900Q893-F896 PolarHBondContact O-N 3.03Å; Q893-F896 VanDerWaalsContact O-N 3.16Å; F896-T898 VanDerWaalsContact C-N 3.31Å; F896-T898 PolarHBondContact O-N 3.11Å; F896-D899 PolarHBondContact O-N 3.01Å; F896-F900 HydrophobicContact CB-CD2 4Å; F896-F900 HydrophobicContact CB-CE2 3.8Å; F896-F900 HydrophobicContact CD1-CE2 4.41Å; F896-F900 HydrophobicContact CG-CE2 4.43Å; F896-F900 WeakPolarHBondContact O-CD2 3.27Å; F896-F900 PolarHBondContact O-N 3.23Å
897T64.4Low67.3Low55 Ų5571.3 Ų71.334%0.33739%0.394SS..Hα-helixtrans-61.5-35.6-175.361.40000113.6Q893 G894 N895 M901Q893-T897 HydrophobicContact CB-CG2 4.11Å; Q893-T897 WeakPolarHBondContact O-CG2 3.4Å; Q893-T897 PolarHBondContact O-N 3.15Å; Q893-T897 VanDerWaalsContact O-N 3.1Å; G894-T897 PolarHBondContact O-N 3.14Å; G894-T897 PolarHBondContact O-OG1 3.12Å; N895-T897 VanDerWaalsContact C-N 3.3Å; N895-T897 PolarHBondContact O-N 3.42Å; T897-M901 VanDerWaalsContact O-CB 3.3Å; T897-M901 WeakPolarHBondContact O-CB 3.41Å; T897-M901 WeakPolarHBondContact O-CE 3.45Å; T897-M901 VanDerWaalsContact O-CG 3.24Å; T897-M901 WeakPolarHBondContact O-CG 3.17Å; T897-M901 PolarHBondContact O-N 3.2Å
898T73.4Confident68.5Low78 Ų7871.1 Ų71.148%0.47939%0.393SS..Hα-helixtrans-69.2-45.8-177.153.70000112.1N895 F896 F900 M901 E902N895-T898 PolarHBondContact O-OG1 3.01Å; F896-T898 VanDerWaalsContact C-N 3.31Å; F896-T898 PolarHBondContact O-N 3.11Å; T898-F900 PolarHBondContact O-N 3.26Å; T898-M901 HydrophobicContact CG2-CE 4.33Å; T898-M901 WeakPolarHBondContact O-CB 3.4Å; T898-M901 PolarHBondContact O-N 3.23Å; T898-M901 VanDerWaalsContact O-N 3.16Å; T898-E902 PolarHBondContact O-N 3.08Å; T898-E902 VanDerWaalsContact O-N 3.1Å
899D80.6Confident70Confident62 Ų6271.3 Ų71.333%0.33239%0.388SS..Hα-helixtrans-64.7-44.2-179.6-66.4-11.6000110.7I825 F896 M901 E902 I903I825-D899 HydrophobicContact CD1-CB 3.73Å; I825-D899 HydrophobicContact CG2-CB 4.44Å; F896-D899 PolarHBondContact O-N 3.01Å; D899-M901 VanDerWaalsContact C-N 3.31Å; D899-M901 PolarHBondContact O-N 3.09Å; D899-E902 PolarHBondContact O-N 3.21Å; D899-E902 VanDerWaalsContact O-N 3.15Å; D899-I903 WeakPolarHBondContact O-CG1 3.41Å; D899-I903 PolarHBondContact O-N 3.08Å; D899-I903 VanDerWaalsContact O-N 3.15Å
900F84.9Confident71.9Confident11.5 Ų11.568.7 Ų68.75%0.0537%0.368CS..Hα-helixtrans-66-32.1175.2-69.7-57.5000112.7V854 Q859 F896 T898 I903 K904 L940 L945V854-F900 HydrophobicContact CB-CE1 4.49Å; V854-F900 HydrophobicContact CG1-CE1 4.4Å; V854-F900 HydrophobicContact CG2-CE1 4.31Å; Q859-F900 HydrophobicContact CG-CZ 4.17Å; Q859-F900 VanDerWaalsContact NE2-CE2 3.35Å; F896-F900 HydrophobicContact CB-CD2 4Å; F896-F900 HydrophobicContact CB-CE2 3.8Å; F896-F900 HydrophobicContact CD1-CE2 4.41Å; F896-F900 HydrophobicContact CG-CE2 4.43Å; F896-F900 WeakPolarHBondContact O-CD2 3.27Å; F896-F900 PolarHBondContact O-N 3.23Å; T898-F900 PolarHBondContact O-N 3.26Å; F900-I903 HydrophobicContact CD1-CD1 4.07Å; F900-I903 HydrophobicContact CE1-CD1 4.48Å; F900-I903 PolarHBondContact O-N 3.05Å; F900-K904 WeakPolarHBondContact O-CB 3.19Å; F900-K904 VanDerWaalsContact O-CG 3.28Å; F900-K904 WeakPolarHBondContact O-CG 3.36Å; F900-K904 PolarHBondContact O-N 3.2Å; F900-L940 HydrophobicContact CD1-CD2 4.12Å; F900-L940 HydrophobicContact CE1-CD2 4.43Å; F900-L945 HydrophobicContact CD1-CD1 3.82Å; F900-L945 HydrophobicContact CD2-CD1 4.39Å; F900-L945 HydrophobicContact CD2-CD2 4.19Å; F900-L945 HydrophobicContact CE1-CD1 4.02Å; F900-L945 HydrophobicContact CE2-CD1 4.5Å; F900-L945 HydrophobicContact CE2-CD2 4.44Å; F900-L945 HydrophobicContact CG-CD1 4.05Å; F900-L945 HydrophobicContact CG-CD2 4.41Å; F900-L945 HydrophobicContact CZ-CD1 4.4Å
901M86.3Confident74Confident93.5 Ų93.563.3 Ų63.346%0.46133%0.334SS..Hα-helixtrans-61.8-42.4171.7-82.6-172.5-98.900111.5T897 T898 D899 I903 K904 N905T897-M901 VanDerWaalsContact O-CB 3.3Å; T897-M901 WeakPolarHBondContact O-CB 3.41Å; T897-M901 WeakPolarHBondContact O-CE 3.45Å; T897-M901 VanDerWaalsContact O-CG 3.24Å; T897-M901 WeakPolarHBondContact O-CG 3.17Å; T897-M901 PolarHBondContact O-N 3.2Å; T898-M901 HydrophobicContact CG2-CE 4.33Å; T898-M901 WeakPolarHBondContact O-CB 3.4Å; T898-M901 PolarHBondContact O-N 3.23Å; T898-M901 VanDerWaalsContact O-N 3.16Å; D899-M901 VanDerWaalsContact C-N 3.31Å; D899-M901 PolarHBondContact O-N 3.09Å; M901-I903 VanDerWaalsContact C-N 3.32Å; M901-I903 PolarHBondContact O-N 3.05Å; M901-K904 PolarHBondContact O-N 3.09Å; M901-N905 WeakPolarHBondContact O-CB 3.42Å; M901-N905 PolarHBondContact O-N 2.92Å; M901-N905 PolarHBondContact O-ND2 3.06Å
902E87.4Confident76.2Confident72 Ų7259.8 Ų59.834%0.33632%0.316SS..Hα-helixtrans-63-38.9176.4-66.2-166.2175.400112.6L829 R833 T898 D899 N905 F906L829-E902 HydrophobicContact CD1-CB 3.7Å; R833-E902 PolarHBondContact NH2-O 3.13Å; T898-E902 PolarHBondContact O-N 3.08Å; T898-E902 VanDerWaalsContact O-N 3.1Å; D899-E902 PolarHBondContact O-N 3.21Å; D899-E902 VanDerWaalsContact O-N 3.15Å; E902-N905 PolarHBondContact O-N 3.07Å; E902-F906 PolarHBondContact O-N 3.36Å
903I90.4Very high78.2Confident0 Ų054.9 Ų54.90%030%0.295CS..Hα-helixtrans-65.7-46.6176.2-60.2171.7000110.6I825 L829 L849 V854 D899 F900 M901 N905 F906 V907 L936 L940I825-I903 HydrophobicContact CG2-CD1 4.02Å; I825-I903 HydrophobicContact CG2-CG1 4.09Å; L829-I903 HydrophobicContact CD1-CG1 4.01Å; L829-I903 HydrophobicContact CD2-CG1 4.17Å; L829-I903 HydrophobicContact CG-CG1 4.42Å; L849-I903 HydrophobicContact CD1-CD1 4.41Å; L849-I903 HydrophobicContact CD2-CD1 4.23Å; L849-I903 HydrophobicContact CD2-CG1 4.2Å; L849-I903 HydrophobicContact CD2-CG2 4.27Å; L849-I903 HydrophobicContact CG-CD1 4.49Å; V854-I903 HydrophobicContact CG2-CD1 4.07Å; D899-I903 WeakPolarHBondContact O-CG1 3.41Å; D899-I903 PolarHBondContact O-N 3.08Å; D899-I903 VanDerWaalsContact O-N 3.15Å; F900-I903 HydrophobicContact CD1-CD1 4.07Å; F900-I903 HydrophobicContact CE1-CD1 4.48Å; F900-I903 PolarHBondContact O-N 3.05Å; M901-I903 VanDerWaalsContact C-N 3.32Å; M901-I903 PolarHBondContact O-N 3.05Å; I903-N905 VanDerWaalsContact C-N 3.33Å; I903-N905 PolarHBondContact O-N 3.2Å; I903-F906 WeakPolarHBondContact O-CB 3.42Å; I903-F906 PolarHBondContact O-N 3.28Å; I903-V907 WeakPolarHBondContact O-CG2 3.36Å; I903-V907 PolarHBondContact O-N 3.37Å; I903-L936 HydrophobicContact CG2-CD1 4.37Å; I903-L936 HydrophobicContact CG2-CD2 4Å; I903-L936 HydrophobicContact CG2-CG 4.42Å; I903-L940 HydrophobicContact CG2-CD1 3.88Å
904K89.4Confident80Confident18 Ų1849.9 Ų49.98%0.07827%0.272CS..Hα-helixtrans-60.2-43176.4-73.3173.8158.5-175.40112F900 M901 F906 V907 N908 L940 L945 Y946 E950F900-K904 WeakPolarHBondContact O-CB 3.19Å; F900-K904 VanDerWaalsContact O-CG 3.28Å; F900-K904 WeakPolarHBondContact O-CG 3.36Å; F900-K904 PolarHBondContact O-N 3.2Å; M901-K904 PolarHBondContact O-N 3.09Å; K904-F906 VanDerWaalsContact C-N 3.32Å; K904-F906 PolarHBondContact O-N 3.36Å; K904-V907 PolarHBondContact O-N 3.09Å; K904-N908 WeakPolarHBondContact O-CB 3.18Å; K904-N908 PolarHBondContact O-N 2.98Å; K904-N908 PolarHBondContact O-ND2 3.22Å; K904-L940 HydrophobicContact CG-CD1 4.47Å; K904-L945 VanDerWaalsContact CE-O 3.23Å; K904-L945 WeakPolarHBondContact CE-O 3.32Å; K904-L945 PolarHBondContact NZ-O 3.19Å; K904-Y946 HydrophobicContact CD-CE1 4.47Å; K904-Y946 HydrophobicContact CG-CE1 4.34Å; K904-Y946 HydrophobicContact CG-CE2 4.16Å; K904-E950 VanDerWaalsContact CE-OE2 3.32Å; K904-E950 WeakPolarHBondContact CE-OE2 3.31Å; K904-E950 IonicContact NZ-OE1 2.89Å; K904-E950 PolarHBondContact NZ-OE1 3.24Å; K904-E950 IonicContact NZ-OE2 3.03Å; K904-E950 PolarHBondContact NZ-OE2 3.2Å
905N90.2Very high81.8Confident85 Ų8549.4 Ų49.446%0.45526%0.258SS..Hα-helixtrans-61-44.7176.1-70.6-16.8000110.6M901 E902 I903 V907 N908 D909M901-N905 WeakPolarHBondContact O-CB 3.42Å; M901-N905 PolarHBondContact O-N 2.92Å; M901-N905 PolarHBondContact O-ND2 3.06Å; E902-N905 PolarHBondContact O-N 3.07Å; I903-N905 VanDerWaalsContact C-N 3.33Å; I903-N905 PolarHBondContact O-N 3.2Å; N905-V907 PolarHBondContact O-N 2.95Å; N905-N908 PolarHBondContact O-N 3.33Å; N905-D909 WeakPolarHBondContact O-CB 3.3Å; N905-D909 PolarHBondContact O-N 3.04Å
906F92.1Very high83.5Confident6.5 Ų6.546.9 Ų46.93%0.02925%0.252CS..Hα-helixtrans-57.6-46.5174168.6-95.2000112.9L829 M832 R833 E902 I903 K904 N908 D909 Y910 V933L829-F906 HydrophobicContact CD2-CB 4.05Å; L829-F906 HydrophobicContact CD2-CD1 4.48Å; L829-F906 HydrophobicContact CD2-CG 4.18Å; M832-F906 HydrophobicContact CB-CE1 4.4Å; M832-F906 HydrophobicContact CB-CE2 3.96Å; M832-F906 HydrophobicContact CB-CZ 3.81Å; M832-F906 HydrophobicContact CE-CD1 3.66Å; M832-F906 HydrophobicContact CE-CE1 3.22Å; M832-F906 HydrophobicContact CE-CG 4.48Å; M832-F906 HydrophobicContact CE-CZ 3.76Å; R833-F906 HydrophobicContact CG-CD2 3.51Å; R833-F906 VanDerWaalsContact CG-CD2 3.47Å; R833-F906 HydrophobicContact CG-CE2 3.87Å; E902-F906 PolarHBondContact O-N 3.36Å; I903-F906 WeakPolarHBondContact O-CB 3.42Å; I903-F906 PolarHBondContact O-N 3.28Å; K904-F906 VanDerWaalsContact C-N 3.32Å; K904-F906 PolarHBondContact O-N 3.36Å; F906-N908 VanDerWaalsContact C-N 3.32Å; F906-N908 PolarHBondContact O-N 3.46Å; F906-D909 PolarHBondContact O-N 2.97Å; F906-Y910 HydrophobicContact CZ-CD2 4.5Å; F906-Y910 VanDerWaalsContact O-CB 3.27Å; F906-Y910 WeakPolarHBondContact O-CB 3.23Å; F906-Y910 PolarHBondContact O-N 3.06Å; F906-V933 HydrophobicContact CE1-CG2 4.26Å
907V91.1Very high84.5Confident0 Ų044.8 Ų44.80%025%0.249CC..Hα-helixtrans-60.3-45.11781730000110.3I903 K904 N905 Y910 L911 V933 L936 L940I903-V907 WeakPolarHBondContact O-CG2 3.36Å; I903-V907 PolarHBondContact O-N 3.37Å; K904-V907 PolarHBondContact O-N 3.09Å; N905-V907 PolarHBondContact O-N 2.95Å; V907-Y910 PolarHBondContact O-N 3.16Å; V907-L911 HydrophobicContact CG1-CD1 4.04Å; V907-L911 HydrophobicContact CG1-CG 4.43Å; V907-L911 WeakPolarHBondContact O-CB 3.35Å; V907-L911 VanDerWaalsContact O-CG 3.29Å; V907-L911 WeakPolarHBondContact O-CG 3.42Å; V907-L911 PolarHBondContact O-N 3.27Å; V907-V933 HydrophobicContact CG1-CG1 4.28Å; V907-V933 HydrophobicContact CG2-CG1 4.38Å; V907-L936 HydrophobicContact CG2-CD2 4.15Å; V907-L936 HydrophobicContact CG2-CG 4.47Å; V907-L940 HydrophobicContact CG2-CD1 4.48Å
908N89Confident84.4Confident24.75 Ų24.7545 Ų4513%0.13226%0.261CS..Hα-helixtrans-61.8-50.6178.1-83.7-38.9000112.4K904 N905 F906 Y910 L911 D912 K957K904-N908 WeakPolarHBondContact O-CB 3.18Å; K904-N908 PolarHBondContact O-N 2.98Å; K904-N908 PolarHBondContact O-ND2 3.22Å; N905-N908 PolarHBondContact O-N 3.33Å; F906-N908 VanDerWaalsContact C-N 3.32Å; F906-N908 PolarHBondContact O-N 3.46Å; N908-Y910 VanDerWaalsContact C-N 3.3Å; N908-Y910 PolarHBondContact O-N 3.2Å; N908-L911 PolarHBondContact O-N 2.9Å; N908-D912 WeakPolarHBondContact O-CB 3.34Å; N908-D912 VanDerWaalsContact O-CG 3.24Å; N908-D912 PolarHBondContact O-N 3.17Å; N908-K957 PolarHBondContact O-NZ 3.27Å; N908-K957 PolarHBondContact OD1-NZ 3.35Å; N908-K957 VanDerWaalsContact OD1-NZ 3.13Å
909D89.7Confident83.6Confident82.25 Ų82.2545.7 Ų45.744%0.4427%0.269SS..Hα-helixtrans-60-42178.8-64.6-22.3000111N905 F906 D912 N913N905-D909 WeakPolarHBondContact O-CB 3.3Å; N905-D909 PolarHBondContact O-N 3.04Å; F906-D909 PolarHBondContact O-N 2.97Å; D909-D912 PolarHBondContact O-N 3.2Å; D909-N913 WeakPolarHBondContact O-CB 3.29Å; D909-N913 PolarHBondContact O-N 3.3Å; D909-N913 PolarHBondContact O-ND2 3.21Å
910Y89.9Confident82.7Confident15 Ų1545.5 Ų45.56%0.05926%0.264CS..Hα-helixtrans-64-46.7177.6179.9-93.6000111.9F906 V907 N908 D912 N913 M914 L929 T930 V933F906-Y910 HydrophobicContact CZ-CD2 4.5Å; F906-Y910 VanDerWaalsContact O-CB 3.27Å; F906-Y910 WeakPolarHBondContact O-CB 3.23Å; F906-Y910 PolarHBondContact O-N 3.06Å; V907-Y910 PolarHBondContact O-N 3.16Å; N908-Y910 VanDerWaalsContact C-N 3.3Å; N908-Y910 PolarHBondContact O-N 3.2Å; Y910-D912 VanDerWaalsContact C-N 3.34Å; Y910-D912 PolarHBondContact O-N 3.27Å; Y910-N913 PolarHBondContact O-N 3.15Å; Y910-M914 HydrophobicContact CD1-CE 4.1Å; Y910-M914 HydrophobicContact CE1-CE 3.54Å; Y910-M914 HydrophobicContact CE1-SD 4.47Å; Y910-M914 VanDerWaalsContact O-CB 3.27Å; Y910-M914 WeakPolarHBondContact O-CB 3.46Å; Y910-M914 PolarHBondContact O-N 3.16Å; Y910-L929 HydrophobicContact CE2-CD2 3.64Å; Y910-L929 HydrophobicContact CE2-CG 4.03Å; Y910-L929 WeakPolarHBondContact OH-CD2 3.36Å; Y910-L929 WeakPolarHBondContact OH-CG 3.38Å; Y910-T930 HydrophobicContact CE1-CG2 4.38Å; Y910-T930 PolarHBondContact OH-N 2.86Å; Y910-T930 PolarHBondContact OH-OG1 3.1Å; Y910-V933 HydrophobicContact CD1-CB 4.17Å; Y910-V933 HydrophobicContact CD1-CG1 3.75Å; Y910-V933 HydrophobicContact CD1-CG2 4.07Å; Y910-V933 HydrophobicContact CE1-CB 4.17Å; Y910-V933 HydrophobicContact CE1-CG1 4.24Å; Y910-V933 HydrophobicContact CE1-CG2 4.05Å; Y910-V933 HydrophobicContact CG-CG1 4.44Å; Y910-V933 HydrophobicContact CG-CG2 4.45Å
911L87.5Confident81.8Confident2.5 Ų2.546.8 Ų46.81%0.01327%0.271CS..Hα-helixtrans-63.7-40.1177.3-69.3178.2000111.1V907 N908 M914 L915 I934 L954 K957 L958V907-L911 HydrophobicContact CG1-CD1 4.04Å; V907-L911 HydrophobicContact CG1-CG 4.43Å; V907-L911 WeakPolarHBondContact O-CB 3.35Å; V907-L911 VanDerWaalsContact O-CG 3.29Å; V907-L911 WeakPolarHBondContact O-CG 3.42Å; V907-L911 PolarHBondContact O-N 3.27Å; N908-L911 PolarHBondContact O-N 2.9Å; L911-M914 HydrophobicContact CD2-CE 3.7Å; L911-M914 HydrophobicContact CD2-SD 4.46Å; L911-M914 WeakPolarHBondContact O-CB 3.32Å; L911-M914 PolarHBondContact O-N 3.18Å; L911-L915 WeakPolarHBondContact O-CB 3.47Å; L911-L915 WeakPolarHBondContact O-CG 3.44Å; L911-L915 PolarHBondContact O-N 3.14Å; L911-I934 HydrophobicContact CD2-CD1 4.04Å; L911-L954 HydrophobicContact CD1-CD1 3.62Å; L911-K957 HydrophobicContact CB-CD 4.25Å; L911-K957 HydrophobicContact CD1-CB 4.45Å; L911-K957 HydrophobicContact CD1-CD 4.43Å; L911-L958 HydrophobicContact CD1-CD2 4.5Å
912D87.3Confident80.9Confident69.75 Ų69.7547.3 Ų47.337%0.37328%0.284SS..Hα-helixtrans-65.9-44.6178.6-69.5-25.3000111.8N908 D909 Y910 M914 L915 S916 K957N908-D912 WeakPolarHBondContact O-CB 3.34Å; N908-D912 VanDerWaalsContact O-CG 3.24Å; N908-D912 PolarHBondContact O-N 3.17Å; D909-D912 PolarHBondContact O-N 3.2Å; Y910-D912 VanDerWaalsContact C-N 3.34Å; Y910-D912 PolarHBondContact O-N 3.27Å; D912-M914 VanDerWaalsContact C-N 3.26Å; D912-M914 PolarHBondContact O-N 3.32Å; D912-L915 PolarHBondContact O-N 3.28Å; D912-S916 VanDerWaalsContact O-CB 3.31Å; D912-S916 WeakPolarHBondContact O-CB 3.25Å; D912-S916 PolarHBondContact O-N 3.04Å; D912-S916 PolarHBondContact O-OG 3.15Å; D912-K957 WeakPolarHBondContact OD1-CE 3.26Å; D912-K957 IonicContact OD1-NZ 3.27Å; D912-K957 PolarHBondContact OD1-NZ 3.21Å; D912-K957 IonicContact OD2-NZ 3.46Å; D912-K957 PolarHBondContact OD2-NZ 3.21Å
913N84.9Confident80.3Confident77.75 Ų77.7549.5 Ų49.542%0.41629%0.294SS..Hα-helixtrans-61.9-36.8173.4-70.3-18000111.6D909 Y910 S916 S917 Y920D909-N913 WeakPolarHBondContact O-CB 3.29Å; D909-N913 PolarHBondContact O-N 3.3Å; D909-N913 PolarHBondContact O-ND2 3.21Å; Y910-N913 PolarHBondContact O-N 3.15Å; N913-S916 WeakPolarHBondContact CA-OG 3.37Å; N913-S916 PolarHBondContact O-OG 3.31Å; N913-S916 VanDerWaalsContact O-OG 3.05Å; N913-S917 VanDerWaalsContact O-CB 3.3Å; N913-S917 WeakPolarHBondContact O-CB 3.36Å; N913-S917 PolarHBondContact O-N 2.93Å; N913-S917 VanDerWaalsContact O-N 3.13Å; N913-S917 PolarHBondContact O-OG 3.26Å; N913-Y920 WeakPolarHBondContact O-CE2 3.12Å
914M83.1Confident79.7Confident6.5 Ų6.552.2 Ų52.23%0.03231%0.311CS..Hα-helixtrans-68.4-45.9178.4-173.6-140.2-71.400112.3Y910 L911 D912 S916 S917 G918 Y920 L921 T930 M961Y910-M914 HydrophobicContact CD1-CE 4.1Å; Y910-M914 HydrophobicContact CE1-CE 3.54Å; Y910-M914 HydrophobicContact CE1-SD 4.47Å; Y910-M914 VanDerWaalsContact O-CB 3.27Å; Y910-M914 WeakPolarHBondContact O-CB 3.46Å; Y910-M914 PolarHBondContact O-N 3.16Å; L911-M914 HydrophobicContact CD2-CE 3.7Å; L911-M914 HydrophobicContact CD2-SD 4.46Å; L911-M914 WeakPolarHBondContact O-CB 3.32Å; L911-M914 PolarHBondContact O-N 3.18Å; D912-M914 VanDerWaalsContact C-N 3.26Å; D912-M914 PolarHBondContact O-N 3.32Å; M914-S916 VanDerWaalsContact C-N 3.33Å; M914-S916 PolarHBondContact O-N 3.21Å; M914-S917 PolarHBondContact O-OG 3.15Å; M914-S917 VanDerWaalsContact O-OG 3.1Å; M914-G918 PolarHBondContact O-N 3.09Å; M914-Y920 HydrophobicContact CB-CD2 4.21Å; M914-Y920 HydrophobicContact CB-CE2 4.47Å; M914-Y920 HydrophobicContact CG-CD2 4.11Å; M914-Y920 HydrophobicContact CG-CG 4.39Å; M914-L921 HydrophobicContact CE-CD1 3.44Å; M914-L921 VanDerWaalsContact CE-CD1 3.44Å; M914-L921 HydrophobicContact CE-CD2 3.59Å; M914-L921 HydrophobicContact CE-CG 3.57Å; M914-L921 HydrophobicContact SD-CD1 4.15Å; M914-L921 HydrophobicContact SD-CD2 4.35Å; M914-L921 HydrophobicContact SD-CG 4.42Å; M914-T930 HydrophobicContact CE-CG2 3.59Å; M914-T930 HydrophobicContact SD-CG2 3.92Å; M914-T930 VanDerWaalsContact SD-CG2 3.54Å; M914-M961 HydrophobicContact CE-CG 3.87Å; M914-M961 HydrophobicContact SD-CG 4.43Å
915L80.8Confident79.3Confident38.75 Ų38.7552.3 Ų52.320%0.20332%0.317CS..Hα-helixtrans-68.9-32.7179.9-67.8179.3000112.2L911 D912 K957 F960 M961L911-L915 WeakPolarHBondContact O-CB 3.47Å; L911-L915 WeakPolarHBondContact O-CG 3.44Å; L911-L915 PolarHBondContact O-N 3.14Å; D912-L915 PolarHBondContact O-N 3.28Å; L915-K957 HydrophobicContact CD1-CB 4.04Å; L915-K957 HydrophobicContact CD1-CG 4.16Å; L915-F960 HydrophobicContact CB-CD1 4.44Å; L915-F960 HydrophobicContact CB-CE1 4.43Å; L915-F960 HydrophobicContact CD1-CD1 3.97Å; L915-F960 HydrophobicContact CD2-CD1 3.56Å; L915-F960 HydrophobicContact CD2-CE1 4.08Å; L915-F960 HydrophobicContact CG-CD1 4.17Å; L915-M961 HydrophobicContact CD2-CB 4.08Å
916S80.9Confident79Confident95.5 Ų95.550.8 Ų50.867%0.66831%0.305SS*.Hα-helixtrans-75.3-39178.761.90000113.5D912 N913 M914D912-S916 VanDerWaalsContact O-CB 3.31Å; D912-S916 WeakPolarHBondContact O-CB 3.25Å; D912-S916 PolarHBondContact O-N 3.04Å; D912-S916 PolarHBondContact O-OG 3.15Å; N913-S916 WeakPolarHBondContact CA-OG 3.37Å; N913-S916 PolarHBondContact O-OG 3.31Å; N913-S916 VanDerWaalsContact O-OG 3.05Å; M914-S916 VanDerWaalsContact C-N 3.33Å; M914-S916 PolarHBondContact O-N 3.21Å
917S70.9Confident78.6Confident47 Ų4751 Ų5133%0.32931%0.307SS..Hα-helixtrans-78.9-22.9-177.164.40000113.5N913 M914 C919 Y920N913-S917 VanDerWaalsContact O-CB 3.3Å; N913-S917 WeakPolarHBondContact O-CB 3.36Å; N913-S917 PolarHBondContact O-N 2.93Å; N913-S917 VanDerWaalsContact O-N 3.13Å; N913-S917 PolarHBondContact O-OG 3.26Å; M914-S917 PolarHBondContact O-OG 3.15Å; M914-S917 VanDerWaalsContact O-OG 3.1Å; S917-C919 PolarHBondContact O-N 3.3Å; S917-C919 PolarHBondContact O-SG 3.15Å; S917-Y920 WeakPolarHBondContact OG-CD2 3.4Å; S917-Y920 WeakPolarHBondContact OG-CE2 3.34Å
918G62.1Low78.4Confident59 Ų5953 Ų5361%0.60832%0.318SS*.  trans64.4-14.317600000116.5M914M914-G918 PolarHBondContact O-N 3.09Å
919C57.8Low78.4Confident93.25 Ų93.2551.8 Ų51.863%0.6331%0.311SS*.  trans-109.3-12.1-165.5-66.80000115.4S917 L921 S922S917-C919 PolarHBondContact O-N 3.3Å; S917-C919 PolarHBondContact O-SG 3.15Å; C919-L921 PolarHBondContact O-N 3.34Å; C919-L921 VanDerWaalsContact O-N 3.14Å; C919-S922 PolarHBondContact O-N 3Å; C919-S922 VanDerWaalsContact O-N 3.13Å; C919-S922 PolarHBondContact O-OG 2.9Å
920Y62.1Low78.4Confident57.25 Ų57.2547.9 Ų47.923%0.22529%0.29CS..G310 helixtrans-60.5-30.8-174.7-71.7-64.8000113.7N913 M914 S917 S922 E923 Y926N913-Y920 WeakPolarHBondContact O-CE2 3.12Å; M914-Y920 HydrophobicContact CB-CD2 4.21Å; M914-Y920 HydrophobicContact CB-CE2 4.47Å; M914-Y920 HydrophobicContact CG-CD2 4.11Å; M914-Y920 HydrophobicContact CG-CG 4.39Å; S917-Y920 WeakPolarHBondContact OG-CD2 3.4Å; S917-Y920 WeakPolarHBondContact OG-CE2 3.34Å; Y920-S922 PolarHBondContact O-N 3.24Å; Y920-S922 VanDerWaalsContact O-N 3.12Å; Y920-E923 PolarHBondContact O-N 3.28Å; Y920-Y926 AromaticContact CD1-CD1 3.36Å; Y920-Y926 HydrophobicContact CD1-CD1 3.36Å; Y920-Y926 VanDerWaalsContact CD1-CD1 3.47Å; Y920-Y926 AromaticContact CD1-CD2 3.97Å; Y920-Y926 HydrophobicContact CD1-CD2 3.99Å; Y920-Y926 AromaticContact CD1-CE1 3.33Å; Y920-Y926 HydrophobicContact CD1-CE1 3.33Å; Y920-Y926 AromaticContact CD1-CE2 3.85Å; Y920-Y926 HydrophobicContact CD1-CE2 3.96Å; Y920-Y926 AromaticContact CD1-CG 3.7Å; Y920-Y926 HydrophobicContact CD1-CG 3.7Å; Y920-Y926 AromaticContact CD1-CZ 3.63Å; Y920-Y926 AromaticContact CE1-CD1 3.81Å; Y920-Y926 HydrophobicContact CE1-CD1 3.97Å; Y920-Y926 AromaticContact CE1-CE1 3.45Å; Y920-Y926 HydrophobicContact CE1-CE1 3.45Å; Y920-Y926 HydrophobicContact CE1-CE2 4.34Å; Y920-Y926 HydrophobicContact CE1-CG 4.48Å; Y920-Y926 AromaticContact CE1-CZ 3.64Å; Y920-Y926 HydrophobicContact CG-CD1 4.09Å; Y920-Y926 HydrophobicContact CG-CE1 4.34Å; Y920-Y926 HydrophobicContact CG-CG 4.35Å; Y920-Y926 WeakPolarHBondContact O-CB 3.26Å
921L64.1Low78.3Confident39.5 Ų39.547.7 Ų47.721%0.20729%0.29CS..G310 helixtrans-76.5-0.5-175-60.8171.3000114M914 C919 I927 T930 L965 L999M914-L921 HydrophobicContact CE-CD1 3.44Å; M914-L921 VanDerWaalsContact CE-CD1 3.44Å; M914-L921 HydrophobicContact CE-CD2 3.59Å; M914-L921 HydrophobicContact CE-CG 3.57Å; M914-L921 HydrophobicContact SD-CD1 4.15Å; M914-L921 HydrophobicContact SD-CD2 4.35Å; M914-L921 HydrophobicContact SD-CG 4.42Å; C919-L921 PolarHBondContact O-N 3.34Å; C919-L921 VanDerWaalsContact O-N 3.14Å; L921-I927 WeakPolarHBondContact O-CD1 3.29Å; L921-T930 HydrophobicContact CD2-CG2 4.29Å; L921-L965 HydrophobicContact CB-CD2 4.4Å; L921-L965 HydrophobicContact CD1-CD2 3.59Å; L921-L965 VanDerWaalsContact CD1-CD2 3.48Å; L921-L965 HydrophobicContact CD1-CG 3.9Å; L921-L965 HydrophobicContact CD2-CD2 4.12Å; L921-L965 HydrophobicContact CG-CD2 4.28Å; L921-L999 HydrophobicContact CD2-CD2 4.42Å
922S68.3Low78.5Confident103.5 Ų103.548.6 Ų48.672%0.72429%0.294SS*.G310 helixtrans-81.4-24.2172.5-58.70000112.7C919 Y920C919-S922 PolarHBondContact O-N 3Å; C919-S922 VanDerWaalsContact O-N 3.13Å; C919-S922 PolarHBondContact O-OG 2.9Å; Y920-S922 PolarHBondContact O-N 3.24Å; Y920-S922 VanDerWaalsContact O-N 3.12Å
923E75.9Confident78.7Confident117.25 Ų117.2545.3 Ų45.355%0.54828%0.277SS..SBendtrans-101.3129-175-77.4-104.1163.500111.4Y920 G925 Y926 I927Y920-E923 PolarHBondContact O-N 3.28Å; E923-G925 VanDerWaalsContact C-N 3.25Å; E923-G925 PolarHBondContact O-N 3.18Å; E923-G925 VanDerWaalsContact O-N 3.15Å; E923-Y926 HydrophobicContact CB-CD2 3.87Å; E923-Y926 PolarHBondContact O-N 3Å; E923-Y926 VanDerWaalsContact O-N 3.1Å; E923-I927 WeakPolarHBondContact O-CG1 3.36Å; E923-I927 PolarHBondContact O-N 3.08Å; E923-I927 VanDerWaalsContact O-N 3.1Å
924P77.5Confident79Confident56.5 Ų56.541.6 Ų41.637%0.36726%0.257SS..Hα-helixtrans-62.7-30.3-17525.4-34.7000113.3Y926 I927 N928 N992P924-Y926 VanDerWaalsContact C-N 3.34Å; P924-Y926 PolarHBondContact O-N 3.47Å; P924-I927 PolarHBondContact O-N 2.93Å; P924-N928 VanDerWaalsContact O-CG 3.27Å; P924-N928 PolarHBondContact O-N 3.19Å; P924-N928 VanDerWaalsContact O-N 3.11Å; P924-N928 PolarHBondContact O-ND2 3Å; P924-N928 PolarHBondContact O-OD1 2.97Å; P924-N992 WeakPolarHBondContact CB-OD1 3.43Å
925G79.8Confident79.5Confident19.75 Ų19.7542.6 Ų42.620%0.20426%0.262CS..Hα-helixtrans-63.3-40.3176.200000112.6P839 E923 N928 L929P839-G925 VanDerWaalsContact CB-C 3.47Å; P839-G925 VanDerWaalsContact CB-O 3.3Å; P839-G925 WeakPolarHBondContact CB-O 3.29Å; E923-G925 VanDerWaalsContact C-N 3.25Å; E923-G925 PolarHBondContact O-N 3.18Å; E923-G925 VanDerWaalsContact O-N 3.15Å; G925-N928 PolarHBondContact O-N 3.31Å; G925-L929 PolarHBondContact O-N 3Å; G925-L929 VanDerWaalsContact O-N 3.13Å
926Y84.3Confident80Confident53.75 Ų53.7540.8 Ų40.821%0.21125%0.253CS..Hα-helixtrans-78.5-31.1178.5-78-76.7000112.5P839 Y920 E923 P924 N928 L929 T930P839-Y926 HydrophobicContact CB-CD1 4.28Å; P839-Y926 HydrophobicContact CB-CE1 4.43Å; P839-Y926 HydrophobicContact CB-CG 4.34Å; P839-Y926 HydrophobicContact CG-CD1 4.1Å; P839-Y926 HydrophobicContact CG-CD2 3.92Å; P839-Y926 HydrophobicContact CG-CE1 3.88Å; P839-Y926 HydrophobicContact CG-CE2 3.71Å; P839-Y926 HydrophobicContact CG-CG 4.12Å; Y920-Y926 AromaticContact CD1-CD1 3.36Å; Y920-Y926 HydrophobicContact CD1-CD1 3.36Å; Y920-Y926 VanDerWaalsContact CD1-CD1 3.47Å; Y920-Y926 AromaticContact CD1-CD2 3.97Å; Y920-Y926 HydrophobicContact CD1-CD2 3.99Å; Y920-Y926 AromaticContact CD1-CE1 3.33Å; Y920-Y926 HydrophobicContact CD1-CE1 3.33Å; Y920-Y926 AromaticContact CD1-CE2 3.85Å; Y920-Y926 HydrophobicContact CD1-CE2 3.96Å; Y920-Y926 AromaticContact CD1-CG 3.7Å; Y920-Y926 HydrophobicContact CD1-CG 3.7Å; Y920-Y926 AromaticContact CD1-CZ 3.63Å; Y920-Y926 AromaticContact CE1-CD1 3.81Å; Y920-Y926 HydrophobicContact CE1-CD1 3.97Å; Y920-Y926 AromaticContact CE1-CE1 3.45Å; Y920-Y926 HydrophobicContact CE1-CE1 3.45Å; Y920-Y926 HydrophobicContact CE1-CE2 4.34Å; Y920-Y926 HydrophobicContact CE1-CG 4.48Å; Y920-Y926 AromaticContact CE1-CZ 3.64Å; Y920-Y926 HydrophobicContact CG-CD1 4.09Å; Y920-Y926 HydrophobicContact CG-CE1 4.34Å; Y920-Y926 HydrophobicContact CG-CG 4.35Å; Y920-Y926 WeakPolarHBondContact O-CB 3.26Å; E923-Y926 HydrophobicContact CB-CD2 3.87Å; E923-Y926 PolarHBondContact O-N 3Å; E923-Y926 VanDerWaalsContact O-N 3.1Å; P924-Y926 VanDerWaalsContact C-N 3.34Å; P924-Y926 PolarHBondContact O-N 3.47Å; Y926-N928 VanDerWaalsContact C-N 3.3Å; Y926-N928 PolarHBondContact O-N 3.16Å; Y926-L929 HydrophobicContact CD1-CD2 4.39Å; Y926-L929 PolarHBondContact O-N 3.21Å; Y926-T930 VanDerWaalsContact O-CB 3.26Å; Y926-T930 WeakPolarHBondContact O-CB 3.37Å; Y926-T930 PolarHBondContact O-N 2.89Å; Y926-T930 PolarHBondContact O-OG1 2.99Å
927I84.3Confident80.6Confident11.25 Ų11.2536.3 Ų36.36%0.05822%0.221CC..Hα-helixtrans-58.4-45.7169.3-62.5171.4000109.9L921 E923 P924 L929 T930 N931 K995L921-I927 WeakPolarHBondContact O-CD1 3.29Å; E923-I927 WeakPolarHBondContact O-CG1 3.36Å; E923-I927 PolarHBondContact O-N 3.08Å; E923-I927 VanDerWaalsContact O-N 3.1Å; P924-I927 PolarHBondContact O-N 2.93Å; I927-L929 PolarHBondContact O-N 3.49Å; I927-T930 PolarHBondContact O-N 3.02Å; I927-N931 WeakPolarHBondContact O-CB 3.42Å; I927-N931 PolarHBondContact O-N 3.25Å; I927-K995 HydrophobicContact CG2-CB 4.43Å
928N86Confident81.6Confident42.25 Ų42.2535.9 Ų35.923%0.22621%0.214CC..Hα-helixtrans-60.8-48.6176.9-65.9-22.9000111.8P924 G925 Y926 T930 N931 E932 K995P924-N928 VanDerWaalsContact O-CG 3.27Å; P924-N928 PolarHBondContact O-N 3.19Å; P924-N928 VanDerWaalsContact O-N 3.11Å; P924-N928 PolarHBondContact O-ND2 3Å; P924-N928 PolarHBondContact O-OD1 2.97Å; G925-N928 PolarHBondContact O-N 3.31Å; Y926-N928 VanDerWaalsContact C-N 3.3Å; Y926-N928 PolarHBondContact O-N 3.16Å; N928-T930 VanDerWaalsContact C-N 3.32Å; N928-T930 PolarHBondContact O-N 3.26Å; N928-N931 PolarHBondContact O-N 3.19Å; N928-E932 WeakPolarHBondContact O-CG 3.29Å; N928-E932 PolarHBondContact O-N 3.29Å; N928-E932 VanDerWaalsContact O-N 3.07Å; N928-K995 VanDerWaalsContact CG-NZ 3.34Å; N928-K995 PolarHBondContact ND2-NZ 2.92Å; N928-K995 VanDerWaalsContact OD1-CD 3.27Å; N928-K995 WeakPolarHBondContact OD1-CD 3.35Å; N928-K995 WeakPolarHBondContact OD1-CE 3.34Å; N928-K995 PolarHBondContact OD1-NZ 3.14Å
929L89.8Confident82.9Confident0.25 Ų0.2534.6 Ų34.60%0.00119%0.193CC..Hα-helixtrans-58.8-45.7177.8179.161.3000111.3P839 R842 A843 Y910 G925 Y926 I927 N931 E932 V933P839-L929 HydrophobicContact CB-CB 4.43Å; P839-L929 HydrophobicContact CB-CD2 4.44Å; R842-L929 HydrophobicContact CB-CD1 3.66Å; R842-L929 HydrophobicContact CB-CD2 4.19Å; A843-L929 HydrophobicContact CB-CB 4.32Å; A843-L929 HydrophobicContact CB-CD1 4.16Å; Y910-L929 HydrophobicContact CE2-CD2 3.64Å; Y910-L929 HydrophobicContact CE2-CG 4.03Å; Y910-L929 WeakPolarHBondContact OH-CD2 3.36Å; Y910-L929 WeakPolarHBondContact OH-CG 3.38Å; G925-L929 PolarHBondContact O-N 3Å; G925-L929 VanDerWaalsContact O-N 3.13Å; Y926-L929 HydrophobicContact CD1-CD2 4.39Å; Y926-L929 PolarHBondContact O-N 3.21Å; I927-L929 PolarHBondContact O-N 3.49Å; L929-N931 VanDerWaalsContact C-N 3.32Å; L929-N931 PolarHBondContact O-N 3.2Å; L929-E932 PolarHBondContact O-N 3.2Å; L929-V933 HydrophobicContact CD1-CG2 4.35Å; L929-V933 HydrophobicContact CG-CG2 4.49Å; L929-V933 VanDerWaalsContact O-CG2 3.31Å; L929-V933 WeakPolarHBondContact O-CG2 3.42Å; L929-V933 PolarHBondContact O-N 3.03Å
930T88.9Confident84.4Confident0 Ų030.2 Ų30.20%016%0.163CC..Hα-helixtrans-62.4-41.5178.5-57.20000111.3Y910 M914 L921 Y926 I927 N928 E932 V933 I934 L999Y910-T930 HydrophobicContact CE1-CG2 4.38Å; Y910-T930 PolarHBondContact OH-N 2.86Å; Y910-T930 PolarHBondContact OH-OG1 3.1Å; M914-T930 HydrophobicContact CE-CG2 3.59Å; M914-T930 HydrophobicContact SD-CG2 3.92Å; M914-T930 VanDerWaalsContact SD-CG2 3.54Å; L921-T930 HydrophobicContact CD2-CG2 4.29Å; Y926-T930 VanDerWaalsContact O-CB 3.26Å; Y926-T930 WeakPolarHBondContact O-CB 3.37Å; Y926-T930 PolarHBondContact O-N 2.89Å; Y926-T930 PolarHBondContact O-OG1 2.99Å; I927-T930 PolarHBondContact O-N 3.02Å; N928-T930 VanDerWaalsContact C-N 3.32Å; N928-T930 PolarHBondContact O-N 3.26Å; T930-E932 PolarHBondContact O-N 3.19Å; T930-V933 PolarHBondContact O-N 3.02Å; T930-I934 HydrophobicContact CG2-CD1 3.94Å; T930-I934 HydrophobicContact CG2-CG1 4.38Å; T930-I934 WeakPolarHBondContact O-CB 3.27Å; T930-I934 WeakPolarHBondContact O-CG1 3.42Å; T930-I934 PolarHBondContact O-N 3.09Å; T930-L999 HydrophobicContact CG2-CD1 4.07Å; T930-L999 HydrophobicContact CG2-CD2 4.22Å
931N89Confident85.6Confident10.75 Ų10.7527.5 Ų27.56%0.05715%0.152CC..Hα-helixtrans-59.7-47.9175.7-164.210.1000111.3I927 N928 L929 V933 I934 I935 D998 L999 K1002I927-N931 WeakPolarHBondContact O-CB 3.42Å; I927-N931 PolarHBondContact O-N 3.25Å; N928-N931 PolarHBondContact O-N 3.19Å; L929-N931 VanDerWaalsContact C-N 3.32Å; L929-N931 PolarHBondContact O-N 3.2Å; N931-V933 VanDerWaalsContact C-N 3.33Å; N931-V933 PolarHBondContact O-N 3.26Å; N931-I934 PolarHBondContact O-N 3.12Å; N931-I934 VanDerWaalsContact O-N 3.16Å; N931-I935 VanDerWaalsContact O-CG1 3.24Å; N931-I935 WeakPolarHBondContact O-CG1 3.29Å; N931-I935 PolarHBondContact O-N 3.19Å; N931-D998 PolarHBondContact ND2-OD2 2.83Å; N931-L999 HydrophobicContact CB-CD1 4.11Å; N931-K1002 PolarHBondContact ND2-NZ 2.98Å; N931-K1002 VanDerWaalsContact OD1-CD 3.28Å; N931-K1002 WeakPolarHBondContact OD1-CD 3.39Å; N931-K1002 PolarHBondContact OD1-NZ 3.21Å; N931-K1002 VanDerWaalsContact OD1-NZ 3.16Å
932E91.3Very high86.7Confident20.75 Ų20.7527.7 Ų27.710%0.09715%0.151CC..Hα-helixtrans-63.4-38.1176.7-61.9-58.7152.800112.7A843 T846 R847 N928 L929 T930 I934 I935 L936A843-E932 HydrophobicContact CB-CB 4.49Å; A843-E932 HydrophobicContact CB-CG 3.94Å; T846-E932 HydrophobicContact CG2-CB 3.96Å; R847-E932 WeakPolarHBondContact CB-OE2 3.41Å; R847-E932 IonicContact CZ-OE1 3.38Å; R847-E932 VanDerWaalsContact CZ-OE1 3.29Å; R847-E932 IonicContact CZ-OE2 2.83Å; R847-E932 VanDerWaalsContact NE-CD 3.34Å; R847-E932 IonicContact NE-OE1 3.21Å; R847-E932 PolarHBondContact NE-OE1 3.17Å; R847-E932 VanDerWaalsContact NE-OE1 3.16Å; R847-E932 IonicContact NE-OE2 3.4Å; R847-E932 PolarHBondContact NE-OE2 3.35Å; R847-E932 VanDerWaalsContact NE-OE2 3.16Å; R847-E932 IonicContact NH2-OE1 2.69Å; R847-E932 PolarHBondContact NH2-OE1 3.18Å; R847-E932 IonicContact NH2-OE2 2.99Å; N928-E932 WeakPolarHBondContact O-CG 3.29Å; N928-E932 PolarHBondContact O-N 3.29Å; N928-E932 VanDerWaalsContact O-N 3.07Å; L929-E932 PolarHBondContact O-N 3.2Å; T930-E932 PolarHBondContact O-N 3.19Å; E932-I934 VanDerWaalsContact C-N 3.34Å; E932-I934 PolarHBondContact O-N 2.86Å; E932-I935 PolarHBondContact O-N 3.23Å; E932-L936 WeakPolarHBondContact O-CB 3.17Å; E932-L936 PolarHBondContact O-N 3.11Å
933V92.2Very high87.5Confident0.25 Ų0.2523.6 Ų23.60%0.00212%0.121CC..Hα-helixtrans-66.2-37.2175.5174.10000111.4T846 F906 V907 Y910 L929 T930 N931 L936 S937T846-V933 HydrophobicContact CG2-CG2 4.1Å; F906-V933 HydrophobicContact CE1-CG2 4.26Å; V907-V933 HydrophobicContact CG1-CG1 4.28Å; V907-V933 HydrophobicContact CG2-CG1 4.38Å; Y910-V933 HydrophobicContact CD1-CB 4.17Å; Y910-V933 HydrophobicContact CD1-CG1 3.75Å; Y910-V933 HydrophobicContact CD1-CG2 4.07Å; Y910-V933 HydrophobicContact CE1-CB 4.17Å; Y910-V933 HydrophobicContact CE1-CG1 4.24Å; Y910-V933 HydrophobicContact CE1-CG2 4.05Å; Y910-V933 HydrophobicContact CG-CG1 4.44Å; Y910-V933 HydrophobicContact CG-CG2 4.45Å; L929-V933 HydrophobicContact CD1-CG2 4.35Å; L929-V933 HydrophobicContact CG-CG2 4.49Å; L929-V933 VanDerWaalsContact O-CG2 3.31Å; L929-V933 WeakPolarHBondContact O-CG2 3.42Å; L929-V933 PolarHBondContact O-N 3.03Å; T930-V933 PolarHBondContact O-N 3.02Å; N931-V933 VanDerWaalsContact C-N 3.33Å; N931-V933 PolarHBondContact O-N 3.26Å; V933-L936 WeakPolarHBondContact O-CB 3.31Å; V933-L936 PolarHBondContact O-N 3.16Å; V933-S937 WeakPolarHBondContact O-CB 3.36Å; V933-S937 PolarHBondContact O-N 3.1Å
934I91Very high87.8Confident0.25 Ų0.2519.8 Ų19.80%0.00111%0.112CC..Hα-helixtrans-68.9-39.5174.4-68.1-65.7000111.2L911 T930 N931 E932 L936 S937 K938 L958 M961 L999 K1002L911-I934 HydrophobicContact CD2-CD1 4.04Å; T930-I934 HydrophobicContact CG2-CD1 3.94Å; T930-I934 HydrophobicContact CG2-CG1 4.38Å; T930-I934 WeakPolarHBondContact O-CB 3.27Å; T930-I934 WeakPolarHBondContact O-CG1 3.42Å; T930-I934 PolarHBondContact O-N 3.09Å; N931-I934 PolarHBondContact O-N 3.12Å; N931-I934 VanDerWaalsContact O-N 3.16Å; E932-I934 VanDerWaalsContact C-N 3.34Å; E932-I934 PolarHBondContact O-N 2.86Å; I934-L936 VanDerWaalsContact C-N 3.31Å; I934-L936 PolarHBondContact O-N 3.2Å; I934-S937 WeakPolarHBondContact CA-OG 3.34Å; I934-S937 PolarHBondContact O-N 3.24Å; I934-S937 PolarHBondContact O-OG 3.29Å; I934-K938 VanDerWaalsContact O-CB 3.32Å; I934-K938 WeakPolarHBondContact O-CB 3.11Å; I934-K938 PolarHBondContact O-N 3.05Å; I934-L958 HydrophobicContact CD1-CD2 3.43Å; I934-L958 VanDerWaalsContact CD1-CD2 3.43Å; I934-L958 HydrophobicContact CG1-CD2 4.39Å; I934-M961 HydrophobicContact CD1-CE 3.64Å; I934-M961 HydrophobicContact CD1-SD 4.29Å; I934-M961 HydrophobicContact CG1-CE 4.09Å; I934-L999 HydrophobicContact CB-CD1 4Å; I934-L999 HydrophobicContact CD1-CD1 3.56Å; I934-L999 HydrophobicContact CD1-CG 4.07Å; I934-L999 HydrophobicContact CG1-CD1 3.64Å; I934-L999 HydrophobicContact CG2-CD1 4.43Å; I934-K1002 HydrophobicContact CG2-CB 4.09Å
935I91.7Very high88Confident28.75 Ų28.7518.3 Ų18.315%0.14710%0.101CC..Hα-helixtrans-60-45.3173-62.4162.9000110.2L850 N931 E932 S937 K938 N939 K1002L850-I935 HydrophobicContact CD2-CG2 3.59Å; N931-I935 VanDerWaalsContact O-CG1 3.24Å; N931-I935 WeakPolarHBondContact O-CG1 3.29Å; N931-I935 PolarHBondContact O-N 3.19Å; E932-I935 PolarHBondContact O-N 3.23Å; I935-S937 PolarHBondContact O-N 3.1Å; I935-K938 PolarHBondContact O-N 3.21Å; I935-N939 PolarHBondContact O-N 3.39Å; I935-N939 PolarHBondContact O-ND2 2.86Å; I935-K1002 HydrophobicContact CD1-CD 4.33Å; I935-K1002 HydrophobicContact CG1-CD 3.66Å
936L93.3Very high88.2Confident0 Ų018.1 Ų18.10%010%0.095CC..Hα-helixtrans-57.7-49.3175.1176.362.6000111M832 T846 L849 L850 V854 I903 V907 E932 V933 I934 K938 N939 L940M832-L936 HydrophobicContact CE-CD2 4.17Å; T846-L936 HydrophobicContact CG2-CB 4.15Å; T846-L936 HydrophobicContact CG2-CD2 3.93Å; L849-L936 HydrophobicContact CD2-CD2 4.24Å; L850-L936 HydrophobicContact CB-CD1 4.14Å; L850-L936 HydrophobicContact CD1-CD1 3.99Å; V854-L936 HydrophobicContact CB-CD1 4.49Å; V854-L936 HydrophobicContact CG1-CD1 4.47Å; V854-L936 HydrophobicContact CG2-CD1 3.93Å; I903-L936 HydrophobicContact CG2-CD1 4.37Å; I903-L936 HydrophobicContact CG2-CD2 4Å; I903-L936 HydrophobicContact CG2-CG 4.42Å; V907-L936 HydrophobicContact CG2-CD2 4.15Å; V907-L936 HydrophobicContact CG2-CG 4.47Å; E932-L936 WeakPolarHBondContact O-CB 3.17Å; E932-L936 PolarHBondContact O-N 3.11Å; V933-L936 WeakPolarHBondContact O-CB 3.31Å; V933-L936 PolarHBondContact O-N 3.16Å; I934-L936 VanDerWaalsContact C-N 3.31Å; I934-L936 PolarHBondContact O-N 3.2Å; L936-K938 VanDerWaalsContact C-N 3.33Å; L936-K938 PolarHBondContact O-N 3.28Å; L936-N939 PolarHBondContact O-N 3.27Å; L936-L940 HydrophobicContact CD1-CD1 4.29Å; L936-L940 HydrophobicContact CD1-CG 4.33Å; L936-L940 HydrophobicContact CG-CD1 4.16Å; L936-L940 VanDerWaalsContact O-CG 3.25Å; L936-L940 WeakPolarHBondContact O-CG 3.4Å; L936-L940 PolarHBondContact O-N 3.1Å
937S92.8Very high88Confident0.25 Ų0.2518.8 Ų18.80%0.00210%0.102CC..Hα-helixtrans-61.7-41.317875.90000112.4V933 I934 I935 N939 L940 V941V933-S937 WeakPolarHBondContact O-CB 3.36Å; V933-S937 PolarHBondContact O-N 3.1Å; I934-S937 WeakPolarHBondContact CA-OG 3.34Å; I934-S937 PolarHBondContact O-N 3.24Å; I934-S937 PolarHBondContact O-OG 3.29Å; I935-S937 PolarHBondContact O-N 3.1Å; S937-N939 PolarHBondContact O-N 3.03Å; S937-L940 PolarHBondContact O-N 3.08Å; S937-V941 WeakPolarHBondContact O-CB 3.42Å; S937-V941 VanDerWaalsContact O-CG2 3.28Å; S937-V941 WeakPolarHBondContact O-CG2 3.36Å; S937-V941 PolarHBondContact O-N 3.14Å
938K92Very high87.8Confident39 Ų3918.7 Ų18.717%0.1710%0.101CC..Hα-helixtrans-59.8-48.1177.8176.4-177.4169.3-178.80111.1I934 I935 L936 V941 F942 D1005 V1006I934-K938 VanDerWaalsContact O-CB 3.32Å; I934-K938 WeakPolarHBondContact O-CB 3.11Å; I934-K938 PolarHBondContact O-N 3.05Å; I935-K938 PolarHBondContact O-N 3.21Å; L936-K938 VanDerWaalsContact C-N 3.33Å; L936-K938 PolarHBondContact O-N 3.28Å; K938-V941 WeakPolarHBondContact O-CB 3.4Å; K938-V941 PolarHBondContact O-N 3.19Å; K938-F942 HydrophobicContact CD-CE2 4.37Å; K938-F942 HydrophobicContact CD-CZ 4.41Å; K938-F942 HydrophobicContact CG-CD1 4.43Å; K938-F942 HydrophobicContact CG-CD2 4.33Å; K938-F942 HydrophobicContact CG-CE1 4.16Å; K938-F942 HydrophobicContact CG-CE2 4.1Å; K938-F942 HydrophobicContact CG-CG 4.5Å; K938-F942 HydrophobicContact CG-CZ 4.03Å; K938-F942 WeakPolarHBondContact O-CB 3.23Å; K938-F942 WeakPolarHBondContact O-CD1 3.2Å; K938-F942 WeakPolarHBondContact O-CG 3.25Å; K938-F942 PolarHBondContact O-N 3.05Å; K938-D1005 HydrophobicContact CD-CB 4.01Å; K938-D1005 WeakPolarHBondContact CE-OD2 3.46Å; K938-D1005 IonicContact NZ-OD1 3.43Å; K938-D1005 IonicContact NZ-OD2 3.3Å; K938-D1005 PolarHBondContact NZ-OD2 3.03Å; K938-V1006 HydrophobicContact CB-CG2 3.59Å; K938-V1006 HydrophobicContact CD-CG2 4.45Å; K938-V1006 HydrophobicContact CG-CG2 3.85Å
939N89.2Confident87.6Confident32.25 Ų32.2523.8 Ų23.817%0.17212%0.122CC..Hα-helixtrans-67.4-40.3179.4-72.6-15.9000111.8L850 I935 L936 S937 V941 F942 F943L850-N939 HydrophobicContact CD1-CB 3.59Å; L850-N939 WeakPolarHBondContact CD1-ND2 3.41Å; L850-N939 VanDerWaalsContact CD2-ND2 3.31Å; L850-N939 WeakPolarHBondContact CD2-ND2 3.3Å; I935-N939 PolarHBondContact O-N 3.39Å; I935-N939 PolarHBondContact O-ND2 2.86Å; L936-N939 PolarHBondContact O-N 3.27Å; S937-N939 PolarHBondContact O-N 3.03Å; N939-V941 VanDerWaalsContact C-N 3.29Å; N939-V941 PolarHBondContact O-N 3.02Å; N939-F942 PolarHBondContact O-N 3.35Å; N939-F943 HydrophobicContact CB-CD2 4.48Å; N939-F943 HydrophobicContact CB-CE2 4.03Å; N939-F943 HydrophobicContact CB-CZ 4.48Å; N939-F943 WeakPolarHBondContact O-CB 3.4Å; N939-F943 WeakPolarHBondContact O-CD2 3.35Å; N939-F943 WeakPolarHBondContact O-CG 3.31Å; N939-F943 PolarHBondContact O-N 3.19Å
940L89.5Confident87.3Confident0 Ų026.7 Ų26.70%014%0.135CC..Hα-helixtrans-60.4-38.8173.6-68.3169.8000112.5V854 F900 I903 K904 V907 L936 S937 L945 Y946V854-L940 HydrophobicContact CG1-CD2 3.55Å; V854-L940 HydrophobicContact CG1-CG 4.21Å; V854-L940 HydrophobicContact CG2-CD2 4.45Å; F900-L940 HydrophobicContact CD1-CD2 4.12Å; F900-L940 HydrophobicContact CE1-CD2 4.43Å; I903-L940 HydrophobicContact CG2-CD1 3.88Å; K904-L940 HydrophobicContact CG-CD1 4.47Å; V907-L940 HydrophobicContact CG2-CD1 4.48Å; L936-L940 HydrophobicContact CD1-CD1 4.29Å; L936-L940 HydrophobicContact CD1-CG 4.33Å; L936-L940 HydrophobicContact CG-CD1 4.16Å; L936-L940 VanDerWaalsContact O-CG 3.25Å; L936-L940 WeakPolarHBondContact O-CG 3.4Å; L936-L940 PolarHBondContact O-N 3.1Å; S937-L940 PolarHBondContact O-N 3.08Å; L940-L945 HydrophobicContact CB-CD1 4.46Å; L940-L945 HydrophobicContact CD2-CD1 3.5Å; L940-L945 VanDerWaalsContact CD2-CD1 3.49Å; L940-L945 WeakPolarHBondContact O-CB 3.33Å; L940-L945 PolarHBondContact O-N 2.95Å; L940-L945 VanDerWaalsContact O-N 3.14Å; L940-Y946 HydrophobicContact CB-CD2 4.07Å; L940-Y946 HydrophobicContact CB-CE2 3.55Å; L940-Y946 HydrophobicContact CD1-CE2 4.18Å; L940-Y946 HydrophobicContact CG-CE2 4.5Å
941V87.8Confident87.2Confident1.25 Ų1.2527.1 Ų27.11%0.00814%0.137CC..Hα-helixtrans-65.3-47173.8169.60000110.5S937 K938 N939 F943 G944 Y946 L951 L954 V1006 Y1009S937-V941 WeakPolarHBondContact O-CB 3.42Å; S937-V941 VanDerWaalsContact O-CG2 3.28Å; S937-V941 WeakPolarHBondContact O-CG2 3.36Å; S937-V941 PolarHBondContact O-N 3.14Å; K938-V941 WeakPolarHBondContact O-CB 3.4Å; K938-V941 PolarHBondContact O-N 3.19Å; N939-V941 VanDerWaalsContact C-N 3.29Å; N939-V941 PolarHBondContact O-N 3.02Å; V941-F943 VanDerWaalsContact C-N 3.26Å; V941-F943 PolarHBondContact O-N 3.15Å; V941-G944 WeakPolarHBondContact O-CA 2.99Å; V941-G944 PolarHBondContact O-N 3.15Å; V941-Y946 HydrophobicContact CB-CD2 4.47Å; V941-Y946 HydrophobicContact CG2-CD2 3.78Å; V941-Y946 HydrophobicContact CG2-CE2 4.09Å; V941-Y946 HydrophobicContact CG2-CG 4.24Å; V941-L951 HydrophobicContact CB-CD1 4.3Å; V941-L951 HydrophobicContact CB-CD2 4.24Å; V941-L951 HydrophobicContact CG1-CD1 3.59Å; V941-L951 HydrophobicContact CG1-CD2 3.71Å; V941-L951 HydrophobicContact CG2-CD1 3.68Å; V941-L951 HydrophobicContact CG2-CD2 3.72Å; V941-L954 HydrophobicContact CG2-CD2 3.58Å; V941-V1006 HydrophobicContact CG1-CG1 4.37Å; V941-V1006 HydrophobicContact CG2-CG1 4.13Å; V941-Y1009 HydrophobicContact CG1-CD1 3.23Å; V941-Y1009 HydrophobicContact CG1-CE1 3.51Å; V941-Y1009 VanDerWaalsContact CG1-CE1 3.44Å; V941-Y1009 HydrophobicContact CG1-CG 3.88Å; V941-Y1009 WeakPolarHBondContact O-CE1 3.4Å; V941-Y1009 PolarHBondContact O-OH 3.26Å
942F87.2Confident86.8Confident42.75 Ų42.7527.5 Ų27.519%0.18814%0.139CC..Hα-helixtrans-67.6-26.2-178.2-75.911.9000112.8L861 H862 K938 N939 G944 D1005 Y1009L861-F942 HydrophobicContact CD2-CB 3.85Å; L861-F942 HydrophobicContact CD2-CD2 4.27Å; H862-F942 WeakPolarHBondContact CB-O 3.23Å; H862-F942 PolarHBondContact N-O 2.99Å; K938-F942 HydrophobicContact CD-CE2 4.37Å; K938-F942 HydrophobicContact CD-CZ 4.41Å; K938-F942 HydrophobicContact CG-CD1 4.43Å; K938-F942 HydrophobicContact CG-CD2 4.33Å; K938-F942 HydrophobicContact CG-CE1 4.16Å; K938-F942 HydrophobicContact CG-CE2 4.1Å; K938-F942 HydrophobicContact CG-CG 4.5Å; K938-F942 HydrophobicContact CG-CZ 4.03Å; K938-F942 WeakPolarHBondContact O-CB 3.23Å; K938-F942 WeakPolarHBondContact O-CD1 3.2Å; K938-F942 WeakPolarHBondContact O-CG 3.25Å; K938-F942 PolarHBondContact O-N 3.05Å; N939-F942 PolarHBondContact O-N 3.35Å; F942-G944 VanDerWaalsContact C-N 3.26Å; F942-G944 PolarHBondContact O-N 3Å; F942-D1005 HydrophobicContact CZ-CB 4.16Å; F942-Y1009 AromaticContact CD1-CD2 3.57Å; F942-Y1009 HydrophobicContact CD1-CD2 3.57Å; F942-Y1009 HydrophobicContact CD1-CE2 4.07Å; F942-Y1009 AromaticContact CD1-CG 3.91Å; F942-Y1009 HydrophobicContact CD1-CG 3.91Å; F942-Y1009 AromaticContact CE1-CD2 3.72Å; F942-Y1009 HydrophobicContact CE1-CD2 3.72Å; F942-Y1009 AromaticContact CE1-CG 3.87Å; F942-Y1009 HydrophobicContact CE1-CG 3.87Å; F942-Y1009 HydrophobicContact CG-CD2 4.43Å
943F85Confident86.6Confident19 Ų1930.3 Ų30.38%0.08316%0.155CC..THydrogen-bonded Turntrans-80.94.4170.8-59.9-35.6000113.7V854 D855 Q859 E860 L861 N939 V941 L945V854-F943 HydrophobicContact CG1-CD2 4.01Å; V854-F943 HydrophobicContact CG1-CE2 3.99Å; V854-F943 WeakPolarHBondContact O-CE2 3.33Å; D855-F943 HydrophobicContact CB-CE2 4.21Å; D855-F943 HydrophobicContact CB-CZ 4.07Å; D855-F943 WeakPolarHBondContact OD1-CZ 3.35Å; Q859-F943 HydrophobicContact CB-CB 4.26Å; Q859-F943 HydrophobicContact CB-CD1 4.16Å; Q859-F943 HydrophobicContact CB-CD2 3.92Å; Q859-F943 HydrophobicContact CB-CE1 4.46Å; Q859-F943 HydrophobicContact CB-CE2 4.28Å; Q859-F943 HydrophobicContact CB-CG 3.87Å; Q859-F943 HydrophobicContact CG-CB 4.43Å; Q859-F943 HydrophobicContact CG-CD2 4.24Å; Q859-F943 HydrophobicContact CG-CG 4.39Å; E860-F943 WeakPolarHBondContact O-CA 3.36Å; E860-F943 WeakPolarHBondContact O-CD1 3.36Å; L861-F943 HydrophobicContact CD2-CD1 4.28Å; L861-F943 HydrophobicContact CD2-CE1 3.98Å; L861-F943 HydrophobicContact CG-CE1 4.48Å; N939-F943 HydrophobicContact CB-CD2 4.48Å; N939-F943 HydrophobicContact CB-CE2 4.03Å; N939-F943 HydrophobicContact CB-CZ 4.48Å; N939-F943 WeakPolarHBondContact O-CB 3.4Å; N939-F943 WeakPolarHBondContact O-CD2 3.35Å; N939-F943 WeakPolarHBondContact O-CG 3.31Å; N939-F943 PolarHBondContact O-N 3.19Å; V941-F943 VanDerWaalsContact C-N 3.26Å; V941-F943 PolarHBondContact O-N 3.15Å; F943-L945 VanDerWaalsContact C-N 3.33Å; F943-L945 HydrophobicContact CB-CD1 4.27Å; F943-L945 HydrophobicContact CB-CG 4.18Å; F943-L945 PolarHBondContact O-N 2.94Å
944G80.6Confident86.3Confident35.75 Ų35.7530.3 Ų30.337%0.36916%0.155SC..THydrogen-bonded Turntrans69.221.3176.300000114.1V941 F942 Y946V941-G944 WeakPolarHBondContact O-CA 2.99Å; V941-G944 PolarHBondContact O-N 3.15Å; F942-G944 VanDerWaalsContact C-N 3.26Å; F942-G944 PolarHBondContact O-N 3Å; G944-Y946 VanDerWaalsContact C-N 3.34Å
945L82.7Confident86.1Confident25.25 Ų25.2530.3 Ų30.313%0.13215%0.154CC..  trans-77.8-21.5-176.2-64.8170.5000112.6F900 K904 L940 F943F900-L945 HydrophobicContact CD1-CD1 3.82Å; F900-L945 HydrophobicContact CD2-CD1 4.39Å; F900-L945 HydrophobicContact CD2-CD2 4.19Å; F900-L945 HydrophobicContact CE1-CD1 4.02Å; F900-L945 HydrophobicContact CE2-CD1 4.5Å; F900-L945 HydrophobicContact CE2-CD2 4.44Å; F900-L945 HydrophobicContact CG-CD1 4.05Å; F900-L945 HydrophobicContact CG-CD2 4.41Å; F900-L945 HydrophobicContact CZ-CD1 4.4Å; K904-L945 VanDerWaalsContact CE-O 3.23Å; K904-L945 WeakPolarHBondContact CE-O 3.32Å; K904-L945 PolarHBondContact NZ-O 3.19Å; L940-L945 HydrophobicContact CB-CD1 4.46Å; L940-L945 HydrophobicContact CD2-CD1 3.5Å; L940-L945 VanDerWaalsContact CD2-CD1 3.49Å; L940-L945 WeakPolarHBondContact O-CB 3.33Å; L940-L945 PolarHBondContact O-N 2.95Å; L940-L945 VanDerWaalsContact O-N 3.14Å; F943-L945 VanDerWaalsContact C-N 3.33Å; F943-L945 HydrophobicContact CB-CD1 4.27Å; F943-L945 HydrophobicContact CB-CG 4.18Å; F943-L945 PolarHBondContact O-N 2.94Å
946Y82.8Confident85.8Confident16 Ų1632.4 Ų32.46%0.06316%0.164CC..SBendtrans-86.4134.2179.7-80.4-102.1000111.9K904 L940 V941 G944 E950 L951 L954K904-Y946 HydrophobicContact CD-CE1 4.47Å; K904-Y946 HydrophobicContact CG-CE1 4.34Å; K904-Y946 HydrophobicContact CG-CE2 4.16Å; L940-Y946 HydrophobicContact CB-CD2 4.07Å; L940-Y946 HydrophobicContact CB-CE2 3.55Å; L940-Y946 HydrophobicContact CD1-CE2 4.18Å; L940-Y946 HydrophobicContact CG-CE2 4.5Å; V941-Y946 HydrophobicContact CB-CD2 4.47Å; V941-Y946 HydrophobicContact CG2-CD2 3.78Å; V941-Y946 HydrophobicContact CG2-CE2 4.09Å; V941-Y946 HydrophobicContact CG2-CG 4.24Å; G944-Y946 VanDerWaalsContact C-N 3.34Å; Y946-E950 HydrophobicContact CD1-CB 3.65Å; Y946-E950 HydrophobicContact CE1-CB 4.38Å; Y946-E950 HydrophobicContact CG-CB 4.47Å; Y946-L951 VanDerWaalsContact CB-CD2 3.48Å; Y946-L951 HydrophobicContact CG-CD2 4.11Å; Y946-L954 HydrophobicContact CD1-CD2 4.4Å; Y946-L954 HydrophobicContact CE1-CB 4.46Å; Y946-L954 HydrophobicContact CE1-CD2 4Å; Y946-L954 HydrophobicContact CE2-CD2 4.41Å
947N80.5Confident85.5Confident67.75 Ų67.7533.3 Ų33.336%0.36217%0.168SC..  trans-75.1164.5169.21.228.1000110.5E884 K949 E950 L951E884-N947 WeakPolarHBondContact OE1-CB 3.36Å; E884-N947 PolarHBondContact OE1-ND2 2.56Å; E884-N947 PolarHBondContact OE2-ND2 3.21Å; N947-K949 VanDerWaalsContact C-N 3.29Å; N947-K949 PolarHBondContact O-N 3.02Å; N947-K949 PolarHBondContact OD1-N 2.9Å; N947-K949 VanDerWaalsContact OD1-N 3.15Å; N947-E950 HydrophobicContact CB-CG 4.13Å; N947-E950 VanDerWaalsContact CG-CD 3.41Å; N947-E950 PolarHBondContact N-OE2 3.15Å; N947-E950 VanDerWaalsContact N-OE2 3.14Å; N947-E950 PolarHBondContact ND2-OE1 3.09Å; N947-E950 PolarHBondContact ND2-OE2 3.47Å; N947-E950 CarbonylContact O-C 3.51Å; N947-E950 PolarHBondContact O-N 3.05Å; N947-E950 VanDerWaalsContact O-N 3.08Å; N947-E950 VanDerWaalsContact OD1-CB 3.27Å; N947-E950 WeakPolarHBondContact OD1-CB 3.45Å; N947-E950 WeakPolarHBondContact OD1-CG 3.24Å; N947-E950 PolarHBondContact OD1-N 3.22Å; N947-E950 PolarHBondContact OD1-OE2 3.06Å; N947-L951 VanDerWaalsContact O-CB 3.27Å; N947-L951 WeakPolarHBondContact O-CB 3.46Å; N947-L951 WeakPolarHBondContact O-CG 3.36Å; N947-L951 PolarHBondContact O-N 3.03Å
948I79.8Confident85.2Confident10 Ų1033.3 Ų33.35%0.05117%0.168CC..Hα-helixtrans-57.6-44.1-176.2-74.7170.6000111.4V880 Y883 E884 E950 L951 L952 V1013 Y1017 L1091V880-I948 HydrophobicContact CG1-CB 3.97Å; V880-I948 HydrophobicContact CG1-CD1 3.93Å; V880-I948 HydrophobicContact CG1-CG1 4.45Å; V880-I948 HydrophobicContact CG1-CG2 4.28Å; Y883-I948 HydrophobicContact CD1-CD1 3.21Å; Y883-I948 HydrophobicContact CD1-CG1 4.29Å; Y883-I948 HydrophobicContact CE1-CD1 3.31Å; Y883-I948 HydrophobicContact CE1-CG1 4.07Å; Y883-I948 HydrophobicContact CG-CD1 4.11Å; E884-I948 PolarHBondContact OE1-N 3.15Å; E884-I948 VanDerWaalsContact OE1-N 3.13Å; I948-E950 VanDerWaalsContact C-N 3.31Å; I948-E950 PolarHBondContact O-N 3.2Å; I948-L951 PolarHBondContact O-N 3.23Å; I948-L952 HydrophobicContact CG2-CD1 3.7Å; I948-L952 HydrophobicContact CG2-CG 4.34Å; I948-L952 VanDerWaalsContact O-CD1 3.27Å; I948-L952 WeakPolarHBondContact O-CD1 3.32Å; I948-L952 VanDerWaalsContact O-CG 3.23Å; I948-L952 WeakPolarHBondContact O-CG 3.45Å; I948-L952 PolarHBondContact O-N 2.94Å; I948-V1013 HydrophobicContact CG1-CG1 4.3Å; I948-Y1017 HydrophobicContact CD1-CD2 3.96Å; I948-Y1017 HydrophobicContact CD1-CE2 4.43Å; I948-Y1017 HydrophobicContact CD1-CG 4.42Å; I948-L1091 HydrophobicContact CG2-CD2 3.69Å; I948-L1091 HydrophobicContact CG2-CG 4.49Å
949K81.6Confident84.8Confident150.5 Ų150.531.5 Ų31.565%0.65416%0.16SC*.Hα-helixtrans-62.7-42.5-178.9-66.2-175.4178.5-1760111.9N947 L952 L953N947-K949 VanDerWaalsContact C-N 3.29Å; N947-K949 PolarHBondContact O-N 3.02Å; N947-K949 PolarHBondContact OD1-N 2.9Å; N947-K949 VanDerWaalsContact OD1-N 3.15Å; K949-L952 PolarHBondContact O-N 2.94Å; K949-L953 WeakPolarHBondContact O-CB 3.33Å; K949-L953 PolarHBondContact O-N 3.21Å; K949-L953 VanDerWaalsContact O-N 3.13Å
950E85.2Confident84.5Confident60.25 Ų60.2533.8 Ų33.828%0.28217%0.168SC..Hα-helixtrans-68.5-40.2177.4-61.7170.2167.500111.1K904 Y946 N947 I948 L952 L953 L954K904-E950 VanDerWaalsContact CE-OE2 3.32Å; K904-E950 WeakPolarHBondContact CE-OE2 3.31Å; K904-E950 IonicContact NZ-OE1 2.89Å; K904-E950 PolarHBondContact NZ-OE1 3.24Å; K904-E950 IonicContact NZ-OE2 3.03Å; K904-E950 PolarHBondContact NZ-OE2 3.2Å; Y946-E950 HydrophobicContact CD1-CB 3.65Å; Y946-E950 HydrophobicContact CE1-CB 4.38Å; Y946-E950 HydrophobicContact CG-CB 4.47Å; N947-E950 HydrophobicContact CB-CG 4.13Å; N947-E950 VanDerWaalsContact CG-CD 3.41Å; N947-E950 PolarHBondContact N-OE2 3.15Å; N947-E950 VanDerWaalsContact N-OE2 3.14Å; N947-E950 PolarHBondContact ND2-OE1 3.09Å; N947-E950 PolarHBondContact ND2-OE2 3.47Å; N947-E950 CarbonylContact O-C 3.51Å; N947-E950 PolarHBondContact O-N 3.05Å; N947-E950 VanDerWaalsContact O-N 3.08Å; N947-E950 VanDerWaalsContact OD1-CB 3.27Å; N947-E950 WeakPolarHBondContact OD1-CB 3.45Å; N947-E950 WeakPolarHBondContact OD1-CG 3.24Å; N947-E950 PolarHBondContact OD1-N 3.22Å; N947-E950 PolarHBondContact OD1-OE2 3.06Å; I948-E950 VanDerWaalsContact C-N 3.31Å; I948-E950 PolarHBondContact O-N 3.2Å; E950-L952 VanDerWaalsContact C-N 3.34Å; E950-L952 PolarHBondContact O-N 3.06Å; E950-L953 PolarHBondContact O-N 3.18Å; E950-L954 VanDerWaalsContact O-CB 3.31Å; E950-L954 WeakPolarHBondContact O-CB 3.29Å; E950-L954 PolarHBondContact O-N 3.18Å
951L84.8Confident84.2Confident8.25 Ų8.2533.8 Ų33.84%0.04317%0.169CC..Hα-helixtrans-62-40.7177.1-127.8118.9000111.8V941 Y946 N947 I948 L954 G955 Y1009 I1010 V1013V941-L951 HydrophobicContact CB-CD1 4.3Å; V941-L951 HydrophobicContact CB-CD2 4.24Å; V941-L951 HydrophobicContact CG1-CD1 3.59Å; V941-L951 HydrophobicContact CG1-CD2 3.71Å; V941-L951 HydrophobicContact CG2-CD1 3.68Å; V941-L951 HydrophobicContact CG2-CD2 3.72Å; Y946-L951 VanDerWaalsContact CB-CD2 3.48Å; Y946-L951 HydrophobicContact CG-CD2 4.11Å; N947-L951 VanDerWaalsContact O-CB 3.27Å; N947-L951 WeakPolarHBondContact O-CB 3.46Å; N947-L951 WeakPolarHBondContact O-CG 3.36Å; N947-L951 PolarHBondContact O-N 3.03Å; I948-L951 PolarHBondContact O-N 3.23Å; L951-L954 PolarHBondContact O-N 2.96Å; L951-G955 PolarHBondContact O-N 3.2Å; L951-Y1009 HydrophobicContact CD2-CD1 4.44Å; L951-Y1009 HydrophobicContact CD2-CE1 4.38Å; L951-I1010 HydrophobicContact CB-CG1 4.49Å; L951-I1010 HydrophobicContact CD1-CD1 4.15Å; L951-I1010 HydrophobicContact CD1-CG1 3.74Å; L951-I1010 HydrophobicContact CD2-CG1 4.25Å; L951-I1010 HydrophobicContact CG-CD1 4.27Å; L951-I1010 HydrophobicContact CG-CG1 3.74Å; L951-I1010 WeakPolarHBondContact O-CD1 3.48Å; L951-V1013 HydrophobicContact CD1-CB 4.49Å; L951-V1013 HydrophobicContact CD1-CG1 4.16Å; L951-V1013 HydrophobicContact CD1-CG2 4.29Å; L951-V1013 HydrophobicContact CD2-CB 4.24Å; L951-V1013 HydrophobicContact CD2-CG1 4.18Å; L951-V1013 HydrophobicContact CD2-CG2 4.07Å
952L82.1Confident83.9Confident19.75 Ų19.7533.9 Ų33.910%0.10317%0.169CC..Hα-helixtrans-69.5-42.9176.8-68.4161.3000111.8I948 K949 E950 L954 G955 Q956 I1090 L1091I948-L952 HydrophobicContact CG2-CD1 3.7Å; I948-L952 HydrophobicContact CG2-CG 4.34Å; I948-L952 VanDerWaalsContact O-CD1 3.27Å; I948-L952 WeakPolarHBondContact O-CD1 3.32Å; I948-L952 VanDerWaalsContact O-CG 3.23Å; I948-L952 WeakPolarHBondContact O-CG 3.45Å; I948-L952 PolarHBondContact O-N 2.94Å; K949-L952 PolarHBondContact O-N 2.94Å; E950-L952 VanDerWaalsContact C-N 3.34Å; E950-L952 PolarHBondContact O-N 3.06Å; L952-L954 VanDerWaalsContact C-N 3.29Å; L952-L954 PolarHBondContact O-N 3.09Å; L952-G955 WeakPolarHBondContact O-CA 3.3Å; L952-G955 PolarHBondContact O-N 3.22Å; L952-G955 VanDerWaalsContact O-N 3.14Å; L952-Q956 VanDerWaalsContact O-CG 3.3Å; L952-Q956 WeakPolarHBondContact O-CG 3.46Å; L952-Q956 PolarHBondContact O-N 3.27Å; L952-I1090 HydrophobicContact CD1-CG2 4.48Å; L952-I1090 WeakPolarHBondContact CD1-O 3.42Å; L952-L1091 HydrophobicContact CD1-CD2 4.14Å; L952-L1091 HydrophobicContact CD1-CG 4.36Å; L952-L1091 HydrophobicContact CD2-CB 4.49Å; L952-L1091 HydrophobicContact CD2-CD2 4.19Å; L952-L1091 HydrophobicContact CG-CD2 4.29Å
953L86.1Confident83.4Confident79.25 Ų79.2534 Ų3442%0.41517%0.172SC..Hα-helixtrans-60.1-42.9174.9-175.369000110.7K949 E950 Q956 K957K949-L953 WeakPolarHBondContact O-CB 3.33Å; K949-L953 PolarHBondContact O-N 3.21Å; K949-L953 VanDerWaalsContact O-N 3.13Å; E950-L953 PolarHBondContact O-N 3.18Å; L953-Q956 PolarHBondContact O-N 3Å; L953-K957 WeakPolarHBondContact O-CG 3.33Å; L953-K957 PolarHBondContact O-N 3.17Å; L953-K957 VanDerWaalsContact O-N 3.12Å
954L87.1Confident82.9Confident0 Ų037.1 Ų37.10%019%0.186CC..Hα-helixtrans-61.5-47.7173.2-179.163.6000110.8L911 V941 Y946 E950 L951 L952 Q956 K957 L958 V1006L911-L954 HydrophobicContact CD1-CD1 3.62Å; V941-L954 HydrophobicContact CG2-CD2 3.58Å; Y946-L954 HydrophobicContact CD1-CD2 4.4Å; Y946-L954 HydrophobicContact CE1-CB 4.46Å; Y946-L954 HydrophobicContact CE1-CD2 4Å; Y946-L954 HydrophobicContact CE2-CD2 4.41Å; E950-L954 VanDerWaalsContact O-CB 3.31Å; E950-L954 WeakPolarHBondContact O-CB 3.29Å; E950-L954 PolarHBondContact O-N 3.18Å; L951-L954 PolarHBondContact O-N 2.96Å; L952-L954 VanDerWaalsContact C-N 3.29Å; L952-L954 PolarHBondContact O-N 3.09Å; L954-Q956 VanDerWaalsContact C-N 3.33Å; L954-Q956 PolarHBondContact O-N 3.04Å; L954-K957 PolarHBondContact O-N 3.02Å; L954-K957 VanDerWaalsContact O-N 3.16Å; L954-L958 HydrophobicContact CD1-CD1 4.35Å; L954-L958 HydrophobicContact CD1-CD2 4.46Å; L954-L958 HydrophobicContact CD1-CG 4.2Å; L954-L958 HydrophobicContact CG-CD1 4.04Å; L954-L958 HydrophobicContact CG-CG 4.28Å; L954-L958 WeakPolarHBondContact O-CB 3.33Å; L954-L958 VanDerWaalsContact O-CG 3.27Å; L954-L958 WeakPolarHBondContact O-CG 3.35Å; L954-L958 PolarHBondContact O-N 2.98Å; L954-V1006 HydrophobicContact CD2-CG1 4.45Å
955G86Confident82.3Confident0 Ų035.8 Ų35.80%017%0.171CC..Hα-helixtrans-52.9-47.8175.800000112.7L951 L952 K957 L958 V959 V1093L951-G955 PolarHBondContact O-N 3.2Å; L952-G955 WeakPolarHBondContact O-CA 3.3Å; L952-G955 PolarHBondContact O-N 3.22Å; L952-G955 VanDerWaalsContact O-N 3.14Å; G955-K957 PolarHBondContact O-N 3.16Å; G955-L958 WeakPolarHBondContact O-CB 3.18Å; G955-L958 PolarHBondContact O-N 3.02Å; G955-L958 VanDerWaalsContact O-N 3.12Å; G955-V959 WeakPolarHBondContact O-CB 3.11Å; G955-V959 VanDerWaalsContact O-CG2 3.29Å; G955-V959 WeakPolarHBondContact O-CG2 3.36Å; G955-V959 PolarHBondContact O-N 3.22Å; G955-V1093 CarbonylContact C-O 3.53Å
956Q86.4Confident81.1Confident73.5 Ų73.535.2 Ų35.234%0.34317%0.171SC..Hα-helixtrans-60.1-46.5177.3-70.7172.35.600112L952 L953 L954 L958 V959 F960 V1093L952-Q956 VanDerWaalsContact O-CG 3.3Å; L952-Q956 WeakPolarHBondContact O-CG 3.46Å; L952-Q956 PolarHBondContact O-N 3.27Å; L953-Q956 PolarHBondContact O-N 3Å; L954-Q956 VanDerWaalsContact C-N 3.33Å; L954-Q956 PolarHBondContact O-N 3.04Å; Q956-L958 VanDerWaalsContact C-N 3.33Å; Q956-L958 PolarHBondContact O-N 3.13Å; Q956-V959 PolarHBondContact O-N 3.18Å; Q956-F960 WeakPolarHBondContact O-CB 3.35Å; Q956-F960 PolarHBondContact O-N 3.06Å; Q956-V1093 WeakPolarHBondContact CG-O 3.2Å; Q956-V1093 PolarHBondContact N-O 3.32Å; Q956-V1093 VanDerWaalsContact N-O 3.17Å
957K87Confident79.5Confident19 Ų1937.3 Ų37.38%0.08319%0.188CC..Hα-helixtrans-60.8-42.3176.4-69.2176.9-178.4-164.50111.7N908 L911 D912 L915 L953 L954 G955 F960 M961N908-K957 PolarHBondContact O-NZ 3.27Å; N908-K957 PolarHBondContact OD1-NZ 3.35Å; N908-K957 VanDerWaalsContact OD1-NZ 3.13Å; L911-K957 HydrophobicContact CB-CD 4.25Å; L911-K957 HydrophobicContact CD1-CB 4.45Å; L911-K957 HydrophobicContact CD1-CD 4.43Å; D912-K957 WeakPolarHBondContact OD1-CE 3.26Å; D912-K957 IonicContact OD1-NZ 3.27Å; D912-K957 PolarHBondContact OD1-NZ 3.21Å; D912-K957 IonicContact OD2-NZ 3.46Å; D912-K957 PolarHBondContact OD2-NZ 3.21Å; L915-K957 HydrophobicContact CD1-CB 4.04Å; L915-K957 HydrophobicContact CD1-CG 4.16Å; L953-K957 WeakPolarHBondContact O-CG 3.33Å; L953-K957 PolarHBondContact O-N 3.17Å; L953-K957 VanDerWaalsContact O-N 3.12Å; L954-K957 PolarHBondContact O-N 3.02Å; L954-K957 VanDerWaalsContact O-N 3.16Å; G955-K957 PolarHBondContact O-N 3.16Å; K957-F960 PolarHBondContact O-N 3.12Å; K957-M961 WeakPolarHBondContact O-CB 3.17Å; K957-M961 PolarHBondContact O-N 3.33Å
958L86.6Confident77.7Confident0 Ų038.6 Ų38.60%020%0.199CC..Hα-helixtrans-67.8-43.5179.2-70-176.9000112.7L911 I934 L954 G955 Q956 F960 M961 L962 T1003 V1006L911-L958 HydrophobicContact CD1-CD2 4.5Å; I934-L958 HydrophobicContact CD1-CD2 3.43Å; I934-L958 VanDerWaalsContact CD1-CD2 3.43Å; I934-L958 HydrophobicContact CG1-CD2 4.39Å; L954-L958 HydrophobicContact CD1-CD1 4.35Å; L954-L958 HydrophobicContact CD1-CD2 4.46Å; L954-L958 HydrophobicContact CD1-CG 4.2Å; L954-L958 HydrophobicContact CG-CD1 4.04Å; L954-L958 HydrophobicContact CG-CG 4.28Å; L954-L958 WeakPolarHBondContact O-CB 3.33Å; L954-L958 VanDerWaalsContact O-CG 3.27Å; L954-L958 WeakPolarHBondContact O-CG 3.35Å; L954-L958 PolarHBondContact O-N 2.98Å; G955-L958 WeakPolarHBondContact O-CB 3.18Å; G955-L958 PolarHBondContact O-N 3.02Å; G955-L958 VanDerWaalsContact O-N 3.12Å; Q956-L958 VanDerWaalsContact C-N 3.33Å; Q956-L958 PolarHBondContact O-N 3.13Å; L958-F960 VanDerWaalsContact C-N 3.34Å; L958-F960 PolarHBondContact O-N 2.91Å; L958-M961 HydrophobicContact CD2-CE 3.56Å; L958-M961 WeakPolarHBondContact O-CB 3.39Å; L958-M961 PolarHBondContact O-N 3.15Å; L958-L962 WeakPolarHBondContact O-CG 3.37Å; L958-L962 PolarHBondContact O-N 3.06Å; L958-T1003 HydrophobicContact CB-CG2 3.71Å; L958-T1003 HydrophobicContact CD1-CG2 4.26Å; L958-T1003 HydrophobicContact CD2-CG2 4.07Å; L958-T1003 HydrophobicContact CG-CG2 4.21Å; L958-V1006 HydrophobicContact CD1-CB 3.84Å; L958-V1006 HydrophobicContact CD1-CG1 3.59Å; L958-V1006 HydrophobicContact CD1-CG2 4.35Å
959V83.8Confident75.8Confident1.25 Ų1.2542.5 Ų42.51%0.00822%0.22CC..Hα-helixtrans-64.6-41.2175.81800000110.5G955 Q956 M961 L962 N963 I1007 V1093 D1094 L1100 L1101 V1104G955-V959 WeakPolarHBondContact O-CB 3.11Å; G955-V959 VanDerWaalsContact O-CG2 3.29Å; G955-V959 WeakPolarHBondContact O-CG2 3.36Å; G955-V959 PolarHBondContact O-N 3.22Å; Q956-V959 PolarHBondContact O-N 3.18Å; V959-M961 VanDerWaalsContact C-N 3.34Å; V959-M961 PolarHBondContact O-N 2.97Å; V959-L962 PolarHBondContact O-N 3.24Å; V959-N963 PolarHBondContact O-N 3.17Å; V959-I1007 HydrophobicContact CG2-CD1 3.95Å; V959-I1007 HydrophobicContact CG2-CG1 4.43Å; V959-V1093 HydrophobicContact CG2-CG1 4.41Å; V959-D1094 HydrophobicContact CG1-CB 4.18Å; V959-D1094 HydrophobicContact CG2-CB 4.39Å; V959-L1100 HydrophobicContact CB-CD2 4.16Å; V959-L1100 HydrophobicContact CG1-CB 4.37Å; V959-L1100 HydrophobicContact CG1-CD2 3.34Å; V959-L1100 VanDerWaalsContact CG1-CD2 3.46Å; V959-L1100 HydrophobicContact CG1-CG 4.18Å; V959-L1101 HydrophobicContact CG1-CB 4.45Å; V959-L1101 HydrophobicContact CG1-CD1 4.29Å; V959-L1101 HydrophobicContact CG2-CD1 4.07Å; V959-V1104 HydrophobicContact CG1-CB 4.49Å; V959-V1104 HydrophobicContact CG1-CG2 4.3Å
960F82.2Confident73.8Confident79.5 Ų79.540.6 Ų40.635%0.34922%0.216SC..Hα-helixtrans-64.1-39.6175.7-172.4-101000112.1L915 Q956 K957 L958 N963 Q964L915-F960 HydrophobicContact CB-CD1 4.44Å; L915-F960 HydrophobicContact CB-CE1 4.43Å; L915-F960 HydrophobicContact CD1-CD1 3.97Å; L915-F960 HydrophobicContact CD2-CD1 3.56Å; L915-F960 HydrophobicContact CD2-CE1 4.08Å; L915-F960 HydrophobicContact CG-CD1 4.17Å; Q956-F960 WeakPolarHBondContact O-CB 3.35Å; Q956-F960 PolarHBondContact O-N 3.06Å; K957-F960 PolarHBondContact O-N 3.12Å; L958-F960 VanDerWaalsContact C-N 3.34Å; L958-F960 PolarHBondContact O-N 2.91Å; F960-N963 WeakPolarHBondContact O-CB 3.38Å; F960-N963 PolarHBondContact O-N 3.07Å; F960-Q964 HydrophobicContact CD1-CG 4.33Å; F960-Q964 HydrophobicContact CE1-CG 3.99Å; F960-Q964 HydrophobicContact CZ-CG 4.34Å; F960-Q964 VanDerWaalsContact CZ-NE2 3.32Å; F960-Q964 WeakPolarHBondContact O-CG 3.44Å; F960-Q964 PolarHBondContact O-N 2.96Å
961M82.8Confident71.6Confident1.5 Ų1.545.9 Ų45.91%0.00724%0.239CC..Hα-helixtrans-60.7-45172.7177-107.2-64.100112.1M914 L915 I934 K957 L958 V959 N963 Q964 L965 L999 T1003M914-M961 HydrophobicContact CE-CG 3.87Å; M914-M961 HydrophobicContact SD-CG 4.43Å; L915-M961 HydrophobicContact CD2-CB 4.08Å; I934-M961 HydrophobicContact CD1-CE 3.64Å; I934-M961 HydrophobicContact CD1-SD 4.29Å; I934-M961 HydrophobicContact CG1-CE 4.09Å; K957-M961 WeakPolarHBondContact O-CB 3.17Å; K957-M961 PolarHBondContact O-N 3.33Å; L958-M961 HydrophobicContact CD2-CE 3.56Å; L958-M961 WeakPolarHBondContact O-CB 3.39Å; L958-M961 PolarHBondContact O-N 3.15Å; V959-M961 VanDerWaalsContact C-N 3.34Å; V959-M961 PolarHBondContact O-N 2.97Å; M961-N963 VanDerWaalsContact C-N 3.28Å; M961-N963 PolarHBondContact O-N 3.01Å; M961-Q964 PolarHBondContact O-N 3.34Å; M961-L965 HydrophobicContact CG-CD1 4.19Å; M961-L965 WeakPolarHBondContact O-CB 3.32Å; M961-L965 WeakPolarHBondContact O-CG 3.41Å; M961-L965 PolarHBondContact O-N 3.23Å; M961-L965 HydrophobicContact SD-CD1 3.5Å; M961-L965 VanDerWaalsContact SD-CD1 3.55Å; M961-L965 WeakPolarHBondContact SD-CD1 3.32Å; M961-L965 HydrophobicContact SD-CG 4.44Å; M961-L999 HydrophobicContact SD-CD2 4.44Å; M961-T1003 HydrophobicContact CE-CG2 3.95Å; M961-T1003 WeakPolarHBondContact CE-OG1 3.28Å
962L80.6Confident69.1Low3 Ų352 Ų522%0.01627%0.271CS..Hα-helixtrans-61.5-36.2174.4-72.3176.3000112.5L958 V959 L965 G966 K1000 T1003 L1004 I1007 V1104 L1108L958-L962 WeakPolarHBondContact O-CG 3.37Å; L958-L962 PolarHBondContact O-N 3.06Å; V959-L962 PolarHBondContact O-N 3.24Å; L962-L965 HydrophobicContact CD2-CD1 4.43Å; L962-L965 PolarHBondContact O-N 3.24Å; L962-G966 PolarHBondContact O-N 3.08Å; L962-G966 VanDerWaalsContact O-N 3.09Å; L962-K1000 HydrophobicContact CD2-CB 4.17Å; L962-K1000 HydrophobicContact CD2-CG 3.85Å; L962-T1003 HydrophobicContact CD1-CG2 3.76Å; L962-T1003 HydrophobicContact CD2-CG2 4.12Å; L962-T1003 HydrophobicContact CG-CG2 3.78Å; L962-L1004 HydrophobicContact CD1-CD2 4Å; L962-I1007 HydrophobicContact CD1-CD1 3.78Å; L962-V1104 HydrophobicContact CB-CG1 3.63Å; L962-V1104 HydrophobicContact CD1-CG1 4.26Å; L962-L1108 HydrophobicContact CD1-CD1 4.45Å
963N78.2Confident66.8Low45 Ų4553.8 Ų53.824%0.24129%0.286CS..Hα-helixtrans-64.2-45.8175.7-171.333.7000111.6V959 F960 M961 L965 G966 S967 V1104 R1107V959-N963 PolarHBondContact O-N 3.17Å; F960-N963 WeakPolarHBondContact O-CB 3.38Å; F960-N963 PolarHBondContact O-N 3.07Å; M961-N963 VanDerWaalsContact C-N 3.28Å; M961-N963 PolarHBondContact O-N 3.01Å; N963-L965 VanDerWaalsContact C-N 3.34Å; N963-L965 PolarHBondContact O-N 3.34Å; N963-G966 PolarHBondContact O-N 3.22Å; N963-G966 VanDerWaalsContact O-N 3.12Å; N963-S967 PolarHBondContact O-N 3.17Å; N963-S967 PolarHBondContact O-OG 3.11Å; N963-V1104 HydrophobicContact CB-CG2 3.8Å; N963-R1107 PolarHBondContact OD1-NH1 3.34Å
964Q73.5Confident64.2Low83.5 Ų83.555 Ų5539%0.3929%0.293SS..Hα-helixtrans-63.3-40.2177-66.5-67.213.800112.3F960 M961 G966 S967F960-Q964 HydrophobicContact CD1-CG 4.33Å; F960-Q964 HydrophobicContact CE1-CG 3.99Å; F960-Q964 HydrophobicContact CZ-CG 4.34Å; F960-Q964 VanDerWaalsContact CZ-NE2 3.32Å; F960-Q964 WeakPolarHBondContact O-CG 3.44Å; F960-Q964 PolarHBondContact O-N 2.96Å; M961-Q964 PolarHBondContact O-N 3.34Å; Q964-G966 PolarHBondContact O-N 3.05Å; Q964-S967 WeakPolarHBondContact O-CB 3.29Å; Q964-S967 PolarHBondContact O-N 3.17Å; Q964-S967 PolarHBondContact O-OG 3.3Å
965L67.9Low61.8Low7.5 Ų7.561.2 Ų61.24%0.03933%0.325CS..Hα-helixtrans-64.3-20.4173.8-77.2171.9000113.9L921 M961 L962 N963 T968 L996 L999 K1000L921-L965 HydrophobicContact CB-CD2 4.4Å; L921-L965 HydrophobicContact CD1-CD2 3.59Å; L921-L965 VanDerWaalsContact CD1-CD2 3.48Å; L921-L965 HydrophobicContact CD1-CG 3.9Å; L921-L965 HydrophobicContact CD2-CD2 4.12Å; L921-L965 HydrophobicContact CG-CD2 4.28Å; M961-L965 HydrophobicContact CG-CD1 4.19Å; M961-L965 WeakPolarHBondContact O-CB 3.32Å; M961-L965 WeakPolarHBondContact O-CG 3.41Å; M961-L965 PolarHBondContact O-N 3.23Å; M961-L965 HydrophobicContact SD-CD1 3.5Å; M961-L965 VanDerWaalsContact SD-CD1 3.55Å; M961-L965 WeakPolarHBondContact SD-CD1 3.32Å; M961-L965 HydrophobicContact SD-CG 4.44Å; L962-L965 HydrophobicContact CD2-CD1 4.43Å; L962-L965 PolarHBondContact O-N 3.24Å; N963-L965 VanDerWaalsContact C-N 3.34Å; N963-L965 PolarHBondContact O-N 3.34Å; L965-T968 PolarHBondContact O-OG1 3.34Å; L965-L996 HydrophobicContact CD1-CD1 4.48Å; L965-L996 HydrophobicContact CD2-CD1 3.5Å; L965-L996 VanDerWaalsContact CD2-CD1 3.47Å; L965-L996 HydrophobicContact CD2-CG 4.37Å; L965-L999 HydrophobicContact CD1-CD2 4.03Å; L965-K1000 HydrophobicContact CD1-CG 4.39Å
966G58.5Low59.4Low13.75 Ų13.7571.1 Ų71.114%0.14236%0.363CS..Hα-helixtrans-81.2-29.6175.100000112.9L962 N963 Q964 T968 N969 R1107L962-G966 PolarHBondContact O-N 3.08Å; L962-G966 VanDerWaalsContact O-N 3.09Å; N963-G966 PolarHBondContact O-N 3.22Å; N963-G966 VanDerWaalsContact O-N 3.12Å; Q964-G966 PolarHBondContact O-N 3.05Å; G966-T968 VanDerWaalsContact C-N 3.3Å; G966-T968 PolarHBondContact O-N 3.05Å; G966-T968 VanDerWaalsContact O-N 3.09Å; G966-N969 PolarHBondContact O-N 3.1Å; G966-N969 VanDerWaalsContact O-N 3.15Å; G966-R1107 PolarHBondContact O-NH1 3.21Å; G966-R1107 PolarHBondContact O-NH2 3.36Å
967S49.3Very low56.8Low60.25 Ų60.2575 Ų7542%0.42138%0.379SS..Hα-helixtrans-71-21.6-173.5-39.40000114N963 Q964 N969 D970N963-S967 PolarHBondContact O-N 3.17Å; N963-S967 PolarHBondContact O-OG 3.11Å; Q964-S967 WeakPolarHBondContact O-CB 3.29Å; Q964-S967 PolarHBondContact O-N 3.17Å; Q964-S967 PolarHBondContact O-OG 3.3Å; S967-N969 VanDerWaalsContact C-N 3.28Å; S967-N969 PolarHBondContact O-N 3.29Å; S967-D970 PolarHBondContact O-N 2.95Å
968T41.8Very low54Low95 Ų9581.5 Ų81.558%0.58341%0.412SS*.THydrogen-bonded Turntrans-76.2317857.70000113L965 G966 D970L965-T968 PolarHBondContact O-OG1 3.34Å; G966-T968 VanDerWaalsContact C-N 3.3Å; G966-T968 PolarHBondContact O-N 3.05Å; G966-T968 VanDerWaalsContact O-N 3.09Å; T968-D970 VanDerWaalsContact C-N 3.26Å; T968-D970 PolarHBondContact O-N 3.09Å
969N41Very low51.6Low92.5 Ų92.591.1 Ų91.150%0.49545%0.454SS..G310 helixtrans-89.828.5169.6-73.25.1000116G966 S967 F971 R1107G966-N969 PolarHBondContact O-N 3.1Å; G966-N969 VanDerWaalsContact O-N 3.15Å; S967-N969 VanDerWaalsContact C-N 3.28Å; S967-N969 PolarHBondContact O-N 3.29Å; N969-F971 PolarHBondContact O-N 3.11Å; N969-R1107 PolarHBondContact O-NH2 3.37Å; N969-R1107 VanDerWaalsContact O-NH2 3.09Å
970D39Very low49.1Very low109.75 Ų109.7599.4 Ų99.459%0.58749%0.492SS*.  trans-65.648.6164-76.3-16.4000114.4S967 T968 N972 S973S967-D970 PolarHBondContact O-N 2.95Å; T968-D970 VanDerWaalsContact C-N 3.26Å; T968-D970 PolarHBondContact O-N 3.09Å; D970-N972 PolarHBondContact O-N 3.04Å; D970-S973 PolarHBondContact O-N 3.08Å
971F38.8Very low46.6Very low172.5 Ų172.5103.8 Ų103.876%0.75752%0.516SS*.THydrogen-bonded Turntrans-84.6-27.8174.4-84.9-86.8000115.5N969 I1110N969-F971 PolarHBondContact O-N 3.11Å; F971-I1110 HydrophobicContact CE2-CG2 4.48Å
972N32.9Very low44.1Very low135.25 Ų135.25110.3 Ų110.372%0.72355%0.55SS**Hα-helixtrans-82.9-29.2-177.5-85.7-8.4000115.2D970 N974D970-N972 PolarHBondContact O-N 3.04Å; N972-N974 VanDerWaalsContact C-N 3.35Å
973S32.9Very low41.8Very low58.5 Ų58.5116.3 Ų116.341%0.40959%0.588SS.*Hα-helixtrans-81-22.8-176.1-161.30000113.4D970 I975 Y976 K977D970-S973 PolarHBondContact O-N 3.08Å; S973-I975 PolarHBondContact O-N 2.93Å; S973-Y976 PolarHBondContact O-N 2.85Å; S973-K977 PolarHBondContact O-N 3Å
974N32.5Very low39.4Very low104.75 Ų104.75119.2 Ų119.256%0.5661%0.612SS**Hα-helixtrans-76.6-26.6-176.2-73.9-17.9000113.3N972 Y976 K977 M978N972-N974 VanDerWaalsContact C-N 3.35Å; N974-Y976 VanDerWaalsContact C-N 3.33Å; N974-Y976 PolarHBondContact O-N 2.99Å; N974-K977 PolarHBondContact O-N 3.35Å; N974-M978 WeakPolarHBondContact O-CB 3.31Å; N974-M978 PolarHBondContact O-N 3.12Å; N974-M978 VanDerWaalsContact O-N 3.1Å
975I35.3Very low37.4Very low129.25 Ų129.25118.7 Ų118.766%0.66362%0.617SS**Hα-helixtrans-69.7-33.7178.8-63.6179.1000111.7S973S973-I975 PolarHBondContact O-N 2.93Å
976Y36.1Very low35.7Very low207.25 Ų207.25123.8 Ų123.881%0.81365%0.649SS**Hα-helixtrans-86-17.5-178-72.7-72.9000114.6S973 N974S973-Y976 PolarHBondContact O-N 2.85Å; N974-Y976 VanDerWaalsContact C-N 3.33Å; N974-Y976 PolarHBondContact O-N 2.99Å
977K31.6Very low34.3Very low156 Ų156129.6 Ų129.668%0.67868%0.676SS**Hα-helixtrans-101-15.3179-73.8-174.4177.9178.30115S973 N974 K979 E980S973-K977 PolarHBondContact O-N 3Å; N974-K977 PolarHBondContact O-N 3.35Å; K977-K979 PolarHBondContact O-N 3.24Å; K977-K979 VanDerWaalsContact O-N 3.11Å; K977-E980 PolarHBondContact O-N 3.27Å; K977-E980 VanDerWaalsContact O-N 3.13Å; K977-E980 VanDerWaalsContact O-O 3.13Å
978M28.4Very low33.4Very low155.5 Ų155.5132.8 Ų132.877%0.76669%0.687SS**THydrogen-bonded Turntrans-68-9.7-177.2-125.7-166.2-178.100115.1N974 E980N974-M978 WeakPolarHBondContact O-CB 3.31Å; N974-M978 PolarHBondContact O-N 3.12Å; N974-M978 VanDerWaalsContact O-N 3.1Å; M978-E980 VanDerWaalsContact C-N 3.29Å
979K35.7Very low33.2Very low202.5 Ų202.5131.3 Ų131.388%0.8868%0.678SS**THydrogen-bonded Turntrans-86-9.4176.1-84.6-172.4175.4-179.80115K977K977-K979 PolarHBondContact O-N 3.24Å; K977-K979 VanDerWaalsContact O-N 3.11Å
980E32.5Very low33.4Very low173.75 Ų173.75129.5 Ų129.581%0.81267%0.673SS**SBendtrans-127.6103178.4-72.1-173.5166.600112.5K977 M978K977-E980 PolarHBondContact O-N 3.27Å; K977-E980 VanDerWaalsContact O-N 3.13Å; K977-E980 VanDerWaalsContact O-O 3.13Å; M978-E980 VanDerWaalsContact C-N 3.29Å
981M30.2Very low34.1Very low173.75 Ų173.75127 Ų12786%0.85666%0.664SS**  trans100.570.9174.8-63.4-165.1166.600116.9T983M981-T983 PolarHBondContact O-N 3.13Å
982N29.2Very low35.1Very low136 Ų136121.1 Ų121.173%0.72764%0.64SS**  trans-69.9129148.7-73.9-32.7000109.7
983T31.9Very low36.7Very low131 Ų131117.7 Ų117.780%0.80462%0.622SS**SBendtrans12651.1150.663.50000116.5M981M981-T983 PolarHBondContact O-N 3.13Å
984S29.2Very low38.8Very low105.5 Ų105.5119.8 Ų119.874%0.73863%0.629SS**SBendtrans173.9-11167-46.80000117.7
985S29.8Very low40.9Very low72 Ų72118.7 Ų118.750%0.50362%0.619SS.*SBendtrans-89.7-16.1-171.843.50000115.9L987 L988 T989S985-L987 PolarHBondContact O-N 3.06Å; S985-L988 PolarHBondContact O-N 3.02Å; S985-T989 VanDerWaalsContact O-CG2 3.27Å; S985-T989 WeakPolarHBondContact O-CG2 3.27Å; S985-T989 PolarHBondContact O-N 3.18Å; S985-T989 VanDerWaalsContact O-N 3.15Å; S985-T989 PolarHBondContact O-OG1 3Å
986T33.2Very low43.1Very low115 Ų115113.7 Ų113.771%0.70659%0.593SS**Hα-helixtrans-71.4-22.2-175.6450000114.9T989T986-T989 WeakPolarHBondContact CA-OG1 3.38Å; T986-T989 PolarHBondContact O-OG1 3.28Å; T986-T989 VanDerWaalsContact O-OG1 3.07Å
987L29.2Very low45.3Very low135 Ų135105.4 Ų105.471%0.70756%0.562SS**Hα-helixtrans-82.7-31.2-179.7-126.1137.9000112.6S985 T989 S990S985-L987 PolarHBondContact O-N 3.06Å; L987-T989 PolarHBondContact O-N 2.93Å; L987-S990 PolarHBondContact O-N 3.37Å; L987-S990 PolarHBondContact O-OG 3.01Å
988L29.8Very low47.8Very low127.75 Ų127.75101.1 Ų101.167%0.66955%0.546SS*.Hα-helixtrans-79.5-24.5175.3-69.4175.1000112.3S985 S991 N992S985-L988 PolarHBondContact O-N 3.02Å; L988-S991 PolarHBondContact O-OG 3.45Å; L988-N992 PolarHBondContact O-ND2 3.38Å; L988-N992 VanDerWaalsContact O-ND2 3.09Å
989T37.3Very low50.6Low63.25 Ų63.2593.7 Ų93.739%0.38851%0.51SS..Hα-helixtrans-69.7-38.5174.955.40000111.5S985 T986 L987 S991 N992 D993S985-T989 VanDerWaalsContact O-CG2 3.27Å; S985-T989 WeakPolarHBondContact O-CG2 3.27Å; S985-T989 PolarHBondContact O-N 3.18Å; S985-T989 VanDerWaalsContact O-N 3.15Å; S985-T989 PolarHBondContact O-OG1 3Å; T986-T989 WeakPolarHBondContact CA-OG1 3.38Å; T986-T989 PolarHBondContact O-OG1 3.28Å; T986-T989 VanDerWaalsContact O-OG1 3.07Å; L987-T989 PolarHBondContact O-N 2.93Å; T989-S991 PolarHBondContact O-N 3.09Å; T989-N992 CarbonylContact O-C 3.52Å; T989-N992 WeakPolarHBondContact O-CA 3.46Å; T989-N992 WeakPolarHBondContact O-CB 3.35Å; T989-N992 PolarHBondContact O-N 3.3Å; T989-N992 VanDerWaalsContact O-N 3.1Å; T989-D993 VanDerWaalsContact C-OD2 3.3Å; T989-D993 VanDerWaalsContact O-CB 3.31Å; T989-D993 WeakPolarHBondContact O-CB 3.12Å; T989-D993 PolarHBondContact O-N 3.06Å; T989-D993 VanDerWaalsContact O-OD2 3.1Å
990S46.7Very low53Low54.5 Ų54.584.7 Ų84.738%0.38147%0.471SS..Hα-helixtrans-56.7-47.4-175.665.40000114.1L987 N992 D993 D994L987-S990 PolarHBondContact O-N 3.37Å; L987-S990 PolarHBondContact O-OG 3.01Å; S990-N992 VanDerWaalsContact C-N 3.28Å; S990-N992 PolarHBondContact O-N 3.18Å; S990-D993 WeakPolarHBondContact O-CB 3.49Å; S990-D993 PolarHBondContact O-N 3.01Å; S990-D994 VanDerWaalsContact O-CG 3.27Å; S990-D994 PolarHBondContact O-N 3.24Å
991S52.7Low55.6Low57 Ų5777.3 Ų77.340%0.39944%0.437SS..Hα-helixtrans-67.7-29.7179.365.20000113.4L988 T989 K995L988-S991 PolarHBondContact O-OG 3.45Å; T989-S991 PolarHBondContact O-N 3.09Å; S991-K995 WeakPolarHBondContact O-CG 3.37Å; S991-K995 PolarHBondContact O-N 3.23Å
992N59.2Low58.4Low48.75 Ų48.7570.8 Ų70.826%0.26140%0.404SS..Hα-helixtrans-76-38176.2-71.6-11.8000110.4P924 L988 T989 S990 K995 L996P924-N992 WeakPolarHBondContact CB-OD1 3.43Å; L988-N992 PolarHBondContact O-ND2 3.38Å; L988-N992 VanDerWaalsContact O-ND2 3.09Å; T989-N992 CarbonylContact O-C 3.52Å; T989-N992 WeakPolarHBondContact O-CA 3.46Å; T989-N992 WeakPolarHBondContact O-CB 3.35Å; T989-N992 PolarHBondContact O-N 3.3Å; T989-N992 VanDerWaalsContact O-N 3.1Å; S990-N992 VanDerWaalsContact C-N 3.28Å; S990-N992 PolarHBondContact O-N 3.18Å; N992-K995 PolarHBondContact O-N 2.87Å; N992-L996 VanDerWaalsContact O-CB 3.23Å; N992-L996 WeakPolarHBondContact O-CB 3.36Å; N992-L996 PolarHBondContact O-N 3.26Å
993D67.7Low61.1Low65.25 Ų65.2564.4 Ų64.435%0.34937%0.369SS..Hα-helixtrans-63.5-44176.2-65-29.2000110.3T989 S990 K995 L996 F997T989-D993 VanDerWaalsContact C-OD2 3.3Å; T989-D993 VanDerWaalsContact O-CB 3.31Å; T989-D993 WeakPolarHBondContact O-CB 3.12Å; T989-D993 PolarHBondContact O-N 3.06Å; T989-D993 VanDerWaalsContact O-OD2 3.1Å; S990-D993 WeakPolarHBondContact O-CB 3.49Å; S990-D993 PolarHBondContact O-N 3.01Å; D993-K995 PolarHBondContact O-N 3.11Å; D993-L996 CarbonylContact O-C 3.5Å; D993-L996 WeakPolarHBondContact O-CA 3.39Å; D993-L996 VanDerWaalsContact O-CB 3.3Å; D993-L996 WeakPolarHBondContact O-CB 3.43Å; D993-L996 PolarHBondContact O-N 2.96Å; D993-L996 VanDerWaalsContact O-N 3.1Å; D993-F997 VanDerWaalsContact C-CD2 3.48Å; D993-F997 HydrophobicContact CB-CD2 4.42Å; D993-F997 HydrophobicContact CB-CE2 3.95Å; D993-F997 WeakPolarHBondContact O-CD2 3.47Å; D993-F997 VanDerWaalsContact O-CG 3.3Å; D993-F997 WeakPolarHBondContact O-CG 3.43Å; D993-F997 PolarHBondContact O-N 3.31Å
994D75.5Confident63.8Low102 Ų10258.1 Ų58.155%0.54533%0.331SS..Hα-helixtrans-57.9-47.9176.6-71.2-18.2000112S990 L996 F997 D998S990-D994 VanDerWaalsContact O-CG 3.27Å; S990-D994 PolarHBondContact O-N 3.24Å; D994-L996 VanDerWaalsContact C-N 3.29Å; D994-L996 PolarHBondContact O-N 3.05Å; D994-F997 PolarHBondContact O-N 3.3Å; D994-D998 WeakPolarHBondContact O-CB 3.43Å; D994-D998 PolarHBondContact O-N 3.1Å
995K77.6Confident66.6Low80.75 Ų80.7554.8 Ų54.835%0.35131%0.305SS..Hα-helixtrans-66.5-31.7176.7-69.9-176.9177.9-176.90112.8I927 N928 S991 N992 D993 D998 L999I927-K995 HydrophobicContact CG2-CB 4.43Å; N928-K995 VanDerWaalsContact CG-NZ 3.34Å; N928-K995 PolarHBondContact ND2-NZ 2.92Å; N928-K995 VanDerWaalsContact OD1-CD 3.27Å; N928-K995 WeakPolarHBondContact OD1-CD 3.35Å; N928-K995 WeakPolarHBondContact OD1-CE 3.34Å; N928-K995 PolarHBondContact OD1-NZ 3.14Å; S991-K995 WeakPolarHBondContact O-CG 3.37Å; S991-K995 PolarHBondContact O-N 3.23Å; N992-K995 PolarHBondContact O-N 2.87Å; D993-K995 PolarHBondContact O-N 3.11Å; K995-D998 PolarHBondContact O-N 3.36Å; K995-L999 WeakPolarHBondContact O-CB 3.34Å; K995-L999 PolarHBondContact O-N 3.06Å
996L81.5Confident69.4Low24.5 Ų24.551.3 Ų51.313%0.12828%0.281CS..Hα-helixtrans-68.1-39.3174.7-166.268.9000111.3L965 N992 D993 D994 L999 K1000L965-L996 HydrophobicContact CD1-CD1 4.48Å; L965-L996 HydrophobicContact CD2-CD1 3.5Å; L965-L996 VanDerWaalsContact CD2-CD1 3.47Å; L965-L996 HydrophobicContact CD2-CG 4.37Å; N992-L996 VanDerWaalsContact O-CB 3.23Å; N992-L996 WeakPolarHBondContact O-CB 3.36Å; N992-L996 PolarHBondContact O-N 3.26Å; D993-L996 CarbonylContact O-C 3.5Å; D993-L996 WeakPolarHBondContact O-CA 3.39Å; D993-L996 VanDerWaalsContact O-CB 3.3Å; D993-L996 WeakPolarHBondContact O-CB 3.43Å; D993-L996 PolarHBondContact O-N 2.96Å; D993-L996 VanDerWaalsContact O-N 3.1Å; D994-L996 VanDerWaalsContact C-N 3.29Å; D994-L996 PolarHBondContact O-N 3.05Å; L996-L999 HydrophobicContact CD1-CD2 4.33Å; L996-L999 WeakPolarHBondContact O-CB 3.44Å; L996-L999 PolarHBondContact O-N 3.34Å; L996-K1000 VanDerWaalsContact O-CG 3.28Å; L996-K1000 WeakPolarHBondContact O-CG 3.39Å; L996-K1000 PolarHBondContact O-N 2.99Å
997F83Confident71.9Confident33.25 Ų33.2545.9 Ų45.915%0.14625%0.247CC..Hα-helixtrans-65.7-43.3174-66.8-56.6000111.3D993 D994 L999 K1000 L1001 N1113 L1116D993-F997 VanDerWaalsContact C-CD2 3.48Å; D993-F997 HydrophobicContact CB-CD2 4.42Å; D993-F997 HydrophobicContact CB-CE2 3.95Å; D993-F997 WeakPolarHBondContact O-CD2 3.47Å; D993-F997 VanDerWaalsContact O-CG 3.3Å; D993-F997 WeakPolarHBondContact O-CG 3.43Å; D993-F997 PolarHBondContact O-N 3.31Å; D994-F997 PolarHBondContact O-N 3.3Å; F997-L999 VanDerWaalsContact C-N 3.35Å; F997-L999 PolarHBondContact O-N 2.98Å; F997-K1000 WeakPolarHBondContact O-CB 3.44Å; F997-K1000 PolarHBondContact O-N 3.22Å; F997-L1001 WeakPolarHBondContact O-CB 3.43Å; F997-L1001 WeakPolarHBondContact O-CG 3.4Å; F997-L1001 PolarHBondContact O-N 3.15Å; F997-N1113 HydrophobicContact CD1-CB 3.89Å; F997-N1113 HydrophobicContact CD2-CB 4.44Å; F997-N1113 HydrophobicContact CE1-CB 4Å; F997-N1113 HydrophobicContact CG-CB 4.15Å; F997-N1113 HydrophobicContact CZ-CB 4.35Å; F997-L1116 HydrophobicContact CD1-CD2 3.81Å; F997-L1116 HydrophobicContact CE1-CD2 4.27Å
998D83.6Confident74.7Confident67 Ų6741.5 Ų41.536%0.35822%0.223SC..Hα-helixtrans-59.6-44.6174.3-128.613.3000112.1N931 D994 K995 K1000 L1001 K1002N931-D998 PolarHBondContact ND2-OD2 2.83Å; D994-D998 WeakPolarHBondContact O-CB 3.43Å; D994-D998 PolarHBondContact O-N 3.1Å; K995-D998 PolarHBondContact O-N 3.36Å; D998-K1000 VanDerWaalsContact C-N 3.33Å; D998-K1000 PolarHBondContact O-N 3.22Å; D998-L1001 PolarHBondContact O-N 3.26Å; D998-K1002 VanDerWaalsContact CG-NZ 3.3Å; D998-K1002 WeakPolarHBondContact O-CB 3.47Å; D998-K1002 VanDerWaalsContact O-CG 3.28Å; D998-K1002 WeakPolarHBondContact O-CG 3.37Å; D998-K1002 PolarHBondContact O-N 3.33Å; D998-K1002 WeakPolarHBondContact OD1-CE 3.45Å; D998-K1002 IonicContact OD1-NZ 3.25Å; D998-K1002 PolarHBondContact OD1-NZ 3.32Å; D998-K1002 VanDerWaalsContact OD1-NZ 3.16Å; D998-K1002 IonicContact OD2-NZ 3.24Å; D998-K1002 PolarHBondContact OD2-NZ 3.17Å
999L86.6Confident77.5Confident0 Ų036.2 Ų36.20%019%0.194CC..Hα-helixtrans-56.6-47.1174.1179.372.9000111.3L921 T930 N931 I934 M961 L965 K995 L996 F997 K1002 T1003L921-L999 HydrophobicContact CD2-CD2 4.42Å; T930-L999 HydrophobicContact CG2-CD1 4.07Å; T930-L999 HydrophobicContact CG2-CD2 4.22Å; N931-L999 HydrophobicContact CB-CD1 4.11Å; I934-L999 HydrophobicContact CB-CD1 4Å; I934-L999 HydrophobicContact CD1-CD1 3.56Å; I934-L999 HydrophobicContact CD1-CG 4.07Å; I934-L999 HydrophobicContact CG1-CD1 3.64Å; I934-L999 HydrophobicContact CG2-CD1 4.43Å; M961-L999 HydrophobicContact SD-CD2 4.44Å; L965-L999 HydrophobicContact CD1-CD2 4.03Å; K995-L999 WeakPolarHBondContact O-CB 3.34Å; K995-L999 PolarHBondContact O-N 3.06Å; L996-L999 HydrophobicContact CD1-CD2 4.33Å; L996-L999 WeakPolarHBondContact O-CB 3.44Å; L996-L999 PolarHBondContact O-N 3.34Å; F997-L999 VanDerWaalsContact C-N 3.35Å; F997-L999 PolarHBondContact O-N 2.98Å; L999-K1002 PolarHBondContact O-N 3.11Å; L999-T1003 WeakPolarHBondContact O-CB 3.4Å; L999-T1003 PolarHBondContact O-N 3.05Å; L999-T1003 PolarHBondContact O-OG1 3.09Å
1000K87.3Confident79.7Confident13 Ų1333.4 Ų33.46%0.05718%0.177CC..Hα-helixtrans-62.7-45.9178.3-72.6172178.5177.60111.1L962 L965 L996 F997 D998 K1002 T1003 L1004 L1108 L1116L962-K1000 HydrophobicContact CD2-CB 4.17Å; L962-K1000 HydrophobicContact CD2-CG 3.85Å; L965-K1000 HydrophobicContact CD1-CG 4.39Å; L996-K1000 VanDerWaalsContact O-CG 3.28Å; L996-K1000 WeakPolarHBondContact O-CG 3.39Å; L996-K1000 PolarHBondContact O-N 2.99Å; F997-K1000 WeakPolarHBondContact O-CB 3.44Å; F997-K1000 PolarHBondContact O-N 3.22Å; D998-K1000 VanDerWaalsContact C-N 3.33Å; D998-K1000 PolarHBondContact O-N 3.22Å; K1000-K1002 PolarHBondContact O-N 2.96Å; K1000-T1003 WeakPolarHBondContact O-CB 3.45Å; K1000-T1003 PolarHBondContact O-N 3.27Å; K1000-L1004 WeakPolarHBondContact O-CG 3.33Å; K1000-L1004 PolarHBondContact O-N 3.07Å; K1000-L1108 HydrophobicContact CD-CD2 4.13Å; K1000-L1116 HydrophobicContact CB-CD1 3.94Å; K1000-L1116 HydrophobicContact CB-CD2 4.34Å; K1000-L1116 HydrophobicContact CD-CD2 3.96Å
1001L87.3Confident81.4Confident19 Ų1931.1 Ų31.110%0.09916%0.16CC..Hα-helixtrans-60.5-44.6179.1-76.7170.8000112.7F997 D998 T1003 L1004 D1005 E1115 L1116 K1119F997-L1001 WeakPolarHBondContact O-CB 3.43Å; F997-L1001 WeakPolarHBondContact O-CG 3.4Å; F997-L1001 PolarHBondContact O-N 3.15Å; D998-L1001 PolarHBondContact O-N 3.26Å; L1001-T1003 VanDerWaalsContact C-N 3.32Å; L1001-T1003 PolarHBondContact O-N 3.18Å; L1001-L1004 CarbonylContact O-C 3.55Å; L1001-L1004 WeakPolarHBondContact O-CB 3.38Å; L1001-L1004 PolarHBondContact O-N 3.09Å; L1001-L1004 VanDerWaalsContact O-N 3.11Å; L1001-D1005 PolarHBondContact O-N 3.33Å; L1001-E1115 HydrophobicContact CD1-CB 4.24Å; L1001-E1115 HydrophobicContact CD1-CG 4.02Å; L1001-E1115 HydrophobicContact CD2-CB 4.37Å; L1001-E1115 HydrophobicContact CD2-CG 3.95Å; L1001-L1116 HydrophobicContact CD2-CB 4.31Å; L1001-L1116 HydrophobicContact CD2-CD1 4.23Å; L1001-L1116 HydrophobicContact CG-CD1 4.45Å; L1001-K1119 HydrophobicContact CD2-CB 4.34Å; L1001-K1119 HydrophobicContact CD2-CD 3.98Å; L1001-K1119 HydrophobicContact CD2-CG 4.37Å; L1001-K1119 PolarHBondContact O-NZ 3.28Å; L1001-K1119 VanDerWaalsContact O-NZ 3.12Å
1002K87.7Confident83Confident37 Ų3729.7 Ų29.716%0.16115%0.148CC..Hα-helixtrans-65.2-36.7176.2-72.1164.8177169.40112.4N931 I934 I935 D998 L999 K1000 L1004 D1005 V1006N931-K1002 PolarHBondContact ND2-NZ 2.98Å; N931-K1002 VanDerWaalsContact OD1-CD 3.28Å; N931-K1002 WeakPolarHBondContact OD1-CD 3.39Å; N931-K1002 PolarHBondContact OD1-NZ 3.21Å; N931-K1002 VanDerWaalsContact OD1-NZ 3.16Å; I934-K1002 HydrophobicContact CG2-CB 4.09Å; I935-K1002 HydrophobicContact CD1-CD 4.33Å; I935-K1002 HydrophobicContact CG1-CD 3.66Å; D998-K1002 VanDerWaalsContact CG-NZ 3.3Å; D998-K1002 WeakPolarHBondContact O-CB 3.47Å; D998-K1002 VanDerWaalsContact O-CG 3.28Å; D998-K1002 WeakPolarHBondContact O-CG 3.37Å; D998-K1002 PolarHBondContact O-N 3.33Å; D998-K1002 WeakPolarHBondContact OD1-CE 3.45Å; D998-K1002 IonicContact OD1-NZ 3.25Å; D998-K1002 PolarHBondContact OD1-NZ 3.32Å; D998-K1002 VanDerWaalsContact OD1-NZ 3.16Å; D998-K1002 IonicContact OD2-NZ 3.24Å; D998-K1002 PolarHBondContact OD2-NZ 3.17Å; L999-K1002 PolarHBondContact O-N 3.11Å; K1000-K1002 PolarHBondContact O-N 2.96Å; K1002-L1004 VanDerWaalsContact C-N 3.32Å; K1002-L1004 PolarHBondContact O-N 3.49Å; K1002-D1005 WeakPolarHBondContact CA-OD2 3.35Å; K1002-D1005 WeakPolarHBondContact O-CB 3.3Å; K1002-D1005 PolarHBondContact O-N 2.97Å; K1002-V1006 PolarHBondContact O-N 2.98Å
1003T86.8Confident84.2Confident0.2 Ų0.228 Ų280%0.00114%0.139CC..Hα-helixtrans-64.4-40.7174.2-53.60000111L958 M961 L962 L999 K1000 L1001 D1005 V1006 I1007L958-T1003 HydrophobicContact CB-CG2 3.71Å; L958-T1003 HydrophobicContact CD1-CG2 4.26Å; L958-T1003 HydrophobicContact CD2-CG2 4.07Å; L958-T1003 HydrophobicContact CG-CG2 4.21Å; M961-T1003 HydrophobicContact CE-CG2 3.95Å; M961-T1003 WeakPolarHBondContact CE-OG1 3.28Å; L962-T1003 HydrophobicContact CD1-CG2 3.76Å; L962-T1003 HydrophobicContact CD2-CG2 4.12Å; L962-T1003 HydrophobicContact CG-CG2 3.78Å; L999-T1003 WeakPolarHBondContact O-CB 3.4Å; L999-T1003 PolarHBondContact O-N 3.05Å; L999-T1003 PolarHBondContact O-OG1 3.09Å; K1000-T1003 WeakPolarHBondContact O-CB 3.45Å; K1000-T1003 PolarHBondContact O-N 3.27Å; L1001-T1003 VanDerWaalsContact C-N 3.32Å; L1001-T1003 PolarHBondContact O-N 3.18Å; T1003-D1005 VanDerWaalsContact C-N 3.33Å; T1003-D1005 PolarHBondContact O-N 3.19Å; T1003-V1006 PolarHBondContact O-N 3.15Å; T1003-I1007 HydrophobicContact CG2-CD1 4.36Å; T1003-I1007 WeakPolarHBondContact O-CG1 3.36Å; T1003-I1007 PolarHBondContact O-N 3.16Å; T1003-I1007 VanDerWaalsContact O-N 3.13Å
1004L87.4Confident85Confident0 Ų026.5 Ų26.50%013%0.129CC..Hα-helixtrans-65.1-32.8174.3-66.8-179.9000112.7L962 K1000 L1001 K1002 V1006 I1007 E1008 L1105 L1108 L1116 K1119 L1123L962-L1004 HydrophobicContact CD1-CD2 4Å; K1000-L1004 WeakPolarHBondContact O-CG 3.33Å; K1000-L1004 PolarHBondContact O-N 3.07Å; L1001-L1004 CarbonylContact O-C 3.55Å; L1001-L1004 WeakPolarHBondContact O-CB 3.38Å; L1001-L1004 PolarHBondContact O-N 3.09Å; L1001-L1004 VanDerWaalsContact O-N 3.11Å; K1002-L1004 VanDerWaalsContact C-N 3.32Å; K1002-L1004 PolarHBondContact O-N 3.49Å; L1004-V1006 VanDerWaalsContact C-N 3.31Å; L1004-V1006 PolarHBondContact O-N 3.16Å; L1004-I1007 HydrophobicContact CD2-CD1 4.26Å; L1004-I1007 PolarHBondContact O-N 3.08Å; L1004-E1008 WeakPolarHBondContact O-CB 3.29Å; L1004-E1008 PolarHBondContact O-N 3.02Å; L1004-L1105 HydrophobicContact CD2-CD2 3.76Å; L1004-L1108 HydrophobicContact CD1-CD1 4.43Å; L1004-L1108 HydrophobicContact CD2-CD1 4.18Å; L1004-L1116 HydrophobicContact CD1-CD1 3.59Å; L1004-K1119 HydrophobicContact CB-CD 3.94Å; L1004-K1119 HydrophobicContact CB-CG 4.35Å; L1004-K1119 HydrophobicContact CD1-CB 4.33Å; L1004-K1119 HydrophobicContact CD1-CD 4.3Å; L1004-K1119 HydrophobicContact CD1-CG 4.25Å; L1004-L1123 HydrophobicContact CB-CD1 3.88Å; L1004-L1123 HydrophobicContact CD1-CD1 4.46Å; L1004-L1123 HydrophobicContact CD2-CD1 3.84Å; L1004-L1123 HydrophobicContact CG-CD1 4.27Å
1005D89.5Confident85.3Confident34.8 Ų34.821.9 Ų21.919%0.18610%0.104CC..Hα-helixtrans-60.7-41.2173.5-72.1-47.6000111.8K938 F942 L1001 K1002 T1003 I1007 E1008 Y1009 K1119K938-D1005 HydrophobicContact CD-CB 4.01Å; K938-D1005 WeakPolarHBondContact CE-OD2 3.46Å; K938-D1005 IonicContact NZ-OD1 3.43Å; K938-D1005 IonicContact NZ-OD2 3.3Å; K938-D1005 PolarHBondContact NZ-OD2 3.03Å; F942-D1005 HydrophobicContact CZ-CB 4.16Å; L1001-D1005 PolarHBondContact O-N 3.33Å; K1002-D1005 WeakPolarHBondContact CA-OD2 3.35Å; K1002-D1005 WeakPolarHBondContact O-CB 3.3Å; K1002-D1005 PolarHBondContact O-N 2.97Å; T1003-D1005 VanDerWaalsContact C-N 3.33Å; T1003-D1005 PolarHBondContact O-N 3.19Å; D1005-I1007 VanDerWaalsContact C-N 3.35Å; D1005-E1008 WeakPolarHBondContact O-CB 3.3Å; D1005-E1008 PolarHBondContact O-N 3.06Å; D1005-Y1009 PolarHBondContact O-N 3.28Å; D1005-Y1009 VanDerWaalsContact O-N 3.1Å; D1005-K1119 IonicContact OD1-NZ 3.55Å; D1005-K1119 PolarHBondContact OD1-NZ 3.23Å; D1005-K1119 IonicContact OD2-NZ 3.38Å; D1005-K1119 PolarHBondContact OD2-NZ 3.2Å
1006V87.6Confident85.6Confident0 Ų018 Ų180%09%0.088CC..Hα-helixtrans-67.1-42.6177.9-178.60000110.1K938 V941 L954 L958 K1002 T1003 L1004 E1008 Y1009 I1010K938-V1006 HydrophobicContact CB-CG2 3.59Å; K938-V1006 HydrophobicContact CD-CG2 4.45Å; K938-V1006 HydrophobicContact CG-CG2 3.85Å; V941-V1006 HydrophobicContact CG1-CG1 4.37Å; V941-V1006 HydrophobicContact CG2-CG1 4.13Å; L954-V1006 HydrophobicContact CD2-CG1 4.45Å; L958-V1006 HydrophobicContact CD1-CB 3.84Å; L958-V1006 HydrophobicContact CD1-CG1 3.59Å; L958-V1006 HydrophobicContact CD1-CG2 4.35Å; K1002-V1006 PolarHBondContact O-N 2.98Å; T1003-V1006 PolarHBondContact O-N 3.15Å; L1004-V1006 VanDerWaalsContact C-N 3.31Å; L1004-V1006 PolarHBondContact O-N 3.16Å; V1006-E1008 VanDerWaalsContact C-N 3.32Å; V1006-E1008 PolarHBondContact O-N 3.18Å; V1006-Y1009 WeakPolarHBondContact O-CB 3.47Å; V1006-Y1009 PolarHBondContact O-N 3.15Å; V1006-I1010 HydrophobicContact CG1-CD1 4.14Å; V1006-I1010 HydrophobicContact CG1-CG1 4.49Å; V1006-I1010 VanDerWaalsContact O-CG1 3.27Å; V1006-I1010 WeakPolarHBondContact O-CG1 3.25Å; V1006-I1010 PolarHBondContact O-N 3.08Å
1007I86Confident85.6Confident0.4 Ų0.417.6 Ų17.60%0.0028%0.084CC..Hα-helixtrans-61.7-42176.5-67.6167.5000110.9V959 L962 T1003 L1004 D1005 Y1009 I1010 L1011 V1093 L1101V959-I1007 HydrophobicContact CG2-CD1 3.95Å; V959-I1007 HydrophobicContact CG2-CG1 4.43Å; L962-I1007 HydrophobicContact CD1-CD1 3.78Å; T1003-I1007 HydrophobicContact CG2-CD1 4.36Å; T1003-I1007 WeakPolarHBondContact O-CG1 3.36Å; T1003-I1007 PolarHBondContact O-N 3.16Å; T1003-I1007 VanDerWaalsContact O-N 3.13Å; L1004-I1007 HydrophobicContact CD2-CD1 4.26Å; L1004-I1007 PolarHBondContact O-N 3.08Å; D1005-I1007 VanDerWaalsContact C-N 3.35Å; I1007-Y1009 VanDerWaalsContact C-N 3.33Å; I1007-Y1009 PolarHBondContact O-N 3.25Å; I1007-I1010 WeakPolarHBondContact O-CB 3.36Å; I1007-I1010 PolarHBondContact O-N 3.11Å; I1007-I1010 VanDerWaalsContact O-N 3.14Å; I1007-L1011 WeakPolarHBondContact O-CG 3.36Å; I1007-L1011 PolarHBondContact O-N 2.95Å; I1007-V1093 HydrophobicContact CG2-CG1 4.49Å; I1007-L1101 HydrophobicContact CD1-CD1 4.31Å; I1007-L1101 HydrophobicContact CG2-CD1 4.14Å; I1007-L1101 HydrophobicContact CG2-CD2 4.46Å
1008E87.8Confident85.6Confident42.2 Ų42.216.1 Ų16.120%0.1978%0.078CC..Hα-helixtrans-56.9-47.6175.7-169.5168.5-171.800111.5L1004 D1005 V1006 I1010 L1011 D1012 K1119 Q1122 L1123 R1126L1004-E1008 WeakPolarHBondContact O-CB 3.29Å; L1004-E1008 PolarHBondContact O-N 3.02Å; D1005-E1008 WeakPolarHBondContact O-CB 3.3Å; D1005-E1008 PolarHBondContact O-N 3.06Å; V1006-E1008 VanDerWaalsContact C-N 3.32Å; V1006-E1008 PolarHBondContact O-N 3.18Å; E1008-I1010 VanDerWaalsContact C-N 3.32Å; E1008-I1010 PolarHBondContact O-N 3.24Å; E1008-L1011 WeakPolarHBondContact O-CB 3.39Å; E1008-L1011 PolarHBondContact O-N 3.05Å; E1008-L1011 VanDerWaalsContact O-N 3.1Å; E1008-D1012 PolarHBondContact O-N 3.1Å; E1008-D1012 VanDerWaalsContact O-N 3.07Å; E1008-D1012 VanDerWaalsContact O-OD2 3.12Å; E1008-K1119 WeakPolarHBondContact OE2-CE 3.35Å; E1008-K1119 IonicContact OE2-NZ 3.62Å; E1008-Q1122 PolarHBondContact OE1-NE2 3.08Å; E1008-L1123 HydrophobicContact CB-CD2 3.79Å; E1008-L1123 HydrophobicContact CG-CD2 3.87Å; E1008-R1126 VanDerWaalsContact CG-NH1 3.32Å; E1008-R1126 PolarHBondContact O-NH1 3.28Å; E1008-R1126 IonicContact OE1-NH1 2.68Å; E1008-R1126 PolarHBondContact OE1-NH1 3.2Å
1009Y88Confident85.5Confident17 Ų1712.9 Ų12.97%0.0676%0.061CC..Hα-helixtrans-62-38.6176-175-83.9000112.8H862 P864 V941 F942 L951 D1005 V1006 I1007 L1011 D1012 V1013H862-Y1009 PolarHBondContact ND1-OH 3.21Å; H862-Y1009 PolarHBondContact O-OH 3.29Å; P864-Y1009 HydrophobicContact CB-CD2 4.08Å; P864-Y1009 HydrophobicContact CB-CE1 4.35Å; P864-Y1009 HydrophobicContact CB-CE2 3.74Å; P864-Y1009 HydrophobicContact CG-CD2 4.14Å; P864-Y1009 HydrophobicContact CG-CE2 4.03Å; V941-Y1009 HydrophobicContact CG1-CD1 3.23Å; V941-Y1009 HydrophobicContact CG1-CE1 3.51Å; V941-Y1009 VanDerWaalsContact CG1-CE1 3.44Å; V941-Y1009 HydrophobicContact CG1-CG 3.88Å; V941-Y1009 WeakPolarHBondContact O-CE1 3.4Å; V941-Y1009 PolarHBondContact O-OH 3.26Å; F942-Y1009 AromaticContact CD1-CD2 3.57Å; F942-Y1009 HydrophobicContact CD1-CD2 3.57Å; F942-Y1009 HydrophobicContact CD1-CE2 4.07Å; F942-Y1009 AromaticContact CD1-CG 3.91Å; F942-Y1009 HydrophobicContact CD1-CG 3.91Å; F942-Y1009 AromaticContact CE1-CD2 3.72Å; F942-Y1009 HydrophobicContact CE1-CD2 3.72Å; F942-Y1009 AromaticContact CE1-CG 3.87Å; F942-Y1009 HydrophobicContact CE1-CG 3.87Å; F942-Y1009 HydrophobicContact CG-CD2 4.43Å; L951-Y1009 HydrophobicContact CD2-CD1 4.44Å; L951-Y1009 HydrophobicContact CD2-CE1 4.38Å; D1005-Y1009 PolarHBondContact O-N 3.28Å; D1005-Y1009 VanDerWaalsContact O-N 3.1Å; V1006-Y1009 WeakPolarHBondContact O-CB 3.47Å; V1006-Y1009 PolarHBondContact O-N 3.15Å; I1007-Y1009 VanDerWaalsContact C-N 3.33Å; I1007-Y1009 PolarHBondContact O-N 3.25Å; Y1009-L1011 VanDerWaalsContact C-N 3.28Å; Y1009-L1011 PolarHBondContact O-N 3.28Å; Y1009-D1012 WeakPolarHBondContact O-CB 3.4Å; Y1009-D1012 PolarHBondContact O-N 3.01Å; Y1009-D1012 VanDerWaalsContact O-N 3.15Å; Y1009-V1013 HydrophobicContact CD1-CG2 3.88Å; Y1009-V1013 HydrophobicContact CE1-CG2 3.52Å; Y1009-V1013 VanDerWaalsContact CE1-CG2 3.48Å; Y1009-V1013 WeakPolarHBondContact O-CG2 3.33Å; Y1009-V1013 PolarHBondContact O-N 3.11Å
1010I84.2Confident85.2Confident4.2 Ų4.213 Ų132%0.0226%0.061CC..Hα-helixtrans-62.5-38.4175.1-65168.5000110.7L951 V1006 I1007 E1008 D1012 V1013 R1014 V1093L951-I1010 HydrophobicContact CB-CG1 4.49Å; L951-I1010 HydrophobicContact CD1-CD1 4.15Å; L951-I1010 HydrophobicContact CD1-CG1 3.74Å; L951-I1010 HydrophobicContact CD2-CG1 4.25Å; L951-I1010 HydrophobicContact CG-CD1 4.27Å; L951-I1010 HydrophobicContact CG-CG1 3.74Å; L951-I1010 WeakPolarHBondContact O-CD1 3.48Å; V1006-I1010 HydrophobicContact CG1-CD1 4.14Å; V1006-I1010 HydrophobicContact CG1-CG1 4.49Å; V1006-I1010 VanDerWaalsContact O-CG1 3.27Å; V1006-I1010 WeakPolarHBondContact O-CG1 3.25Å; V1006-I1010 PolarHBondContact O-N 3.08Å; I1007-I1010 WeakPolarHBondContact O-CB 3.36Å; I1007-I1010 PolarHBondContact O-N 3.11Å; I1007-I1010 VanDerWaalsContact O-N 3.14Å; E1008-I1010 VanDerWaalsContact C-N 3.32Å; E1008-I1010 PolarHBondContact O-N 3.24Å; I1010-D1012 VanDerWaalsContact C-N 3.34Å; I1010-V1013 PolarHBondContact O-N 3.15Å; I1010-R1014 WeakPolarHBondContact O-CB 3.28Å; I1010-R1014 PolarHBondContact O-N 3.17Å; I1010-V1093 HydrophobicContact CD1-CG1 4.42Å; I1010-V1093 HydrophobicContact CG2-CB 4.44Å; I1010-V1093 HydrophobicContact CG2-CG1 4.09Å; I1010-V1093 HydrophobicContact CG2-CG2 3.76Å
1011L82.8Confident84.8Confident7.2 Ų7.212.5 Ų12.54%0.0386%0.06CC..Hα-helixtrans-64.7-39174.5-64.4177.5000111.6I1007 E1008 Y1009 R1014 V1015 V1093 L1123 R1126I1007-L1011 WeakPolarHBondContact O-CG 3.36Å; I1007-L1011 PolarHBondContact O-N 2.95Å; E1008-L1011 WeakPolarHBondContact O-CB 3.39Å; E1008-L1011 PolarHBondContact O-N 3.05Å; E1008-L1011 VanDerWaalsContact O-N 3.1Å; Y1009-L1011 VanDerWaalsContact C-N 3.28Å; Y1009-L1011 PolarHBondContact O-N 3.28Å; L1011-R1014 WeakPolarHBondContact O-CB 3.25Å; L1011-R1014 PolarHBondContact O-N 3.13Å; L1011-V1015 WeakPolarHBondContact O-CG2 3.37Å; L1011-V1015 PolarHBondContact O-N 3.15Å; L1011-V1093 HydrophobicContact CD2-CG2 4.08Å; L1011-L1123 HydrophobicContact CD1-CD2 3.95Å; L1011-R1126 HydrophobicContact CD1-CB 4.49Å
1012D86.7Confident84.3Confident27.4 Ų27.411.9 Ų11.915%0.1476%0.056CC..Hα-helixtrans-62.5-46.6174.2-74.3-57.6000112.3P864 I865 E1008 Y1009 I1010 R1014 V1015 D1016 R1126P864-D1012 HydrophobicContact CB-CB 3.51Å; P864-D1012 VanDerWaalsContact CB-CB 3.48Å; P864-D1012 HydrophobicContact CG-CB 3.43Å; P864-D1012 VanDerWaalsContact CG-CB 3.43Å; I865-D1012 HydrophobicContact CD1-CB 4.37Å; I865-D1012 WeakPolarHBondContact CD1-OD1 3.43Å; I865-D1012 HydrophobicContact CG1-CB 4.19Å; E1008-D1012 PolarHBondContact O-N 3.1Å; E1008-D1012 VanDerWaalsContact O-N 3.07Å; E1008-D1012 VanDerWaalsContact O-OD2 3.12Å; Y1009-D1012 WeakPolarHBondContact O-CB 3.4Å; Y1009-D1012 PolarHBondContact O-N 3.01Å; Y1009-D1012 VanDerWaalsContact O-N 3.15Å; I1010-D1012 VanDerWaalsContact C-N 3.34Å; D1012-R1014 VanDerWaalsContact C-N 3.25Å; D1012-R1014 PolarHBondContact O-N 3.06Å; D1012-V1015 PolarHBondContact O-N 3.26Å; D1012-V1015 VanDerWaalsContact O-N 3.15Å; D1012-D1016 PolarHBondContact O-N 3.1Å; D1012-R1126 IonicContact OD1-CZ 3.32Å; D1012-R1126 IonicContact OD1-NH1 3.06Å; D1012-R1126 PolarHBondContact OD1-NH1 3.3Å; D1012-R1126 IonicContact OD1-NH2 3.31Å; D1012-R1126 PolarHBondContact OD1-NH2 3.31Å; D1012-R1126 IonicContact OD2-CZ 3.31Å; D1012-R1126 IonicContact OD2-NH1 3.39Å; D1012-R1126 PolarHBondContact OD2-NH1 2.86Å; D1012-R1126 IonicContact OD2-NH2 3.24Å; D1012-R1126 PolarHBondContact OD2-NH2 2.92Å
1013V83Confident83.7Confident12.4 Ų12.410.4 Ų10.48%0.0755%0.05CC..Hα-helixtrans-61.3-36.3176173.70000111.1P864 I948 L951 Y1009 I1010 D1016 Y1017P864-V1013 HydrophobicContact CB-CG2 4Å; I948-V1013 HydrophobicContact CG1-CG1 4.3Å; L951-V1013 HydrophobicContact CD1-CB 4.49Å; L951-V1013 HydrophobicContact CD1-CG1 4.16Å; L951-V1013 HydrophobicContact CD1-CG2 4.29Å; L951-V1013 HydrophobicContact CD2-CB 4.24Å; L951-V1013 HydrophobicContact CD2-CG1 4.18Å; L951-V1013 HydrophobicContact CD2-CG2 4.07Å; Y1009-V1013 HydrophobicContact CD1-CG2 3.88Å; Y1009-V1013 HydrophobicContact CE1-CG2 3.52Å; Y1009-V1013 VanDerWaalsContact CE1-CG2 3.48Å; Y1009-V1013 WeakPolarHBondContact O-CG2 3.33Å; Y1009-V1013 PolarHBondContact O-N 3.11Å; I1010-V1013 PolarHBondContact O-N 3.15Å; V1013-D1016 PolarHBondContact O-N 3.19Å; V1013-Y1017 WeakPolarHBondContact O-CB 3.38Å; V1013-Y1017 PolarHBondContact O-N 3.13Å
1014R84.3Confident83.1Confident35 Ų3510.4 Ų10.413%0.1325%0.05CC..Hα-helixtrans-62.5-45.1174.9179.6179.5-175.2-169.61.4111.6I1010 L1011 D1012 D1016 Y1017 Q1018 L1091 N1092 Q1130I1010-R1014 WeakPolarHBondContact O-CB 3.28Å; I1010-R1014 PolarHBondContact O-N 3.17Å; L1011-R1014 WeakPolarHBondContact O-CB 3.25Å; L1011-R1014 PolarHBondContact O-N 3.13Å; D1012-R1014 VanDerWaalsContact C-N 3.25Å; D1012-R1014 PolarHBondContact O-N 3.06Å; R1014-D1016 VanDerWaalsContact C-N 3.33Å; R1014-Y1017 PolarHBondContact O-N 3.25Å; R1014-Q1018 VanDerWaalsContact O-CG 3.31Å; R1014-Q1018 WeakPolarHBondContact O-CG 3.35Å; R1014-Q1018 PolarHBondContact O-N 3.04Å; R1014-L1091 HydrophobicContact CB-CD1 4.46Å; R1014-L1091 HydrophobicContact CG-CB 4.2Å; R1014-L1091 HydrophobicContact CG-CD1 4.28Å; R1014-L1091 HydrophobicContact CG-CD2 4.13Å; R1014-L1091 VanDerWaalsContact CZ-O 3.24Å; R1014-L1091 PolarHBondContact NE-O 3.03Å; R1014-L1091 PolarHBondContact NH2-O 3.44Å; R1014-N1092 PolarHBondContact NH2-OD1 3.11Å; R1014-Q1130 VanDerWaalsContact NH2-OE1 3.16Å
1015V83.2Confident82.4Confident3.8 Ų3.810.4 Ų10.42%0.0235%0.05CC..Hα-helixtrans-62.8-42.2175.7174.50000110.5I865 L1011 D1012 Y1017 Q1018 I1019 E1133 L1134 K1137I865-V1015 HydrophobicContact CD1-CB 4.45Å; I865-V1015 HydrophobicContact CD1-CG1 4.31Å; L1011-V1015 WeakPolarHBondContact O-CG2 3.37Å; L1011-V1015 PolarHBondContact O-N 3.15Å; D1012-V1015 PolarHBondContact O-N 3.26Å; D1012-V1015 VanDerWaalsContact O-N 3.15Å; V1015-Y1017 VanDerWaalsContact C-N 3.34Å; V1015-Y1017 PolarHBondContact O-N 3.14Å; V1015-Q1018 WeakPolarHBondContact O-CB 3.32Å; V1015-Q1018 PolarHBondContact O-N 3.21Å; V1015-Q1018 VanDerWaalsContact O-N 3.15Å; V1015-I1019 HydrophobicContact CG1-CD1 4.17Å; V1015-I1019 WeakPolarHBondContact O-CG1 3.29Å; V1015-I1019 PolarHBondContact O-N 3.2Å; V1015-E1133 HydrophobicContact CG2-CG 4.46Å; V1015-L1134 HydrophobicContact CG1-CD1 4.22Å; V1015-K1137 HydrophobicContact CG1-CB 4.29Å; V1015-K1137 HydrophobicContact CG1-CG 4.22Å
1016D84.4Confident81.6Confident0 Ų010.3 Ų10.30%05%0.049CC..Hα-helixtrans-62.4-39.4177.5-167.468.4000112.7P864 I865 Q866 R869 Y883 N887 D1012 V1013 R1014 I1019 F1020P864-D1016 WeakPolarHBondContact O-CB 3.24Å; I865-D1016 WeakPolarHBondContact CA-OD1 3.43Å; I865-D1016 HydrophobicContact CG1-CB 4.34Å; Q866-D1016 PolarHBondContact N-OD1 3.14Å; R869-D1016 IonicContact CZ-OD1 3.27Å; R869-D1016 PolarHBondContact NH2-O 2.98Å; R869-D1016 IonicContact NH2-OD1 3.29Å; R869-D1016 PolarHBondContact NH2-OD1 3.26Å; R869-D1016 IonicContact NH2-OD2 3.21Å; R869-D1016 PolarHBondContact NH2-OD2 3.09Å; R869-D1016 VanDerWaalsContact NH2-OD2 3.09Å; Y883-D1016 HydrophobicContact CE2-CB 4.46Å; Y883-D1016 WeakPolarHBondContact CE2-OD2 3.3Å; Y883-D1016 VanDerWaalsContact CZ-OD2 3.23Å; Y883-D1016 PolarHBondContact OH-OD2 3.33Å; N887-D1016 PolarHBondContact ND2-OD2 3.18Å; D1012-D1016 PolarHBondContact O-N 3.1Å; V1013-D1016 PolarHBondContact O-N 3.19Å; R1014-D1016 VanDerWaalsContact C-N 3.33Å; D1016-I1019 PolarHBondContact O-N 3.12Å; D1016-F1020 PolarHBondContact O-N 2.99Å
1017Y81.3Confident80.9Confident15 Ų1513.6 Ų13.66%0.0596%0.062CC..Hα-helixtrans-65.9-40.1172.9-177.5-94.6000112.3V880 Y883 I948 V1013 R1014 V1015 I1019 F1020 C1021 L1091V880-Y1017 HydrophobicContact CB-CE2 4.48Å; V880-Y1017 HydrophobicContact CG2-CE2 4.07Å; Y883-Y1017 HydrophobicContact CD1-CD2 4.21Å; Y883-Y1017 AromaticContact CD2-CD2 3.77Å; Y883-Y1017 HydrophobicContact CD2-CD2 3.77Å; Y883-Y1017 HydrophobicContact CD2-CE2 4.49Å; Y883-Y1017 HydrophobicContact CD2-CG 4.48Å; Y883-Y1017 HydrophobicContact CE2-CD2 4.3Å; Y883-Y1017 AromaticContact CG-CD2 3.68Å; Y883-Y1017 HydrophobicContact CG-CD2 3.68Å; Y883-Y1017 HydrophobicContact CG-CE2 4.25Å; I948-Y1017 HydrophobicContact CD1-CD2 3.96Å; I948-Y1017 HydrophobicContact CD1-CE2 4.43Å; I948-Y1017 HydrophobicContact CD1-CG 4.42Å; V1013-Y1017 WeakPolarHBondContact O-CB 3.38Å; V1013-Y1017 PolarHBondContact O-N 3.13Å; R1014-Y1017 PolarHBondContact O-N 3.25Å; V1015-Y1017 VanDerWaalsContact C-N 3.34Å; V1015-Y1017 PolarHBondContact O-N 3.14Å; Y1017-I1019 VanDerWaalsContact C-N 3.34Å; Y1017-I1019 PolarHBondContact O-N 3.21Å; Y1017-F1020 WeakPolarHBondContact O-CA 3.35Å; Y1017-F1020 WeakPolarHBondContact O-CB 3.27Å; Y1017-F1020 PolarHBondContact O-N 3.04Å; Y1017-F1020 VanDerWaalsContact O-N 3.1Å; Y1017-C1021 WeakPolarHBondContact CE1-SG 3.41Å; Y1017-C1021 VanDerWaalsContact CZ-SG 3.54Å; Y1017-C1021 PolarHBondContact O-N 3.1Å; Y1017-C1021 PolarHBondContact O-SG 3.23Å; Y1017-C1021 VanDerWaalsContact O-SG 3.41Å; Y1017-L1091 HydrophobicContact CD1-CD1 3.3Å; Y1017-L1091 HydrophobicContact CD1-CD2 3.44Å; Y1017-L1091 HydrophobicContact CD1-CG 4.27Å; Y1017-L1091 HydrophobicContact CD2-CD1 4.39Å; Y1017-L1091 HydrophobicContact CE1-CD1 3.71Å; Y1017-L1091 HydrophobicContact CE1-CD2 4.02Å; Y1017-L1091 HydrophobicContact CE1-CG 4.17Å; Y1017-L1091 HydrophobicContact CG-CD1 3.54Å; Y1017-L1091 HydrophobicContact CG-CD2 4.03Å
1018Q82.7Confident79.9Confident3.2 Ų3.215.5 Ų15.52%0.0158%0.075CC..Hα-helixtrans-60.9-43.8174.4-72.9170.4-21.600111.3R1014 V1015 F1020 C1021 L1022 L1063 L1134R1014-Q1018 VanDerWaalsContact O-CG 3.31Å; R1014-Q1018 WeakPolarHBondContact O-CG 3.35Å; R1014-Q1018 PolarHBondContact O-N 3.04Å; V1015-Q1018 WeakPolarHBondContact O-CB 3.32Å; V1015-Q1018 PolarHBondContact O-N 3.21Å; V1015-Q1018 VanDerWaalsContact O-N 3.15Å; Q1018-F1020 VanDerWaalsContact C-N 3.28Å; Q1018-F1020 PolarHBondContact O-N 3.17Å; Q1018-C1021 PolarHBondContact O-N 3.26Å; Q1018-L1022 WeakPolarHBondContact O-CG 3.42Å; Q1018-L1022 PolarHBondContact O-N 3.05Å; Q1018-L1022 VanDerWaalsContact O-N 3.11Å; Q1018-L1063 HydrophobicContact CB-CD1 4.35Å; Q1018-L1063 HydrophobicContact CG-CD1 4.4Å; Q1018-L1063 HydrophobicContact CG-CD2 4.21Å; Q1018-L1134 HydrophobicContact CB-CD1 3.76Å; Q1018-L1134 HydrophobicContact CB-CD2 4.18Å
1019I81.1Confident78.8Confident0 Ų014 Ų140%07%0.069CC..Hα-helixtrans-58.4-43.2172.7-67.1170.5000110.2I865 V1015 D1016 Y1017 C1021 L1022 L1023 L1134 K1137 L1138 V1141I865-I1019 HydrophobicContact CG2-CD1 4.21Å; V1015-I1019 HydrophobicContact CG1-CD1 4.17Å; V1015-I1019 WeakPolarHBondContact O-CG1 3.29Å; V1015-I1019 PolarHBondContact O-N 3.2Å; D1016-I1019 PolarHBondContact O-N 3.12Å; Y1017-I1019 VanDerWaalsContact C-N 3.34Å; Y1017-I1019 PolarHBondContact O-N 3.21Å; I1019-C1021 PolarHBondContact O-N 3Å; I1019-L1022 PolarHBondContact O-N 3Å; I1019-L1023 HydrophobicContact CG2-CD1 3.88Å; I1019-L1023 HydrophobicContact CG2-CG 4.34Å; I1019-L1023 WeakPolarHBondContact O-CB 3.28Å; I1019-L1023 VanDerWaalsContact O-CG 3.3Å; I1019-L1023 WeakPolarHBondContact O-CG 3.34Å; I1019-L1023 PolarHBondContact O-N 3.19Å; I1019-L1134 HydrophobicContact CD1-CD1 4.49Å; I1019-L1134 HydrophobicContact CG1-CD1 3.57Å; I1019-K1137 HydrophobicContact CD1-CB 3.97Å; I1019-L1138 HydrophobicContact CG1-CD1 4.4Å; I1019-L1138 HydrophobicContact CG2-CD1 4.01Å; I1019-V1141 HydrophobicContact CD1-CG2 4.23Å; I1019-V1141 HydrophobicContact CG2-CG2 3.92Å
1020F80.5Confident77.3Confident0.4 Ų0.421 Ų210%0.00210%0.099CC..Hα-helixtrans-60.8-48.2176.9179.8-96.2000112.9R869 L874 N882 Y883 A886 D1016 Y1017 Q1018 L1022 L1023 T1024R869-F1020 VanDerWaalsContact NH1-CB 3.28Å; R869-F1020 VanDerWaalsContact NH1-N 3.11Å; L874-F1020 HydrophobicContact CD2-CD2 3.82Å; L874-F1020 HydrophobicContact CD2-CE2 3.72Å; N882-F1020 VanDerWaalsContact C-CZ 3.44Å; N882-F1020 HydrophobicContact CB-CE1 4.26Å; N882-F1020 HydrophobicContact CB-CZ 3.88Å; N882-F1020 WeakPolarHBondContact O-CZ 3.44Å; Y883-F1020 HydrophobicContact CD2-CB 3.56Å; Y883-F1020 AromaticContact CD2-CD1 3.99Å; Y883-F1020 HydrophobicContact CD2-CD1 4Å; Y883-F1020 AromaticContact CD2-CD2 4Å; Y883-F1020 HydrophobicContact CD2-CD2 4.03Å; Y883-F1020 AromaticContact CD2-CG 3.61Å; Y883-F1020 HydrophobicContact CD2-CG 3.61Å; Y883-F1020 HydrophobicContact CE2-CB 4.11Å; Y883-F1020 HydrophobicContact CG-CD1 4.4Å; Y883-F1020 HydrophobicContact CG-CG 4.37Å; Y883-F1020 VanDerWaalsContact N-CZ 3.34Å; A886-F1020 HydrophobicContact CB-CD2 4.38Å; A886-F1020 HydrophobicContact CB-CE2 3.71Å; A886-F1020 HydrophobicContact CB-CZ 4.46Å; D1016-F1020 PolarHBondContact O-N 2.99Å; Y1017-F1020 WeakPolarHBondContact O-CA 3.35Å; Y1017-F1020 WeakPolarHBondContact O-CB 3.27Å; Y1017-F1020 PolarHBondContact O-N 3.04Å; Y1017-F1020 VanDerWaalsContact O-N 3.1Å; Q1018-F1020 VanDerWaalsContact C-N 3.28Å; Q1018-F1020 PolarHBondContact O-N 3.17Å; F1020-L1022 VanDerWaalsContact C-N 3.32Å; F1020-L1022 PolarHBondContact O-N 3.2Å; F1020-L1023 PolarHBondContact O-N 3.3Å; F1020-L1023 VanDerWaalsContact O-N 3.15Å; F1020-T1024 HydrophobicContact CD1-CG2 3.99Å; F1020-T1024 HydrophobicContact CD2-CG2 4.39Å; F1020-T1024 HydrophobicContact CE1-CG2 3.54Å; F1020-T1024 HydrophobicContact CE2-CG2 3.97Å; F1020-T1024 HydrophobicContact CG-CG2 4.38Å; F1020-T1024 HydrophobicContact CZ-CG2 3.52Å; F1020-T1024 VanDerWaalsContact CZ-CG2 3.48Å; F1020-T1024 WeakPolarHBondContact O-CG2 3.34Å; F1020-T1024 PolarHBondContact O-N 3.21Å; F1020-T1024 PolarHBondContact O-OG1 3.32Å
1021C78.5Confident75.8Confident4 Ų424.6 Ų24.63%0.02712%0.116CC..Hα-helixtrans-55.9-48.1176.7-70.10000111.3Y1017 Q1018 I1019 L1023 T1024 T1025 Q1059 L1063Y1017-C1021 WeakPolarHBondContact CE1-SG 3.41Å; Y1017-C1021 VanDerWaalsContact CZ-SG 3.54Å; Y1017-C1021 PolarHBondContact O-N 3.1Å; Y1017-C1021 PolarHBondContact O-SG 3.23Å; Y1017-C1021 VanDerWaalsContact O-SG 3.41Å; Q1018-C1021 PolarHBondContact O-N 3.26Å; I1019-C1021 PolarHBondContact O-N 3Å; C1021-L1023 VanDerWaalsContact C-N 3.34Å; C1021-L1023 PolarHBondContact O-N 3.02Å; C1021-T1024 WeakPolarHBondContact CA-OG1 3.33Å; C1021-T1024 PolarHBondContact O-N 2.96Å; C1021-T1024 VanDerWaalsContact O-N 3.12Å; C1021-T1024 PolarHBondContact O-OG1 3.17Å; C1021-T1025 WeakPolarHBondContact O-CB 3.03Å; C1021-T1025 PolarHBondContact O-N 3.19Å; C1021-T1025 PolarHBondContact O-OG1 3.29Å; C1021-Q1059 PolarHBondContact O-OE1 3.13Å; C1021-L1063 HydrophobicContact CB-CD1 4.15Å; C1021-L1063 HydrophobicContact CB-CD2 4.14Å
1022L76.9Confident74Confident6 Ų627.8 Ų27.83%0.03114%0.138CC..Hα-helixtrans-60-44.2177.4-68.7173000112.2Q1018 I1019 F1020 T1024 T1025 L1026 V1056 L1060 L1063 L1134 L1138 M1716 I1720Q1018-L1022 WeakPolarHBondContact O-CG 3.42Å; Q1018-L1022 PolarHBondContact O-N 3.05Å; Q1018-L1022 VanDerWaalsContact O-N 3.11Å; I1019-L1022 PolarHBondContact O-N 3Å; F1020-L1022 VanDerWaalsContact C-N 3.32Å; F1020-L1022 PolarHBondContact O-N 3.2Å; L1022-T1024 PolarHBondContact O-N 3.22Å; L1022-T1025 WeakPolarHBondContact CA-OG1 3.22Å; L1022-T1025 WeakPolarHBondContact O-CA 3.49Å; L1022-T1025 VanDerWaalsContact O-CB 3.27Å; L1022-T1025 WeakPolarHBondContact O-CB 3.39Å; L1022-T1025 PolarHBondContact O-N 3.17Å; L1022-T1025 VanDerWaalsContact O-N 3.14Å; L1022-T1025 PolarHBondContact O-OG1 2.78Å; L1022-T1025 VanDerWaalsContact O-OG1 3.13Å; L1022-L1026 WeakPolarHBondContact O-CG 3.37Å; L1022-L1026 PolarHBondContact O-N 3.18Å; L1022-L1026 VanDerWaalsContact O-N 3.1Å; L1022-V1056 HydrophobicContact CD2-CG1 4.16Å; L1022-L1060 HydrophobicContact CD2-CD2 4.1Å; L1022-L1060 HydrophobicContact CD2-CG 4.36Å; L1022-L1063 HydrophobicContact CD2-CD1 4.37Å; L1022-L1063 HydrophobicContact CG-CD1 4.31Å; L1022-L1134 HydrophobicContact CD1-CD1 4.35Å; L1022-L1134 HydrophobicContact CD1-CD2 3.98Å; L1022-L1134 HydrophobicContact CD1-CG 4.34Å; L1022-L1138 HydrophobicContact CB-CD1 4.45Å; L1022-L1138 HydrophobicContact CD1-CD1 3.79Å; L1022-L1138 HydrophobicContact CD1-CD2 4.35Å; L1022-M1716 HydrophobicContact CB-CE 4.46Å; L1022-I1720 HydrophobicContact CD1-CD1 3.9Å; L1022-I1720 HydrophobicContact CD2-CD1 3.94Å; L1022-I1720 HydrophobicContact CG-CD1 4.41Å
1023L75.7Confident71.7Confident5.6 Ų5.634.6 Ų34.63%0.02917%0.168CC..Hα-helixtrans-67-36.7177.4-70.2175.3000113.1L874 I1019 F1020 C1021 T1025 L1026 R1027 V1141 L1143 F1713L874-L1023 HydrophobicContact CD1-CB 4.07Å; L874-L1023 HydrophobicContact CD1-CD1 4.46Å; L874-L1023 HydrophobicContact CD2-CB 4.4Å; I1019-L1023 HydrophobicContact CG2-CD1 3.88Å; I1019-L1023 HydrophobicContact CG2-CG 4.34Å; I1019-L1023 WeakPolarHBondContact O-CB 3.28Å; I1019-L1023 VanDerWaalsContact O-CG 3.3Å; I1019-L1023 WeakPolarHBondContact O-CG 3.34Å; I1019-L1023 PolarHBondContact O-N 3.19Å; F1020-L1023 PolarHBondContact O-N 3.3Å; F1020-L1023 VanDerWaalsContact O-N 3.15Å; C1021-L1023 VanDerWaalsContact C-N 3.34Å; C1021-L1023 PolarHBondContact O-N 3.02Å; L1023-T1025 VanDerWaalsContact C-N 3.28Å; L1023-T1025 PolarHBondContact O-N 3.31Å; L1023-L1026 HydrophobicContact CD2-CD1 4.21Å; L1023-L1026 WeakPolarHBondContact O-CB 3.43Å; L1023-L1026 PolarHBondContact O-N 3.11Å; L1023-R1027 PolarHBondContact O-N 3.22Å; L1023-R1027 VanDerWaalsContact O-N 3.1Å; L1023-V1141 HydrophobicContact CD1-CG1 4.34Å; L1023-L1143 HydrophobicContact CD2-CD1 4.49Å; L1023-L1143 HydrophobicContact CD2-CD2 4.48Å; L1023-F1713 HydrophobicContact CD2-CD2 3.86Å; L1023-F1713 HydrophobicContact CD2-CE2 3.51Å; L1023-F1713 VanDerWaalsContact CD2-CE2 3.48Å; L1023-F1713 HydrophobicContact CD2-CZ 4.42Å
1024T74.5Confident69.6Low0.2 Ų0.238.8 Ų38.80%0.00120%0.204CC..Hα-helixtrans-66.6-31.5173.756.60000112.1G875 S878 F1020 C1021 L1022 R1027 S1028G875-T1024 WeakPolarHBondContact O-CG2 3.44Å; S878-T1024 PolarHBondContact OG-OG1 3Å; S878-T1024 VanDerWaalsContact OG-OG1 3.11Å; F1020-T1024 HydrophobicContact CD1-CG2 3.99Å; F1020-T1024 HydrophobicContact CD2-CG2 4.39Å; F1020-T1024 HydrophobicContact CE1-CG2 3.54Å; F1020-T1024 HydrophobicContact CE2-CG2 3.97Å; F1020-T1024 HydrophobicContact CG-CG2 4.38Å; F1020-T1024 HydrophobicContact CZ-CG2 3.52Å; F1020-T1024 VanDerWaalsContact CZ-CG2 3.48Å; F1020-T1024 WeakPolarHBondContact O-CG2 3.34Å; F1020-T1024 PolarHBondContact O-N 3.21Å; F1020-T1024 PolarHBondContact O-OG1 3.32Å; C1021-T1024 WeakPolarHBondContact CA-OG1 3.33Å; C1021-T1024 PolarHBondContact O-N 2.96Å; C1021-T1024 VanDerWaalsContact O-N 3.12Å; C1021-T1024 PolarHBondContact O-OG1 3.17Å; L1022-T1024 PolarHBondContact O-N 3.22Å; T1024-R1027 CarbonylContact O-C 3.46Å; T1024-R1027 WeakPolarHBondContact O-CB 2.97Å; T1024-R1027 PolarHBondContact O-N 3.03Å; T1024-R1027 VanDerWaalsContact O-N 3.16Å; T1024-S1028 PolarHBondContact O-N 3.04Å; T1024-S1028 PolarHBondContact O-OG 3.5Å
1025T72.7Confident67.3Low0.6 Ų0.641.6 Ų41.60%0.00423%0.228CC..Hα-helixtrans-64.8-44172.2-45.90000111.3C1021 L1022 L1023 R1027 S1028 V1029 E1055 V1056 Q1059C1021-T1025 WeakPolarHBondContact O-CB 3.03Å; C1021-T1025 PolarHBondContact O-N 3.19Å; C1021-T1025 PolarHBondContact O-OG1 3.29Å; L1022-T1025 WeakPolarHBondContact CA-OG1 3.22Å; L1022-T1025 WeakPolarHBondContact O-CA 3.49Å; L1022-T1025 VanDerWaalsContact O-CB 3.27Å; L1022-T1025 WeakPolarHBondContact O-CB 3.39Å; L1022-T1025 PolarHBondContact O-N 3.17Å; L1022-T1025 VanDerWaalsContact O-N 3.14Å; L1022-T1025 PolarHBondContact O-OG1 2.78Å; L1022-T1025 VanDerWaalsContact O-OG1 3.13Å; L1023-T1025 VanDerWaalsContact C-N 3.28Å; L1023-T1025 PolarHBondContact O-N 3.31Å; T1025-R1027 PolarHBondContact O-N 3.33Å; T1025-S1028 WeakPolarHBondContact CA-OG 3.41Å; T1025-S1028 PolarHBondContact O-N 2.96Å; T1025-S1028 VanDerWaalsContact O-N 3.14Å; T1025-S1028 PolarHBondContact O-OG 3.12Å; T1025-V1029 WeakPolarHBondContact O-CG2 3.18Å; T1025-V1029 PolarHBondContact O-N 3.28Å; T1025-E1055 HydrophobicContact CG2-CB 3.8Å; T1025-E1055 HydrophobicContact CG2-CG 3.55Å; T1025-E1055 VanDerWaalsContact CG2-CG 3.43Å; T1025-V1056 HydrophobicContact CG2-CG2 4.21Å; T1025-Q1059 HydrophobicContact CG2-CG 3.97Å; T1025-Q1059 VanDerWaalsContact OG1-CG 3.3Å; T1025-Q1059 WeakPolarHBondContact OG1-CG 3.33Å; T1025-Q1059 PolarHBondContact OG1-NE2 3.19Å; T1025-Q1059 PolarHBondContact OG1-OE1 3.23Å
1026L72.6Confident65.3Low31 Ų3146.3 Ų46.316%0.16226%0.262CS..Hα-helixtrans-61.6-32175.2-133.6158.6000111.6W871 L1022 L1023 L1052 V1056 I1709 Q1712 F1713 M1716W871-L1026 HydrophobicContact CH2-CD2 3.44Å; W871-L1026 VanDerWaalsContact CH2-CD2 3.44Å; W871-L1026 HydrophobicContact CZ3-CD2 3.48Å; L1022-L1026 WeakPolarHBondContact O-CG 3.37Å; L1022-L1026 PolarHBondContact O-N 3.18Å; L1022-L1026 VanDerWaalsContact O-N 3.1Å; L1023-L1026 HydrophobicContact CD2-CD1 4.21Å; L1023-L1026 WeakPolarHBondContact O-CB 3.43Å; L1023-L1026 PolarHBondContact O-N 3.11Å; L1026-L1052 HydrophobicContact CD2-CD2 3.86Å; L1026-L1052 HydrophobicContact CG-CD2 4.45Å; L1026-V1056 HydrophobicContact CD2-CG2 4.38Å; L1026-I1709 HydrophobicContact CD2-CG2 4.28Å; L1026-Q1712 HydrophobicContact CD1-CB 4.46Å; L1026-F1713 VanDerWaalsContact CD1-CA 3.42Å; L1026-F1713 HydrophobicContact CD1-CB 3.81Å; L1026-F1713 HydrophobicContact CD1-CD2 3.95Å; L1026-F1713 HydrophobicContact CD1-CG 4.4Å; L1026-M1716 HydrophobicContact CB-SD 3.97Å; L1026-M1716 HydrophobicContact CD1-CB 4.35Å; L1026-M1716 HydrophobicContact CD1-CE 4.01Å; L1026-M1716 HydrophobicContact CD1-SD 3.94Å; L1026-M1716 HydrophobicContact CG-SD 4.45Å
1027R71.8Confident63.3Low69.8 Ų69.852 Ų5226%0.26329%0.292SS..Hα-helixtrans-80.9-26.7176.5-170.7166.6176.8175.3-8.2113.9W871 S872 L874 L1023 T1024 T1025 V1029 K1030W871-R1027 HydrophobicContact CH2-CB 3.82Å; W871-R1027 HydrophobicContact CH2-CG 4.07Å; W871-R1027 HydrophobicContact CZ2-CB 4.21Å; W871-R1027 HydrophobicContact CZ2-CG 3.92Å; W871-R1027 HydrophobicContact CZ3-CB 4.25Å; W871-R1027 HydrophobicContact CZ3-CG 4.5Å; W871-R1027 PolarHBondContact O-NH1 3.19Å; S872-R1027 VanDerWaalsContact C-NH1 3.32Å; S872-R1027 PolarHBondContact O-NH1 2.99Å; S872-R1027 VanDerWaalsContact O-NH1 3.11Å; L874-R1027 VanDerWaalsContact O-CD 3.27Å; L874-R1027 WeakPolarHBondContact O-CD 3.37Å; L874-R1027 PolarHBondContact O-NE 3.12Å; L874-R1027 PolarHBondContact O-NH1 3.19Å; L1023-R1027 PolarHBondContact O-N 3.22Å; L1023-R1027 VanDerWaalsContact O-N 3.1Å; T1024-R1027 CarbonylContact O-C 3.46Å; T1024-R1027 WeakPolarHBondContact O-CB 2.97Å; T1024-R1027 PolarHBondContact O-N 3.03Å; T1024-R1027 VanDerWaalsContact O-N 3.16Å; T1025-R1027 PolarHBondContact O-N 3.33Å; R1027-V1029 VanDerWaalsContact C-N 3.31Å; R1027-K1030 PolarHBondContact O-N 3.4Å
1028S64.8Low61.6Low40.4 Ų40.458.6 Ų58.628%0.28333%0.328SS..Hα-helixtrans-71.4-28.3178.458.70000112.6T1024 T1025 K1030 Q1031 E1055T1024-S1028 PolarHBondContact O-N 3.04Å; T1024-S1028 PolarHBondContact O-OG 3.5Å; T1025-S1028 WeakPolarHBondContact CA-OG 3.41Å; T1025-S1028 PolarHBondContact O-N 2.96Å; T1025-S1028 VanDerWaalsContact O-N 3.14Å; T1025-S1028 PolarHBondContact O-OG 3.12Å; S1028-K1030 PolarHBondContact O-N 2.97Å; S1028-Q1031 PolarHBondContact O-N 2.78Å; S1028-E1055 WeakPolarHBondContact CB-OE1 3.39Å; S1028-E1055 VanDerWaalsContact OG-CD 3.3Å; S1028-E1055 PolarHBondContact OG-OE1 3.25Å; S1028-E1055 PolarHBondContact OG-OE2 3.4Å
1029V64.3Low59.9Low11.6 Ų11.665.2 Ų65.27%0.0736%0.363CS..SBendtrans-67.5125.7175.8178.70000111.2T1025 R1027 Q1031 Q1048 E1051 L1052 E1055T1025-V1029 WeakPolarHBondContact O-CG2 3.18Å; T1025-V1029 PolarHBondContact O-N 3.28Å; R1027-V1029 VanDerWaalsContact C-N 3.31Å; V1029-Q1031 VanDerWaalsContact C-N 3.25Å; V1029-Q1031 PolarHBondContact O-N 3.02Å; V1029-Q1031 VanDerWaalsContact O-N 3.08Å; V1029-Q1048 HydrophobicContact CG1-CB 4.5Å; V1029-Q1048 HydrophobicContact CG1-CG 4.39Å; V1029-E1051 HydrophobicContact CG1-CB 4.44Å; V1029-L1052 HydrophobicContact CB-CD2 3.7Å; V1029-L1052 VanDerWaalsContact CB-CD2 3.44Å; V1029-L1052 HydrophobicContact CB-CG 4.08Å; V1029-L1052 HydrophobicContact CG1-CD1 4.44Å; V1029-L1052 HydrophobicContact CG1-CD2 4.07Å; V1029-L1052 HydrophobicContact CG1-CG 3.87Å; V1029-L1052 HydrophobicContact CG2-CD2 3.41Å; V1029-L1052 HydrophobicContact CG2-CG 3.85Å; V1029-E1055 HydrophobicContact CG2-CB 4.38Å; V1029-E1055 VanDerWaalsContact CG2-OE2 3.22Å; V1029-E1055 WeakPolarHBondContact CG2-OE2 3.44Å
1030K56.4Low58.5Low162.4 Ų162.471.2 Ų71.271%0.70639%0.391SS*.PPolyproline II helixtrans-59.4105.6-178.8-73.1-177.1179.1176.30111.1R1027 S1028 P1032 Q1048R1027-K1030 PolarHBondContact O-N 3.4Å; S1028-K1030 PolarHBondContact O-N 2.97Å; K1030-P1032 VanDerWaalsContact O-CD 3.28Å; K1030-P1032 WeakPolarHBondContact O-CD 3.5Å; K1030-Q1048 PolarHBondContact O-NE2 2.97Å
1031Q52.9Low57Low79.8 Ų79.876.2 Ų76.237%0.37342%0.417SS..PPolyproline II helixtrans-77.5140.7171-67.1-146.2-22.700109.6W871 S1028 V1029 E1033 F1705W871-Q1031 VanDerWaalsContact CZ2-NE2 3.31Å; S1028-Q1031 PolarHBondContact O-N 2.78Å; V1029-Q1031 VanDerWaalsContact C-N 3.25Å; V1029-Q1031 PolarHBondContact O-N 3.02Å; V1029-Q1031 VanDerWaalsContact O-N 3.08Å; Q1031-E1033 VanDerWaalsContact C-N 3.32Å; Q1031-E1033 PolarHBondContact O-N 3.02Å; Q1031-E1033 VanDerWaalsContact O-N 3.16Å; Q1031-F1705 HydrophobicContact CB-CE2 4.36Å
1032P45.1Very low55.8Low75 Ų7582.4 Ų82.449%0.48745%0.446SS..  trans-63.6106.5174.425.7-31.4000108.7K1030 A1034 L1044K1030-P1032 VanDerWaalsContact O-CD 3.28Å; K1030-P1032 WeakPolarHBondContact O-CD 3.5Å; P1032-A1034 PolarHBondContact O-N 2.97Å; P1032-L1044 HydrophobicContact CB-CD2 4.33Å
1033E39.9Very low54.7Low169.8 Ų169.886.7 Ų86.779%0.79347%0.469SS*.  trans-59.4134157.5-68.1-176.317400106.8Q1031 C1035Q1031-E1033 VanDerWaalsContact C-N 3.32Å; Q1031-E1033 PolarHBondContact O-N 3.02Å; Q1031-E1033 VanDerWaalsContact O-N 3.16Å; E1033-C1035 VanDerWaalsContact C-N 3.28Å; E1033-C1035 PolarHBondContact O-N 3.12Å
1034A38.4Very low53.6Low100.8 Ų100.889.9 Ų89.983%0.83349%0.485SS*.  trans-51.950.9179.100000114P1032 S1036 L1701P1032-A1034 PolarHBondContact O-N 2.97Å; A1034-S1036 PolarHBondContact O-N 3.05Å; A1034-S1036 VanDerWaalsContact O-N 3.09Å; A1034-L1701 HydrophobicContact CB-CD2 4.47Å
1035C34.8Very low52.8Low93.2 Ų93.294.3 Ų94.363%0.6351%0.506SS*.  trans-88.8112.4175.2-81.60000108.8E1033 N1037E1033-C1035 VanDerWaalsContact C-N 3.28Å; E1033-C1035 PolarHBondContact O-N 3.12Å; C1035-N1037 PolarHBondContact O-N 3.17Å
1036S40.9Very low52.1Low103.8 Ų103.899.9 Ų99.973%0.72653%0.53SS*.  trans-5152.4175.5460000115.8A1034A1034-S1036 PolarHBondContact O-N 3.05Å; A1034-S1036 VanDerWaalsContact O-N 3.09Å
1037N43.3Very low51.4Low118.6 Ų118.6104.2 Ų104.263%0.63455%0.55SS*.  trans-128.6112.3172.8-66-17.8000112.1C1035 L1039 E1040C1035-N1037 PolarHBondContact O-N 3.17Å; N1037-L1039 PolarHBondContact O-N 3.02Å; N1037-L1039 VanDerWaalsContact O-N 3.16Å; N1037-E1040 PolarHBondContact O-N 3.34Å
1038N46.7Very low50.7Low153.4 Ų153.4102.6 Ų102.682%0.8255%0.545SS*.  trans-6415.6-176.7-64.6-23.5000114.9E1040N1038-E1040 PolarHBondContact O-N 3.49Å
1039L47Very low50.4Low141.8 Ų141.8103.9 Ų103.974%0.74255%0.552SS**THydrogen-bonded Turntrans-84.524.8175.2-71.2172.7000111.5N1037 L1041 L1044N1037-L1039 PolarHBondContact O-N 3.02Å; N1037-L1039 VanDerWaalsContact O-N 3.16Å; L1039-L1041 VanDerWaalsContact C-N 3.32Å; L1039-L1041 PolarHBondContact O-N 2.86Å; L1039-L1041 VanDerWaalsContact O-N 3.13Å; L1039-L1044 HydrophobicContact CB-CD1 3.9Å; L1039-L1044 HydrophobicContact CB-CG 4.04Å; L1039-L1044 WeakPolarHBondContact O-CD1 3.25Å
1040E50Low50.4Low127.6 Ų127.6108.6 Ų108.660%0.59658%0.576SS**  trans-79.138.7179.5-66.6176.9174.800111.4N1037 N1038 E1042 D1043 L1044N1037-E1040 PolarHBondContact O-N 3.34Å; N1038-E1040 PolarHBondContact O-N 3.49Å; E1040-E1042 PolarHBondContact O-N 3.13Å; E1040-D1043 PolarHBondContact O-N 3.09Å; E1040-L1044 HydrophobicContact CB-CD1 4.08Å; E1040-L1044 WeakPolarHBondContact O-CB 3.36Å; E1040-L1044 VanDerWaalsContact O-CD1 3.28Å; E1040-L1044 WeakPolarHBondContact O-CD1 3.01Å; E1040-L1044 WeakPolarHBondContact O-CG 3.49Å; E1040-L1044 PolarHBondContact O-N 3.1Å; E1040-L1044 VanDerWaalsContact O-N 3.11Å
1041L49Very low50.8Low104.4 Ų104.4105.5 Ų105.555%0.54756%0.564SS.*Hα-helixtrans-58.6-37.1-176.5-86.9146.2000113.2L1039 D1043 L1044 E1045L1039-L1041 VanDerWaalsContact C-N 3.32Å; L1039-L1041 PolarHBondContact O-N 2.86Å; L1039-L1041 VanDerWaalsContact O-N 3.13Å; L1041-D1043 PolarHBondContact O-N 3.48Å; L1041-L1044 PolarHBondContact O-N 2.87Å; L1041-E1045 VanDerWaalsContact O-CB 3.3Å; L1041-E1045 WeakPolarHBondContact O-CB 3.29Å; L1041-E1045 VanDerWaalsContact O-CG 3.27Å; L1041-E1045 WeakPolarHBondContact O-CG 3.36Å; L1041-E1045 PolarHBondContact O-N 2.96Å; L1041-E1045 VanDerWaalsContact O-N 3.14Å
1042E53.3Low51.2Low135.6 Ų135.6102.8 Ų102.863%0.63455%0.551SS**Hα-helixtrans-68.1-38-179.6-68.9-169.5178.500113.4E1040 E1045 K1046E1040-E1042 PolarHBondContact O-N 3.13Å; E1042-E1045 PolarHBondContact O-N 3.49Å; E1042-K1046 WeakPolarHBondContact O-CB 3.06Å; E1042-K1046 VanDerWaalsContact O-CG 3.22Å; E1042-K1046 WeakPolarHBondContact O-CG 3.26Å; E1042-K1046 PolarHBondContact O-N 3.31Å; E1042-K1046 VanDerWaalsContact O-N 3.13Å; E1042-K1046 IonicContact OE2-NZ 2.77Å
1043D54.6Low52.3Low94.8 Ų94.8101.5 Ų101.551%0.50755%0.545SS..Hα-helixtrans-75-38.4179.2-74.4-22.1000110.9E1040 L1041 E1045 K1046 E1047E1040-D1043 PolarHBondContact O-N 3.09Å; L1041-D1043 PolarHBondContact O-N 3.48Å; D1043-E1045 VanDerWaalsContact C-N 3.34Å; D1043-E1045 PolarHBondContact O-N 3.34Å; D1043-K1046 PolarHBondContact O-N 3.07Å; D1043-K1046 IonicContact OD1-NZ 3.45Å; D1043-E1047 PolarHBondContact O-N 3.06Å
1044L53.2Low53.8Low73.2 Ų73.297.1 Ų97.138%0.38353%0.527SS..Hα-helixtrans-63.3-39.4172-114.9113.3000111.9P1032 L1039 E1040 L1041 K1046 E1047 Q1048P1032-L1044 HydrophobicContact CB-CD2 4.33Å; L1039-L1044 HydrophobicContact CB-CD1 3.9Å; L1039-L1044 HydrophobicContact CB-CG 4.04Å; L1039-L1044 WeakPolarHBondContact O-CD1 3.25Å; E1040-L1044 HydrophobicContact CB-CD1 4.08Å; E1040-L1044 WeakPolarHBondContact O-CB 3.36Å; E1040-L1044 VanDerWaalsContact O-CD1 3.28Å; E1040-L1044 WeakPolarHBondContact O-CD1 3.01Å; E1040-L1044 WeakPolarHBondContact O-CG 3.49Å; E1040-L1044 PolarHBondContact O-N 3.1Å; E1040-L1044 VanDerWaalsContact O-N 3.11Å; L1041-L1044 PolarHBondContact O-N 2.87Å; L1044-K1046 VanDerWaalsContact C-N 3.33Å; L1044-K1046 PolarHBondContact O-N 2.99Å; L1044-E1047 PolarHBondContact O-N 3.27Å; L1044-Q1048 VanDerWaalsContact O-CB 3.28Å; L1044-Q1048 WeakPolarHBondContact O-CB 3.37Å; L1044-Q1048 VanDerWaalsContact O-CG 3.23Å; L1044-Q1048 WeakPolarHBondContact O-CG 3.18Å; L1044-Q1048 PolarHBondContact O-N 2.99Å
1045E56.1Low55.3Low92.6 Ų92.695.8 Ų95.843%0.43350%0.503SS..Hα-helixtrans-63.8-41.3175.6-80.8-174.6-170.600111.7L1041 E1042 D1043 Q1048 T1049 K1711L1041-E1045 VanDerWaalsContact O-CB 3.3Å; L1041-E1045 WeakPolarHBondContact O-CB 3.29Å; L1041-E1045 VanDerWaalsContact O-CG 3.27Å; L1041-E1045 WeakPolarHBondContact O-CG 3.36Å; L1041-E1045 PolarHBondContact O-N 2.96Å; L1041-E1045 VanDerWaalsContact O-N 3.14Å; E1042-E1045 PolarHBondContact O-N 3.49Å; D1043-E1045 VanDerWaalsContact C-N 3.34Å; D1043-E1045 PolarHBondContact O-N 3.34Å; E1045-Q1048 PolarHBondContact O-N 3.44Å; E1045-T1049 WeakPolarHBondContact O-CB 3.04Å; E1045-T1049 WeakPolarHBondContact O-CG2 3.31Å; E1045-T1049 PolarHBondContact O-N 3.13Å; E1045-T1049 PolarHBondContact O-OG1 2.93Å; E1045-K1711 IonicContact OE1-NZ 3.5Å; E1045-K1711 IonicContact OE2-NZ 2.62Å; E1045-K1711 PolarHBondContact OE2-NZ 2.75Å
1046K59.1Low56.9Low118.6 Ų118.692 Ų9252%0.51648%0.477SS..Hα-helixtrans-66.8-44.8176.3-73.5173.2-167.9155.80112E1042 D1043 L1044 Q1048 T1049 L1050E1042-K1046 WeakPolarHBondContact O-CB 3.06Å; E1042-K1046 VanDerWaalsContact O-CG 3.22Å; E1042-K1046 WeakPolarHBondContact O-CG 3.26Å; E1042-K1046 PolarHBondContact O-N 3.31Å; E1042-K1046 VanDerWaalsContact O-N 3.13Å; E1042-K1046 IonicContact OE2-NZ 2.77Å; D1043-K1046 PolarHBondContact O-N 3.07Å; D1043-K1046 IonicContact OD1-NZ 3.45Å; L1044-K1046 VanDerWaalsContact C-N 3.33Å; L1044-K1046 PolarHBondContact O-N 2.99Å; K1046-Q1048 VanDerWaalsContact C-N 3.32Å; K1046-Q1048 PolarHBondContact O-N 3.38Å; K1046-T1049 VanDerWaalsContact CA-OG1 3.31Å; K1046-T1049 WeakPolarHBondContact CA-OG1 3.28Å; K1046-T1049 PolarHBondContact O-N 3.17Å; K1046-T1049 PolarHBondContact O-OG1 3.15Å; K1046-L1050 WeakPolarHBondContact O-CB 3.45Å; K1046-L1050 WeakPolarHBondContact O-CG 3.41Å; K1046-L1050 PolarHBondContact O-N 3.14Å; K1046-L1050 VanDerWaalsContact O-N 3.08Å
1047E57.5Low58.3Low121 Ų12193.1 Ų93.157%0.56547%0.465SS*.Hα-helixtrans-61.7-44.1175.4-75.5-171.2160.800111.2D1043 L1044 T1049 L1050 E1051D1043-E1047 PolarHBondContact O-N 3.06Å; L1044-E1047 PolarHBondContact O-N 3.27Å; E1047-T1049 PolarHBondContact O-N 2.99Å; E1047-L1050 WeakPolarHBondContact O-CB 3.32Å; E1047-L1050 PolarHBondContact O-N 3.09Å; E1047-L1050 VanDerWaalsContact O-N 3.16Å; E1047-E1051 WeakPolarHBondContact O-CB 3.36Å; E1047-E1051 WeakPolarHBondContact O-CG 3.38Å; E1047-E1051 PolarHBondContact O-N 3.03Å
1048Q57.8Low59.5Low35.4 Ų35.491.5 Ų91.517%0.16546%0.457CS..Hα-helixtrans-62.2-40.5176-75.9172.514.900112.6V1029 K1030 L1044 E1045 K1046 L1050 E1051 L1052V1029-Q1048 HydrophobicContact CG1-CB 4.5Å; V1029-Q1048 HydrophobicContact CG1-CG 4.39Å; K1030-Q1048 PolarHBondContact O-NE2 2.97Å; L1044-Q1048 VanDerWaalsContact O-CB 3.28Å; L1044-Q1048 WeakPolarHBondContact O-CB 3.37Å; L1044-Q1048 VanDerWaalsContact O-CG 3.23Å; L1044-Q1048 WeakPolarHBondContact O-CG 3.18Å; L1044-Q1048 PolarHBondContact O-N 2.99Å; E1045-Q1048 PolarHBondContact O-N 3.44Å; K1046-Q1048 VanDerWaalsContact C-N 3.32Å; K1046-Q1048 PolarHBondContact O-N 3.38Å; Q1048-L1050 VanDerWaalsContact C-N 3.31Å; Q1048-L1050 PolarHBondContact O-N 3.13Å; Q1048-E1051 PolarHBondContact O-N 3.05Å; Q1048-L1052 VanDerWaalsContact O-CB 3.26Å; Q1048-L1052 WeakPolarHBondContact O-CB 3.44Å; Q1048-L1052 WeakPolarHBondContact O-CD1 3.22Å; Q1048-L1052 VanDerWaalsContact O-CG 3.26Å; Q1048-L1052 WeakPolarHBondContact O-CG 3.29Å; Q1048-L1052 PolarHBondContact O-N 3.24Å
1049T58.4Low60.6Low68.8 Ų68.885.5 Ų85.542%0.42242%0.424SS..Hα-helixtrans-66-34.7176.254.20000112.4E1045 K1046 E1047 S1053E1045-T1049 WeakPolarHBondContact O-CB 3.04Å; E1045-T1049 WeakPolarHBondContact O-CG2 3.31Å; E1045-T1049 PolarHBondContact O-N 3.13Å; E1045-T1049 PolarHBondContact O-OG1 2.93Å; K1046-T1049 VanDerWaalsContact CA-OG1 3.31Å; K1046-T1049 WeakPolarHBondContact CA-OG1 3.28Å; K1046-T1049 PolarHBondContact O-N 3.17Å; K1046-T1049 PolarHBondContact O-OG1 3.15Å; E1047-T1049 PolarHBondContact O-N 2.99Å; T1049-S1053 VanDerWaalsContact O-CB 3.29Å; T1049-S1053 WeakPolarHBondContact O-CB 3.21Å; T1049-S1053 PolarHBondContact O-N 3.11Å; T1049-S1053 PolarHBondContact O-OG 3.34Å
1050L63.5Low61.5Low110.6 Ų110.680.3 Ų80.358%0.57940%0.397SS*.Hα-helixtrans-70.9-42173.6-95.5142.5000112.2K1046 E1047 Q1048 S1053 N1054K1046-L1050 WeakPolarHBondContact O-CB 3.45Å; K1046-L1050 WeakPolarHBondContact O-CG 3.41Å; K1046-L1050 PolarHBondContact O-N 3.14Å; K1046-L1050 VanDerWaalsContact O-N 3.08Å; E1047-L1050 WeakPolarHBondContact O-CB 3.32Å; E1047-L1050 PolarHBondContact O-N 3.09Å; E1047-L1050 VanDerWaalsContact O-N 3.16Å; Q1048-L1050 VanDerWaalsContact C-N 3.31Å; Q1048-L1050 PolarHBondContact O-N 3.13Å; L1050-S1053 PolarHBondContact O-N 3.14Å; L1050-N1054 WeakPolarHBondContact O-CB 3.31Å; L1050-N1054 PolarHBondContact O-N 3.19Å; L1050-N1054 PolarHBondContact O-ND2 3.14Å; L1050-N1054 VanDerWaalsContact O-ND2 3.11Å
1051E64.9Low62.2Low97.2 Ų97.278 Ų7845%0.45439%0.388SS..Hα-helixtrans-62.2-48173.9-74.5-174.3169.600111.1V1029 E1047 Q1048 S1053 N1054 E1055V1029-E1051 HydrophobicContact CG1-CB 4.44Å; E1047-E1051 WeakPolarHBondContact O-CB 3.36Å; E1047-E1051 WeakPolarHBondContact O-CG 3.38Å; E1047-E1051 PolarHBondContact O-N 3.03Å; Q1048-E1051 PolarHBondContact O-N 3.05Å; E1051-S1053 VanDerWaalsContact C-N 3.34Å; E1051-S1053 PolarHBondContact O-N 3.06Å; E1051-N1054 PolarHBondContact O-N 3.17Å; E1051-E1055 WeakPolarHBondContact O-CB 3.27Å; E1051-E1055 PolarHBondContact O-N 2.97Å
1052L62.3Low62.8Low21.8 Ų21.876.3 Ų76.311%0.11438%0.382CS..Hα-helixtrans-56-49.6173.2-79.5163.8000111.2L1026 V1029 Q1048 N1054 E1055 V1056 Q1712L1026-L1052 HydrophobicContact CD2-CD2 3.86Å; L1026-L1052 HydrophobicContact CG-CD2 4.45Å; V1029-L1052 HydrophobicContact CB-CD2 3.7Å; V1029-L1052 VanDerWaalsContact CB-CD2 3.44Å; V1029-L1052 HydrophobicContact CB-CG 4.08Å; V1029-L1052 HydrophobicContact CG1-CD1 4.44Å; V1029-L1052 HydrophobicContact CG1-CD2 4.07Å; V1029-L1052 HydrophobicContact CG1-CG 3.87Å; V1029-L1052 HydrophobicContact CG2-CD2 3.41Å; V1029-L1052 HydrophobicContact CG2-CG 3.85Å; Q1048-L1052 VanDerWaalsContact O-CB 3.26Å; Q1048-L1052 WeakPolarHBondContact O-CB 3.44Å; Q1048-L1052 WeakPolarHBondContact O-CD1 3.22Å; Q1048-L1052 VanDerWaalsContact O-CG 3.26Å; Q1048-L1052 WeakPolarHBondContact O-CG 3.29Å; Q1048-L1052 PolarHBondContact O-N 3.24Å; L1052-N1054 VanDerWaalsContact C-N 3.31Å; L1052-N1054 PolarHBondContact O-N 3.22Å; L1052-E1055 PolarHBondContact O-N 3.26Å; L1052-V1056 VanDerWaalsContact O-CB 3.23Å; L1052-V1056 WeakPolarHBondContact O-CB 3.47Å; L1052-V1056 WeakPolarHBondContact O-CG2 3.31Å; L1052-V1056 PolarHBondContact O-N 3.29Å; L1052-Q1712 HydrophobicContact CD1-CB 4.12Å; L1052-Q1712 HydrophobicContact CD1-CG 4.16Å
1053S67.6Low63.2Low49 Ų4970.9 Ų70.934%0.34336%0.357SS..Hα-helixtrans-61.5-39.7-179.6-138.40000111.7T1049 L1050 E1051 R1057T1049-S1053 VanDerWaalsContact O-CB 3.29Å; T1049-S1053 WeakPolarHBondContact O-CB 3.21Å; T1049-S1053 PolarHBondContact O-N 3.11Å; T1049-S1053 PolarHBondContact O-OG 3.34Å; L1050-S1053 PolarHBondContact O-N 3.14Å; E1051-S1053 VanDerWaalsContact C-N 3.34Å; E1051-S1053 PolarHBondContact O-N 3.06Å; S1053-R1057 WeakPolarHBondContact O-CB 3.35Å; S1053-R1057 PolarHBondContact O-N 3.02Å
1054N70.5Confident63.8Low77.4 Ų77.467.5 Ų67.541%0.41434%0.338SS..Hα-helixtrans-69.5-43.5177.1-77.2-38.5000112.4L1050 E1051 L1052 R1057 N1058L1050-N1054 WeakPolarHBondContact O-CB 3.31Å; L1050-N1054 PolarHBondContact O-N 3.19Å; L1050-N1054 PolarHBondContact O-ND2 3.14Å; L1050-N1054 VanDerWaalsContact O-ND2 3.11Å; E1051-N1054 PolarHBondContact O-N 3.17Å; L1052-N1054 VanDerWaalsContact C-N 3.31Å; L1052-N1054 PolarHBondContact O-N 3.22Å; N1054-R1057 PolarHBondContact O-N 3.06Å; N1054-R1057 PolarHBondContact OD1-NH2 3Å; N1054-R1057 VanDerWaalsContact OD1-NH2 3.15Å; N1054-N1058 WeakPolarHBondContact O-CB 3.31Å; N1054-N1058 PolarHBondContact O-N 3.07Å; N1054-N1058 PolarHBondContact O-ND2 3.18Å
1055E70.2Confident64Low72 Ų7267.7 Ų67.734%0.33634%0.344SS..Hα-helixtrans-69.9-40.7179.8-144.1139.7172.800111.6T1025 S1028 V1029 E1051 L1052 R1057 N1058 Q1059T1025-E1055 HydrophobicContact CG2-CB 3.8Å; T1025-E1055 HydrophobicContact CG2-CG 3.55Å; T1025-E1055 VanDerWaalsContact CG2-CG 3.43Å; S1028-E1055 WeakPolarHBondContact CB-OE1 3.39Å; S1028-E1055 VanDerWaalsContact OG-CD 3.3Å; S1028-E1055 PolarHBondContact OG-OE1 3.25Å; S1028-E1055 PolarHBondContact OG-OE2 3.4Å; V1029-E1055 HydrophobicContact CG2-CB 4.38Å; V1029-E1055 VanDerWaalsContact CG2-OE2 3.22Å; V1029-E1055 WeakPolarHBondContact CG2-OE2 3.44Å; E1051-E1055 WeakPolarHBondContact O-CB 3.27Å; E1051-E1055 PolarHBondContact O-N 2.97Å; L1052-E1055 PolarHBondContact O-N 3.26Å; E1055-R1057 VanDerWaalsContact C-N 3.34Å; E1055-R1057 PolarHBondContact O-N 2.99Å; E1055-N1058 PolarHBondContact O-N 3.18Å; E1055-Q1059 HydrophobicContact CG-CG 4.44Å; E1055-Q1059 WeakPolarHBondContact O-CB 3.32Å; E1055-Q1059 WeakPolarHBondContact O-CG 3.37Å; E1055-Q1059 PolarHBondContact O-N 3.02Å
1056V69.8Low63.5Low15 Ų1568.1 Ų68.19%0.09135%0.348CS..Hα-helixtrans-62-44.2172.5171.50000110.4L1022 T1025 L1026 L1052 N1058 Q1059 L1060 M1716 I1720L1022-V1056 HydrophobicContact CD2-CG1 4.16Å; T1025-V1056 HydrophobicContact CG2-CG2 4.21Å; L1026-V1056 HydrophobicContact CD2-CG2 4.38Å; L1052-V1056 VanDerWaalsContact O-CB 3.23Å; L1052-V1056 WeakPolarHBondContact O-CB 3.47Å; L1052-V1056 WeakPolarHBondContact O-CG2 3.31Å; L1052-V1056 PolarHBondContact O-N 3.29Å; V1056-N1058 VanDerWaalsContact C-N 3.34Å; V1056-N1058 PolarHBondContact O-N 3.27Å; V1056-Q1059 CarbonylContact O-C 3.55Å; V1056-Q1059 PolarHBondContact O-N 3.12Å; V1056-L1060 HydrophobicContact CG1-CD1 3.92Å; V1056-L1060 HydrophobicContact CG1-CG 4.24Å; V1056-L1060 WeakPolarHBondContact O-CB 3.31Å; V1056-L1060 VanDerWaalsContact O-CG 3.28Å; V1056-L1060 WeakPolarHBondContact O-CG 3.29Å; V1056-L1060 PolarHBondContact O-N 3.09Å; V1056-M1716 HydrophobicContact CG2-CG 3.78Å; V1056-M1716 HydrophobicContact CG2-SD 4.19Å; V1056-I1720 HydrophobicContact CG1-CD1 4.26Å; V1056-I1720 HydrophobicContact CG1-CG1 3.55Å
1057R69.1Low62.7Low126.8 Ų126.869.2 Ų69.248%0.47836%0.36SS..Hα-helixtrans-61.3-43.2175.7-176.7177.910288.52.5111.8S1053 N1054 E1055 Q1059 L1060 L1061S1053-R1057 WeakPolarHBondContact O-CB 3.35Å; S1053-R1057 PolarHBondContact O-N 3.02Å; N1054-R1057 PolarHBondContact O-N 3.06Å; N1054-R1057 PolarHBondContact OD1-NH2 3Å; N1054-R1057 VanDerWaalsContact OD1-NH2 3.15Å; E1055-R1057 VanDerWaalsContact C-N 3.34Å; E1055-R1057 PolarHBondContact O-N 2.99Å; R1057-Q1059 VanDerWaalsContact C-N 3.33Å; R1057-L1060 PolarHBondContact O-N 2.98Å; R1057-L1061 HydrophobicContact CG-CD1 4.27Å; R1057-L1061 WeakPolarHBondContact O-CB 3.39Å; R1057-L1061 WeakPolarHBondContact O-CD1 3.39Å; R1057-L1061 VanDerWaalsContact O-CG 3.3Å; R1057-L1061 WeakPolarHBondContact O-CG 3.36Å; R1057-L1061 PolarHBondContact O-N 3.31Å
1058N69.4Low61.4Low84 Ų8469.6 Ų69.645%0.44937%0.366SS..Hα-helixtrans-64.2-41.5176.4-70-21.4000111.4N1054 E1055 V1056 L1061 T1062N1054-N1058 WeakPolarHBondContact O-CB 3.31Å; N1054-N1058 PolarHBondContact O-N 3.07Å; N1054-N1058 PolarHBondContact O-ND2 3.18Å; E1055-N1058 PolarHBondContact O-N 3.18Å; V1056-N1058 VanDerWaalsContact C-N 3.34Å; V1056-N1058 PolarHBondContact O-N 3.27Å; N1058-L1061 WeakPolarHBondContact O-CB 3.38Å; N1058-L1061 PolarHBondContact O-N 3.13Å; N1058-T1062 WeakPolarHBondContact O-CG2 3.37Å; N1058-T1062 PolarHBondContact O-N 3.13Å; N1058-T1062 VanDerWaalsContact O-N 3.12Å; N1058-T1062 PolarHBondContact O-OG1 2.79Å
1059Q69.5Low60.3Low27.6 Ų27.675.4 Ų75.413%0.12940%0.397CS..Hα-helixtrans-67.3-41.8175.4-76.8-122.9-3.900112.4S878 C1021 T1025 E1055 V1056 R1057 L1061 T1062 L1063S878-Q1059 PolarHBondContact OG-NE2 3.21Å; S878-Q1059 PolarHBondContact OG-OE1 2.91Å; C1021-Q1059 PolarHBondContact O-OE1 3.13Å; T1025-Q1059 HydrophobicContact CG2-CG 3.97Å; T1025-Q1059 VanDerWaalsContact OG1-CG 3.3Å; T1025-Q1059 WeakPolarHBondContact OG1-CG 3.33Å; T1025-Q1059 PolarHBondContact OG1-NE2 3.19Å; T1025-Q1059 PolarHBondContact OG1-OE1 3.23Å; E1055-Q1059 HydrophobicContact CG-CG 4.44Å; E1055-Q1059 WeakPolarHBondContact O-CB 3.32Å; E1055-Q1059 WeakPolarHBondContact O-CG 3.37Å; E1055-Q1059 PolarHBondContact O-N 3.02Å; V1056-Q1059 CarbonylContact O-C 3.55Å; V1056-Q1059 PolarHBondContact O-N 3.12Å; R1057-Q1059 VanDerWaalsContact C-N 3.33Å; Q1059-L1061 VanDerWaalsContact C-N 3.31Å; Q1059-L1061 PolarHBondContact O-N 3.22Å; Q1059-T1062 WeakPolarHBondContact CA-OG1 3.35Å; Q1059-T1062 CarbonylContact O-C 3.49Å; Q1059-T1062 WeakPolarHBondContact O-CA 3.12Å; Q1059-T1062 WeakPolarHBondContact O-CB 3.44Å; Q1059-T1062 PolarHBondContact O-N 3.22Å; Q1059-T1062 VanDerWaalsContact O-N 3.1Å; Q1059-T1062 PolarHBondContact O-OG1 3.16Å; Q1059-L1063 WeakPolarHBondContact O-CB 3.48Å; Q1059-L1063 VanDerWaalsContact O-CG 3.26Å; Q1059-L1063 WeakPolarHBondContact O-CG 3.35Å; Q1059-L1063 PolarHBondContact O-N 3.26Å
1060L65.9Low59Low32.8 Ų32.876.9 Ų76.917%0.17241%0.411CS..Hα-helixtrans-61.5-39.7174.9-74.5174000111.6L1022 V1056 R1057 T1062 L1063 F1064 I1720 Q1723 L1724L1022-L1060 HydrophobicContact CD2-CD2 4.1Å; L1022-L1060 HydrophobicContact CD2-CG 4.36Å; V1056-L1060 HydrophobicContact CG1-CD1 3.92Å; V1056-L1060 HydrophobicContact CG1-CG 4.24Å; V1056-L1060 WeakPolarHBondContact O-CB 3.31Å; V1056-L1060 VanDerWaalsContact O-CG 3.28Å; V1056-L1060 WeakPolarHBondContact O-CG 3.29Å; V1056-L1060 PolarHBondContact O-N 3.09Å; R1057-L1060 PolarHBondContact O-N 2.98Å; L1060-T1062 VanDerWaalsContact C-N 3.27Å; L1060-T1062 PolarHBondContact O-N 3.23Å; L1060-L1063 PolarHBondContact O-N 3.17Å; L1060-F1064 HydrophobicContact CD2-CD2 4.24Å; L1060-F1064 HydrophobicContact CD2-CE2 4.16Å; L1060-F1064 WeakPolarHBondContact O-CB 3.22Å; L1060-F1064 PolarHBondContact O-N 3.06Å; L1060-I1720 HydrophobicContact CD1-CG1 4.26Å; L1060-I1720 HydrophobicContact CD2-CG2 4.45Å; L1060-Q1723 HydrophobicContact CD1-CB 4.15Å; L1060-L1724 HydrophobicContact CD1-CD2 4.47Å; L1060-L1724 HydrophobicContact CD1-CG 4.37Å; L1060-L1724 HydrophobicContact CD2-CD1 4.25Å; L1060-L1724 HydrophobicContact CD2-CD2 4.29Å; L1060-L1724 HydrophobicContact CD2-CG 4.44Å
1061L63.6Low57.5Low78.8 Ų78.879.6 Ų79.641%0.41342%0.42SS..Hα-helixtrans-62.4-31.6172.7-76.4163.2000112.5R1057 N1058 Q1059 F1064 L1066R1057-L1061 HydrophobicContact CG-CD1 4.27Å; R1057-L1061 WeakPolarHBondContact O-CB 3.39Å; R1057-L1061 WeakPolarHBondContact O-CD1 3.39Å; R1057-L1061 VanDerWaalsContact O-CG 3.3Å; R1057-L1061 WeakPolarHBondContact O-CG 3.36Å; R1057-L1061 PolarHBondContact O-N 3.31Å; N1058-L1061 WeakPolarHBondContact O-CB 3.38Å; N1058-L1061 PolarHBondContact O-N 3.13Å; Q1059-L1061 VanDerWaalsContact C-N 3.31Å; Q1059-L1061 PolarHBondContact O-N 3.22Å; L1061-F1064 CarbonylContact O-C 3.46Å; L1061-L1066 HydrophobicContact CD2-CD1 3.87Å
1062T62.9Low55.8Low69.4 Ų69.481.7 Ų81.743%0.42643%0.434SS..Hα-helixtrans-78.2-35.4175.146.60000113.1N1058 Q1059 L1060 L1088N1058-T1062 WeakPolarHBondContact O-CG2 3.37Å; N1058-T1062 PolarHBondContact O-N 3.13Å; N1058-T1062 VanDerWaalsContact O-N 3.12Å; N1058-T1062 PolarHBondContact O-OG1 2.79Å; Q1059-T1062 WeakPolarHBondContact CA-OG1 3.35Å; Q1059-T1062 CarbonylContact O-C 3.49Å; Q1059-T1062 WeakPolarHBondContact O-CA 3.12Å; Q1059-T1062 WeakPolarHBondContact O-CB 3.44Å; Q1059-T1062 PolarHBondContact O-N 3.22Å; Q1059-T1062 VanDerWaalsContact O-N 3.1Å; Q1059-T1062 PolarHBondContact O-OG1 3.16Å; L1060-T1062 VanDerWaalsContact C-N 3.27Å; L1060-T1062 PolarHBondContact O-N 3.23Å; T1062-L1088 HydrophobicContact CG2-CD2 3.95Å; T1062-L1088 WeakPolarHBondContact O-CD2 3.3Å
1063L61.5Low54.3Low21.6 Ų21.688.9 Ų88.911%0.11347%0.472CS..Hα-helixtrans-77.8-32.9179.6-66.6175.8000112.4Q1018 C1021 L1022 Q1059 L1060 L1091Q1018-L1063 HydrophobicContact CB-CD1 4.35Å; Q1018-L1063 HydrophobicContact CG-CD1 4.4Å; Q1018-L1063 HydrophobicContact CG-CD2 4.21Å; C1021-L1063 HydrophobicContact CB-CD1 4.15Å; C1021-L1063 HydrophobicContact CB-CD2 4.14Å; L1022-L1063 HydrophobicContact CD2-CD1 4.37Å; L1022-L1063 HydrophobicContact CG-CD1 4.31Å; Q1059-L1063 WeakPolarHBondContact O-CB 3.48Å; Q1059-L1063 VanDerWaalsContact O-CG 3.26Å; Q1059-L1063 WeakPolarHBondContact O-CG 3.35Å; Q1059-L1063 PolarHBondContact O-N 3.26Å; L1060-L1063 PolarHBondContact O-N 3.17Å; L1063-L1091 HydrophobicContact CD2-CD1 4.16Å
1064F67.3Low52.6Low23.8 Ų23.894 Ų9410%0.10449%0.491CS..SBendtrans-126.885.3178.9-57.4-77.4000109.5L1060 L1061 L1066 Q1130 Q1131 L1134 L1724L1060-F1064 HydrophobicContact CD2-CD2 4.24Å; L1060-F1064 HydrophobicContact CD2-CE2 4.16Å; L1060-F1064 WeakPolarHBondContact O-CB 3.22Å; L1060-F1064 PolarHBondContact O-N 3.06Å; L1061-F1064 CarbonylContact O-C 3.46Å; F1064-L1066 PolarHBondContact O-N 3.07Å; F1064-L1066 VanDerWaalsContact O-N 3.15Å; F1064-Q1130 HydrophobicContact CE1-CB 4.08Å; F1064-Q1131 HydrophobicContact CD1-CG 4.06Å; F1064-Q1131 HydrophobicContact CD2-CG 4.44Å; F1064-Q1131 HydrophobicContact CE1-CG 3.81Å; F1064-Q1131 HydrophobicContact CE2-CG 4.28Å; F1064-Q1131 HydrophobicContact CG-CG 4.39Å; F1064-Q1131 HydrophobicContact CZ-CG 3.93Å; F1064-L1134 HydrophobicContact CE2-CD2 3.76Å; F1064-L1134 HydrophobicContact CZ-CD2 3.79Å; F1064-L1724 HydrophobicContact CD2-CD2 4.36Å; F1064-L1724 HydrophobicContact CE2-CD2 4.47Å
1065P57.7Low50.7Low77 Ų7797.9 Ų97.950%0.551%0.509SS..  trans-61.1113173.93.9-1.7000109.1N1067 L1088P1065-N1067 PolarHBondContact O-N 3.03Å; P1065-L1088 HydrophobicContact CB-CD2 4.34Å; P1065-L1088 HydrophobicContact CG-CD2 4.18Å
1066L46.2Very low49Very low100.8 Ų100.8101.2 Ų101.253%0.52853%0.528SS..  trans-62.2129.5166.1-87.793.5000107.6L1061 F1064 N1068L1061-L1066 HydrophobicContact CD2-CD1 3.87Å; F1064-L1066 PolarHBondContact O-N 3.07Å; F1064-L1066 VanDerWaalsContact O-N 3.15Å; L1066-N1068 PolarHBondContact O-N 3.25Å
1067N40.2Very low47.1Very low143.4 Ų143.4107.9 Ų107.977%0.76756%0.563SS**  trans-58.474.4173.6-78.6-12.7000111.7P1065 L1069P1065-N1067 PolarHBondContact O-N 3.03Å; N1067-L1069 PolarHBondContact O-N 3.14Å; N1067-L1069 VanDerWaalsContact O-N 3.16Å
1068N31.5Very low45.3Very low127.6 Ų127.6105.3 Ų105.368%0.68257%0.565SS**  trans-87.361.6164.1-79.3-12.5000108.7L1066 S1070L1066-N1068 PolarHBondContact O-N 3.25Å; N1068-S1070 PolarHBondContact O-N 3.21Å
1069L33.4Very low43.5Very low158.6 Ų158.6107.5 Ų107.583%0.8358%0.584SS**THydrogen-bonded Turntrans-75.212.9167.8-82.9170.8000112.8N1067 Q1071N1067-L1069 PolarHBondContact O-N 3.14Å; N1067-L1069 VanDerWaalsContact O-N 3.16Å; L1069-Q1071 VanDerWaalsContact C-N 3.34Å; L1069-Q1071 PolarHBondContact O-N 3.15Å
1070S32.3Very low41.6Very low100.2 Ų100.2114.1 Ų114.170%0.70161%0.612SS**THydrogen-bonded Turntrans-113.817.9-173.753.30000115.3N1068N1068-S1070 PolarHBondContact O-N 3.21Å
1071Q31.4Very low39.9Very low167.4 Ų167.4123.7 Ų123.778%0.78265%0.648SS**SBendtrans-130.762.1169.1-81.4-175.5-12.600114.1L1069L1069-Q1071 VanDerWaalsContact C-N 3.34Å; L1069-Q1071 PolarHBondContact O-N 3.15Å
1072N30.2Very low38.2Very low140.2 Ų140.2125.6 Ų125.675%0.7566%0.658SS**  trans106.158.2162.9-57.8-16.9000115.9E1074N1072-E1074 HydrophobicContact CB-CB 4.36Å; N1072-E1074 HydrophobicContact CB-CG 4.39Å; N1072-E1074 PolarHBondContact O-N 3.33Å; N1072-E1074 VanDerWaalsContact O-N 3.08Å
1073L29.2Very low36.9Very low173.6 Ų173.6127.6 Ų127.691%0.90968%0.675SS**  trans-74.647.3151.7-82.6161.5000110.9M1075L1073-M1075 PolarHBondContact O-N 3.1Å
1074E33.6Very low35.5Very low156 Ų156131.1 Ų131.173%0.72970%0.698SS**  trans-92.696163.3-74.7-170.5170.400108N1072 N1076N1072-E1074 HydrophobicContact CB-CB 4.36Å; N1072-E1074 HydrophobicContact CB-CG 4.39Å; N1072-E1074 PolarHBondContact O-N 3.33Å; N1072-E1074 VanDerWaalsContact O-N 3.08Å; E1074-N1076 VanDerWaalsContact C-N 3.34Å; E1074-N1076 PolarHBondContact O-N 3.36Å
1075M30.3Very low33.9Very low160.2 Ų160.2137.2 Ų137.279%0.78973%0.727SS**  trans-24.791.7159.7-63.6-76.3-68.300112.6L1073L1073-M1075 PolarHBondContact O-N 3.1Å
1076N33.2Very low33Very low141 Ų141139.3 Ų139.375%0.75473%0.733SS**  trans-131.390.9164.2-83.8-40.6000107.9E1074 S1078E1074-N1076 VanDerWaalsContact C-N 3.34Å; E1074-N1076 PolarHBondContact O-N 3.36Å; N1076-S1078 VanDerWaalsContact C-N 3.3Å; N1076-S1078 PolarHBondContact O-N 3.16Å
1077D31.6Very low32.7Very low154.2 Ų154.2140.7 Ų140.783%0.82574%0.735SS**  trans-51.395.7168.2-68.9-48000110.9
1078S30Very low32.7Very low73.8 Ų73.8138 Ų13852%0.51672%0.72SS.*  trans-164.3116147.356.60000110.3N1076 K1080N1076-S1078 VanDerWaalsContact C-N 3.3Å; N1076-S1078 PolarHBondContact O-N 3.16Å; S1078-K1080 VanDerWaalsContact C-N 3.26Å; S1078-K1080 PolarHBondContact O-N 3.07Å
1079P32.1Very low33.4Very low129.6 Ų129.6135 Ų13584%0.84271%0.707SS**  trans-77.976.8173.733-30.8000107.8Y1081P1079-Y1081 PolarHBondContact O-N 3.19Å
1080K29.2Very low34.3Very low166.8 Ų166.8129.7 Ų129.773%0.72568%0.679SS**  trans-81.2108.3167.3-79.7-178.9178.6174.30107.3S1078 N1082S1078-K1080 VanDerWaalsContact C-N 3.26Å; S1078-K1080 PolarHBondContact O-N 3.07Å; K1080-N1082 VanDerWaalsContact C-N 3.32Å; K1080-N1082 PolarHBondContact O-N 3.24Å
1081Y30.6Very low35.4Very low233 Ų233125.9 Ų125.991%0.91465%0.65SS**  trans-36.283.1165.6-82.4-99.7000112.2P1079 S1083P1079-Y1081 PolarHBondContact O-N 3.19Å; Y1081-S1083 PolarHBondContact O-N 3.27Å
1082N28.3Very low37Very low119.2 Ų119.2118.9 Ų118.964%0.63762%0.618SS**  trans-96.9108.5164.1-80.1-16000106.1K1080 T1084 E1085K1080-N1082 VanDerWaalsContact C-N 3.32Å; K1080-N1082 PolarHBondContact O-N 3.24Å; N1082-T1084 PolarHBondContact O-N 3Å; N1082-T1084 PolarHBondContact O-OG1 3.2Å; N1082-E1085 PolarHBondContact O-N 3.04Å
1083S34.4Very low38.5Very low111.8 Ų111.8112.4 Ų112.478%0.78258%0.584SS**THydrogen-bonded Turntrans-58.122.4178.449.60000115.5Y1081Y1081-S1083 PolarHBondContact O-N 3.27Å
1084T32.2Very low40.1Very low95.6 Ų95.6104.4 Ų104.459%0.58754%0.542SS*.THydrogen-bonded Turntrans-100.2-14.7177.948.80000113.2N1082 D1086 K1087N1082-T1084 PolarHBondContact O-N 3Å; N1082-T1084 PolarHBondContact O-OG1 3.2Å; T1084-D1086 VanDerWaalsContact C-N 3.28Å; T1084-D1086 PolarHBondContact O-N 3.23Å; T1084-K1087 PolarHBondContact O-N 3.18Å
1085E34.1Very low41.3Very low151.8 Ų151.898.8 Ų98.871%0.70953%0.526SS*.Hα-helixtrans-68.2-24.4178.4-73.6-169.9160.800113.2N1082 K1087 L1088 T1089N1082-E1085 PolarHBondContact O-N 3.04Å; E1085-K1087 PolarHBondContact O-N 3.22Å; E1085-L1088 PolarHBondContact O-N 3.34Å; E1085-T1089 WeakPolarHBondContact O-CB 3.41Å; E1085-T1089 VanDerWaalsContact O-CG2 3.27Å; E1085-T1089 WeakPolarHBondContact O-CG2 3.36Å; E1085-T1089 PolarHBondContact O-N 3.13Å; E1085-T1089 PolarHBondContact O-OG1 2.91Å
1086D39.6Very low42.7Very low120.2 Ų120.298 Ų9864%0.64352%0.515SS*.Hα-helixtrans-72.4-30.7179.3-79.6-10.7000112.6T1084 L1088 T1089 I1090T1084-D1086 VanDerWaalsContact C-N 3.28Å; T1084-D1086 PolarHBondContact O-N 3.23Å; D1086-L1088 PolarHBondContact O-N 3.2Å; D1086-T1089 PolarHBondContact O-N 2.94Å; D1086-T1089 PolarHBondContact O-OG1 3.29Å; D1086-I1090 HydrophobicContact CB-CD1 4.23Å; D1086-I1090 WeakPolarHBondContact O-CB 3.36Å; D1086-I1090 WeakPolarHBondContact O-CD1 3.4Å; D1086-I1090 WeakPolarHBondContact O-CG1 3.31Å; D1086-I1090 PolarHBondContact O-N 3.19Å; D1086-I1090 VanDerWaalsContact O-N 3.17Å
1087K40.3Very low43.8Very low129.6 Ų129.697.5 Ų97.556%0.56351%0.508SS*.Hα-helixtrans-75.2-36-175-74-168174.9-1660114.3D879 T1084 E1085 T1089 I1090D879-K1087 IonicContact OD1-NZ 3.81Å; T1084-K1087 PolarHBondContact O-N 3.18Å; E1085-K1087 PolarHBondContact O-N 3.22Å; K1087-T1089 VanDerWaalsContact C-N 3.26Å; K1087-T1089 PolarHBondContact O-N 2.89Å; K1087-I1090 HydrophobicContact CG-CD1 4.47Å
1088L39.7Very low45.3Very low87.2 Ų87.290.3 Ų90.346%0.45747%0.471SS..Hα-helixtrans-78.5-27.2-176.9-70.5166.4000112.6T1062 P1065 E1085 D1086T1062-L1088 HydrophobicContact CG2-CD2 3.95Å; T1062-L1088 WeakPolarHBondContact O-CD2 3.3Å; P1065-L1088 HydrophobicContact CB-CD2 4.34Å; P1065-L1088 HydrophobicContact CG-CD2 4.18Å; E1085-L1088 PolarHBondContact O-N 3.34Å; D1086-L1088 PolarHBondContact O-N 3.2Å
1089T46.8Very low47.2Very low65.6 Ų65.693.5 Ų93.540%0.40248%0.478SS..Hα-helixtrans-90.1-14-174.352.70000113.2E1085 D1086 K1087 L1091 N1092E1085-T1089 WeakPolarHBondContact O-CB 3.41Å; E1085-T1089 VanDerWaalsContact O-CG2 3.27Å; E1085-T1089 WeakPolarHBondContact O-CG2 3.36Å; E1085-T1089 PolarHBondContact O-N 3.13Å; E1085-T1089 PolarHBondContact O-OG1 2.91Å; D1086-T1089 PolarHBondContact O-N 2.94Å; D1086-T1089 PolarHBondContact O-OG1 3.29Å; K1087-T1089 VanDerWaalsContact C-N 3.26Å; K1087-T1089 PolarHBondContact O-N 2.89Å; T1089-L1091 VanDerWaalsContact C-N 3.31Å; T1089-L1091 PolarHBondContact O-N 3.13Å; T1089-L1091 VanDerWaalsContact O-N 3.12Å; T1089-N1092 WeakPolarHBondContact O-CB 3.16Å; T1089-N1092 PolarHBondContact O-N 3.12Å
1090I50.6Low49.2Very low46.6 Ų46.689.6 Ų89.624%0.23945%0.449CS..THydrogen-bonded Turntrans-59.2-25.8-169-67.5175.6000113.8V880 L952 D1086 K1087V880-I1090 HydrophobicContact CG2-CD1 4.22Å; V880-I1090 HydrophobicContact CG2-CG2 3.6Å; V880-I1090 VanDerWaalsContact CG2-CG2 3.48Å; L952-I1090 HydrophobicContact CD1-CG2 4.48Å; L952-I1090 WeakPolarHBondContact CD1-O 3.42Å; D1086-I1090 HydrophobicContact CB-CD1 4.23Å; D1086-I1090 WeakPolarHBondContact O-CB 3.36Å; D1086-I1090 WeakPolarHBondContact O-CD1 3.4Å; D1086-I1090 WeakPolarHBondContact O-CG1 3.31Å; D1086-I1090 PolarHBondContact O-N 3.19Å; D1086-I1090 VanDerWaalsContact O-N 3.17Å; K1087-I1090 HydrophobicContact CG-CD1 4.47Å
1091L55.4Low51.4Low19.6 Ų19.681.7 Ų81.710%0.10342%0.415CS..THydrogen-bonded Turntrans-119.425.4-176.9-69.6159.8000114.1I948 L952 R1014 Y1017 L1063 T1089 V1093I948-L1091 HydrophobicContact CG2-CD2 3.69Å; I948-L1091 HydrophobicContact CG2-CG 4.49Å; L952-L1091 HydrophobicContact CD1-CD2 4.14Å; L952-L1091 HydrophobicContact CD1-CG 4.36Å; L952-L1091 HydrophobicContact CD2-CB 4.49Å; L952-L1091 HydrophobicContact CD2-CD2 4.19Å; L952-L1091 HydrophobicContact CG-CD2 4.29Å; R1014-L1091 HydrophobicContact CB-CD1 4.46Å; R1014-L1091 HydrophobicContact CG-CB 4.2Å; R1014-L1091 HydrophobicContact CG-CD1 4.28Å; R1014-L1091 HydrophobicContact CG-CD2 4.13Å; R1014-L1091 VanDerWaalsContact CZ-O 3.24Å; R1014-L1091 PolarHBondContact NE-O 3.03Å; R1014-L1091 PolarHBondContact NH2-O 3.44Å; Y1017-L1091 HydrophobicContact CD1-CD1 3.3Å; Y1017-L1091 HydrophobicContact CD1-CD2 3.44Å; Y1017-L1091 HydrophobicContact CD1-CG 4.27Å; Y1017-L1091 HydrophobicContact CD2-CD1 4.39Å; Y1017-L1091 HydrophobicContact CE1-CD1 3.71Å; Y1017-L1091 HydrophobicContact CE1-CD2 4.02Å; Y1017-L1091 HydrophobicContact CE1-CG 4.17Å; Y1017-L1091 HydrophobicContact CG-CD1 3.54Å; Y1017-L1091 HydrophobicContact CG-CD2 4.03Å; L1063-L1091 HydrophobicContact CD2-CD1 4.16Å; T1089-L1091 VanDerWaalsContact C-N 3.31Å; T1089-L1091 PolarHBondContact O-N 3.13Å; T1089-L1091 VanDerWaalsContact O-N 3.12Å; L1091-V1093 PolarHBondContact O-N 3.18Å
1092N65.6Low53.4Low21.4 Ų21.472.8 Ų72.811%0.11438%0.383CS..  trans-81.7104.5173.5-90.1-18.4000110.3R1014 T1089 D1094 G1095 H1097 G1098R1014-N1092 PolarHBondContact NH2-OD1 3.11Å; T1089-N1092 WeakPolarHBondContact O-CB 3.16Å; T1089-N1092 PolarHBondContact O-N 3.12Å; N1092-D1094 PolarHBondContact O-N 3.16Å; N1092-D1094 VanDerWaalsContact O-N 3.14Å; N1092-D1094 PolarHBondContact OD1-OD1 3.44Å; N1092-G1095 PolarHBondContact O-N 3.16Å; N1092-H1097 VanDerWaalsContact ND2-CA 3.29Å; N1092-H1097 WeakPolarHBondContact ND2-CA 3.31Å; N1092-H1097 PolarHBondContact ND2-N 2.89Å; N1092-H1097 PolarHBondContact ND2-ND1 3.14Å; N1092-H1097 WeakPolarHBondContact OD1-CA 3.36Å; N1092-H1097 PolarHBondContact OD1-N 3.33Å; N1092-G1098 PolarHBondContact OD1-N 3.47Å
1093V61.4Low55.6Low4 Ų469 Ų692%0.02437%0.372CS..THydrogen-bonded Turntrans-54-33.7-179-176.50000112.6G955 Q956 V959 I1007 I1010 L1011 L1091 L1101G955-V1093 CarbonylContact C-O 3.53Å; Q956-V1093 WeakPolarHBondContact CG-O 3.2Å; Q956-V1093 PolarHBondContact N-O 3.32Å; Q956-V1093 VanDerWaalsContact N-O 3.17Å; V959-V1093 HydrophobicContact CG2-CG1 4.41Å; I1007-V1093 HydrophobicContact CG2-CG1 4.49Å; I1010-V1093 HydrophobicContact CD1-CG1 4.42Å; I1010-V1093 HydrophobicContact CG2-CB 4.44Å; I1010-V1093 HydrophobicContact CG2-CG1 4.09Å; I1010-V1093 HydrophobicContact CG2-CG2 3.76Å; L1011-V1093 HydrophobicContact CD2-CG2 4.08Å; L1091-V1093 PolarHBondContact O-N 3.18Å; V1093-L1101 HydrophobicContact CB-CD2 4.42Å
1094D62.5Low57.6Low5.8 Ų5.864 Ų643%0.03134%0.337CS..THydrogen-bonded Turntrans-106.6-9.8-176.366.9-6.9000114.7V959 N1092 Y1096 H1097 G1098 Q1099 L1100 L1101V959-D1094 HydrophobicContact CG1-CB 4.18Å; V959-D1094 HydrophobicContact CG2-CB 4.39Å; N1092-D1094 PolarHBondContact O-N 3.16Å; N1092-D1094 VanDerWaalsContact O-N 3.14Å; N1092-D1094 PolarHBondContact OD1-OD1 3.44Å; D1094-Y1096 VanDerWaalsContact C-N 3.26Å; D1094-Y1096 VanDerWaalsContact O-CD2 3.24Å; D1094-Y1096 WeakPolarHBondContact O-CD2 3.32Å; D1094-Y1096 PolarHBondContact O-N 3.03Å; D1094-Y1096 PolarHBondContact OD1-N 3.11Å; D1094-H1097 PolarHBondContact OD1-N 3.15Å; D1094-G1098 WeakPolarHBondContact OD1-CA 3.41Å; D1094-G1098 PolarHBondContact OD1-N 3.17Å; D1094-G1098 WeakPolarHBondContact OD2-CA 3.37Å; D1094-G1098 PolarHBondContact OD2-N 3.24Å; D1094-Q1099 PolarHBondContact OD2-N 3.05Å; D1094-L1100 HydrophobicContact CB-CB 4.11Å; D1094-L1100 HydrophobicContact CB-CD2 4.22Å; D1094-L1100 WeakPolarHBondContact OD2-CA 3.24Å; D1094-L1100 WeakPolarHBondContact OD2-CB 3.32Å; D1094-L1100 PolarHBondContact OD2-N 3.14Å; D1094-L1101 HydrophobicContact CB-CB 4.2Å; D1094-L1101 PolarHBondContact OD2-N 2.98Å
1095G59.4Low59.8Low38.2 Ų38.259.5 Ų59.539%0.39431%0.309SS..SBendtrans76.5-3.6-174.600000115.5N1092N1092-G1095 PolarHBondContact O-N 3.16Å
1096Y59.3Low61.7Low142.4 Ų142.454 Ų5456%0.55829%0.29SS*.SBendtrans-121.138.8-176.6-64.8-89.4000112.1D1094 G1098 Q1099 L1100D1094-Y1096 VanDerWaalsContact C-N 3.26Å; D1094-Y1096 VanDerWaalsContact O-CD2 3.24Å; D1094-Y1096 WeakPolarHBondContact O-CD2 3.32Å; D1094-Y1096 PolarHBondContact O-N 3.03Å; D1094-Y1096 PolarHBondContact OD1-N 3.11Å; Y1096-G1098 VanDerWaalsContact C-N 3.31Å; Y1096-G1098 PolarHBondContact O-N 3.18Å; Y1096-G1098 VanDerWaalsContact O-N 3.14Å; Y1096-Q1099 WeakPolarHBondContact O-CB 3.37Å; Y1096-Q1099 WeakPolarHBondContact O-CG 3.41Å; Y1096-Q1099 PolarHBondContact O-N 3.04Å; Y1096-L1100 HydrophobicContact CD2-CB 4.18Å; Y1096-L1100 HydrophobicContact CD2-CD1 3.39Å; Y1096-L1100 HydrophobicContact CD2-CD2 4.09Å; Y1096-L1100 HydrophobicContact CD2-CG 3.92Å; Y1096-L1100 HydrophobicContact CE2-CD1 3.57Å; Y1096-L1100 HydrophobicContact CE2-CD2 4.41Å; Y1096-L1100 HydrophobicContact CE2-CG 4.28Å; Y1096-L1100 HydrophobicContact CG-CB 4.27Å; Y1096-L1100 HydrophobicContact CG-CD1 3.93Å; Y1096-L1100 HydrophobicContact CG-CG 3.85Å
1097H57.7Low63.3Low130.4 Ų130.453.7 Ų53.760%0.60428%0.28SS*.THydrogen-bonded Turntrans56.731.5-179.7-54.5-68.5000113.7N1092 D1094 Q1099N1092-H1097 VanDerWaalsContact ND2-CA 3.29Å; N1092-H1097 WeakPolarHBondContact ND2-CA 3.31Å; N1092-H1097 PolarHBondContact ND2-N 2.89Å; N1092-H1097 PolarHBondContact ND2-ND1 3.14Å; N1092-H1097 WeakPolarHBondContact OD1-CA 3.36Å; N1092-H1097 PolarHBondContact OD1-N 3.33Å; D1094-H1097 PolarHBondContact OD1-N 3.15Å; H1097-Q1099 VanDerWaalsContact C-N 3.25Å; H1097-Q1099 PolarHBondContact O-N 3.12Å
1098G62.5Low65Low4.6 Ų4.648 Ų485%0.04726%0.255CS..THydrogen-bonded Turntrans79-5.6-178.100000114.9N1092 D1094 Y1096 L1100 L1101 I1102N1092-G1098 PolarHBondContact OD1-N 3.47Å; D1094-G1098 WeakPolarHBondContact OD1-CA 3.41Å; D1094-G1098 PolarHBondContact OD1-N 3.17Å; D1094-G1098 WeakPolarHBondContact OD2-CA 3.37Å; D1094-G1098 PolarHBondContact OD2-N 3.24Å; Y1096-G1098 VanDerWaalsContact C-N 3.31Å; Y1096-G1098 PolarHBondContact O-N 3.18Å; Y1096-G1098 VanDerWaalsContact O-N 3.14Å; G1098-L1100 VanDerWaalsContact C-N 3.34Å; G1098-L1100 PolarHBondContact O-N 3.26Å; G1098-L1101 PolarHBondContact O-N 3Å; G1098-I1102 WeakPolarHBondContact O-CB 3.28Å; G1098-I1102 WeakPolarHBondContact O-CD1 3.38Å; G1098-I1102 VanDerWaalsContact O-CG1 3.22Å; G1098-I1102 WeakPolarHBondContact O-CG1 3.45Å; G1098-I1102 PolarHBondContact O-N 3.03Å
1099Q69.2Low66.6Low141 Ų14144.5 Ų44.566%0.65924%0.238SC*.Hα-helixtrans-67-37.2-176.1-64.5-176.7-0.300112.6D1094 Y1096 H1097 G1103D1094-Q1099 PolarHBondContact OD2-N 3.05Å; Y1096-Q1099 WeakPolarHBondContact O-CB 3.37Å; Y1096-Q1099 WeakPolarHBondContact O-CG 3.41Å; Y1096-Q1099 PolarHBondContact O-N 3.04Å; H1097-Q1099 VanDerWaalsContact C-N 3.25Å; H1097-Q1099 PolarHBondContact O-N 3.12Å; Q1099-G1103 PolarHBondContact O-N 3.43Å
1100L73.5Confident67.8Low46.4 Ų46.447 Ų4724%0.24325%0.248CC..Hα-helixtrans-70.9-42.9177.1-110167.7000110.1V959 D1094 Y1096 G1098 I1102 G1103 V1104V959-L1100 HydrophobicContact CB-CD2 4.16Å; V959-L1100 HydrophobicContact CG1-CB 4.37Å; V959-L1100 HydrophobicContact CG1-CD2 3.34Å; V959-L1100 VanDerWaalsContact CG1-CD2 3.46Å; V959-L1100 HydrophobicContact CG1-CG 4.18Å; D1094-L1100 HydrophobicContact CB-CB 4.11Å; D1094-L1100 HydrophobicContact CB-CD2 4.22Å; D1094-L1100 WeakPolarHBondContact OD2-CA 3.24Å; D1094-L1100 WeakPolarHBondContact OD2-CB 3.32Å; D1094-L1100 PolarHBondContact OD2-N 3.14Å; Y1096-L1100 HydrophobicContact CD2-CB 4.18Å; Y1096-L1100 HydrophobicContact CD2-CD1 3.39Å; Y1096-L1100 HydrophobicContact CD2-CD2 4.09Å; Y1096-L1100 HydrophobicContact CD2-CG 3.92Å; Y1096-L1100 HydrophobicContact CE2-CD1 3.57Å; Y1096-L1100 HydrophobicContact CE2-CD2 4.41Å; Y1096-L1100 HydrophobicContact CE2-CG 4.28Å; Y1096-L1100 HydrophobicContact CG-CB 4.27Å; Y1096-L1100 HydrophobicContact CG-CD1 3.93Å; Y1096-L1100 HydrophobicContact CG-CG 3.85Å; G1098-L1100 VanDerWaalsContact C-N 3.34Å; G1098-L1100 PolarHBondContact O-N 3.26Å; L1100-I1102 VanDerWaalsContact C-N 3.35Å; L1100-I1102 PolarHBondContact O-N 3.13Å; L1100-G1103 PolarHBondContact O-N 3.29Å; L1100-V1104 HydrophobicContact CD2-CG2 3.9Å; L1100-V1104 WeakPolarHBondContact O-CB 3.38Å; L1100-V1104 VanDerWaalsContact O-CG2 3.26Å; L1100-V1104 WeakPolarHBondContact O-CG2 3.34Å; L1100-V1104 PolarHBondContact O-N 3.19Å
1101L75.4Confident68.8Low2.2 Ų2.246 Ų461%0.01224%0.244CC..Hα-helixtrans-59.7-46.7176.4-179.861.8000111.2V959 I1007 V1093 D1094 G1098 G1103 V1104 L1105V959-L1101 HydrophobicContact CG1-CB 4.45Å; V959-L1101 HydrophobicContact CG1-CD1 4.29Å; V959-L1101 HydrophobicContact CG2-CD1 4.07Å; I1007-L1101 HydrophobicContact CD1-CD1 4.31Å; I1007-L1101 HydrophobicContact CG2-CD1 4.14Å; I1007-L1101 HydrophobicContact CG2-CD2 4.46Å; V1093-L1101 HydrophobicContact CB-CD2 4.42Å; D1094-L1101 HydrophobicContact CB-CB 4.2Å; D1094-L1101 PolarHBondContact OD2-N 2.98Å; G1098-L1101 PolarHBondContact O-N 3Å; L1101-G1103 VanDerWaalsContact C-N 3.35Å; L1101-G1103 PolarHBondContact O-N 2.97Å; L1101-V1104 PolarHBondContact O-N 3.27Å; L1101-L1105 HydrophobicContact CD1-CD1 3.92Å; L1101-L1105 HydrophobicContact CD1-CD2 4.47Å; L1101-L1105 HydrophobicContact CD1-CG 3.97Å; L1101-L1105 HydrophobicContact CG-CD1 3.87Å; L1101-L1105 HydrophobicContact CG-CG 4.32Å; L1101-L1105 WeakPolarHBondContact O-CB 3.32Å; L1101-L1105 VanDerWaalsContact O-CG 3.26Å; L1101-L1105 WeakPolarHBondContact O-CG 3.27Å; L1101-L1105 PolarHBondContact O-N 3.2Å
1102I74.2Confident69.5Low45 Ų4551.1 Ų51.123%0.23128%0.277CS..Hα-helixtrans-60-46.7176-67.6163000110.5G1098 L1100 V1104 L1105 A1106 L1124 F1128G1098-I1102 WeakPolarHBondContact O-CB 3.28Å; G1098-I1102 WeakPolarHBondContact O-CD1 3.38Å; G1098-I1102 VanDerWaalsContact O-CG1 3.22Å; G1098-I1102 WeakPolarHBondContact O-CG1 3.45Å; G1098-I1102 PolarHBondContact O-N 3.03Å; L1100-I1102 VanDerWaalsContact C-N 3.35Å; L1100-I1102 PolarHBondContact O-N 3.13Å; I1102-V1104 VanDerWaalsContact C-N 3.35Å; I1102-V1104 PolarHBondContact O-N 3.04Å; I1102-L1105 PolarHBondContact O-N 3.04Å; I1102-A1106 VanDerWaalsContact O-CB 3.22Å; I1102-A1106 WeakPolarHBondContact O-CB 3.33Å; I1102-A1106 PolarHBondContact O-N 3.17Å; I1102-L1124 HydrophobicContact CG2-CD1 4.24Å; I1102-F1128 HydrophobicContact CD1-CE1 4.23Å; I1102-F1128 HydrophobicContact CD1-CZ 4.07Å; I1102-F1128 HydrophobicContact CG1-CE2 4.48Å; I1102-F1128 HydrophobicContact CG1-CZ 4.26Å; I1102-F1128 HydrophobicContact CG2-CZ 4.23Å
1103G73.2Confident70Confident40.6 Ų40.652 Ų5242%0.41928%0.282SS..Hα-helixtrans-61.2-41.2178.900000113.1Q1099 L1100 L1101 R1107Q1099-G1103 PolarHBondContact O-N 3.43Å; L1100-G1103 PolarHBondContact O-N 3.29Å; L1101-G1103 VanDerWaalsContact C-N 3.35Å; L1101-G1103 PolarHBondContact O-N 2.97Å; G1103-R1107 WeakPolarHBondContact O-CB 3.32Å; G1103-R1107 PolarHBondContact O-N 3.14Å; G1103-R1107 VanDerWaalsContact O-N 3.16Å
1104V76.8Confident70.9Confident6.2 Ų6.256.3 Ų56.34%0.03831%0.308CS..Hα-helixtrans-68-49.4176.51710000110.9V959 L962 N963 L1100 L1101 I1102 A1106 R1107 L1108V959-V1104 HydrophobicContact CG1-CB 4.49Å; V959-V1104 HydrophobicContact CG1-CG2 4.3Å; L962-V1104 HydrophobicContact CB-CG1 3.63Å; L962-V1104 HydrophobicContact CD1-CG1 4.26Å; N963-V1104 HydrophobicContact CB-CG2 3.8Å; L1100-V1104 HydrophobicContact CD2-CG2 3.9Å; L1100-V1104 WeakPolarHBondContact O-CB 3.38Å; L1100-V1104 VanDerWaalsContact O-CG2 3.26Å; L1100-V1104 WeakPolarHBondContact O-CG2 3.34Å; L1100-V1104 PolarHBondContact O-N 3.19Å; L1101-V1104 PolarHBondContact O-N 3.27Å; I1102-V1104 VanDerWaalsContact C-N 3.35Å; I1102-V1104 PolarHBondContact O-N 3.04Å; V1104-A1106 PolarHBondContact O-N 3.11Å; V1104-R1107 WeakPolarHBondContact O-CB 3.19Å; V1104-R1107 PolarHBondContact O-N 3.33Å; V1104-R1107 VanDerWaalsContact O-N 3.15Å; V1104-L1108 HydrophobicContact CG1-CD1 3.97Å; V1104-L1108 HydrophobicContact CG1-CG 4.4Å; V1104-L1108 VanDerWaalsContact O-CG 3.28Å; V1104-L1108 WeakPolarHBondContact O-CG 3.22Å; V1104-L1108 PolarHBondContact O-N 3.25Å
1105L78.8Confident71.8Confident1.6 Ų1.662 Ų621%0.00833%0.334CS..Hα-helixtrans-62.1-43.6179.7-70.4175.9000111.9L1004 L1101 I1102 R1107 L1108 C1109 L1123 L1124L1004-L1105 HydrophobicContact CD2-CD2 3.76Å; L1101-L1105 HydrophobicContact CD1-CD1 3.92Å; L1101-L1105 HydrophobicContact CD1-CD2 4.47Å; L1101-L1105 HydrophobicContact CD1-CG 3.97Å; L1101-L1105 HydrophobicContact CG-CD1 3.87Å; L1101-L1105 HydrophobicContact CG-CG 4.32Å; L1101-L1105 WeakPolarHBondContact O-CB 3.32Å; L1101-L1105 VanDerWaalsContact O-CG 3.26Å; L1101-L1105 WeakPolarHBondContact O-CG 3.27Å; L1101-L1105 PolarHBondContact O-N 3.2Å; I1102-L1105 PolarHBondContact O-N 3.04Å; L1105-R1107 VanDerWaalsContact C-N 3.27Å; L1105-R1107 PolarHBondContact O-N 3.02Å; L1105-L1108 CarbonylContact O-C 3.37Å; L1105-L1108 PolarHBondContact O-N 3.07Å; L1105-L1108 VanDerWaalsContact O-N 3.15Å; L1105-C1109 PolarHBondContact O-N 3.12Å; L1105-C1109 PolarHBondContact O-SG 3.23Å; L1105-L1123 HydrophobicContact CD1-CB 4.01Å; L1105-L1123 HydrophobicContact CD2-CB 4.17Å; L1105-L1123 HydrophobicContact CD2-CD1 4.34Å; L1105-L1124 HydrophobicContact CB-CD1 4.3Å; L1105-L1124 HydrophobicContact CD1-CB 4.49Å; L1105-L1124 HydrophobicContact CD1-CD1 4.47Å
1106A73.1Confident73Confident36 Ų3660.2 Ų60.230%0.29832%0.315SS..Hα-helixtrans-60-38.2176.100000111.8I1102 V1104 C1109 L1738I1102-A1106 VanDerWaalsContact O-CB 3.22Å; I1102-A1106 WeakPolarHBondContact O-CB 3.33Å; I1102-A1106 PolarHBondContact O-N 3.17Å; V1104-A1106 PolarHBondContact O-N 3.11Å; A1106-C1109 WeakPolarHBondContact O-CB 3.21Å; A1106-C1109 PolarHBondContact O-N 3.06Å; A1106-L1738 HydrophobicContact CB-CD2 4.39Å
1107R73.6Confident74Confident113 Ų11356.6 Ų56.643%0.42630%0.303SS..Hα-helixtrans-68-41.2174-170.8179.8-801712.6112.1N963 G966 N969 G1103 V1104 L1105 C1109 I1110N963-R1107 PolarHBondContact OD1-NH1 3.34Å; G966-R1107 PolarHBondContact O-NH1 3.21Å; G966-R1107 PolarHBondContact O-NH2 3.36Å; N969-R1107 PolarHBondContact O-NH2 3.37Å; N969-R1107 VanDerWaalsContact O-NH2 3.09Å; G1103-R1107 WeakPolarHBondContact O-CB 3.32Å; G1103-R1107 PolarHBondContact O-N 3.14Å; G1103-R1107 VanDerWaalsContact O-N 3.16Å; V1104-R1107 WeakPolarHBondContact O-CB 3.19Å; V1104-R1107 PolarHBondContact O-N 3.33Å; V1104-R1107 VanDerWaalsContact O-N 3.15Å; L1105-R1107 VanDerWaalsContact C-N 3.27Å; L1105-R1107 PolarHBondContact O-N 3.02Å; R1107-C1109 VanDerWaalsContact C-N 3.28Å; R1107-C1109 PolarHBondContact O-N 3.22Å; R1107-I1110 WeakPolarHBondContact O-CB 3.38Å; R1107-I1110 PolarHBondContact O-N 3.2Å; R1107-I1110 VanDerWaalsContact O-N 3.12Å
1108L76.1Confident75Confident11 Ų1153.9 Ų53.96%0.05829%0.292CS..Hα-helixtrans-65.6-29.2177.7-66.7172.8000112.4L962 K1000 L1004 V1104 L1105 I1110 S1111 L1116 S1120L962-L1108 HydrophobicContact CD1-CD1 4.45Å; K1000-L1108 HydrophobicContact CD-CD2 4.13Å; L1004-L1108 HydrophobicContact CD1-CD1 4.43Å; L1004-L1108 HydrophobicContact CD2-CD1 4.18Å; V1104-L1108 HydrophobicContact CG1-CD1 3.97Å; V1104-L1108 HydrophobicContact CG1-CG 4.4Å; V1104-L1108 VanDerWaalsContact O-CG 3.28Å; V1104-L1108 WeakPolarHBondContact O-CG 3.22Å; V1104-L1108 PolarHBondContact O-N 3.25Å; L1105-L1108 CarbonylContact O-C 3.37Å; L1105-L1108 PolarHBondContact O-N 3.07Å; L1105-L1108 VanDerWaalsContact O-N 3.15Å; L1108-I1110 PolarHBondContact O-N 3.24Å; L1108-S1111 VanDerWaalsContact O-CB 3.23Å; L1108-S1111 WeakPolarHBondContact O-CB 3.42Å; L1108-S1111 PolarHBondContact O-N 3.2Å; L1108-S1111 VanDerWaalsContact O-N 3.07Å; L1108-S1111 PolarHBondContact O-OG 3.25Å; L1108-L1116 HydrophobicContact CD2-CD1 4.5Å; L1108-L1116 HydrophobicContact CD2-CD2 4.16Å; L1108-S1120 VanDerWaalsContact CB-OG 3.25Å; L1108-S1120 WeakPolarHBondContact CB-OG 3.41Å
1109C73.3Confident76Confident12.8 Ų12.855.2 Ų55.29%0.08630%0.296CS..THydrogen-bonded Turntrans-62.4-21173.2-67.90000113.5L1105 A1106 R1107 S1111 K1117 S1120L1105-C1109 PolarHBondContact O-N 3.12Å; L1105-C1109 PolarHBondContact O-SG 3.23Å; A1106-C1109 WeakPolarHBondContact O-CB 3.21Å; A1106-C1109 PolarHBondContact O-N 3.06Å; R1107-C1109 VanDerWaalsContact C-N 3.28Å; R1107-C1109 PolarHBondContact O-N 3.22Å; C1109-S1111 VanDerWaalsContact C-N 3.3Å; C1109-K1117 WeakPolarHBondContact O-CE 3.41Å; C1109-K1117 WeakPolarHBondContact O-CG 3.38Å; C1109-S1120 WeakPolarHBondContact CA-OG 3.42Å; C1109-S1120 PolarHBondContact N-OG 3.14Å; C1109-S1120 PolarHBondContact SG-OG 2.89Å; C1109-S1120 VanDerWaalsContact SG-OG 3.42Å
1110I72.1Confident76.7Confident118.6 Ų118.648.5 Ų48.561%0.60827%0.265SS*.THydrogen-bonded Turntrans-86.8-5.7178.3-52165.7000111.1F971 R1107 L1108F971-I1110 HydrophobicContact CE2-CG2 4.48Å; R1107-I1110 WeakPolarHBondContact O-CB 3.38Å; R1107-I1110 PolarHBondContact O-N 3.2Å; R1107-I1110 VanDerWaalsContact O-N 3.12Å; L1108-I1110 PolarHBondContact O-N 3.24Å
1111S72.3Confident77.1Confident24.6 Ų24.647.6 Ų47.617%0.17226%0.26CS..SBendtrans-64.7156.4-179.369.50000113.1L1108 C1109 N1113 L1116L1108-S1111 VanDerWaalsContact O-CB 3.23Å; L1108-S1111 WeakPolarHBondContact O-CB 3.42Å; L1108-S1111 PolarHBondContact O-N 3.2Å; L1108-S1111 VanDerWaalsContact O-N 3.07Å; L1108-S1111 PolarHBondContact O-OG 3.25Å; C1109-S1111 VanDerWaalsContact C-N 3.3Å; S1111-N1113 VanDerWaalsContact C-N 3.34Å; S1111-L1116 WeakPolarHBondContact OG-CD2 3.23Å
1112T70Confident77.4Confident127.8 Ų127.851.4 Ų51.478%0.78428%0.278SS*.SBendtrans-75.3-21.6179.849.90000113.4
1113N76.2Confident77.8Confident40.2 Ų40.249.3 Ų49.322%0.21527%0.267CS..  trans-81.6125.4-177.9-174.7-46.6000110.9F997 S1111 E1115 L1116 K1117F997-N1113 HydrophobicContact CD1-CB 3.89Å; F997-N1113 HydrophobicContact CD2-CB 4.44Å; F997-N1113 HydrophobicContact CE1-CB 4Å; F997-N1113 HydrophobicContact CG-CB 4.15Å; F997-N1113 HydrophobicContact CZ-CB 4.35Å; S1111-N1113 VanDerWaalsContact C-N 3.34Å; N1113-E1115 PolarHBondContact OD1-N 3.07Å; N1113-L1116 HydrophobicContact CB-CB 4.09Å; N1113-L1116 PolarHBondContact O-N 3.24Å; N1113-L1116 PolarHBondContact OD1-N 3.12Å; N1113-K1117 VanDerWaalsContact O-CB 3.31Å; N1113-K1117 WeakPolarHBondContact O-CB 3.35Å; N1113-K1117 PolarHBondContact O-N 3.11Å; N1113-K1117 VanDerWaalsContact O-N 3.13Å
1114V79.7Confident78.1Confident94 Ų9448 Ų4857%0.5725%0.251SS*.Hα-helixtrans-64-44.4-177.2178.10000112.4L1116 K1117 L1118 L1748V1114-L1116 PolarHBondContact O-N 3Å; V1114-K1117 PolarHBondContact O-N 3.23Å; V1114-L1118 HydrophobicContact CG1-CD1 4.08Å; V1114-L1118 HydrophobicContact CG1-CG 4.4Å; V1114-L1118 WeakPolarHBondContact O-CB 3.45Å; V1114-L1118 WeakPolarHBondContact O-CG 3.33Å; V1114-L1118 PolarHBondContact O-N 3.17Å; V1114-L1748 HydrophobicContact CG1-CD1 4.31Å; V1114-L1748 HydrophobicContact CG1-CD2 3.41Å; V1114-L1748 VanDerWaalsContact CG1-CD2 3.47Å; V1114-L1748 HydrophobicContact CG1-CG 4.37Å
1115E82.4Confident78.3Confident125 Ų12551.2 Ų51.258%0.58426%0.264SS*.Hα-helixtrans-66.4-43.1-177.9-79.6-177.4172.400111.3L1001 N1113 K1117 L1118 K1119L1001-E1115 HydrophobicContact CD1-CB 4.24Å; L1001-E1115 HydrophobicContact CD1-CG 4.02Å; L1001-E1115 HydrophobicContact CD2-CB 4.37Å; L1001-E1115 HydrophobicContact CD2-CG 3.95Å; N1113-E1115 PolarHBondContact OD1-N 3.07Å; E1115-K1117 VanDerWaalsContact C-N 3.3Å; E1115-K1117 PolarHBondContact O-N 3.11Å; E1115-L1118 WeakPolarHBondContact O-CB 3.27Å; E1115-L1118 PolarHBondContact O-N 3.02Å; E1115-K1119 WeakPolarHBondContact O-CB 3.27Å; E1115-K1119 PolarHBondContact O-N 3Å
1116L83.1Confident78.4Confident0 Ų052.4 Ų52.40%027%0.269CS..Hα-helixtrans-63.2-42.5176.7-178.460.7000111.2F997 K1000 L1001 L1004 L1108 S1111 N1113 V1114 L1118 S1120F997-L1116 HydrophobicContact CD1-CD2 3.81Å; F997-L1116 HydrophobicContact CE1-CD2 4.27Å; K1000-L1116 HydrophobicContact CB-CD1 3.94Å; K1000-L1116 HydrophobicContact CB-CD2 4.34Å; K1000-L1116 HydrophobicContact CD-CD2 3.96Å; L1001-L1116 HydrophobicContact CD2-CB 4.31Å; L1001-L1116 HydrophobicContact CD2-CD1 4.23Å; L1001-L1116 HydrophobicContact CG-CD1 4.45Å; L1004-L1116 HydrophobicContact CD1-CD1 3.59Å; L1108-L1116 HydrophobicContact CD2-CD1 4.5Å; L1108-L1116 HydrophobicContact CD2-CD2 4.16Å; S1111-L1116 WeakPolarHBondContact OG-CD2 3.23Å; N1113-L1116 HydrophobicContact CB-CB 4.09Å; N1113-L1116 PolarHBondContact O-N 3.24Å; N1113-L1116 PolarHBondContact OD1-N 3.12Å; V1114-L1116 PolarHBondContact O-N 3Å; L1116-L1118 VanDerWaalsContact C-N 3.34Å; L1116-S1120 VanDerWaalsContact O-CB 3.25Å; L1116-S1120 WeakPolarHBondContact O-CB 3.29Å; L1116-S1120 PolarHBondContact O-N 3.3Å; L1116-S1120 PolarHBondContact O-OG 3.13Å
1117K79.9Confident78.7Confident67.8 Ų67.851.9 Ų51.930%0.29526%0.26SS..Hα-helixtrans-61.5-46.6175.7-179.8176.3-177.3-176.80111.8C1109 N1113 V1114 E1115 S1120 L1121 D1744 L1748C1109-K1117 WeakPolarHBondContact O-CE 3.41Å; C1109-K1117 WeakPolarHBondContact O-CG 3.38Å; N1113-K1117 VanDerWaalsContact O-CB 3.31Å; N1113-K1117 WeakPolarHBondContact O-CB 3.35Å; N1113-K1117 PolarHBondContact O-N 3.11Å; N1113-K1117 VanDerWaalsContact O-N 3.13Å; V1114-K1117 PolarHBondContact O-N 3.23Å; E1115-K1117 VanDerWaalsContact C-N 3.3Å; E1115-K1117 PolarHBondContact O-N 3.11Å; K1117-S1120 WeakPolarHBondContact CA-OG 3.31Å; K1117-S1120 PolarHBondContact O-N 2.87Å; K1117-S1120 PolarHBondContact O-OG 3.32Å; K1117-S1120 VanDerWaalsContact O-OG 3.05Å; K1117-L1121 VanDerWaalsContact O-CB 3.27Å; K1117-L1121 WeakPolarHBondContact O-CB 3.4Å; K1117-L1121 PolarHBondContact O-N 3.16Å; K1117-L1121 VanDerWaalsContact O-N 3.07Å; K1117-D1744 VanDerWaalsContact CE-CB 3.45Å; K1117-D1744 WeakPolarHBondContact CE-OD2 3.13Å; K1117-D1744 IonicContact NZ-OD1 2.7Å; K1117-D1744 PolarHBondContact NZ-OD1 3.08Å; K1117-D1744 IonicContact NZ-OD2 3.25Å; K1117-D1744 PolarHBondContact NZ-OD2 3.11Å; K1117-L1748 HydrophobicContact CD-CD1 4.18Å; K1117-L1748 HydrophobicContact CG-CD1 4.22Å
1118L80.6Confident78.8Confident72.8 Ų72.850 Ų5038%0.38126%0.255SS..Hα-helixtrans-61.4-49.5179.2-77.5176.4000111.9V1114 E1115 L1116 L1121 Q1122 L1748 F1750V1114-L1118 HydrophobicContact CG1-CD1 4.08Å; V1114-L1118 HydrophobicContact CG1-CG 4.4Å; V1114-L1118 WeakPolarHBondContact O-CB 3.45Å; V1114-L1118 WeakPolarHBondContact O-CG 3.33Å; V1114-L1118 PolarHBondContact O-N 3.17Å; E1115-L1118 WeakPolarHBondContact O-CB 3.27Å; E1115-L1118 PolarHBondContact O-N 3.02Å; L1116-L1118 VanDerWaalsContact C-N 3.34Å; L1118-L1121 PolarHBondContact O-N 3.14Å; L1118-Q1122 WeakPolarHBondContact O-CB 3.32Å; L1118-Q1122 PolarHBondContact O-N 3.19Å; L1118-L1748 HydrophobicContact CD1-CB 4.14Å; L1118-L1748 HydrophobicContact CD2-CB 3.18Å; L1118-L1748 HydrophobicContact CD2-CD1 3.65Å; L1118-L1748 HydrophobicContact CD2-CG 3.98Å; L1118-L1748 HydrophobicContact CG-CB 3.85Å; L1118-L1748 HydrophobicContact CG-CD1 3.89Å; L1118-L1748 HydrophobicContact CG-CG 4.34Å; L1118-F1750 HydrophobicContact CB-CE2 4.37Å; L1118-F1750 HydrophobicContact CD1-CE2 4.32Å; L1118-F1750 HydrophobicContact CD2-CD2 3.54Å; L1118-F1750 HydrophobicContact CD2-CE2 3.4Å; L1118-F1750 VanDerWaalsContact CD2-CE2 3.45Å; L1118-F1750 HydrophobicContact CG-CE2 4.26Å
1119K82.8Confident79Confident32.2 Ų32.251 Ų5114%0.1426%0.263CS..Hα-helixtrans-67.5-40.8-178.7-152.3-179.9-177.2-170.40112.5L1001 L1004 D1005 E1008 E1115 L1121 Q1122 L1123L1001-K1119 HydrophobicContact CD2-CB 4.34Å; L1001-K1119 HydrophobicContact CD2-CD 3.98Å; L1001-K1119 HydrophobicContact CD2-CG 4.37Å; L1001-K1119 PolarHBondContact O-NZ 3.28Å; L1001-K1119 VanDerWaalsContact O-NZ 3.12Å; L1004-K1119 HydrophobicContact CB-CD 3.94Å; L1004-K1119 HydrophobicContact CB-CG 4.35Å; L1004-K1119 HydrophobicContact CD1-CB 4.33Å; L1004-K1119 HydrophobicContact CD1-CD 4.3Å; L1004-K1119 HydrophobicContact CD1-CG 4.25Å; D1005-K1119 IonicContact OD1-NZ 3.55Å; D1005-K1119 PolarHBondContact OD1-NZ 3.23Å; D1005-K1119 IonicContact OD2-NZ 3.38Å; D1005-K1119 PolarHBondContact OD2-NZ 3.2Å; E1008-K1119 WeakPolarHBondContact OE2-CE 3.35Å; E1008-K1119 IonicContact OE2-NZ 3.62Å; E1115-K1119 WeakPolarHBondContact O-CB 3.27Å; E1115-K1119 PolarHBondContact O-N 3Å; K1119-L1121 VanDerWaalsContact C-N 3.31Å; K1119-L1121 PolarHBondContact O-N 3.07Å; K1119-Q1122 PolarHBondContact O-N 3.08Å; K1119-L1123 HydrophobicContact CG-CD1 4.4Å; K1119-L1123 WeakPolarHBondContact O-CB 3.42Å; K1119-L1123 VanDerWaalsContact O-CG 3.29Å; K1119-L1123 WeakPolarHBondContact O-CG 3.33Å; K1119-L1123 PolarHBondContact O-N 3.22Å
1120S84Confident79.3Confident0 Ų051.2 Ų51.20%026%0.263CS..Hα-helixtrans-63.3-39.9176.117.70000111.7L1108 C1109 L1116 K1117 L1123 L1124L1108-S1120 VanDerWaalsContact CB-OG 3.25Å; L1108-S1120 WeakPolarHBondContact CB-OG 3.41Å; C1109-S1120 WeakPolarHBondContact CA-OG 3.42Å; C1109-S1120 PolarHBondContact N-OG 3.14Å; C1109-S1120 PolarHBondContact SG-OG 2.89Å; C1109-S1120 VanDerWaalsContact SG-OG 3.42Å; L1116-S1120 VanDerWaalsContact O-CB 3.25Å; L1116-S1120 WeakPolarHBondContact O-CB 3.29Å; L1116-S1120 PolarHBondContact O-N 3.3Å; L1116-S1120 PolarHBondContact O-OG 3.13Å; K1117-S1120 WeakPolarHBondContact CA-OG 3.31Å; K1117-S1120 PolarHBondContact O-N 2.87Å; K1117-S1120 PolarHBondContact O-OG 3.32Å; K1117-S1120 VanDerWaalsContact O-OG 3.05Å; S1120-L1123 PolarHBondContact O-N 3.17Å; S1120-L1124 VanDerWaalsContact O-CB 3.3Å; S1120-L1124 WeakPolarHBondContact O-CB 3.33Å; S1120-L1124 PolarHBondContact O-N 3.13Å
1121L80.7Confident79.6Confident27.6 Ų27.648.3 Ų48.315%0.14525%0.247CC..Hα-helixtrans-68.8-42.1176.9-171.376.8000111.7K1117 L1118 K1119 L1123 L1124 F1125 H1741 D1744 L1745K1117-L1121 VanDerWaalsContact O-CB 3.27Å; K1117-L1121 WeakPolarHBondContact O-CB 3.4Å; K1117-L1121 PolarHBondContact O-N 3.16Å; K1117-L1121 VanDerWaalsContact O-N 3.07Å; L1118-L1121 PolarHBondContact O-N 3.14Å; K1119-L1121 VanDerWaalsContact C-N 3.31Å; K1119-L1121 PolarHBondContact O-N 3.07Å; L1121-L1123 VanDerWaalsContact C-N 3.34Å; L1121-L1123 PolarHBondContact O-N 3.05Å; L1121-L1124 HydrophobicContact CD1-CD2 4.38Å; L1121-L1124 WeakPolarHBondContact O-CB 3.38Å; L1121-L1124 PolarHBondContact O-N 3.21Å; L1121-L1124 VanDerWaalsContact O-N 3.16Å; L1121-F1125 HydrophobicContact CD1-CD2 3.98Å; L1121-F1125 HydrophobicContact CD1-CE1 4.49Å; L1121-F1125 HydrophobicContact CD1-CE2 3.64Å; L1121-F1125 VanDerWaalsContact CD1-CE2 3.46Å; L1121-F1125 HydrophobicContact CD1-CZ 4.34Å; L1121-F1125 HydrophobicContact CD2-CD2 3.66Å; L1121-F1125 HydrophobicContact CD2-CE2 3.89Å; L1121-F1125 HydrophobicContact CD2-CZ 4Å; L1121-F1125 HydrophobicContact CG-CD2 3.95Å; L1121-F1125 HydrophobicContact CG-CE2 3.62Å; L1121-F1125 VanDerWaalsContact CG-CE2 3.49Å; L1121-F1125 HydrophobicContact CG-CZ 4.01Å; L1121-F1125 VanDerWaalsContact O-CD2 3.22Å; L1121-F1125 WeakPolarHBondContact O-CD2 3.37Å; L1121-F1125 WeakPolarHBondContact O-CG 3.22Å; L1121-F1125 PolarHBondContact O-N 3.36Å; L1121-H1741 HydrophobicContact CD1-CB 4.26Å; L1121-D1744 HydrophobicContact CD2-CB 4.41Å; L1121-L1745 HydrophobicContact CD2-CD2 3.41Å; L1121-L1745 VanDerWaalsContact CD2-CD2 3.46Å; L1121-L1745 HydrophobicContact CD2-CG 3.74Å; L1121-L1745 HydrophobicContact CG-CD2 3.89Å; L1121-L1745 HydrophobicContact CG-CG 4.47Å
1122Q83.1Confident80Confident82 Ų8251.1 Ų51.138%0.38326%0.257SS..Hα-helixtrans-57.9-47173.7-179.4-175.8-12.700111.3E1008 L1118 K1119 L1124 F1125 R1126E1008-Q1122 PolarHBondContact OE1-NE2 3.08Å; L1118-Q1122 WeakPolarHBondContact O-CB 3.32Å; L1118-Q1122 PolarHBondContact O-N 3.19Å; K1119-Q1122 PolarHBondContact O-N 3.08Å; Q1122-L1124 VanDerWaalsContact C-N 3.33Å; Q1122-L1124 PolarHBondContact O-N 3.33Å; Q1122-F1125 PolarHBondContact O-N 3.18Å; Q1122-R1126 VanDerWaalsContact O-CB 3.26Å; Q1122-R1126 WeakPolarHBondContact O-CB 3.19Å; Q1122-R1126 WeakPolarHBondContact O-CG 3.41Å; Q1122-R1126 PolarHBondContact O-N 3.29Å
1123L81.7Confident80.6Confident0.6 Ų0.646.3 Ų46.30%0.00323%0.226CC..Hα-helixtrans-66.8-34.9177.5-69.7173.8000112.5L1004 E1008 L1011 L1105 K1119 S1120 L1121 R1126 H1127L1004-L1123 HydrophobicContact CB-CD1 3.88Å; L1004-L1123 HydrophobicContact CD1-CD1 4.46Å; L1004-L1123 HydrophobicContact CD2-CD1 3.84Å; L1004-L1123 HydrophobicContact CG-CD1 4.27Å; E1008-L1123 HydrophobicContact CB-CD2 3.79Å; E1008-L1123 HydrophobicContact CG-CD2 3.87Å; L1011-L1123 HydrophobicContact CD1-CD2 3.95Å; L1105-L1123 HydrophobicContact CD1-CB 4.01Å; L1105-L1123 HydrophobicContact CD2-CB 4.17Å; L1105-L1123 HydrophobicContact CD2-CD1 4.34Å; K1119-L1123 HydrophobicContact CG-CD1 4.4Å; K1119-L1123 WeakPolarHBondContact O-CB 3.42Å; K1119-L1123 VanDerWaalsContact O-CG 3.29Å; K1119-L1123 WeakPolarHBondContact O-CG 3.33Å; K1119-L1123 PolarHBondContact O-N 3.22Å; S1120-L1123 PolarHBondContact O-N 3.17Å; L1121-L1123 VanDerWaalsContact C-N 3.34Å; L1121-L1123 PolarHBondContact O-N 3.05Å; L1123-R1126 PolarHBondContact O-N 2.92Å; L1123-H1127 WeakPolarHBondContact O-CB 3.45Å; L1123-H1127 PolarHBondContact O-N 2.97Å
1124L80.2Confident81Confident15 Ų1544.5 Ų44.58%0.07922%0.216CC..Hα-helixtrans-64.2-48.1174.6-171.967.2000110.9I1102 L1105 S1120 L1121 Q1122 R1126 H1127 F1128 L1738I1102-L1124 HydrophobicContact CG2-CD1 4.24Å; L1105-L1124 HydrophobicContact CB-CD1 4.3Å; L1105-L1124 HydrophobicContact CD1-CB 4.49Å; L1105-L1124 HydrophobicContact CD1-CD1 4.47Å; S1120-L1124 VanDerWaalsContact O-CB 3.3Å; S1120-L1124 WeakPolarHBondContact O-CB 3.33Å; S1120-L1124 PolarHBondContact O-N 3.13Å; L1121-L1124 HydrophobicContact CD1-CD2 4.38Å; L1121-L1124 WeakPolarHBondContact O-CB 3.38Å; L1121-L1124 PolarHBondContact O-N 3.21Å; L1121-L1124 VanDerWaalsContact O-N 3.16Å; Q1122-L1124 VanDerWaalsContact C-N 3.33Å; Q1122-L1124 PolarHBondContact O-N 3.33Å; L1124-R1126 VanDerWaalsContact C-N 3.35Å; L1124-R1126 PolarHBondContact O-N 3.24Å; L1124-H1127 WeakPolarHBondContact O-CB 3.23Å; L1124-H1127 PolarHBondContact O-N 3.19Å; L1124-F1128 HydrophobicContact CD1-CD2 4.31Å; L1124-F1128 HydrophobicContact CD1-CE2 3.72Å; L1124-F1128 HydrophobicContact CG-CD2 4.28Å; L1124-F1128 HydrophobicContact CG-CE2 4.06Å; L1124-F1128 VanDerWaalsContact O-CD2 3.27Å; L1124-F1128 WeakPolarHBondContact O-CD2 3.34Å; L1124-F1128 PolarHBondContact O-N 3.19Å; L1124-F1128 VanDerWaalsContact O-N 3.13Å; L1124-L1738 HydrophobicContact CD1-CD1 4.36Å; L1124-L1738 HydrophobicContact CD2-CD1 3.51Å; L1124-L1738 VanDerWaalsContact CD2-CD1 3.44Å; L1124-L1738 HydrophobicContact CD2-CD2 3.95Å; L1124-L1738 HydrophobicContact CD2-CG 4.32Å; L1124-L1738 HydrophobicContact CG-CD1 3.88Å
1125F80.1Confident81Confident72 Ų7242.2 Ų42.232%0.31620%0.2SC..Hα-helixtrans-61-45.5175-77.8-54.7000111.7L1121 Q1122 H1127 F1128 S1129 L1735 L1745 L1757L1121-F1125 HydrophobicContact CD1-CD2 3.98Å; L1121-F1125 HydrophobicContact CD1-CE1 4.49Å; L1121-F1125 HydrophobicContact CD1-CE2 3.64Å; L1121-F1125 VanDerWaalsContact CD1-CE2 3.46Å; L1121-F1125 HydrophobicContact CD1-CZ 4.34Å; L1121-F1125 HydrophobicContact CD2-CD2 3.66Å; L1121-F1125 HydrophobicContact CD2-CE2 3.89Å; L1121-F1125 HydrophobicContact CD2-CZ 4Å; L1121-F1125 HydrophobicContact CG-CD2 3.95Å; L1121-F1125 HydrophobicContact CG-CE2 3.62Å; L1121-F1125 VanDerWaalsContact CG-CE2 3.49Å; L1121-F1125 HydrophobicContact CG-CZ 4.01Å; L1121-F1125 VanDerWaalsContact O-CD2 3.22Å; L1121-F1125 WeakPolarHBondContact O-CD2 3.37Å; L1121-F1125 WeakPolarHBondContact O-CG 3.22Å; L1121-F1125 PolarHBondContact O-N 3.36Å; Q1122-F1125 PolarHBondContact O-N 3.18Å; F1125-H1127 VanDerWaalsContact C-N 3.26Å; F1125-H1127 PolarHBondContact O-N 3.08Å; F1125-F1128 CarbonylContact O-C 3.54Å; F1125-F1128 WeakPolarHBondContact O-CA 3.08Å; F1125-F1128 PolarHBondContact O-N 3.24Å; F1125-F1128 VanDerWaalsContact O-N 3.11Å; F1125-S1129 VanDerWaalsContact O-CB 3.31Å; F1125-S1129 WeakPolarHBondContact O-CB 3.4Å; F1125-S1129 PolarHBondContact O-N 3.18Å; F1125-S1129 PolarHBondContact O-OG 2.91Å; F1125-S1129 VanDerWaalsContact O-OG 3.08Å; F1125-L1735 HydrophobicContact CD1-CD1 4.08Å; F1125-L1735 HydrophobicContact CD1-CD2 3.54Å; F1125-L1735 HydrophobicContact CD1-CG 4.42Å; F1125-L1735 HydrophobicContact CE1-CD1 4.14Å; F1125-L1735 HydrophobicContact CE1-CD2 3.64Å; F1125-L1735 HydrophobicContact CE1-CG 4.48Å; F1125-L1735 HydrophobicContact CG-CD2 4.28Å; F1125-L1735 HydrophobicContact CZ-CD2 4.46Å; F1125-L1745 HydrophobicContact CD2-CD1 4.25Å; F1125-L1745 HydrophobicContact CD2-CD2 4.23Å; F1125-L1745 HydrophobicContact CE1-CD1 4.46Å; F1125-L1745 HydrophobicContact CE2-CD1 3.49Å; F1125-L1745 VanDerWaalsContact CE2-CD1 3.46Å; F1125-L1745 HydrophobicContact CE2-CD2 3.94Å; F1125-L1745 HydrophobicContact CE2-CG 3.98Å; F1125-L1745 HydrophobicContact CZ-CD1 3.67Å; F1125-L1745 HydrophobicContact CZ-CG 4.41Å; F1125-L1757 HydrophobicContact CD1-CD1 4.43Å; F1125-L1757 HydrophobicContact CE1-CD1 3.85Å; F1125-L1757 VanDerWaalsContact CE1-CD1 3.45Å; F1125-L1757 HydrophobicContact CZ-CD1 4.02Å; F1125-L1757 HydrophobicContact CZ-CD2 4.48Å
1126R82.4Confident81.1Confident27.6 Ų27.639.5 Ų39.510%0.10419%0.19CC..Hα-helixtrans-56.8-40.5175.4-152.3-179.6162.1-175.2-4.9112E1008 L1011 D1012 Q1122 L1123 L1124 F1128 S1129 Q1130 E1133E1008-R1126 VanDerWaalsContact CG-NH1 3.32Å; E1008-R1126 PolarHBondContact O-NH1 3.28Å; E1008-R1126 IonicContact OE1-NH1 2.68Å; E1008-R1126 PolarHBondContact OE1-NH1 3.2Å; L1011-R1126 HydrophobicContact CD1-CB 4.49Å; D1012-R1126 IonicContact OD1-CZ 3.32Å; D1012-R1126 IonicContact OD1-NH1 3.06Å; D1012-R1126 PolarHBondContact OD1-NH1 3.3Å; D1012-R1126 IonicContact OD1-NH2 3.31Å; D1012-R1126 PolarHBondContact OD1-NH2 3.31Å; D1012-R1126 IonicContact OD2-CZ 3.31Å; D1012-R1126 IonicContact OD2-NH1 3.39Å; D1012-R1126 PolarHBondContact OD2-NH1 2.86Å; D1012-R1126 IonicContact OD2-NH2 3.24Å; D1012-R1126 PolarHBondContact OD2-NH2 2.92Å; Q1122-R1126 VanDerWaalsContact O-CB 3.26Å; Q1122-R1126 WeakPolarHBondContact O-CB 3.19Å; Q1122-R1126 WeakPolarHBondContact O-CG 3.41Å; Q1122-R1126 PolarHBondContact O-N 3.29Å; L1123-R1126 PolarHBondContact O-N 2.92Å; L1124-R1126 VanDerWaalsContact C-N 3.35Å; L1124-R1126 PolarHBondContact O-N 3.24Å; R1126-F1128 VanDerWaalsContact C-N 3.29Å; R1126-F1128 PolarHBondContact O-N 3.05Å; R1126-S1129 WeakPolarHBondContact CA-OG 3.41Å; R1126-S1129 CarbonylContact O-C 3.55Å; R1126-S1129 PolarHBondContact O-N 3Å; R1126-S1129 VanDerWaalsContact O-N 3.13Å; R1126-S1129 PolarHBondContact O-OG 2.76Å; R1126-Q1130 WeakPolarHBondContact O-CG 3.32Å; R1126-Q1130 PolarHBondContact O-N 2.92Å; R1126-E1133 WeakPolarHBondContact CG-OE2 3.38Å; R1126-E1133 IonicContact CZ-OE1 3.9Å; R1126-E1133 VanDerWaalsContact CZ-OE1 3.25Å; R1126-E1133 IonicContact CZ-OE2 3.65Å; R1126-E1133 IonicContact NE-OE1 3.34Å; R1126-E1133 PolarHBondContact NE-OE1 3.16Å; R1126-E1133 VanDerWaalsContact NE-OE1 3.09Å; R1126-E1133 IonicContact NE-OE2 3.06Å; R1126-E1133 PolarHBondContact NE-OE2 3.01Å; R1126-E1133 VanDerWaalsContact NE-OE2 3.16Å; R1126-E1133 IonicContact NH2-OE1 2.96Å; R1126-E1133 PolarHBondContact NH2-OE1 2.95Å; R1126-E1133 IonicContact NH2-OE2 3.2Å; R1126-E1133 PolarHBondContact NH2-OE2 2.72Å
1127H77.6Confident81.1Confident25.6 Ų25.642 Ų4212%0.11920%0.2CC..Hα-helixtrans-64.2-32.4176.5-170.2-79000112.9L1123 L1124 F1125 Q1130L1123-H1127 WeakPolarHBondContact O-CB 3.45Å; L1123-H1127 PolarHBondContact O-N 2.97Å; L1124-H1127 WeakPolarHBondContact O-CB 3.23Å; L1124-H1127 PolarHBondContact O-N 3.19Å; F1125-H1127 VanDerWaalsContact C-N 3.26Å; F1125-H1127 PolarHBondContact O-N 3.08Å; H1127-Q1130 PolarHBondContact CD2-NE2 3.25Å; H1127-Q1130 VanDerWaalsContact CD2-NE2 3.35Å; H1127-Q1130 PolarHBondContact NE2-NE2 3.32Å; H1127-Q1130 VanDerWaalsContact O-CG 3.31Å; H1127-Q1130 WeakPolarHBondContact O-CG 3.36Å; H1127-Q1130 PolarHBondContact O-NE2 3.04Å
1128F76.2Confident81.2Confident73.6 Ų73.640 Ų4032%0.32319%0.193SC..THydrogen-bonded Turntrans-92.3-4.5175.4-69.4-70.9000113.8I1102 L1124 F1125 R1126 E1731 L1735 L1738I1102-F1128 HydrophobicContact CD1-CE1 4.23Å; I1102-F1128 HydrophobicContact CD1-CZ 4.07Å; I1102-F1128 HydrophobicContact CG1-CE2 4.48Å; I1102-F1128 HydrophobicContact CG1-CZ 4.26Å; I1102-F1128 HydrophobicContact CG2-CZ 4.23Å; L1124-F1128 HydrophobicContact CD1-CD2 4.31Å; L1124-F1128 HydrophobicContact CD1-CE2 3.72Å; L1124-F1128 HydrophobicContact CG-CD2 4.28Å; L1124-F1128 HydrophobicContact CG-CE2 4.06Å; L1124-F1128 VanDerWaalsContact O-CD2 3.27Å; L1124-F1128 WeakPolarHBondContact O-CD2 3.34Å; L1124-F1128 PolarHBondContact O-N 3.19Å; L1124-F1128 VanDerWaalsContact O-N 3.13Å; F1125-F1128 CarbonylContact O-C 3.54Å; F1125-F1128 WeakPolarHBondContact O-CA 3.08Å; F1125-F1128 PolarHBondContact O-N 3.24Å; F1125-F1128 VanDerWaalsContact O-N 3.11Å; R1126-F1128 VanDerWaalsContact C-N 3.29Å; R1126-F1128 PolarHBondContact O-N 3.05Å; F1128-E1731 WeakPolarHBondContact O-CB 3.38Å; F1128-E1731 WeakPolarHBondContact O-CG 3.45Å; F1128-E1731 VanDerWaalsContact O-OE2 3.13Å; F1128-L1735 HydrophobicContact CB-CD1 3.73Å; F1128-L1735 VanDerWaalsContact CB-CD1 3.45Å; F1128-L1735 HydrophobicContact CB-CD2 3.62Å; F1128-L1735 VanDerWaalsContact CB-CD2 3.44Å; F1128-L1735 HydrophobicContact CB-CG 3.45Å; F1128-L1735 HydrophobicContact CD1-CG 4.41Å; F1128-L1735 HydrophobicContact CD2-CD2 3.55Å; F1128-L1735 HydrophobicContact CD2-CG 3.71Å; F1128-L1735 HydrophobicContact CE2-CD2 4.11Å; F1128-L1735 HydrophobicContact CG-CD1 4.25Å; F1128-L1735 HydrophobicContact CG-CD2 3.86Å; F1128-L1735 HydrophobicContact CG-CG 3.91Å; F1128-L1738 HydrophobicContact CD2-CD1 4.02Å; F1128-L1738 HydrophobicContact CE2-CD1 3.84Å
1129S80.4Confident81.3Confident32 Ų3242.6 Ų42.622%0.22420%0.201CC..SBendtrans-113.920.6177.570.80000112.8F1125 R1126 Q1131 E1132 E1133F1125-S1129 VanDerWaalsContact O-CB 3.31Å; F1125-S1129 WeakPolarHBondContact O-CB 3.4Å; F1125-S1129 PolarHBondContact O-N 3.18Å; F1125-S1129 PolarHBondContact O-OG 2.91Å; F1125-S1129 VanDerWaalsContact O-OG 3.08Å; R1126-S1129 WeakPolarHBondContact CA-OG 3.41Å; R1126-S1129 CarbonylContact O-C 3.55Å; R1126-S1129 PolarHBondContact O-N 3Å; R1126-S1129 VanDerWaalsContact O-N 3.13Å; R1126-S1129 PolarHBondContact O-OG 2.76Å; S1129-Q1131 VanDerWaalsContact C-N 3.29Å; S1129-Q1131 PolarHBondContact O-N 3.03Å; S1129-Q1131 VanDerWaalsContact O-N 3.14Å; S1129-E1132 PolarHBondContact O-N 3.2Å; S1129-E1132 VanDerWaalsContact O-N 3.11Å; S1129-E1133 VanDerWaalsContact O-CB 3.31Å; S1129-E1133 WeakPolarHBondContact O-CB 3.29Å; S1129-E1133 PolarHBondContact O-N 3.11Å
1130Q79.7Confident81.3Confident17 Ų1745.3 Ų45.38%0.07921%0.214CC..Hα-helixtrans-59-37.4-174.7-69.3179.11500112.7R1014 F1064 R1126 H1127 E1133 L1134R1014-Q1130 VanDerWaalsContact NH2-OE1 3.16Å; F1064-Q1130 HydrophobicContact CE1-CB 4.08Å; R1126-Q1130 WeakPolarHBondContact O-CG 3.32Å; R1126-Q1130 PolarHBondContact O-N 2.92Å; H1127-Q1130 PolarHBondContact CD2-NE2 3.25Å; H1127-Q1130 VanDerWaalsContact CD2-NE2 3.35Å; H1127-Q1130 PolarHBondContact NE2-NE2 3.32Å; H1127-Q1130 VanDerWaalsContact O-CG 3.31Å; H1127-Q1130 WeakPolarHBondContact O-CG 3.36Å; H1127-Q1130 PolarHBondContact O-NE2 3.04Å; Q1130-E1133 PolarHBondContact O-N 2.89Å; Q1130-L1134 VanDerWaalsContact O-CB 3.29Å; Q1130-L1134 WeakPolarHBondContact O-CB 3.39Å; Q1130-L1134 PolarHBondContact O-N 3.22Å
1131Q78.5Confident81.1Confident56.4 Ų56.446 Ų4626%0.26422%0.219SC..Hα-helixtrans-68.7-43.5-179.6-68.5177.8200112F1064 S1129 L1134 I1135 L1724 I1728 E1731F1064-Q1131 HydrophobicContact CD1-CG 4.06Å; F1064-Q1131 HydrophobicContact CD2-CG 4.44Å; F1064-Q1131 HydrophobicContact CE1-CG 3.81Å; F1064-Q1131 HydrophobicContact CE2-CG 4.28Å; F1064-Q1131 HydrophobicContact CG-CG 4.39Å; F1064-Q1131 HydrophobicContact CZ-CG 3.93Å; S1129-Q1131 VanDerWaalsContact C-N 3.29Å; S1129-Q1131 PolarHBondContact O-N 3.03Å; S1129-Q1131 VanDerWaalsContact O-N 3.14Å; Q1131-L1134 PolarHBondContact O-N 3.04Å; Q1131-I1135 WeakPolarHBondContact O-CD1 3.11Å; Q1131-I1135 VanDerWaalsContact O-CG1 3.28Å; Q1131-I1135 WeakPolarHBondContact O-CG1 3.43Å; Q1131-I1135 PolarHBondContact O-N 3.09Å; Q1131-I1135 VanDerWaalsContact O-N 3.11Å; Q1131-L1724 HydrophobicContact CB-CD1 4.19Å; Q1131-L1724 HydrophobicContact CB-CD2 4.49Å; Q1131-L1724 HydrophobicContact CG-CD1 4.42Å; Q1131-L1724 HydrophobicContact CG-CD2 4.08Å; Q1131-I1728 HydrophobicContact CB-CD1 4.47Å; Q1131-I1728 HydrophobicContact CB-CG1 3.81Å; Q1131-I1728 VanDerWaalsContact OE1-N 3.13Å; Q1131-E1731 VanDerWaalsContact CD-OE1 3.22Å; Q1131-E1731 VanDerWaalsContact CG-OE1 3.28Å; Q1131-E1731 WeakPolarHBondContact CG-OE1 3.37Å; Q1131-E1731 PolarHBondContact N-OE1 2.84Å; Q1131-E1731 PolarHBondContact N-OE2 2.67Å; Q1131-E1731 PolarHBondContact NE2-OE1 3.45Å; Q1131-E1731 VanDerWaalsContact NE2-OE1 3.14Å
1132E80.6Confident81Confident83 Ų8345.3 Ų45.339%0.38822%0.215SC..Hα-helixtrans-65.8-43.1175.6-173.3-172.3167.300111S1129 L1134 I1135 N1136 Y1732 K1756S1129-E1132 PolarHBondContact O-N 3.2Å; S1129-E1132 VanDerWaalsContact O-N 3.11Å; E1132-L1134 VanDerWaalsContact C-N 3.33Å; E1132-L1134 PolarHBondContact O-N 3.04Å; E1132-I1135 PolarHBondContact O-N 3.21Å; E1132-N1136 WeakPolarHBondContact O-CB 3.4Å; E1132-N1136 VanDerWaalsContact O-CG 3.31Å; E1132-N1136 PolarHBondContact O-N 3.38Å; E1132-N1136 PolarHBondContact O-ND2 3.33Å; E1132-Y1732 PolarHBondContact OE2-OH 3.43Å; E1132-K1756 IonicContact OE1-NZ 2.92Å; E1132-K1756 PolarHBondContact OE1-NZ 3.26Å; E1132-K1756 VanDerWaalsContact OE1-NZ 3.09Å
1133E83.7Confident80.6Confident27.2 Ų27.243 Ų4313%0.12721%0.205CC..Hα-helixtrans-58.3-48.5175.8-174177-178.800111V1015 R1126 S1129 Q1130 I1135 N1136 K1137V1015-E1133 HydrophobicContact CG2-CG 4.46Å; R1126-E1133 WeakPolarHBondContact CG-OE2 3.38Å; R1126-E1133 IonicContact CZ-OE1 3.9Å; R1126-E1133 VanDerWaalsContact CZ-OE1 3.25Å; R1126-E1133 IonicContact CZ-OE2 3.65Å; R1126-E1133 IonicContact NE-OE1 3.34Å; R1126-E1133 PolarHBondContact NE-OE1 3.16Å; R1126-E1133 VanDerWaalsContact NE-OE1 3.09Å; R1126-E1133 IonicContact NE-OE2 3.06Å; R1126-E1133 PolarHBondContact NE-OE2 3.01Å; R1126-E1133 VanDerWaalsContact NE-OE2 3.16Å; R1126-E1133 IonicContact NH2-OE1 2.96Å; R1126-E1133 PolarHBondContact NH2-OE1 2.95Å; R1126-E1133 IonicContact NH2-OE2 3.2Å; R1126-E1133 PolarHBondContact NH2-OE2 2.72Å; S1129-E1133 VanDerWaalsContact O-CB 3.31Å; S1129-E1133 WeakPolarHBondContact O-CB 3.29Å; S1129-E1133 PolarHBondContact O-N 3.11Å; Q1130-E1133 PolarHBondContact O-N 2.89Å; E1133-I1135 VanDerWaalsContact C-N 3.34Å; E1133-I1135 PolarHBondContact O-N 3.02Å; E1133-N1136 PolarHBondContact O-N 3.04Å; E1133-K1137 HydrophobicContact CG-CG 4.17Å; E1133-K1137 WeakPolarHBondContact O-CB 3.39Å; E1133-K1137 WeakPolarHBondContact O-CG 3.25Å; E1133-K1137 PolarHBondContact O-N 3.28Å
1134L83.9Confident80.4Confident2.6 Ų2.643.2 Ų43.21%0.01421%0.206CC..Hα-helixtrans-56.4-46.5177.5177.962.1000112V1015 Q1018 I1019 L1022 F1064 Q1130 Q1131 E1132 K1137 L1138V1015-L1134 HydrophobicContact CG1-CD1 4.22Å; Q1018-L1134 HydrophobicContact CB-CD1 3.76Å; Q1018-L1134 HydrophobicContact CB-CD2 4.18Å; I1019-L1134 HydrophobicContact CD1-CD1 4.49Å; I1019-L1134 HydrophobicContact CG1-CD1 3.57Å; L1022-L1134 HydrophobicContact CD1-CD1 4.35Å; L1022-L1134 HydrophobicContact CD1-CD2 3.98Å; L1022-L1134 HydrophobicContact CD1-CG 4.34Å; F1064-L1134 HydrophobicContact CE2-CD2 3.76Å; F1064-L1134 HydrophobicContact CZ-CD2 3.79Å; Q1130-L1134 VanDerWaalsContact O-CB 3.29Å; Q1130-L1134 WeakPolarHBondContact O-CB 3.39Å; Q1130-L1134 PolarHBondContact O-N 3.22Å; Q1131-L1134 PolarHBondContact O-N 3.04Å; E1132-L1134 VanDerWaalsContact C-N 3.33Å; E1132-L1134 PolarHBondContact O-N 3.04Å; L1134-K1137 PolarHBondContact O-N 3.09Å; L1134-L1138 VanDerWaalsContact O-CB 3.24Å; L1134-L1138 WeakPolarHBondContact O-CB 3.34Å; L1134-L1138 PolarHBondContact O-N 3.23Å
1135I80.1Confident79.9Confident45.2 Ų45.244.8 Ų44.823%0.23222%0.216CC..Hα-helixtrans-62.2-48178.7-68.9164.7000110.8Q1131 E1132 E1133 K1137 L1138 K1139 I1720 E1721 L1724 I1728Q1131-I1135 WeakPolarHBondContact O-CD1 3.11Å; Q1131-I1135 VanDerWaalsContact O-CG1 3.28Å; Q1131-I1135 WeakPolarHBondContact O-CG1 3.43Å; Q1131-I1135 PolarHBondContact O-N 3.09Å; Q1131-I1135 VanDerWaalsContact O-N 3.11Å; E1132-I1135 PolarHBondContact O-N 3.21Å; E1133-I1135 VanDerWaalsContact C-N 3.34Å; E1133-I1135 PolarHBondContact O-N 3.02Å; I1135-K1137 VanDerWaalsContact C-N 3.32Å; I1135-K1137 PolarHBondContact O-N 3.13Å; I1135-L1138 PolarHBondContact O-N 3.13Å; I1135-K1139 HydrophobicContact CG2-CD 4.48Å; I1135-K1139 WeakPolarHBondContact O-CG 3.4Å; I1135-K1139 PolarHBondContact O-N 3.05Å; I1135-K1139 VanDerWaalsContact O-N 3.11Å; I1135-I1720 HydrophobicContact CG1-CG2 4.13Å; I1135-E1721 HydrophobicContact CD1-CG 4.19Å; I1135-E1721 HydrophobicContact CG1-CG 4.41Å; I1135-E1721 HydrophobicContact CG2-CG 3.69Å; I1135-E1721 WeakPolarHBondContact CG2-OE1 3.38Å; I1135-L1724 HydrophobicContact CD1-CB 4.2Å; I1135-L1724 HydrophobicContact CD1-CD1 4.03Å; I1135-L1724 HydrophobicContact CG1-CD1 4.19Å; I1135-I1728 HydrophobicContact CD1-CD1 3.97Å
1136N84.3Confident79.6Confident69.4 Ų69.443 Ų4337%0.37121%0.212SC..Hα-helixtrans-64.3-38.2-178.3-73.3-27.4000111.9E1132 E1133E1132-N1136 WeakPolarHBondContact O-CB 3.4Å; E1132-N1136 VanDerWaalsContact O-CG 3.31Å; E1132-N1136 PolarHBondContact O-N 3.38Å; E1132-N1136 PolarHBondContact O-ND2 3.33Å; E1133-N1136 PolarHBondContact O-N 3.04Å
1137K83.6Confident79.2Confident51.6 Ų51.647.6 Ų47.622%0.22424%0.239CC..Hα-helixtrans-71.1-41.5175.6-63.9-67.4-178.3178.60111.8I865 Y867 V1015 I1019 E1133 L1134 I1135 K1139 Q1140 V1141I865-K1137 HydrophobicContact CD1-CD 3.96Å; I865-K1137 HydrophobicContact CD1-CG 4.24Å; Y867-K1137 HydrophobicContact CE1-CB 4.49Å; Y867-K1137 HydrophobicContact CE1-CD 3.97Å; Y867-K1137 VanDerWaalsContact OH-CD 3.24Å; Y867-K1137 WeakPolarHBondContact OH-CD 3.4Å; Y867-K1137 PolarHBondContact OH-NZ 3.15Å; V1015-K1137 HydrophobicContact CG1-CB 4.29Å; V1015-K1137 HydrophobicContact CG1-CG 4.22Å; I1019-K1137 HydrophobicContact CD1-CB 3.97Å; E1133-K1137 HydrophobicContact CG-CG 4.17Å; E1133-K1137 WeakPolarHBondContact O-CB 3.39Å; E1133-K1137 WeakPolarHBondContact O-CG 3.25Å; E1133-K1137 PolarHBondContact O-N 3.28Å; L1134-K1137 PolarHBondContact O-N 3.09Å; I1135-K1137 VanDerWaalsContact C-N 3.32Å; I1135-K1137 PolarHBondContact O-N 3.13Å; K1137-K1139 VanDerWaalsContact C-N 3.3Å; K1137-K1139 PolarHBondContact O-N 3.08Å; K1137-Q1140 WeakPolarHBondContact O-CB 3.35Å; K1137-Q1140 PolarHBondContact O-N 3.2Å; K1137-V1141 PolarHBondContact O-N 3.2Å
1138L81.8Confident79.1Confident27 Ų2749 Ų4914%0.14125%0.249CC..Hα-helixtrans-60.2-38.6177.4-173.581.6000112I1019 L1022 L1134 I1135 Q1140 V1141 F1713 M1716 I1717 I1720I1019-L1138 HydrophobicContact CG1-CD1 4.4Å; I1019-L1138 HydrophobicContact CG2-CD1 4.01Å; L1022-L1138 HydrophobicContact CB-CD1 4.45Å; L1022-L1138 HydrophobicContact CD1-CD1 3.79Å; L1022-L1138 HydrophobicContact CD1-CD2 4.35Å; L1134-L1138 VanDerWaalsContact O-CB 3.24Å; L1134-L1138 WeakPolarHBondContact O-CB 3.34Å; L1134-L1138 PolarHBondContact O-N 3.23Å; I1135-L1138 PolarHBondContact O-N 3.13Å; L1138-Q1140 PolarHBondContact O-N 3.25Å; L1138-V1141 WeakPolarHBondContact O-CB 3.3Å; L1138-V1141 PolarHBondContact O-N 3.23Å; L1138-V1141 VanDerWaalsContact O-N 3.12Å; L1138-F1713 HydrophobicContact CD1-CE2 3.87Å; L1138-F1713 HydrophobicContact CD1-CZ 4Å; L1138-F1713 HydrophobicContact CG-CE2 4.28Å; L1138-F1713 HydrophobicContact CG-CZ 4.15Å; L1138-M1716 HydrophobicContact CD2-CE 4.4Å; L1138-I1717 HydrophobicContact CD2-CG1 3.79Å; L1138-I1717 HydrophobicContact CG-CD1 4.46Å; L1138-I1717 HydrophobicContact CG-CG1 4.06Å; L1138-I1720 HydrophobicContact CD2-CD1 3.81Å
1139K81.9Confident79Confident126.8 Ų126.845.5 Ų45.555%0.55123%0.234SC*.THydrogen-bonded Turntrans-61-26.3174.1-74.3175.5-179.3174.50113.9I1135 K1137 I1717 E1721I1135-K1139 HydrophobicContact CG2-CD 4.48Å; I1135-K1139 WeakPolarHBondContact O-CG 3.4Å; I1135-K1139 PolarHBondContact O-N 3.05Å; I1135-K1139 VanDerWaalsContact O-N 3.11Å; K1137-K1139 VanDerWaalsContact C-N 3.3Å; K1137-K1139 PolarHBondContact O-N 3.08Å; K1139-I1717 HydrophobicContact CG-CG2 4.12Å; K1139-E1721 WeakPolarHBondContact CE-OE1 3.27Å; K1139-E1721 IonicContact NZ-OE1 3.29Å; K1139-E1721 PolarHBondContact NZ-OE1 3.16Å
1140Q82.2Confident78.8Confident89.2 Ų89.244.3 Ų44.342%0.41723%0.225SC..THydrogen-bonded Turntrans-85.3-15.9178.5-64.4178.45.400112.4Y867 K1137 L1138 Q1142 Q1258 H1262Y867-Q1140 HydrophobicContact CD1-CB 3.66Å; Y867-Q1140 HydrophobicContact CE1-CB 3.77Å; Y867-Q1140 VanDerWaalsContact CE1-OE1 3.24Å; Y867-Q1140 PolarHBondContact OH-OE1 3.23Å; K1137-Q1140 WeakPolarHBondContact O-CB 3.35Å; K1137-Q1140 PolarHBondContact O-N 3.2Å; L1138-Q1140 PolarHBondContact O-N 3.25Å; Q1140-Q1142 PolarHBondContact O-N 3.25Å; Q1140-Q1258 PolarHBondContact O-NE2 3.07Å; Q1140-H1262 PolarHBondContact O-CE1 2.98Å; Q1140-H1262 PolarHBondContact O-NE2 3.15Å; Q1140-H1262 VanDerWaalsContact O-NE2 3.16Å
1141V80.7Confident78.9Confident14.2 Ų14.249.9 Ų49.99%0.08625%0.249CC..  trans-67.1126.3-178.1176.50000110.3Y867 I1019 L1023 K1137 L1138 F1713Y867-V1141 HydrophobicContact CD1-CG2 4.42Å; Y867-V1141 CarbonylContact O-C 3.56Å; Y867-V1141 VanDerWaalsContact O-CA 3.31Å; Y867-V1141 WeakPolarHBondContact O-CA 3.37Å; Y867-V1141 WeakPolarHBondContact O-CG1 3.48Å; I1019-V1141 HydrophobicContact CD1-CG2 4.23Å; I1019-V1141 HydrophobicContact CG2-CG2 3.92Å; L1023-V1141 HydrophobicContact CD1-CG1 4.34Å; K1137-V1141 PolarHBondContact O-N 3.2Å; L1138-V1141 WeakPolarHBondContact O-CB 3.3Å; L1138-V1141 PolarHBondContact O-N 3.23Å; L1138-V1141 VanDerWaalsContact O-N 3.12Å; V1141-F1713 HydrophobicContact CB-CZ 4.27Å; V1141-F1713 HydrophobicContact CG1-CZ 4.49Å
1142Q77.4Confident78.8Confident13.8 Ų13.847.8 Ų47.86%0.06424%0.24CC..EExtended strand (participates in β ladder)trans-102.7112.8173.3-173.4-179.58.900109.2Y867 R869 Q1140 L1144 Q1255 L1259Y867-Q1142 PolarHBondContact O-N 3.08Å; R869-Q1142 PolarHBondContact N-O 2.99Å; Q1140-Q1142 PolarHBondContact O-N 3.25Å; Q1142-L1144 HydrophobicContact CG-CD2 4.47Å; Q1142-Q1255 PolarHBondContact NE2-O 3.2Å; Q1142-L1259 VanDerWaalsContact OE1-CD2 3.23Å
1143L76Confident78.9Confident34.2 Ų34.244.9 Ų44.918%0.17923%0.225CC..EExtended strand (participates in β ladder)trans-91.3112.3179.1-17265.9000110.5R869 W871 L874 L1023 V1145 I1709R869-L1143 HydrophobicContact CB-CD1 4.34Å; W871-L1143 HydrophobicContact CB-CD1 4.38Å; W871-L1143 HydrophobicContact CB-CG 4.43Å; W871-L1143 HydrophobicContact CD2-CD2 4.22Å; W871-L1143 HydrophobicContact CE3-CD1 3.93Å; W871-L1143 HydrophobicContact CE3-CD2 3.51Å; W871-L1143 VanDerWaalsContact CE3-CD2 3.4Å; W871-L1143 HydrophobicContact CE3-CG 4.02Å; W871-L1143 HydrophobicContact CZ3-CD1 4.3Å; W871-L1143 HydrophobicContact CZ3-CD2 3.77Å; W871-L1143 HydrophobicContact CZ3-CG 4.5Å; L874-L1143 HydrophobicContact CD1-CD1 3.96Å; L1023-L1143 HydrophobicContact CD2-CD1 4.49Å; L1023-L1143 HydrophobicContact CD2-CD2 4.48Å; L1143-V1145 HydrophobicContact CD2-CG2 4.14Å; L1143-V1145 HydrophobicContact CG-CG2 4.25Å; L1143-V1145 PolarHBondContact O-N 3.19Å; L1143-I1709 HydrophobicContact CD2-CG2 3.62Å
1144L76.4Confident78.8Confident3.2 Ų3.250.1 Ų50.12%0.01724%0.244CC..EExtended strand (participates in β ladder)trans-87.9104.3-178.7-63.7166000110.2R869 L870 W871 Q1142 I1150 Y1153 F1251 L1259R869-L1144 PolarHBondContact O-N 3.01Å; L870-L1144 HydrophobicContact CD2-CB 4.38Å; L870-L1144 HydrophobicContact CD2-CD1 4.15Å; W871-L1144 WeakPolarHBondContact CB-O 3.24Å; W871-L1144 PolarHBondContact N-O 3.25Å; Q1142-L1144 HydrophobicContact CG-CD2 4.47Å; L1144-I1150 HydrophobicContact CB-CG1 4.21Å; L1144-Y1153 HydrophobicContact CD1-CD1 4.17Å; L1144-Y1153 HydrophobicContact CD1-CD2 4.09Å; L1144-Y1153 HydrophobicContact CD1-CG 3.68Å; L1144-F1251 HydrophobicContact CD2-CE2 4.33Å; L1144-F1251 HydrophobicContact CD2-CZ 3.97Å; L1144-L1259 HydrophobicContact CD1-CD1 4.35Å; L1144-L1259 HydrophobicContact CD1-CD2 4.12Å; L1144-L1259 HydrophobicContact CD2-CD1 4.25Å; L1144-L1259 HydrophobicContact CD2-CD2 4.24Å
1145V69.9Low78.7Confident48.8 Ų48.854 Ų5430%0.29626%0.262SS..  trans-99.5-34.2179.2-174.40000112.2W871 L1143 F1705 A1706 I1709W871-V1145 HydrophobicContact CB-CB 4.4Å; W871-V1145 HydrophobicContact CB-CG2 4.07Å; W871-V1145 HydrophobicContact CG-CG1 4.4Å; W871-V1145 HydrophobicContact CG-CG2 4.28Å; L1143-V1145 HydrophobicContact CD2-CG2 4.14Å; L1143-V1145 HydrophobicContact CG-CG2 4.25Å; L1143-V1145 PolarHBondContact O-N 3.19Å; V1145-F1705 HydrophobicContact CG1-CD1 3.72Å; V1145-F1705 HydrophobicContact CG1-CE1 3.79Å; V1145-A1706 HydrophobicContact CB-CB 4.04Å; V1145-A1706 HydrophobicContact CG1-CB 4.03Å; V1145-I1709 HydrophobicContact CG1-CD1 3.7Å; V1145-I1709 HydrophobicContact CG2-CB 4.13Å; V1145-I1709 HydrophobicContact CG2-CD1 4.05Å; V1145-I1709 HydrophobicContact CG2-CG2 3.74Å
1146S74.4Confident78.8Confident34.6 Ų34.651.8 Ų51.824%0.24225%0.251CS..SBendtrans-77.9139.1-175.161.10000112.7T1148 G1149 I1150S1146-T1148 PolarHBondContact O-N 3.26Å; S1146-T1148 PolarHBondContact OG-OG1 3.32Å; S1146-G1149 PolarHBondContact O-N 3.07Å; S1146-G1149 VanDerWaalsContact O-N 3.14Å; S1146-G1149 PolarHBondContact OG-N 3.02Å; S1146-G1149 VanDerWaalsContact OG-N 3.15Å; S1146-I1150 VanDerWaalsContact O-CG1 3.25Å; S1146-I1150 WeakPolarHBondContact O-CG1 3.41Å; S1146-I1150 PolarHBondContact O-N 3.17Å
1147D74.5Confident78.6Confident123.2 Ų123.251.4 Ų51.466%0.65925%0.246SC*.Hα-helixtrans-59.4-32.1176.5-71.9-35.9000112.6K1151D1147-K1151 VanDerWaalsContact O-CG 3.31Å; D1147-K1151 WeakPolarHBondContact O-CG 3.38Å; D1147-K1151 PolarHBondContact O-N 3.17Å; D1147-K1151 VanDerWaalsContact O-N 3.11Å
1148T75.7Confident78.6Confident55.4 Ų55.455 Ų5534%0.3426%0.263SS..Hα-helixtrans-66.3-49.7174.750.30000111.3S1146 I1150 K1151 I1152 S1250S1146-T1148 PolarHBondContact O-N 3.26Å; S1146-T1148 PolarHBondContact OG-OG1 3.32Å; T1148-I1150 VanDerWaalsContact C-N 3.3Å; T1148-I1150 PolarHBondContact O-N 3.23Å; T1148-K1151 PolarHBondContact O-N 3.21Å; T1148-I1152 VanDerWaalsContact O-CG1 3.31Å; T1148-I1152 WeakPolarHBondContact O-CG1 3.4Å; T1148-I1152 PolarHBondContact O-N 3.13Å; T1148-S1250 WeakPolarHBondContact CG2-OG 3.34Å; T1148-S1250 PolarHBondContact OG1-OG 2.85Å
1149G74.1Confident78.6Confident0 Ų055.5 Ų55.50%027%0.265CS..Hα-helixtrans-62.2-37.5177.700000112.7S1146 I1152 Y1153 F1251S1146-G1149 PolarHBondContact O-N 3.07Å; S1146-G1149 VanDerWaalsContact O-N 3.14Å; S1146-G1149 PolarHBondContact OG-N 3.02Å; S1146-G1149 VanDerWaalsContact OG-N 3.15Å; G1149-I1152 PolarHBondContact O-N 3.24Å; G1149-Y1153 WeakPolarHBondContact O-CB 3.25Å; G1149-Y1153 PolarHBondContact O-N 3.25Å; G1149-F1251 VanDerWaalsContact CA-CE2 3.47Å
1150I76.4Confident78.5Confident8.2 Ų8.249.5 Ų49.54%0.04224%0.239CC..Hα-helixtrans-64.6-42.9175.9-66.5171000111.5L870 L1144 S1146 T1148 Y1153 R1154L870-I1150 HydrophobicContact CD2-CB 4.09Å; L870-I1150 HydrophobicContact CD2-CD1 4.44Å; L870-I1150 HydrophobicContact CD2-CG1 3.69Å; L870-I1150 HydrophobicContact CD2-CG2 3.75Å; L1144-I1150 HydrophobicContact CB-CG1 4.21Å; S1146-I1150 VanDerWaalsContact O-CG1 3.25Å; S1146-I1150 WeakPolarHBondContact O-CG1 3.41Å; S1146-I1150 PolarHBondContact O-N 3.17Å; T1148-I1150 VanDerWaalsContact C-N 3.3Å; T1148-I1150 PolarHBondContact O-N 3.23Å; I1150-Y1153 PolarHBondContact O-N 2.91Å; I1150-R1154 VanDerWaalsContact CG2-NH2 3.27Å; I1150-R1154 WeakPolarHBondContact O-CG 3.29Å; I1150-R1154 PolarHBondContact O-N 3.2Å; I1150-R1154 VanDerWaalsContact O-N 3.1Å
1151K79.9Confident78.3Confident133.6 Ų133.648.8 Ų48.858%0.58124%0.238SC*.Hα-helixtrans-63-46.5175.9-75.6175.3-176.5179.30111.4D1147 T1148 Y1153 R1154 Q1155D1147-K1151 VanDerWaalsContact O-CG 3.31Å; D1147-K1151 WeakPolarHBondContact O-CG 3.38Å; D1147-K1151 PolarHBondContact O-N 3.17Å; D1147-K1151 VanDerWaalsContact O-N 3.11Å; T1148-K1151 PolarHBondContact O-N 3.21Å; K1151-Y1153 VanDerWaalsContact C-N 3.35Å; K1151-Y1153 PolarHBondContact O-N 3.25Å; K1151-R1154 PolarHBondContact O-N 3.24Å; K1151-Q1155 WeakPolarHBondContact O-CB 3.4Å; K1151-Q1155 WeakPolarHBondContact O-CG 3.41Å; K1151-Q1155 PolarHBondContact O-N 3.25Å
1152I78Confident78.3Confident11.6 Ų11.651.1 Ų51.16%0.05925%0.252CS..Hα-helixtrans-59-47.3177.9-66.5165.5000110.3T1148 G1149 R1154 Q1155 L1156 L1203 L1206 F1251 L1259T1148-I1152 VanDerWaalsContact O-CG1 3.31Å; T1148-I1152 WeakPolarHBondContact O-CG1 3.4Å; T1148-I1152 PolarHBondContact O-N 3.13Å; G1149-I1152 PolarHBondContact O-N 3.24Å; I1152-R1154 PolarHBondContact O-N 3.18Å; I1152-Q1155 PolarHBondContact O-N 3.24Å; I1152-L1156 HydrophobicContact CG2-CD1 3.68Å; I1152-L1156 HydrophobicContact CG2-CG 4.18Å; I1152-L1156 WeakPolarHBondContact O-CB 3.37Å; I1152-L1156 WeakPolarHBondContact O-CG 3.42Å; I1152-L1156 PolarHBondContact O-N 3.08Å; I1152-L1203 HydrophobicContact CG1-CD2 4.44Å; I1152-L1206 HydrophobicContact CD1-CD1 4.47Å; I1152-F1251 HydrophobicContact CD1-CB 4.09Å; I1152-F1251 HydrophobicContact CD1-CD1 3.98Å; I1152-F1251 HydrophobicContact CD1-CG 4.12Å; I1152-L1259 HydrophobicContact CG2-CD2 4.38Å
1153Y81.9Confident78.4Confident22.6 Ų22.650.4 Ų50.49%0.08925%0.249CC..Hα-helixtrans-59.3-47.6177.7171.4-105.3000113.1A868 L870 L1144 G1149 I1150 K1151 Q1155 L1156 K1157 L1259 L1263A868-Y1153 HydrophobicContact CB-CD2 4.21Å; A868-Y1153 HydrophobicContact CB-CE2 3.7Å; L870-Y1153 HydrophobicContact CD1-CE1 4.33Å; L870-Y1153 HydrophobicContact CD2-CD1 3.99Å; L870-Y1153 HydrophobicContact CD2-CE1 4.36Å; L870-Y1153 HydrophobicContact CG-CD1 4.35Å; L870-Y1153 HydrophobicContact CG-CE1 4.32Å; L1144-Y1153 HydrophobicContact CD1-CD1 4.17Å; L1144-Y1153 HydrophobicContact CD1-CD2 4.09Å; L1144-Y1153 HydrophobicContact CD1-CG 3.68Å; G1149-Y1153 WeakPolarHBondContact O-CB 3.25Å; G1149-Y1153 PolarHBondContact O-N 3.25Å; I1150-Y1153 PolarHBondContact O-N 2.91Å; K1151-Y1153 VanDerWaalsContact C-N 3.35Å; K1151-Y1153 PolarHBondContact O-N 3.25Å; Y1153-Q1155 VanDerWaalsContact C-N 3.33Å; Y1153-Q1155 PolarHBondContact O-N 3.21Å; Y1153-L1156 PolarHBondContact O-N 3.25Å; Y1153-K1157 HydrophobicContact CE1-CD 4.32Å; Y1153-K1157 VanDerWaalsContact O-CB 3.26Å; Y1153-K1157 WeakPolarHBondContact O-CB 3.3Å; Y1153-K1157 PolarHBondContact O-N 3.17Å; Y1153-L1259 HydrophobicContact CD2-CD1 3.53Å; Y1153-L1259 HydrophobicContact CD2-CD2 4.16Å; Y1153-L1259 HydrophobicContact CD2-CG 4.13Å; Y1153-L1259 HydrophobicContact CE2-CD1 4.18Å; Y1153-L1259 HydrophobicContact CG-CD1 4.44Å; Y1153-L1263 HydrophobicContact CD2-CD1 4.38Å; Y1153-L1263 HydrophobicContact CD2-CD2 4.46Å; Y1153-L1263 HydrophobicContact CE2-CD1 4.48Å; Y1153-L1263 HydrophobicContact CE2-CD2 3.82Å; Y1153-L1263 HydrophobicContact CE2-CG 4.43Å
1154R81.5Confident78.6Confident136 Ų13650.8 Ų50.851%0.51325%0.248SC..Hα-helixtrans-61.8-43.1179.1-71.2-178.8-162.5138-0.4111.6I1150 K1151 I1152 Q1158I1150-R1154 VanDerWaalsContact CG2-NH2 3.27Å; I1150-R1154 WeakPolarHBondContact O-CG 3.29Å; I1150-R1154 PolarHBondContact O-N 3.2Å; I1150-R1154 VanDerWaalsContact O-N 3.1Å; K1151-R1154 PolarHBondContact O-N 3.24Å; I1152-R1154 PolarHBondContact O-N 3.18Å; R1154-Q1158 VanDerWaalsContact O-CB 3.29Å; R1154-Q1158 WeakPolarHBondContact O-CB 3.33Å; R1154-Q1158 PolarHBondContact O-N 3.32Å
1155Q82Confident78.6Confident84.6 Ų84.651.2 Ų51.240%0.39525%0.253SS..Hα-helixtrans-65.5-49178.1-74177.3-26.100111.5K1151 I1152 Y1153 K1157 Q1158 H1159 L1203K1151-Q1155 WeakPolarHBondContact O-CB 3.4Å; K1151-Q1155 WeakPolarHBondContact O-CG 3.41Å; K1151-Q1155 PolarHBondContact O-N 3.25Å; I1152-Q1155 PolarHBondContact O-N 3.24Å; Y1153-Q1155 VanDerWaalsContact C-N 3.33Å; Y1153-Q1155 PolarHBondContact O-N 3.21Å; Q1155-K1157 VanDerWaalsContact C-N 3.35Å; Q1155-K1157 PolarHBondContact O-N 3.22Å; Q1155-Q1158 PolarHBondContact O-N 3.19Å; Q1155-H1159 VanDerWaalsContact O-CB 3.29Å; Q1155-H1159 WeakPolarHBondContact O-CB 3.34Å; Q1155-H1159 PolarHBondContact O-CD2 3.04Å; Q1155-H1159 VanDerWaalsContact O-CG 3.29Å; Q1155-H1159 PolarHBondContact O-N 3.28Å; Q1155-L1203 HydrophobicContact CB-CD1 4.1Å
1156L81.9Confident78.8Confident0 Ų050 Ų500%025%0.245CC..Hα-helixtrans-59.4-46.7177.5-74.7175.5000111.4I1152 Y1153 Q1158 H1159 L1160 I1200 L1203 I1256 L1259 L1260 L1263I1152-L1156 HydrophobicContact CG2-CD1 3.68Å; I1152-L1156 HydrophobicContact CG2-CG 4.18Å; I1152-L1156 WeakPolarHBondContact O-CB 3.37Å; I1152-L1156 WeakPolarHBondContact O-CG 3.42Å; I1152-L1156 PolarHBondContact O-N 3.08Å; Y1153-L1156 PolarHBondContact O-N 3.25Å; L1156-Q1158 PolarHBondContact O-N 3.18Å; L1156-H1159 PolarHBondContact O-N 3.08Å; L1156-L1160 VanDerWaalsContact O-CB 3.31Å; L1156-L1160 WeakPolarHBondContact O-CB 3.4Å; L1156-L1160 WeakPolarHBondContact O-CD1 3.33Å; L1156-L1160 WeakPolarHBondContact O-CG 3.4Å; L1156-L1160 PolarHBondContact O-N 3.08Å; L1156-I1200 HydrophobicContact CD2-CB 4.48Å; L1156-I1200 HydrophobicContact CD2-CG1 4.14Å; L1156-I1200 HydrophobicContact CD2-CG2 4.2Å; L1156-L1203 HydrophobicContact CD2-CB 4.45Å; L1156-L1203 HydrophobicContact CD2-CD1 3.86Å; L1156-L1203 HydrophobicContact CG-CD1 4.11Å; L1156-I1256 HydrophobicContact CD1-CG2 4.45Å; L1156-L1259 HydrophobicContact CD1-CD2 3.92Å; L1156-L1259 HydrophobicContact CD1-CG 4.46Å; L1156-L1260 HydrophobicContact CD1-CD2 3.99Å; L1156-L1260 HydrophobicContact CD2-CD2 3.92Å; L1156-L1260 HydrophobicContact CG-CD2 4.47Å; L1156-L1263 HydrophobicContact CB-CD1 3.82Å
1157K81.1Confident78.8Confident60.6 Ų60.648.7 Ų48.726%0.26324%0.235SC..Hα-helixtrans-58.5-51.7177.5-175.4173.4-179.5178.20111.2S889 Y1153 Q1155 H1159 L1160 D1161 L1263S889-K1157 PolarHBondContact OG-NZ 3.06Å; Y1153-K1157 HydrophobicContact CE1-CD 4.32Å; Y1153-K1157 VanDerWaalsContact O-CB 3.26Å; Y1153-K1157 WeakPolarHBondContact O-CB 3.3Å; Y1153-K1157 PolarHBondContact O-N 3.17Å; Q1155-K1157 VanDerWaalsContact C-N 3.35Å; Q1155-K1157 PolarHBondContact O-N 3.22Å; K1157-H1159 VanDerWaalsContact C-N 3.34Å; K1157-H1159 PolarHBondContact O-N 3.01Å; K1157-L1160 PolarHBondContact O-N 3.23Å; K1157-D1161 WeakPolarHBondContact CG-OD2 3.47Å; K1157-D1161 WeakPolarHBondContact O-CB 3.37Å; K1157-D1161 PolarHBondContact O-N 3.05Å; K1157-L1263 HydrophobicContact CB-CD2 4.22Å; K1157-L1263 HydrophobicContact CG-CD2 4.32Å
1158Q82.2Confident78.8Confident127 Ų12745 Ų4559%0.59321%0.214SC*.Hα-helixtrans-57.9-45.6178.2-177.4-179.23.400112.4R1154 Q1155 L1156 D1161 T1162R1154-Q1158 VanDerWaalsContact O-CB 3.29Å; R1154-Q1158 WeakPolarHBondContact O-CB 3.33Å; R1154-Q1158 PolarHBondContact O-N 3.32Å; Q1155-Q1158 PolarHBondContact O-N 3.19Å; L1156-Q1158 PolarHBondContact O-N 3.18Å; Q1158-D1161 PolarHBondContact O-N 3.45Å; Q1158-T1162 WeakPolarHBondContact O-CB 3.35Å; Q1158-T1162 WeakPolarHBondContact O-CG2 3.37Å; Q1158-T1162 PolarHBondContact O-N 3.4Å; Q1158-T1162 PolarHBondContact O-OG1 3.18Å
1159H81.8Confident78.6Confident37 Ų3745.4 Ų45.417%0.17121%0.211CC..Hα-helixtrans-64.4-42179.6-78.6-45.7000112.4Q1155 L1156 K1157 T1162 L1163 I1196 H1199 I1200Q1155-H1159 VanDerWaalsContact O-CB 3.29Å; Q1155-H1159 WeakPolarHBondContact O-CB 3.34Å; Q1155-H1159 PolarHBondContact O-CD2 3.04Å; Q1155-H1159 VanDerWaalsContact O-CG 3.29Å; Q1155-H1159 PolarHBondContact O-N 3.28Å; L1156-H1159 PolarHBondContact O-N 3.08Å; K1157-H1159 VanDerWaalsContact C-N 3.34Å; K1157-H1159 PolarHBondContact O-N 3.01Å; H1159-T1162 WeakPolarHBondContact CA-OG1 3.2Å; H1159-T1162 PolarHBondContact O-N 2.94Å; H1159-T1162 PolarHBondContact O-OG1 3.2Å; H1159-L1163 VanDerWaalsContact O-CB 3.29Å; H1159-L1163 WeakPolarHBondContact O-CB 3.25Å; H1159-L1163 PolarHBondContact O-N 3.28Å; H1159-I1196 HydrophobicContact CB-CG2 3.85Å; H1159-I1196 WeakPolarHBondContact O-CG2 3.34Å; H1159-H1199 AromaticContact CD2-CD2 3.38Å; H1159-H1199 PolarHBondContact CD2-CD2 2.84Å; H1159-H1199 AromaticContact NE2-CD2 3Å; H1159-H1199 PolarHBondContact NE2-CD2 3.46Å; H1159-H1199 AromaticContact NE2-CG 3.64Å; H1159-H1199 AromaticContact NE2-NE2 3.48Å; H1159-H1199 PolarHBondContact NE2-NE2 3.37Å; H1159-I1200 HydrophobicContact CB-CD1 4.45Å; H1159-I1200 HydrophobicContact CB-CG1 4.4Å
1160L80.5Confident78.4Confident2.4 Ų2.446.4 Ų46.41%0.01322%0.218CC..Hα-helixtrans-71.1-39.3179.4-67.8168.7000112.4L1156 K1157 T1162 L1163 R1164 I1200 L1263 V1265 I1268L1156-L1160 VanDerWaalsContact O-CB 3.31Å; L1156-L1160 WeakPolarHBondContact O-CB 3.4Å; L1156-L1160 WeakPolarHBondContact O-CD1 3.33Å; L1156-L1160 WeakPolarHBondContact O-CG 3.4Å; L1156-L1160 PolarHBondContact O-N 3.08Å; K1157-L1160 PolarHBondContact O-N 3.23Å; L1160-T1162 VanDerWaalsContact C-N 3.32Å; L1160-T1162 PolarHBondContact O-N 3.32Å; L1160-L1163 PolarHBondContact O-N 2.84Å; L1160-R1164 VanDerWaalsContact O-CB 3.29Å; L1160-R1164 WeakPolarHBondContact O-CB 3.32Å; L1160-R1164 PolarHBondContact O-N 3.25Å; L1160-I1200 HydrophobicContact CD2-CD1 3.94Å; L1160-L1263 HydrophobicContact CD1-CB 3.65Å; L1160-L1263 HydrophobicContact CD1-CD1 3.82Å; L1160-L1263 HydrophobicContact CD1-CG 4.32Å; L1160-V1265 HydrophobicContact CD1-CG2 3.29Å; L1160-V1265 HydrophobicContact CD2-CB 4.42Å; L1160-V1265 HydrophobicContact CD2-CG1 4.31Å; L1160-V1265 HydrophobicContact CD2-CG2 3.63Å; L1160-V1265 HydrophobicContact CG-CG2 4.07Å; L1160-I1268 HydrophobicContact CB-CD1 3.92Å; L1160-I1268 HydrophobicContact CD2-CD1 4.13Å; L1160-I1268 HydrophobicContact CG-CD1 4.41Å
1161D78.1Confident78Confident73 Ų7347.5 Ų47.539%0.3922%0.223SC..Hα-helixtrans-62.4-43173.9-64.5-17.7000109.9K1157 Q1158 L1163 R1164 G1165K1157-D1161 WeakPolarHBondContact CG-OD2 3.47Å; K1157-D1161 WeakPolarHBondContact O-CB 3.37Å; K1157-D1161 PolarHBondContact O-N 3.05Å; Q1158-D1161 PolarHBondContact O-N 3.45Å; D1161-L1163 PolarHBondContact O-N 3.24Å; D1161-R1164 PolarHBondContact O-N 3.29Å; D1161-G1165 PolarHBondContact O-N 2.86Å; D1161-G1165 VanDerWaalsContact O-N 3.11Å
1162T81.1Confident76.9Confident62.8 Ų62.844.7 Ų44.739%0.38521%0.214SC..Hα-helixtrans-64.6-43.1175.5-35.30000112Q1158 H1159 L1160 G1165 L1166 I1196Q1158-T1162 WeakPolarHBondContact O-CB 3.35Å; Q1158-T1162 WeakPolarHBondContact O-CG2 3.37Å; Q1158-T1162 PolarHBondContact O-N 3.4Å; Q1158-T1162 PolarHBondContact O-OG1 3.18Å; H1159-T1162 WeakPolarHBondContact CA-OG1 3.2Å; H1159-T1162 PolarHBondContact O-N 2.94Å; H1159-T1162 PolarHBondContact O-OG1 3.2Å; L1160-T1162 VanDerWaalsContact C-N 3.32Å; L1160-T1162 PolarHBondContact O-N 3.32Å; T1162-G1165 PolarHBondContact O-N 3.17Å; T1162-L1166 HydrophobicContact CG2-CD1 4.32Å; T1162-L1166 VanDerWaalsContact O-CG 3.31Å; T1162-L1166 WeakPolarHBondContact O-CG 3.37Å; T1162-L1166 PolarHBondContact O-N 3Å; T1162-L1166 VanDerWaalsContact O-N 3.11Å; T1162-I1196 HydrophobicContact CG2-CD1 3.77Å; T1162-I1196 WeakPolarHBondContact OG1-CD1 3.45Å
1163L79.6Confident76.2Confident0 Ų045 Ų450%021%0.214CC..Hα-helixtrans-65-42.6179.6-176.363.1000111.3H1159 L1160 D1161 L1166 I1167 N1193 I1196 L1197 I1268 L1269 L1272H1159-L1163 VanDerWaalsContact O-CB 3.29Å; H1159-L1163 WeakPolarHBondContact O-CB 3.25Å; H1159-L1163 PolarHBondContact O-N 3.28Å; L1160-L1163 PolarHBondContact O-N 2.84Å; D1161-L1163 PolarHBondContact O-N 3.24Å; L1163-L1166 PolarHBondContact O-N 3.17Å; L1163-I1167 HydrophobicContact CD1-CD1 4.34Å; L1163-I1167 HydrophobicContact CG-CD1 3.86Å; L1163-I1167 WeakPolarHBondContact O-CD1 3.36Å; L1163-I1167 VanDerWaalsContact O-CG1 3.29Å; L1163-I1167 WeakPolarHBondContact O-CG1 3.37Å; L1163-I1167 PolarHBondContact O-N 3.06Å; L1163-N1193 WeakPolarHBondContact CD1-OD1 3.23Å; L1163-I1196 HydrophobicContact CB-CG2 4.18Å; L1163-I1196 HydrophobicContact CD2-CG2 4.46Å; L1163-L1197 HydrophobicContact CD2-CD2 3.99Å; L1163-I1268 HydrophobicContact CD2-CG2 3.99Å; L1163-I1268 HydrophobicContact CG-CG2 4.12Å; L1163-L1269 HydrophobicContact CD2-CD2 4.22Å; L1163-L1272 HydrophobicContact CD1-CD2 4.47Å
1164R80.6Confident74.9Confident41.4 Ų41.446.2 Ų46.216%0.15622%0.221CC..Hα-helixtrans-59.4-49.1175.8-172.7-178.4-70.1164.81.8110.9E860 L1160 D1161 L1166 I1167 E1168 I1268E860-R1164 WeakPolarHBondContact OE1-CD 3.33Å; E860-R1164 WeakPolarHBondContact OE2-CD 3.39Å; E860-R1164 IonicContact OE2-CZ 3.2Å; E860-R1164 IonicContact OE2-NE 3.01Å; E860-R1164 IonicContact OE2-NH1 3.33Å; E860-R1164 PolarHBondContact OE2-NH1 2.99Å; E860-R1164 VanDerWaalsContact OE2-NH1 3.15Å; L1160-R1164 VanDerWaalsContact O-CB 3.29Å; L1160-R1164 WeakPolarHBondContact O-CB 3.32Å; L1160-R1164 PolarHBondContact O-N 3.25Å; D1161-R1164 PolarHBondContact O-N 3.29Å; R1164-L1166 VanDerWaalsContact C-N 3.26Å; R1164-L1166 PolarHBondContact O-N 2.99Å; R1164-I1167 WeakPolarHBondContact O-CB 3.31Å; R1164-I1167 PolarHBondContact O-N 3.16Å; R1164-I1167 VanDerWaalsContact O-N 3.12Å; R1164-E1168 WeakPolarHBondContact O-CG 3.35Å; R1164-E1168 PolarHBondContact O-N 3.25Å; R1164-I1268 HydrophobicContact CB-CD1 4.46Å
1165G75.5Confident73.4Confident12.4 Ų12.444.9 Ų44.913%0.12822%0.221CC..Hα-helixtrans-60.6-29.8176.600000114.2D1161 T1162 K1169D1161-G1165 PolarHBondContact O-N 2.86Å; D1161-G1165 VanDerWaalsContact O-N 3.11Å; T1162-G1165 PolarHBondContact O-N 3.17Å; G1165-K1169 WeakPolarHBondContact O-CB 3.3Å; G1165-K1169 WeakPolarHBondContact O-CD 3.39Å; G1165-K1169 WeakPolarHBondContact O-CG 3.35Å; G1165-K1169 PolarHBondContact O-N 3.11Å
1166L74.5Confident71.5Confident22.8 Ų22.844.5 Ų44.512%0.11922%0.221CC..Hα-helixtrans-76.3-36.9174.5-71.1172.4000112.8T1162 L1163 R1164 K1169 S1170 W1173 N1189 N1192 N1193 I1196T1162-L1166 HydrophobicContact CG2-CD1 4.32Å; T1162-L1166 VanDerWaalsContact O-CG 3.31Å; T1162-L1166 WeakPolarHBondContact O-CG 3.37Å; T1162-L1166 PolarHBondContact O-N 3Å; T1162-L1166 VanDerWaalsContact O-N 3.11Å; L1163-L1166 PolarHBondContact O-N 3.17Å; R1164-L1166 VanDerWaalsContact C-N 3.26Å; R1164-L1166 PolarHBondContact O-N 2.99Å; L1166-K1169 CarbonylContact O-C 3.53Å; L1166-K1169 PolarHBondContact O-N 3.17Å; L1166-S1170 PolarHBondContact O-N 2.97Å; L1166-W1173 PolarHBondContact O-NE1 3.25Å; L1166-N1189 HydrophobicContact CD2-CB 4.34Å; L1166-N1192 HydrophobicContact CD1-CB 4.22Å; L1166-N1193 WeakPolarHBondContact CB-OD1 3.41Å; L1166-N1193 WeakPolarHBondContact CD1-OD1 3.35Å; L1166-I1196 HydrophobicContact CD1-CD1 4.2Å
1167I73.3Confident69.7Low9 Ų953.1 Ų53.15%0.04626%0.259CS..Hα-helixtrans-64.8-45.5176-72.8160.7000110.7L1163 R1164 K1169 S1170 I1268 E1271 L1272 I1275L1163-I1167 HydrophobicContact CD1-CD1 4.34Å; L1163-I1167 HydrophobicContact CG-CD1 3.86Å; L1163-I1167 WeakPolarHBondContact O-CD1 3.36Å; L1163-I1167 VanDerWaalsContact O-CG1 3.29Å; L1163-I1167 WeakPolarHBondContact O-CG1 3.37Å; L1163-I1167 PolarHBondContact O-N 3.06Å; R1164-I1167 WeakPolarHBondContact O-CB 3.31Å; R1164-I1167 PolarHBondContact O-N 3.16Å; R1164-I1167 VanDerWaalsContact O-N 3.12Å; I1167-K1169 PolarHBondContact O-N 3.21Å; I1167-S1170 WeakPolarHBondContact O-CB 3.37Å; I1167-S1170 PolarHBondContact O-N 3.12Å; I1167-S1170 VanDerWaalsContact O-N 3.12Å; I1167-S1170 PolarHBondContact O-OG 3.25Å; I1167-S1170 VanDerWaalsContact O-OG 3.1Å; I1167-I1268 HydrophobicContact CD1-CG2 3.47Å; I1167-I1268 VanDerWaalsContact CD1-CG2 3.47Å; I1167-I1268 WeakPolarHBondContact CD1-O 3.49Å; I1167-E1271 HydrophobicContact CG2-CB 3.83Å; I1167-L1272 HydrophobicContact CD1-CB 3.73Å; I1167-L1272 HydrophobicContact CD1-CD1 4.25Å; I1167-L1272 HydrophobicContact CD1-CG 4.4Å; I1167-L1272 HydrophobicContact CG1-CB 4.09Å; I1167-L1272 HydrophobicContact CG1-CD1 3.81Å; I1167-L1272 HydrophobicContact CG1-CG 4.44Å; I1167-I1275 HydrophobicContact CG2-CD1 4.16Å
1168E74.5Confident67.6Low44.2 Ų44.255.2 Ų55.221%0.20728%0.281CS..Hα-helixtrans-64.8-27.4178.8-70.8-171.2-178.700113.2R811 Y813 E860 R1164 S1170 E1171R811-E1168 WeakPolarHBondContact CD-OE2 3.31Å; R811-E1168 IonicContact CZ-OE1 3.06Å; R811-E1168 IonicContact CZ-OE2 3.31Å; R811-E1168 IonicContact NE-OE2 3.53Å; R811-E1168 VanDerWaalsContact NH1-CD 3.29Å; R811-E1168 IonicContact NH1-OE1 3.41Å; R811-E1168 PolarHBondContact NH1-OE1 3.28Å; R811-E1168 IonicContact NH1-OE2 3.08Å; R811-E1168 PolarHBondContact NH1-OE2 3.14Å; Y813-E1168 HydrophobicContact CE2-CB 4.5Å; E860-E1168 VanDerWaalsContact OE1-OE1 3.1Å; R1164-E1168 WeakPolarHBondContact O-CG 3.35Å; R1164-E1168 PolarHBondContact O-N 3.25Å; E1168-S1170 VanDerWaalsContact C-N 3.31Å; E1168-E1171 VanDerWaalsContact O-OE2 3.13Å
1169K72Confident65.3Low63.8 Ų63.851.5 Ų51.528%0.27727%0.269SS..THydrogen-bonded Turntrans-94.617.6176.6-68.9174.8-173.8159.10112.8Y813 D857 G1165 L1166 I1167 E1171 L1172 W1173Y813-K1169 HydrophobicContact CD2-CG 4.08Å; Y813-K1169 HydrophobicContact CE2-CG 3.89Å; D857-K1169 WeakPolarHBondContact OD2-CE 3.42Å; D857-K1169 IonicContact OD2-NZ 3.83Å; D857-K1169 PolarHBondContact OD2-NZ 3.02Å; G1165-K1169 WeakPolarHBondContact O-CB 3.3Å; G1165-K1169 WeakPolarHBondContact O-CD 3.39Å; G1165-K1169 WeakPolarHBondContact O-CG 3.35Å; G1165-K1169 PolarHBondContact O-N 3.11Å; L1166-K1169 CarbonylContact O-C 3.53Å; L1166-K1169 PolarHBondContact O-N 3.17Å; I1167-K1169 PolarHBondContact O-N 3.21Å; K1169-E1171 PolarHBondContact O-N 3.02Å; K1169-E1171 VanDerWaalsContact O-N 3.12Å; K1169-L1172 HydrophobicContact CB-CD1 4.1Å; K1169-L1172 HydrophobicContact CB-CG 4.47Å; K1169-L1172 HydrophobicContact CD-CD1 4.34Å; K1169-L1172 HydrophobicContact CG-CD1 4.22Å; K1169-L1172 WeakPolarHBondContact O-CB 3.38Å; K1169-L1172 PolarHBondContact O-N 2.88Å; K1169-L1172 VanDerWaalsContact O-N 3.11Å; K1169-W1173 VanDerWaalsContact O-CD1 3.25Å; K1169-W1173 PolarHBondContact O-NE1 3.06Å
1170S69.8Low62.8Low20.4 Ų20.457.8 Ų57.814%0.14330%0.3CS..Hα-helixtrans-57.7-33.8-172.359.10000113.2L1166 I1167 E1168 L1172 W1173 M1174L1166-S1170 PolarHBondContact O-N 2.97Å; I1167-S1170 WeakPolarHBondContact O-CB 3.37Å; I1167-S1170 PolarHBondContact O-N 3.12Å; I1167-S1170 VanDerWaalsContact O-N 3.12Å; I1167-S1170 PolarHBondContact O-OG 3.25Å; I1167-S1170 VanDerWaalsContact O-OG 3.1Å; E1168-S1170 VanDerWaalsContact C-N 3.31Å; S1170-L1172 VanDerWaalsContact C-N 3.25Å; S1170-L1172 PolarHBondContact O-N 2.96Å; S1170-W1173 PolarHBondContact O-N 3.04Å; S1170-M1174 WeakPolarHBondContact O-CB 3.41Å; S1170-M1174 WeakPolarHBondContact O-CG 3.32Å; S1170-M1174 PolarHBondContact O-N 3.24Å; S1170-M1174 VanDerWaalsContact O-N 3.09Å
1171E67.5Low60.7Low31.6 Ų31.663.3 Ų63.315%0.14833%0.333CS..Hα-helixtrans-60.3-31.517768.4-77.5179.600113.6Y813 E1168 K1169 H1175Y813-E1171 WeakPolarHBondContact CD2-OE1 3.4Å; E1168-E1171 VanDerWaalsContact O-OE2 3.13Å; K1169-E1171 PolarHBondContact O-N 3.02Å; K1169-E1171 VanDerWaalsContact O-N 3.12Å; E1171-H1175 WeakPolarHBondContact O-CB 3.43Å; E1171-H1175 PolarHBondContact O-N 3.24Å; E1171-H1175 PolarHBondContact O-ND1 3.26Å
1172L56.8Low58.2Low74.8 Ų74.867.1 Ų67.139%0.39235%0.351SS..Hα-helixtrans-71.4-38.9-176.1-62.7179.8000112.5I814 K1169 S1170I814-L1172 HydrophobicContact CG1-CD2 4.47Å; K1169-L1172 HydrophobicContact CB-CD1 4.1Å; K1169-L1172 HydrophobicContact CB-CG 4.47Å; K1169-L1172 HydrophobicContact CD-CD1 4.34Å; K1169-L1172 HydrophobicContact CG-CD1 4.22Å; K1169-L1172 WeakPolarHBondContact O-CB 3.38Å; K1169-L1172 PolarHBondContact O-N 2.88Å; K1169-L1172 VanDerWaalsContact O-N 3.11Å; S1170-L1172 VanDerWaalsContact C-N 3.25Å; S1170-L1172 PolarHBondContact O-N 2.96Å
1173W64.8Low55.9Low19.2 Ų19.267.9 Ų67.97%0.07336%0.359CS..Hα-helixtrans-100.6-9.6-178.551.5-93.5000113.4L1166 K1169 S1170 N1186 N1189 N1190 F1284L1166-W1173 PolarHBondContact O-NE1 3.25Å; K1169-W1173 VanDerWaalsContact O-CD1 3.25Å; K1169-W1173 PolarHBondContact O-NE1 3.06Å; S1170-W1173 PolarHBondContact O-N 3.04Å; W1173-N1186 WeakPolarHBondContact CA-OD1 3.45Å; W1173-N1186 WeakPolarHBondContact CB-OD1 3.45Å; W1173-N1186 PolarHBondContact O-ND2 2.84Å; W1173-N1186 VanDerWaalsContact O-ND2 3.1Å; W1173-N1189 HydrophobicContact CB-CB 4.45Å; W1173-N1189 HydrophobicContact CG-CB 4.35Å; W1173-N1190 VanDerWaalsContact CZ3-OD1 3.26Å; W1173-N1190 WeakPolarHBondContact CZ3-OD1 3.27Å; W1173-F1284 HydrophobicContact CE3-CE1 4.31Å; W1173-F1284 HydrophobicContact CE3-CZ 4.32Å; W1173-F1284 HydrophobicContact CH2-CE1 4.16Å; W1173-F1284 AromaticContact CZ3-CE1 3.73Å; W1173-F1284 HydrophobicContact CZ3-CE1 3.73Å; W1173-F1284 AromaticContact CZ3-CZ 3.67Å; W1173-F1284 HydrophobicContact CZ3-CZ 4.13Å
1174M54.2Low54Low47 Ų4774.2 Ų74.223%0.23239%0.393CS..Hα-helixtrans-85.4-35.7176.7-74.7-67.2-6400114.8S1170 D1176 I1275 F1277 F1284S1170-M1174 WeakPolarHBondContact O-CB 3.41Å; S1170-M1174 WeakPolarHBondContact O-CG 3.32Å; S1170-M1174 PolarHBondContact O-N 3.24Å; S1170-M1174 VanDerWaalsContact O-N 3.09Å; M1174-D1176 VanDerWaalsContact C-N 3.34Å; M1174-D1176 PolarHBondContact O-N 2.91Å; M1174-I1275 HydrophobicContact CE-CG2 4.4Å; M1174-F1277 HydrophobicContact CE-CB 4.44Å; M1174-F1277 HydrophobicContact CE-CD1 3.74Å; M1174-F1277 VanDerWaalsContact CE-CD1 3.48Å; M1174-F1277 HydrophobicContact CE-CE1 4.31Å; M1174-F1277 HydrophobicContact CE-CG 4.37Å; M1174-F1277 HydrophobicContact SD-CD1 4.19Å; M1174-F1277 HydrophobicContact SD-CE1 4.27Å; M1174-F1284 HydrophobicContact CE-CE1 4.34Å; M1174-F1284 HydrophobicContact CE-CZ 4.43Å; M1174-F1284 HydrophobicContact SD-CE1 3.88Å; M1174-F1284 WeakPolarHBondContact SD-CE1 3.44Å; M1174-F1284 HydrophobicContact SD-CE2 4.14Å; M1174-F1284 HydrophobicContact SD-CZ 3.67Å; M1174-F1284 VanDerWaalsContact SD-CZ 3.59Å; M1174-F1284 WeakPolarHBondContact SD-CZ 3.33Å
1175H50.4Low52.3Low108 Ų10877.4 Ų77.450%0.541%0.413SS..SBendtrans-88.1-1.9-171.3-80.783.6000115E691 E1171 K1177 K1278E691-H1175 IonicContact OE2-CE1 3.23Å; E691-H1175 IonicContact OE2-NE2 2.62Å; E1171-H1175 WeakPolarHBondContact O-CB 3.43Å; E1171-H1175 PolarHBondContact O-N 3.24Å; E1171-H1175 PolarHBondContact O-ND1 3.26Å; H1175-K1177 VanDerWaalsContact C-N 3.3Å; H1175-K1177 PolarHBondContact O-N 3.17Å; H1175-K1278 PolarHBondContact NE2-NZ 3.16Å
1176D41.8Very low50.9Low77.6 Ų77.679.2 Ų79.242%0.41542%0.42SS..  trans-81.569.5-173.4-123.81.6000112.4M1174 S1178 C1179 N1186M1174-D1176 VanDerWaalsContact C-N 3.34Å; M1174-D1176 PolarHBondContact O-N 2.91Å; D1176-S1178 PolarHBondContact O-N 3.2Å; D1176-C1179 PolarHBondContact O-N 3.41Å; D1176-C1179 PolarHBondContact OD2-SG 2.95Å; D1176-C1179 VanDerWaalsContact OD2-SG 3.35Å; D1176-N1186 PolarHBondContact OD2-ND2 3.17Å; D1176-N1186 VanDerWaalsContact OD2-ND2 3.16Å
1177K43.6Very low49.7Very low180.8 Ų180.882.5 Ų82.579%0.78644%0.437SS*.G310 helixtrans-65.3-19.9169.4-75.2-169.6176.2-173.40112.7H1175 C1179H1175-K1177 VanDerWaalsContact C-N 3.3Å; H1175-K1177 PolarHBondContact O-N 3.17Å; K1177-C1179 VanDerWaalsContact C-N 3.32Å; K1177-C1179 PolarHBondContact O-N 3.1Å
1178S37.1Very low49Very low103.8 Ų103.885.8 Ų85.873%0.72646%0.455SS*.G310 helixtrans-77.1-14.6-174.6-166.30000114D1176D1176-S1178 PolarHBondContact O-N 3.2Å
1179C32.8Very low48.3Very low49.6 Ų49.686.1 Ų86.134%0.33546%0.458SS..G310 helixtrans-111.322.1-172.8-77.80000114.9D1176 K1177 V1181 M1182 S1183D1176-C1179 PolarHBondContact O-N 3.41Å; D1176-C1179 PolarHBondContact OD2-SG 2.95Å; D1176-C1179 VanDerWaalsContact OD2-SG 3.35Å; K1177-C1179 VanDerWaalsContact C-N 3.32Å; K1177-C1179 PolarHBondContact O-N 3.1Å; C1179-V1181 PolarHBondContact O-N 3.09Å; C1179-V1181 VanDerWaalsContact O-N 3.11Å; C1179-M1182 PolarHBondContact O-N 3.42Å; C1179-M1182 VanDerWaalsContact SG-C 3.58Å; C1179-M1182 PolarHBondContact SG-O 3.18Å; C1179-S1183 PolarHBondContact O-N 3.31Å
1180M30.8Very low47.8Very low168.2 Ų168.284.3 Ų84.383%0.82945%0.451SS*.G310 helixtrans-60.9-17.2162.5-96.1-99.1106.300112.9
1181V34.8Very low47.6Very low118 Ų11887.3 Ų87.372%0.71547%0.465SS*.THydrogen-bonded Turntrans-108.2-21.5-176.6-175.10000114C1179C1179-V1181 PolarHBondContact O-N 3.09Å; C1179-V1181 VanDerWaalsContact O-N 3.11Å
1182M27.4Very low47.7Very low154.4 Ų154.488.8 Ų88.876%0.76147%0.474SS*.SBendtrans-146.366.9-174.4-72.5-76.5111.300115.5C1179C1179-M1182 PolarHBondContact O-N 3.42Å; C1179-M1182 VanDerWaalsContact SG-C 3.58Å; C1179-M1182 PolarHBondContact SG-O 3.18Å
1183S31.8Very low48.4Very low79.2 Ų79.285.3 Ų85.355%0.55446%0.456SS*.  trans178.8118.2156.2-1390000114.5C1179 N1185C1179-S1183 PolarHBondContact O-N 3.31Å; S1183-N1185 PolarHBondContact O-N 3.21Å; S1183-N1185 VanDerWaalsContact O-N 3.16Å
1184N40.8Very low48.6Very low131.6 Ų131.685.7 Ų85.770%0.70446%0.459SS*.THydrogen-bonded Turntrans-65.53.9-179.9-126.319.3000114.5N1188N1184-N1188 PolarHBondContact O-N 3.44Å; N1184-N1188 PolarHBondContact O-ND2 3.09Å; N1184-N1188 PolarHBondContact O-OD1 3.32Å
1185N43.5Very low49.7Very low109 Ų10987.5 Ų87.558%0.58347%0.467SS*.Hα-helixtrans-86.7-34.2-174.4-90.92.6000114.4S1183 N1187 N1188 N1189S1183-N1185 PolarHBondContact O-N 3.21Å; S1183-N1185 VanDerWaalsContact O-N 3.16Å; N1185-N1187 VanDerWaalsContact C-N 3.34Å; N1185-N1187 PolarHBondContact O-N 3.41Å; N1185-N1188 VanDerWaalsContact O-CB 3.24Å; N1185-N1188 WeakPolarHBondContact O-CB 3.38Å; N1185-N1188 VanDerWaalsContact O-CG 3.3Å; N1185-N1188 PolarHBondContact O-N 3.12Å; N1185-N1188 VanDerWaalsContact O-N 3.14Å; N1185-N1188 PolarHBondContact O-ND2 3.05Å; N1185-N1189 PolarHBondContact O-N 2.87Å
1186N45.7Very low50.9Low50.4 Ų50.482.9 Ų82.927%0.2745%0.446SS..Hα-helixtrans-76-28.1-178.1-79.40.7000113W1173 D1176 N1188 N1189 N1190W1173-N1186 WeakPolarHBondContact CA-OD1 3.45Å; W1173-N1186 WeakPolarHBondContact CB-OD1 3.45Å; W1173-N1186 PolarHBondContact O-ND2 2.84Å; W1173-N1186 VanDerWaalsContact O-ND2 3.1Å; D1176-N1186 PolarHBondContact OD2-ND2 3.17Å; D1176-N1186 VanDerWaalsContact OD2-ND2 3.16Å; N1186-N1188 VanDerWaalsContact C-N 3.27Å; N1186-N1188 PolarHBondContact O-N 3.27Å; N1186-N1188 VanDerWaalsContact O-N 3.12Å; N1186-N1189 PolarHBondContact O-N 3.08Å; N1186-N1190 PolarHBondContact O-N 3.39Å; N1186-N1190 VanDerWaalsContact O-N 3.13Å
1187N49.8Very low52.7Low92 Ų9279.2 Ų79.249%0.49243%0.426SS..Hα-helixtrans-56-35.4167.8-79.5-3.7000110.4N1185 N1189 I1191N1185-N1187 VanDerWaalsContact C-N 3.34Å; N1185-N1187 PolarHBondContact O-N 3.41Å; N1187-N1189 PolarHBondContact O-N 3.13Å; N1187-I1191 HydrophobicContact CB-CD1 4.03Å; N1187-I1191 VanDerWaalsContact O-CB 3.22Å; N1187-I1191 WeakPolarHBondContact O-CB 3.32Å; N1187-I1191 VanDerWaalsContact O-CD1 3.28Å; N1187-I1191 WeakPolarHBondContact O-CD1 3.31Å; N1187-I1191 WeakPolarHBondContact O-CG1 3.31Å; N1187-I1191 PolarHBondContact O-N 2.85Å
1188N58.3Low54.3Low78.6 Ų78.672 Ų7242%0.4240%0.398SS..Hα-helixtrans-63.1-41-179.9-66.8-12.4000113.4N1184 N1185 N1186 I1191 N1192N1184-N1188 PolarHBondContact O-N 3.44Å; N1184-N1188 PolarHBondContact O-ND2 3.09Å; N1184-N1188 PolarHBondContact O-OD1 3.32Å; N1185-N1188 VanDerWaalsContact O-CB 3.24Å; N1185-N1188 WeakPolarHBondContact O-CB 3.38Å; N1185-N1188 VanDerWaalsContact O-CG 3.3Å; N1185-N1188 PolarHBondContact O-N 3.12Å; N1185-N1188 VanDerWaalsContact O-N 3.14Å; N1185-N1188 PolarHBondContact O-ND2 3.05Å; N1186-N1188 VanDerWaalsContact C-N 3.27Å; N1186-N1188 PolarHBondContact O-N 3.27Å; N1186-N1188 VanDerWaalsContact O-N 3.12Å; N1188-I1191 PolarHBondContact O-N 2.97Å; N1188-N1192 VanDerWaalsContact O-CB 3.31Å; N1188-N1192 WeakPolarHBondContact O-CB 3.35Å; N1188-N1192 PolarHBondContact O-N 3.18Å; N1188-N1192 PolarHBondContact O-ND2 3.33Å; N1188-N1192 PolarHBondContact O-OD1 2.99Å
1189N61.5Low56.1Low49.6 Ų49.670 Ų7027%0.26538%0.377SS..Hα-helixtrans-70.6-43.5-177.6-72.7-7.5000112.5L1166 W1173 N1185 N1186 N1187 N1192 N1193L1166-N1189 HydrophobicContact CD2-CB 4.34Å; W1173-N1189 HydrophobicContact CB-CB 4.45Å; W1173-N1189 HydrophobicContact CG-CB 4.35Å; N1185-N1189 PolarHBondContact O-N 2.87Å; N1186-N1189 PolarHBondContact O-N 3.08Å; N1187-N1189 PolarHBondContact O-N 3.13Å; N1189-N1192 WeakPolarHBondContact O-CB 3.39Å; N1189-N1192 PolarHBondContact O-N 3.09Å; N1189-N1193 PolarHBondContact O-N 3.19Å
1190N61.4Low58.1Low25.8 Ų25.867.7 Ų67.714%0.13836%0.361CS..Hα-helixtrans-67.4-40.3176.3-73-14.3000111.5W1173 N1186 N1192 N1193 I1194 V1283W1173-N1190 VanDerWaalsContact CZ3-OD1 3.26Å; W1173-N1190 WeakPolarHBondContact CZ3-OD1 3.27Å; N1186-N1190 PolarHBondContact O-N 3.39Å; N1186-N1190 VanDerWaalsContact O-N 3.13Å; N1190-N1192 VanDerWaalsContact C-N 3.3Å; N1190-N1192 PolarHBondContact O-N 3.3Å; N1190-N1193 PolarHBondContact O-N 3.12Å; N1190-I1194 WeakPolarHBondContact O-CG1 3.3Å; N1190-I1194 PolarHBondContact O-N 3.17Å; N1190-I1194 VanDerWaalsContact O-N 3.08Å; N1190-V1283 HydrophobicContact CB-CG1 3.9Å
1191I63.9Low60Low84 Ų8460.2 Ų60.243%0.43133%0.325SS..Hα-helixtrans-61.4-41.3172.8-69.5167.1000110.2N1187 N1188 I1194 Q1195N1187-I1191 HydrophobicContact CB-CD1 4.03Å; N1187-I1191 VanDerWaalsContact O-CB 3.22Å; N1187-I1191 WeakPolarHBondContact O-CB 3.32Å; N1187-I1191 VanDerWaalsContact O-CD1 3.28Å; N1187-I1191 WeakPolarHBondContact O-CD1 3.31Å; N1187-I1191 WeakPolarHBondContact O-CG1 3.31Å; N1187-I1191 PolarHBondContact O-N 2.85Å; N1188-I1191 PolarHBondContact O-N 2.97Å; I1191-I1194 PolarHBondContact O-N 3.09Å; I1191-Q1195 VanDerWaalsContact O-CB 3.26Å; I1191-Q1195 WeakPolarHBondContact O-CB 3.36Å; I1191-Q1195 PolarHBondContact O-N 3.3Å
1192N71Confident61.8Low64 Ų6457.1 Ų57.134%0.34231%0.308SS..Hα-helixtrans-63.2-43.8176.5-88.6-5.2000111.7L1166 N1188 N1189 N1190 I1194 Q1195 I1196L1166-N1192 HydrophobicContact CD1-CB 4.22Å; N1188-N1192 VanDerWaalsContact O-CB 3.31Å; N1188-N1192 WeakPolarHBondContact O-CB 3.35Å; N1188-N1192 PolarHBondContact O-N 3.18Å; N1188-N1192 PolarHBondContact O-ND2 3.33Å; N1188-N1192 PolarHBondContact O-OD1 2.99Å; N1189-N1192 WeakPolarHBondContact O-CB 3.39Å; N1189-N1192 PolarHBondContact O-N 3.09Å; N1190-N1192 VanDerWaalsContact C-N 3.3Å; N1190-N1192 PolarHBondContact O-N 3.3Å; N1192-I1194 PolarHBondContact O-N 3.19Å; N1192-Q1195 PolarHBondContact O-N 2.98Å; N1192-I1196 WeakPolarHBondContact O-CB 3.35Å; N1192-I1196 WeakPolarHBondContact O-CD1 3.39Å; N1192-I1196 WeakPolarHBondContact O-CG1 3.34Å; N1192-I1196 PolarHBondContact O-N 3.18Å
1193N70.6Confident63.7Low0.6 Ų0.650.7 Ų50.70%0.00328%0.277CS..Hα-helixtrans-59-49.9176.2-77.1-22.9000111.6L1163 L1166 N1189 N1190 Q1195 I1196 L1197 I1287L1163-N1193 WeakPolarHBondContact CD1-OD1 3.23Å; L1166-N1193 WeakPolarHBondContact CB-OD1 3.41Å; L1166-N1193 WeakPolarHBondContact CD1-OD1 3.35Å; N1189-N1193 PolarHBondContact O-N 3.19Å; N1190-N1193 PolarHBondContact O-N 3.12Å; N1193-Q1195 VanDerWaalsContact C-N 3.33Å; N1193-Q1195 PolarHBondContact O-N 3.18Å; N1193-I1196 PolarHBondContact O-N 3.22Å; N1193-L1197 VanDerWaalsContact O-CG 3.27Å; N1193-L1197 WeakPolarHBondContact O-CG 3.39Å; N1193-L1197 PolarHBondContact O-N 3.19Å; N1193-I1287 HydrophobicContact CB-CD1 4.07Å; N1193-I1287 HydrophobicContact CB-CG1 4.48Å
1194I70.1Confident65.3Low26.8 Ų26.847.2 Ų47.214%0.13725%0.253CS..Hα-helixtrans-61.3-45.5177.8-68.8173.7000110.4N1190 I1191 N1192 I1196 L1197 C1198 V1283 E1286 I1287 L1290N1190-I1194 WeakPolarHBondContact O-CG1 3.3Å; N1190-I1194 PolarHBondContact O-N 3.17Å; N1190-I1194 VanDerWaalsContact O-N 3.08Å; I1191-I1194 PolarHBondContact O-N 3.09Å; N1192-I1194 PolarHBondContact O-N 3.19Å; I1194-I1196 VanDerWaalsContact C-N 3.33Å; I1194-I1196 PolarHBondContact O-N 3.05Å; I1194-L1197 PolarHBondContact O-N 3.14Å; I1194-C1198 VanDerWaalsContact O-CB 3.3Å; I1194-C1198 WeakPolarHBondContact O-CB 3.4Å; I1194-C1198 PolarHBondContact O-N 3.01Å; I1194-C1198 PolarHBondContact O-SG 3.14Å; I1194-V1283 HydrophobicContact CD1-CB 4.48Å; I1194-V1283 HydrophobicContact CD1-CG1 3.53Å; I1194-E1286 HydrophobicContact CD1-CB 4.39Å; I1194-E1286 HydrophobicContact CD1-CG 4.45Å; I1194-I1287 HydrophobicContact CD1-CG1 4.19Å; I1194-I1287 HydrophobicContact CG1-CD1 4.16Å; I1194-I1287 HydrophobicContact CG1-CG1 3.52Å; I1194-I1287 VanDerWaalsContact CG1-CG1 3.5Å; I1194-L1290 HydrophobicContact CG2-CD1 3.98Å
1195Q75.7Confident66.3Low86.4 Ų86.443.3 Ų43.340%0.40423%0.23SC..Hα-helixtrans-59.5-47.5179-173.9173.8-600110.9I1191 N1192 N1193 L1197 C1198 H1199 I1216I1191-Q1195 VanDerWaalsContact O-CB 3.26Å; I1191-Q1195 WeakPolarHBondContact O-CB 3.36Å; I1191-Q1195 PolarHBondContact O-N 3.3Å; N1192-Q1195 PolarHBondContact O-N 2.98Å; N1193-Q1195 VanDerWaalsContact C-N 3.33Å; N1193-Q1195 PolarHBondContact O-N 3.18Å; Q1195-L1197 PolarHBondContact O-N 3Å; Q1195-C1198 PolarHBondContact O-N 3Å; Q1195-H1199 WeakPolarHBondContact CG-CE1 3.33Å; Q1195-H1199 WeakPolarHBondContact CG-ND1 3.4Å; Q1195-H1199 VanDerWaalsContact O-CB 3.29Å; Q1195-H1199 WeakPolarHBondContact O-CB 3.46Å; Q1195-H1199 PolarHBondContact O-N 3.12Å; Q1195-H1199 PolarHBondContact O-ND1 3.05Å; Q1195-I1216 HydrophobicContact CG-CG2 4.47Å
1196I77.7Confident66.3Low10.2 Ų10.242 Ų425%0.05222%0.223CC..Hα-helixtrans-59.6-48178-70.4163.7000110.9H1159 T1162 L1163 L1166 N1192 N1193 I1194 C1198 H1199 I1200H1159-I1196 HydrophobicContact CB-CG2 3.85Å; H1159-I1196 WeakPolarHBondContact O-CG2 3.34Å; T1162-I1196 HydrophobicContact CG2-CD1 3.77Å; T1162-I1196 WeakPolarHBondContact OG1-CD1 3.45Å; L1163-I1196 HydrophobicContact CB-CG2 4.18Å; L1163-I1196 HydrophobicContact CD2-CG2 4.46Å; L1166-I1196 HydrophobicContact CD1-CD1 4.2Å; N1192-I1196 WeakPolarHBondContact O-CB 3.35Å; N1192-I1196 WeakPolarHBondContact O-CD1 3.39Å; N1192-I1196 WeakPolarHBondContact O-CG1 3.34Å; N1192-I1196 PolarHBondContact O-N 3.18Å; N1193-I1196 PolarHBondContact O-N 3.22Å; I1194-I1196 VanDerWaalsContact C-N 3.33Å; I1194-I1196 PolarHBondContact O-N 3.05Å; I1196-C1198 PolarHBondContact O-N 3.32Å; I1196-H1199 PolarHBondContact O-N 2.98Å; I1196-I1200 HydrophobicContact CG2-CD1 3.94Å; I1196-I1200 HydrophobicContact CG2-CG1 4.5Å; I1196-I1200 WeakPolarHBondContact O-CG1 3.34Å; I1196-I1200 PolarHBondContact O-N 3.19Å
1197L79.2Confident65.9Low0 Ų044.8 Ų44.80%023%0.234CC..Hα-helixtrans-62.7-44.4179.3-66.2169.9000111.5L1163 N1193 I1194 Q1195 H1199 I1200 I1201 L1269 L1272 I1287 L1290 I1294L1163-L1197 HydrophobicContact CD2-CD2 3.99Å; N1193-L1197 VanDerWaalsContact O-CG 3.27Å; N1193-L1197 WeakPolarHBondContact O-CG 3.39Å; N1193-L1197 PolarHBondContact O-N 3.19Å; I1194-L1197 PolarHBondContact O-N 3.14Å; Q1195-L1197 PolarHBondContact O-N 3Å; L1197-H1199 VanDerWaalsContact C-N 3.31Å; L1197-H1199 PolarHBondContact O-N 3.03Å; L1197-I1200 PolarHBondContact O-N 3.1Å; L1197-I1201 WeakPolarHBondContact O-CD1 3.43Å; L1197-I1201 VanDerWaalsContact O-CG1 3.3Å; L1197-I1201 WeakPolarHBondContact O-CG1 3.34Å; L1197-I1201 PolarHBondContact O-N 3.2Å; L1197-L1269 HydrophobicContact CD2-CD2 4.12Å; L1197-L1272 HydrophobicContact CD1-CD2 4.39Å; L1197-L1272 HydrophobicContact CD2-CD2 4.47Å; L1197-I1287 HydrophobicContact CD1-CB 4.47Å; L1197-I1287 HydrophobicContact CD1-CG2 3.95Å; L1197-L1290 HydrophobicContact CB-CB 4.07Å; L1197-L1290 HydrophobicContact CB-CD1 4.25Å; L1197-L1290 HydrophobicContact CD1-CB 4.16Å; L1197-I1294 HydrophobicContact CB-CD1 4.17Å; L1197-I1294 HydrophobicContact CD2-CD1 3.56Å; L1197-I1294 HydrophobicContact CG-CD1 4.47Å
1198C75.6Confident65Low30 Ų3048.2 Ų48.220%0.20325%0.247CC..Hα-helixtrans-61.3-38.3175-71.90000112.3I1194 Q1195 I1196 I1201 S1202I1194-C1198 VanDerWaalsContact O-CB 3.3Å; I1194-C1198 WeakPolarHBondContact O-CB 3.4Å; I1194-C1198 PolarHBondContact O-N 3.01Å; I1194-C1198 PolarHBondContact O-SG 3.14Å; Q1195-C1198 PolarHBondContact O-N 3Å; I1196-C1198 PolarHBondContact O-N 3.32Å; C1198-I1201 PolarHBondContact O-N 3.35Å; C1198-S1202 WeakPolarHBondContact O-CB 3.43Å; C1198-S1202 PolarHBondContact O-N 3.19Å
1199H76.4Confident63.6Low62.2 Ų62.248.7 Ų48.729%0.28825%0.25SC..Hα-helixtrans-67.8-41.3176-90.477.4000111.6H1159 Q1195 I1196 L1197 I1201 S1202 L1203H1159-H1199 AromaticContact CD2-CD2 3.38Å; H1159-H1199 PolarHBondContact CD2-CD2 2.84Å; H1159-H1199 AromaticContact NE2-CD2 3Å; H1159-H1199 PolarHBondContact NE2-CD2 3.46Å; H1159-H1199 AromaticContact NE2-CG 3.64Å; H1159-H1199 AromaticContact NE2-NE2 3.48Å; H1159-H1199 PolarHBondContact NE2-NE2 3.37Å; Q1195-H1199 WeakPolarHBondContact CG-CE1 3.33Å; Q1195-H1199 WeakPolarHBondContact CG-ND1 3.4Å; Q1195-H1199 VanDerWaalsContact O-CB 3.29Å; Q1195-H1199 WeakPolarHBondContact O-CB 3.46Å; Q1195-H1199 PolarHBondContact O-N 3.12Å; Q1195-H1199 PolarHBondContact O-ND1 3.05Å; I1196-H1199 PolarHBondContact O-N 2.98Å; L1197-H1199 VanDerWaalsContact C-N 3.31Å; L1197-H1199 PolarHBondContact O-N 3.03Å; H1199-I1201 VanDerWaalsContact C-N 3.3Å; H1199-I1201 PolarHBondContact O-N 3.31Å; H1199-S1202 WeakPolarHBondContact O-CB 3.43Å; H1199-S1202 PolarHBondContact O-N 3.05Å; H1199-L1203 WeakPolarHBondContact O-CB 3.35Å; H1199-L1203 VanDerWaalsContact O-CG 3.29Å; H1199-L1203 WeakPolarHBondContact O-CG 3.34Å; H1199-L1203 PolarHBondContact O-N 3.15Å
1200I74.6Confident62.1Low0.2 Ų0.252.5 Ų52.50%0.00127%0.27CS..Hα-helixtrans-60-43.7174.6-67.1165.5000110.3L1156 H1159 L1160 I1196 L1197 L1203 C1204 L1260 I1294L1156-I1200 HydrophobicContact CD2-CB 4.48Å; L1156-I1200 HydrophobicContact CD2-CG1 4.14Å; L1156-I1200 HydrophobicContact CD2-CG2 4.2Å; H1159-I1200 HydrophobicContact CB-CD1 4.45Å; H1159-I1200 HydrophobicContact CB-CG1 4.4Å; L1160-I1200 HydrophobicContact CD2-CD1 3.94Å; I1196-I1200 HydrophobicContact CG2-CD1 3.94Å; I1196-I1200 HydrophobicContact CG2-CG1 4.5Å; I1196-I1200 WeakPolarHBondContact O-CG1 3.34Å; I1196-I1200 PolarHBondContact O-N 3.19Å; L1197-I1200 PolarHBondContact O-N 3.1Å; I1200-L1203 PolarHBondContact O-N 3.06Å; I1200-C1204 PolarHBondContact O-N 3.28Å; I1200-C1204 PolarHBondContact O-SG 3.29Å; I1200-L1260 HydrophobicContact CG2-CD2 4.42Å; I1200-I1294 HydrophobicContact CB-CD1 4.24Å; I1200-I1294 HydrophobicContact CG2-CD1 4.04Å; I1200-I1294 HydrophobicContact CG2-CG1 4.37Å; I1200-I1294 HydrophobicContact CG2-CG2 4.29Å
1201I71.2Confident60.6Low11 Ų1157.5 Ų57.56%0.05630%0.296CS..Hα-helixtrans-63-45.6176.1-66.6162.6000110.7L1197 C1198 H1199 L1203 C1204 Q1205 L1290 Y1293 I1294 L1297L1197-I1201 WeakPolarHBondContact O-CD1 3.43Å; L1197-I1201 VanDerWaalsContact O-CG1 3.3Å; L1197-I1201 WeakPolarHBondContact O-CG1 3.34Å; L1197-I1201 PolarHBondContact O-N 3.2Å; C1198-I1201 PolarHBondContact O-N 3.35Å; H1199-I1201 VanDerWaalsContact C-N 3.3Å; H1199-I1201 PolarHBondContact O-N 3.31Å; I1201-L1203 VanDerWaalsContact C-N 3.27Å; I1201-L1203 PolarHBondContact O-N 3.13Å; I1201-C1204 CarbonylContact O-C 3.59Å; I1201-C1204 WeakPolarHBondContact O-CA 3.47Å; I1201-C1204 WeakPolarHBondContact O-CB 3.37Å; I1201-C1204 PolarHBondContact O-N 3.32Å; I1201-C1204 VanDerWaalsContact O-N 3.1Å; I1201-Q1205 HydrophobicContact CG2-CG 4.3Å; I1201-Q1205 WeakPolarHBondContact O-CB 3.28Å; I1201-Q1205 WeakPolarHBondContact O-CG 3.44Å; I1201-Q1205 PolarHBondContact O-N 3.06Å; I1201-L1290 HydrophobicContact CD1-CB 4.18Å; I1201-L1290 HydrophobicContact CD1-CD2 3.55Å; I1201-L1290 HydrophobicContact CD1-CG 4.44Å; I1201-Y1293 HydrophobicContact CD1-CD1 3.87Å; I1201-Y1293 HydrophobicContact CG1-CD1 4.04Å; I1201-Y1293 HydrophobicContact CG1-CE1 4.49Å; I1201-Y1293 HydrophobicContact CG2-CD1 4.07Å; I1201-Y1293 HydrophobicContact CG2-CE1 3.8Å; I1201-I1294 HydrophobicContact CD1-CD1 4.38Å; I1201-I1294 HydrophobicContact CD1-CG1 4.03Å; I1201-I1294 HydrophobicContact CG1-CD1 4.07Å; I1201-I1294 HydrophobicContact CG1-CG1 3.52Å; I1201-I1294 VanDerWaalsContact CG1-CG1 3.47Å; I1201-L1297 HydrophobicContact CG2-CD1 4.33Å
1202S71.3Confident58.9Low53.2 Ų53.257.9 Ų57.937%0.37230%0.298SS..Hα-helixtrans-62.3-33177.1165.80000112.9C1198 H1199 C1204 Q1205 L1206C1198-S1202 WeakPolarHBondContact O-CB 3.43Å; C1198-S1202 PolarHBondContact O-N 3.19Å; H1199-S1202 WeakPolarHBondContact O-CB 3.43Å; H1199-S1202 PolarHBondContact O-N 3.05Å; S1202-C1204 VanDerWaalsContact C-N 3.34Å; S1202-Q1205 CarbonylContact O-C 3.46Å; S1202-Q1205 VanDerWaalsContact O-C 3.26Å; S1202-Q1205 PolarHBondContact O-N 3.22Å; S1202-L1206 PolarHBondContact O-N 3.16Å
1203L68Low56.8Low20.8 Ų20.859.1 Ų59.111%0.10931%0.308CS..Hα-helixtrans-72-32.8174-71.3171.8000112.1I1152 Q1155 L1156 H1199 I1200 I1201 L1206 I1256I1152-L1203 HydrophobicContact CG1-CD2 4.44Å; Q1155-L1203 HydrophobicContact CB-CD1 4.1Å; L1156-L1203 HydrophobicContact CD2-CB 4.45Å; L1156-L1203 HydrophobicContact CD2-CD1 3.86Å; L1156-L1203 HydrophobicContact CG-CD1 4.11Å; H1199-L1203 WeakPolarHBondContact O-CB 3.35Å; H1199-L1203 VanDerWaalsContact O-CG 3.29Å; H1199-L1203 WeakPolarHBondContact O-CG 3.34Å; H1199-L1203 PolarHBondContact O-N 3.15Å; I1200-L1203 PolarHBondContact O-N 3.06Å; I1201-L1203 VanDerWaalsContact C-N 3.27Å; I1201-L1203 PolarHBondContact O-N 3.13Å; L1203-L1206 HydrophobicContact CD2-CD1 4.25Å; L1203-I1256 WeakPolarHBondContact O-CD1 3.35Å
1204C65.9Low54.9Low5.6 Ų5.662.2 Ų62.24%0.03833%0.33CS..Hα-helixtrans-72.9-34.5173.9-670000112.2I1200 I1201 S1202 L1206 M1243 F1253 L1297I1200-C1204 PolarHBondContact O-N 3.28Å; I1200-C1204 PolarHBondContact O-SG 3.29Å; I1201-C1204 CarbonylContact O-C 3.59Å; I1201-C1204 WeakPolarHBondContact O-CA 3.47Å; I1201-C1204 WeakPolarHBondContact O-CB 3.37Å; I1201-C1204 PolarHBondContact O-N 3.32Å; I1201-C1204 VanDerWaalsContact O-N 3.1Å; S1202-C1204 VanDerWaalsContact C-N 3.34Å; C1204-L1206 PolarHBondContact O-N 3.28Å; C1204-M1243 WeakPolarHBondContact O-CE 3.5Å; C1204-F1253 HydrophobicContact CB-CE2 4.01Å; C1204-F1253 WeakPolarHBondContact O-CD2 3.19Å; C1204-F1253 WeakPolarHBondContact O-CE2 3.26Å; C1204-L1297 HydrophobicContact CB-CD1 3.98Å
1205Q61.1Low52.9Low49.4 Ų49.465.3 Ų65.323%0.23135%0.35CS..SBendtrans-104.662.9-178.5-62.3-177.6-18.800110.6I1201 S1202 E1207 Y1293 L1297I1201-Q1205 HydrophobicContact CG2-CG 4.3Å; I1201-Q1205 WeakPolarHBondContact O-CB 3.28Å; I1201-Q1205 WeakPolarHBondContact O-CG 3.44Å; I1201-Q1205 PolarHBondContact O-N 3.06Å; S1202-Q1205 CarbonylContact O-C 3.46Å; S1202-Q1205 VanDerWaalsContact O-C 3.26Å; S1202-Q1205 PolarHBondContact O-N 3.22Å; Q1205-E1207 PolarHBondContact O-N 3.16Å; Q1205-Y1293 VanDerWaalsContact NE2-CE1 3.28Å; Q1205-Y1293 PolarHBondContact NE2-OH 2.97Å; Q1205-L1297 HydrophobicContact CG-CD1 4.24Å
1206L44Very low50.7Low80.8 Ų80.866.1 Ų66.142%0.42336%0.356SS..  trans-61.164.2-178.7-86.1163.4000113I1152 S1202 L1203 C1204 F1251 I1256I1152-L1206 HydrophobicContact CD1-CD1 4.47Å; S1202-L1206 PolarHBondContact O-N 3.16Å; L1203-L1206 HydrophobicContact CD2-CD1 4.25Å; C1204-L1206 PolarHBondContact O-N 3.28Å; L1206-F1251 HydrophobicContact CD1-CB 4.33Å; L1206-F1251 WeakPolarHBondContact CD1-O 3.41Å; L1206-I1256 HydrophobicContact CD1-CD1 4.13Å
1207E37.7Very low48.5Very low110.4 Ų110.473.8 Ų73.852%0.51639%0.392SS..  trans-125.1115.7159.6-71.1-172.9-18000111.1Q1205 N1209 R1238Q1205-E1207 PolarHBondContact O-N 3.16Å; E1207-N1209 VanDerWaalsContact C-N 3.32Å; E1207-N1209 PolarHBondContact O-N 3.28Å; E1207-N1209 PolarHBondContact OE2-ND2 3.5Å; E1207-R1238 IonicContact OE2-CZ 2.78Å; E1207-R1238 VanDerWaalsContact OE2-CZ 3.29Å; E1207-R1238 IonicContact OE2-NE 2.65Å; E1207-R1238 IonicContact OE2-NH1 3.28Å; E1207-R1238 PolarHBondContact OE2-NH1 3.1Å; E1207-R1238 IonicContact OE2-NH2 3.66Å; E1207-R1238 PolarHBondContact OE2-NH2 3.34Å
1208H29.7Very low46.1Very low162.6 Ų162.681.9 Ų81.975%0.75343%0.43SS*.  trans-12.887.8160.1-74.8-74.8000114.6D1210 T1242H1208-D1210 PolarHBondContact O-N 3.04Å; H1208-T1242 WeakPolarHBondContact CD2-CG2 3.12Å
1209N29.1Very low43.8Very low89.4 Ų89.489.1 Ų89.148%0.47846%0.458SS..  trans-9893.3159.9-76.9-32.2000110E1207 L1211 L1212 T1213 Q1234 R1238E1207-N1209 VanDerWaalsContact C-N 3.32Å; E1207-N1209 PolarHBondContact O-N 3.28Å; E1207-N1209 PolarHBondContact OE2-ND2 3.5Å; N1209-L1211 PolarHBondContact O-N 3.48Å; N1209-L1212 HydrophobicContact CB-CB 4.25Å; N1209-L1212 HydrophobicContact CB-CD1 4.1Å; N1209-L1212 HydrophobicContact CB-CG 4.14Å; N1209-L1212 VanDerWaalsContact CG-CD1 3.5Å; N1209-L1212 WeakPolarHBondContact ND2-CD1 3.35Å; N1209-L1212 PolarHBondContact O-N 3.21Å; N1209-L1212 WeakPolarHBondContact OD1-CD1 3.49Å; N1209-L1212 WeakPolarHBondContact OD1-CG 3.5Å; N1209-T1213 PolarHBondContact O-OG1 3.19Å; N1209-Q1234 PolarHBondContact ND2-NE2 3.1Å; N1209-R1238 PolarHBondContact ND2-NH2 2.71Å
1210D30.8Very low41.5Very low128.8 Ų128.891.2 Ų91.269%0.68948%0.48SS*.Hα-helixtrans-90.7-10.4158.7-75.4-22.1000113.6H1208 T1213 S1214H1208-D1210 PolarHBondContact O-N 3.04Å; D1210-T1213 WeakPolarHBondContact CA-OG1 3Å; D1210-T1213 PolarHBondContact O-OG1 3.1Å; D1210-S1214 VanDerWaalsContact O-CB 3.3Å; D1210-S1214 WeakPolarHBondContact O-CB 3.43Å; D1210-S1214 PolarHBondContact O-N 2.89Å; D1210-S1214 PolarHBondContact O-OG 3.21Å
1211L29.6Very low39.4Very low130.8 Ų130.896.9 Ų96.969%0.68552%0.515SS*.Hα-helixtrans-81.8-25.5175.6-91.6153.4000114.5N1209 S1214 T1215N1209-L1211 PolarHBondContact O-N 3.48Å; L1211-S1214 PolarHBondContact O-OG 3.04Å; L1211-T1215 VanDerWaalsContact O-CB 3.26Å; L1211-T1215 WeakPolarHBondContact O-CB 3.47Å; L1211-T1215 VanDerWaalsContact O-CG2 3.23Å; L1211-T1215 WeakPolarHBondContact O-CG2 3.35Å; L1211-T1215 PolarHBondContact O-N 3.24Å; L1211-T1215 PolarHBondContact O-OG1 3.21Å
1212L27.7Very low37.5Very low92.8 Ų92.8103 Ų10349%0.48655%0.547SS..Hα-helixtrans-82.1-29.5176.8-73.9178.2000112.6N1209 S1214 T1215 I1216 L1227N1209-L1212 HydrophobicContact CB-CB 4.25Å; N1209-L1212 HydrophobicContact CB-CD1 4.1Å; N1209-L1212 HydrophobicContact CB-CG 4.14Å; N1209-L1212 VanDerWaalsContact CG-CD1 3.5Å; N1209-L1212 WeakPolarHBondContact ND2-CD1 3.35Å; N1209-L1212 PolarHBondContact O-N 3.21Å; N1209-L1212 WeakPolarHBondContact OD1-CD1 3.49Å; N1209-L1212 WeakPolarHBondContact OD1-CG 3.5Å; L1212-S1214 VanDerWaalsContact C-N 3.32Å; L1212-S1214 PolarHBondContact O-N 3.46Å; L1212-T1215 WeakPolarHBondContact CA-OG1 3.43Å; L1212-T1215 PolarHBondContact O-N 3.19Å; L1212-T1215 PolarHBondContact O-OG1 3.21Å; L1212-I1216 WeakPolarHBondContact O-CB 3.42Å; L1212-I1216 VanDerWaalsContact O-CD1 3.23Å; L1212-I1216 WeakPolarHBondContact O-CD1 3.45Å; L1212-I1216 WeakPolarHBondContact O-CG1 3.16Å; L1212-I1216 PolarHBondContact O-N 3.06Å; L1212-L1227 HydrophobicContact CD2-CD2 3.96Å
1213T28Very low35.5Very low89.2 Ų89.2103.7 Ų103.755%0.54755%0.549SS..Hα-helixtrans-81.2-26.2178.441.90000113.7N1209 D1210 I1216 E1217N1209-T1213 PolarHBondContact O-OG1 3.19Å; D1210-T1213 WeakPolarHBondContact CA-OG1 3Å; D1210-T1213 PolarHBondContact O-OG1 3.1Å; T1213-I1216 PolarHBondContact O-N 2.86Å; T1213-E1217 PolarHBondContact O-N 3.21Å
1214S29.8Very low33.8Very low66 Ų66107.2 Ų107.246%0.46257%0.567SS.*Hα-helixtrans-92.4-7.2179.562.10000114.5D1210 L1211 L1212 I1216 Q1218D1210-S1214 VanDerWaalsContact O-CB 3.3Å; D1210-S1214 WeakPolarHBondContact O-CB 3.43Å; D1210-S1214 PolarHBondContact O-N 2.89Å; D1210-S1214 PolarHBondContact O-OG 3.21Å; L1211-S1214 PolarHBondContact O-OG 3.04Å; L1212-S1214 VanDerWaalsContact C-N 3.32Å; L1212-S1214 PolarHBondContact O-N 3.46Å; S1214-I1216 VanDerWaalsContact C-N 3.35Å; S1214-I1216 PolarHBondContact O-N 2.61Å; S1214-Q1218 PolarHBondContact O-N 3.48Å
1215T27.4Very low32.3Very low92.2 Ų92.2112.3 Ų112.357%0.56659%0.594SS**Hα-helixtrans-83.4-12.6172.648.70000112.7L1211 L1212 Q1218L1211-T1215 VanDerWaalsContact O-CB 3.26Å; L1211-T1215 WeakPolarHBondContact O-CB 3.47Å; L1211-T1215 VanDerWaalsContact O-CG2 3.23Å; L1211-T1215 WeakPolarHBondContact O-CG2 3.35Å; L1211-T1215 PolarHBondContact O-N 3.24Å; L1211-T1215 PolarHBondContact O-OG1 3.21Å; L1212-T1215 WeakPolarHBondContact CA-OG1 3.43Å; L1212-T1215 PolarHBondContact O-N 3.19Å; L1212-T1215 PolarHBondContact O-OG1 3.21Å; T1215-Q1218 PolarHBondContact O-N 2.85Å
1216I30.9Very low31.2Very low103.4 Ų103.4113.4 Ų113.453%0.5360%0.604SS.*Hα-helixtrans-86.3-28.4175.1-66.7171000111Q1195 L1212 T1213 S1214 Q1218Q1195-I1216 HydrophobicContact CG-CG2 4.47Å; L1212-I1216 WeakPolarHBondContact O-CB 3.42Å; L1212-I1216 VanDerWaalsContact O-CD1 3.23Å; L1212-I1216 WeakPolarHBondContact O-CD1 3.45Å; L1212-I1216 WeakPolarHBondContact O-CG1 3.16Å; L1212-I1216 PolarHBondContact O-N 3.06Å; T1213-I1216 PolarHBondContact O-N 2.86Å; S1214-I1216 VanDerWaalsContact C-N 3.35Å; S1214-I1216 PolarHBondContact O-N 2.61Å; I1216-Q1218 VanDerWaalsContact C-N 3.32Å; I1216-Q1218 PolarHBondContact O-N 2.8Å
1217E29.6Very low30.8Very low170.8 Ų170.8111.3 Ų111.380%0.79859%0.593SS**Hα-helixtrans-91.117.4179.3-70.1-175175.700114.5T1213T1213-E1217 PolarHBondContact O-N 3.21Å
1218Q29.9Very low30.7Very low171 Ų171107.7 Ų107.780%0.79958%0.58SS**Hα-helixtrans-13566.4166-79.3-178.919.900114.1S1214 T1215 I1216 S1220S1214-Q1218 PolarHBondContact O-N 3.48Å; T1215-Q1218 PolarHBondContact O-N 2.85Å; I1216-Q1218 VanDerWaalsContact C-N 3.32Å; I1216-Q1218 PolarHBondContact O-N 2.8Å; Q1218-S1220 PolarHBondContact O-N 2.9Å
1219K26.4Very low31Very low180.2 Ų180.2104.5 Ų104.578%0.78357%0.567SS**  trans-118.2106.5171.2-69.3176.9178.2172.70112.3T1221 V1223K1219-T1221 VanDerWaalsContact C-N 3.27Å; K1219-T1221 PolarHBondContact O-N 2.98Å; K1219-V1223 HydrophobicContact CB-CG2 3.57Å; K1219-V1223 VanDerWaalsContact O-CG2 3.23Å; K1219-V1223 WeakPolarHBondContact O-CG2 3.46Å
1220S29.9Very low31.3Very low107.4 Ų107.4104.2 Ų104.275%0.75156%0.563SS**  trans-66.888.4167.453.30000116.1Q1218 N1222Q1218-S1220 PolarHBondContact O-N 2.9Å; S1220-N1222 PolarHBondContact O-N 3.41Å
1221T29Very low31.8Very low119.8 Ų119.8100.2 Ų100.274%0.73554%0.541SS*.SBendtrans159.317157.4520000117.3K1219K1219-T1221 VanDerWaalsContact C-N 3.27Å; K1219-T1221 PolarHBondContact O-N 2.98Å
1222N31.8Very low32Very low138.4 Ų138.496.3 Ų96.374%0.7453%0.525SS*.SBendtrans-133.336.8173.3-62.8-5.1000116.5S1220 I1224S1220-N1222 PolarHBondContact O-N 3.41Å; N1222-I1224 PolarHBondContact O-N 3.38Å
1223V30.2Very low32.5Very low67.8 Ų67.894.2 Ų94.241%0.41152%0.516SS..  trans-93.69-169.4-173.80000113.2K1219 D1225 V1226 L1227K1219-V1223 HydrophobicContact CB-CG2 3.57Å; K1219-V1223 VanDerWaalsContact O-CG2 3.23Å; K1219-V1223 WeakPolarHBondContact O-CG2 3.46Å; V1223-D1225 VanDerWaalsContact C-N 3.26Å; V1223-D1225 PolarHBondContact O-N 3.36Å; V1223-V1226 HydrophobicContact CG1-CB 4.06Å; V1223-V1226 PolarHBondContact O-N 3.01Å; V1223-L1227 HydrophobicContact CB-CD1 4.08Å; V1223-L1227 HydrophobicContact CB-CG 4.38Å; V1223-L1227 HydrophobicContact CG1-CB 4.3Å; V1223-L1227 HydrophobicContact CG1-CD1 3.49Å; V1223-L1227 HydrophobicContact CG1-CD2 4.24Å; V1223-L1227 HydrophobicContact CG1-CG 3.56Å; V1223-L1227 WeakPolarHBondContact O-CA 3.31Å; V1223-L1227 VanDerWaalsContact O-CB 3.29Å; V1223-L1227 WeakPolarHBondContact O-CB 3.37Å; V1223-L1227 VanDerWaalsContact O-CG 3.32Å; V1223-L1227 WeakPolarHBondContact O-CG 3.42Å; V1223-L1227 PolarHBondContact O-N 3.07Å
1224I32.3Very low33Very low95.2 Ų95.293.1 Ų93.149%0.48850%0.504SS..Hα-helixtrans-78.6-32.7-178-62.6175.9000112.2N1222 V1226 S1228 V1283 V1426N1222-I1224 PolarHBondContact O-N 3.38Å; I1224-V1226 VanDerWaalsContact C-N 3.34Å; I1224-V1226 PolarHBondContact O-N 3.35Å; I1224-S1228 WeakPolarHBondContact O-CA 3.48Å; I1224-S1228 WeakPolarHBondContact O-CB 3.26Å; I1224-S1228 PolarHBondContact O-N 3.43Å; I1224-S1228 PolarHBondContact O-OG 3.22Å; I1224-S1228 VanDerWaalsContact O-OG 3.11Å; I1224-V1283 HydrophobicContact CG2-CG2 4.28Å; I1224-V1426 HydrophobicContact CG2-CG1 4.26Å; I1224-V1426 HydrophobicContact CG2-CG2 4.4Å
1225D34.4Very low33.4Very low111.4 Ų111.491.8 Ų91.860%0.59649%0.492SS*.Hα-helixtrans-87.7-16.8-175.4-71.5-20.1000114.3V1223 L1227 S1228 I1229V1223-D1225 VanDerWaalsContact C-N 3.26Å; V1223-D1225 PolarHBondContact O-N 3.36Å; D1225-L1227 VanDerWaalsContact C-N 3.28Å; D1225-L1227 PolarHBondContact O-N 3.1Å; D1225-S1228 WeakPolarHBondContact CA-OG 3.33Å; D1225-S1228 PolarHBondContact O-OG 3.18Å; D1225-S1228 VanDerWaalsContact O-OG 3.04Å; D1225-I1229 HydrophobicContact CB-CB 3.98Å; D1225-I1229 HydrophobicContact CB-CD1 4.01Å; D1225-I1229 HydrophobicContact CB-CG1 4.06Å; D1225-I1229 VanDerWaalsContact O-CB 3.29Å; D1225-I1229 WeakPolarHBondContact O-CB 3.34Å; D1225-I1229 VanDerWaalsContact O-CD1 3.24Å; D1225-I1229 WeakPolarHBondContact O-CD1 3.27Å; D1225-I1229 VanDerWaalsContact O-CG1 3.3Å; D1225-I1229 WeakPolarHBondContact O-CG1 3.33Å; D1225-I1229 PolarHBondContact O-N 2.96Å; D1225-I1229 VanDerWaalsContact O-N 3.15Å; D1225-I1229 WeakPolarHBondContact OD1-CD1 3.43Å
1226V36.1Very low33.8Very low72.8 Ų72.892.1 Ų92.144%0.44149%0.49SS..Hα-helixtrans-78.4-32.2-175.8-177.70000112.1V1223 I1224 I1229 E1230V1223-V1226 HydrophobicContact CG1-CB 4.06Å; V1223-V1226 PolarHBondContact O-N 3.01Å; I1224-V1226 VanDerWaalsContact C-N 3.34Å; I1224-V1226 PolarHBondContact O-N 3.35Å; V1226-I1229 PolarHBondContact O-N 3.28Å; V1226-E1230 HydrophobicContact CG1-CG 4Å; V1226-E1230 WeakPolarHBondContact CG1-OE2 3.39Å; V1226-E1230 WeakPolarHBondContact O-CA 3.49Å; V1226-E1230 VanDerWaalsContact O-CB 3.23Å; V1226-E1230 WeakPolarHBondContact O-CB 3.41Å; V1226-E1230 WeakPolarHBondContact O-CG 3.43Å; V1226-E1230 PolarHBondContact O-N 3.08Å
1227L35.7Very low34Very low36.2 Ų36.291.1 Ų91.119%0.1949%0.486CS..Hα-helixtrans-82.9-41.2177.7-73.4176.5000112.8L1212 V1223 D1225 I1229 E1230 I1231 F1429 K1435L1212-L1227 HydrophobicContact CD2-CD2 3.96Å; V1223-L1227 HydrophobicContact CB-CD1 4.08Å; V1223-L1227 HydrophobicContact CB-CG 4.38Å; V1223-L1227 HydrophobicContact CG1-CB 4.3Å; V1223-L1227 HydrophobicContact CG1-CD1 3.49Å; V1223-L1227 HydrophobicContact CG1-CD2 4.24Å; V1223-L1227 HydrophobicContact CG1-CG 3.56Å; V1223-L1227 WeakPolarHBondContact O-CA 3.31Å; V1223-L1227 VanDerWaalsContact O-CB 3.29Å; V1223-L1227 WeakPolarHBondContact O-CB 3.37Å; V1223-L1227 VanDerWaalsContact O-CG 3.32Å; V1223-L1227 WeakPolarHBondContact O-CG 3.42Å; V1223-L1227 PolarHBondContact O-N 3.07Å; D1225-L1227 VanDerWaalsContact C-N 3.28Å; D1225-L1227 PolarHBondContact O-N 3.1Å; L1227-I1229 VanDerWaalsContact C-N 3.29Å; L1227-I1229 PolarHBondContact O-N 3.1Å; L1227-E1230 PolarHBondContact O-N 3.21Å; L1227-I1231 HydrophobicContact CB-CD1 3.97Å; L1227-I1231 HydrophobicContact CB-CG1 4.4Å; L1227-I1231 HydrophobicContact CD2-CD1 4.29Å; L1227-I1231 HydrophobicContact CD2-CG1 4.31Å; L1227-I1231 HydrophobicContact CG-CD1 4.42Å; L1227-I1231 WeakPolarHBondContact O-CA 3.22Å; L1227-I1231 VanDerWaalsContact O-CB 3.26Å; L1227-I1231 WeakPolarHBondContact O-CB 3.33Å; L1227-I1231 WeakPolarHBondContact O-CD1 3.2Å; L1227-I1231 VanDerWaalsContact O-CG1 3.28Å; L1227-I1231 WeakPolarHBondContact O-CG1 3.31Å; L1227-I1231 PolarHBondContact O-N 2.95Å; L1227-F1429 HydrophobicContact CD1-CD2 3.77Å; L1227-F1429 HydrophobicContact CD1-CE2 3.85Å; L1227-F1429 HydrophobicContact CD2-CD2 4.35Å; L1227-F1429 HydrophobicContact CD2-CE2 4.38Å; L1227-K1435 HydrophobicContact CD2-CD 4.03Å; L1227-K1435 VanDerWaalsContact CD2-CE 3.48Å
1228S36.1Very low34.4Very low35.4 Ų35.488.4 Ų88.425%0.24847%0.469CS..Hα-helixtrans-61.6-41175.456.70000110.7I1224 D1225 S1232 E1286I1224-S1228 WeakPolarHBondContact O-CA 3.48Å; I1224-S1228 WeakPolarHBondContact O-CB 3.26Å; I1224-S1228 PolarHBondContact O-N 3.43Å; I1224-S1228 PolarHBondContact O-OG 3.22Å; I1224-S1228 VanDerWaalsContact O-OG 3.11Å; D1225-S1228 WeakPolarHBondContact CA-OG 3.33Å; D1225-S1228 PolarHBondContact O-OG 3.18Å; D1225-S1228 VanDerWaalsContact O-OG 3.04Å; S1228-S1232 WeakPolarHBondContact O-CA 3.49Å; S1228-S1232 VanDerWaalsContact O-CB 3.26Å; S1228-S1232 WeakPolarHBondContact O-CB 3.32Å; S1228-S1232 PolarHBondContact O-N 3.37Å; S1228-S1232 PolarHBondContact O-OG 3.21Å; S1228-E1286 VanDerWaalsContact CA-OE1 3.31Å; S1228-E1286 WeakPolarHBondContact CA-OE1 3.22Å; S1228-E1286 WeakPolarHBondContact CB-OE1 3.47Å
1229I36.8Very low34.9Very low96.2 Ų96.282.4 Ų82.449%0.49344%0.441SS..Hα-helixtrans-74.6-46177.4-63.2176.1000110.8D1225 V1226 L1227 I1231 S1232 T1233D1225-I1229 HydrophobicContact CB-CB 3.98Å; D1225-I1229 HydrophobicContact CB-CD1 4.01Å; D1225-I1229 HydrophobicContact CB-CG1 4.06Å; D1225-I1229 VanDerWaalsContact O-CB 3.29Å; D1225-I1229 WeakPolarHBondContact O-CB 3.34Å; D1225-I1229 VanDerWaalsContact O-CD1 3.24Å; D1225-I1229 WeakPolarHBondContact O-CD1 3.27Å; D1225-I1229 VanDerWaalsContact O-CG1 3.3Å; D1225-I1229 WeakPolarHBondContact O-CG1 3.33Å; D1225-I1229 PolarHBondContact O-N 2.96Å; D1225-I1229 VanDerWaalsContact O-N 3.15Å; D1225-I1229 WeakPolarHBondContact OD1-CD1 3.43Å; V1226-I1229 PolarHBondContact O-N 3.28Å; L1227-I1229 VanDerWaalsContact C-N 3.29Å; L1227-I1229 PolarHBondContact O-N 3.1Å; I1229-I1231 VanDerWaalsContact C-N 3.34Å; I1229-I1231 PolarHBondContact O-N 3.18Å; I1229-S1232 WeakPolarHBondContact CA-OG 3.28Å; I1229-S1232 CarbonylContact O-C 3.51Å; I1229-S1232 PolarHBondContact O-N 3.04Å; I1229-S1232 VanDerWaalsContact O-N 3.08Å; I1229-S1232 PolarHBondContact O-OG 3.06Å; I1229-S1232 VanDerWaalsContact O-OG 3.11Å; I1229-T1233 HydrophobicContact CB-CG2 4.35Å; I1229-T1233 HydrophobicContact CG2-CG2 3.79Å; I1229-T1233 VanDerWaalsContact CG2-CG2 3.48Å; I1229-T1233 VanDerWaalsContact CG2-OG1 3.26Å; I1229-T1233 WeakPolarHBondContact CG2-OG1 3.28Å; I1229-T1233 VanDerWaalsContact O-CA 3.31Å; I1229-T1233 WeakPolarHBondContact O-CA 3.31Å; I1229-T1233 WeakPolarHBondContact O-CB 3.3Å; I1229-T1233 VanDerWaalsContact O-CG2 3.24Å; I1229-T1233 WeakPolarHBondContact O-CG2 3.37Å; I1229-T1233 PolarHBondContact O-N 3.13Å; I1229-T1233 PolarHBondContact O-OG1 3.03Å
1230E35Very low35.2Very low83.2 Ų83.279.3 Ų79.339%0.38943%0.433SS..Hα-helixtrans-69.2-37.4-179.4-114.4160.7166.600112.9V1226 L1227 S1232 T1233 Q1234 K1435V1226-E1230 HydrophobicContact CG1-CG 4Å; V1226-E1230 WeakPolarHBondContact CG1-OE2 3.39Å; V1226-E1230 WeakPolarHBondContact O-CA 3.49Å; V1226-E1230 VanDerWaalsContact O-CB 3.23Å; V1226-E1230 WeakPolarHBondContact O-CB 3.41Å; V1226-E1230 WeakPolarHBondContact O-CG 3.43Å; V1226-E1230 PolarHBondContact O-N 3.08Å; L1227-E1230 PolarHBondContact O-N 3.21Å; E1230-S1232 VanDerWaalsContact C-N 3.29Å; E1230-S1232 PolarHBondContact O-N 3.22Å; E1230-T1233 VanDerWaalsContact CA-OG1 3.32Å; E1230-T1233 WeakPolarHBondContact CA-OG1 3.31Å; E1230-T1233 PolarHBondContact O-N 3.2Å; E1230-T1233 PolarHBondContact O-OG1 3.2Å; E1230-T1233 VanDerWaalsContact O-OG1 3.07Å; E1230-Q1234 HydrophobicContact CB-CB 4.42Å; E1230-Q1234 WeakPolarHBondContact O-CA 3.32Å; E1230-Q1234 VanDerWaalsContact O-CB 3.26Å; E1230-Q1234 WeakPolarHBondContact O-CB 3.32Å; E1230-Q1234 WeakPolarHBondContact O-CG 3.36Å; E1230-Q1234 PolarHBondContact O-N 3.21Å; E1230-Q1234 PolarHBondContact OE1-NE2 3Å; E1230-K1435 IonicContact OE2-NZ 3.53Å; E1230-K1435 PolarHBondContact OE2-NZ 2.83Å
1231I40.2Very low35.3Very low43.6 Ų43.682.8 Ų82.822%0.22443%0.43CS..Hα-helixtrans-69.2-42.3174.6-64.4171.5000110L1227 I1229 T1233 Q1234 I1235 L1290L1227-I1231 HydrophobicContact CB-CD1 3.97Å; L1227-I1231 HydrophobicContact CB-CG1 4.4Å; L1227-I1231 HydrophobicContact CD2-CD1 4.29Å; L1227-I1231 HydrophobicContact CD2-CG1 4.31Å; L1227-I1231 HydrophobicContact CG-CD1 4.42Å; L1227-I1231 WeakPolarHBondContact O-CA 3.22Å; L1227-I1231 VanDerWaalsContact O-CB 3.26Å; L1227-I1231 WeakPolarHBondContact O-CB 3.33Å; L1227-I1231 WeakPolarHBondContact O-CD1 3.2Å; L1227-I1231 VanDerWaalsContact O-CG1 3.28Å; L1227-I1231 WeakPolarHBondContact O-CG1 3.31Å; L1227-I1231 PolarHBondContact O-N 2.95Å; I1229-I1231 VanDerWaalsContact C-N 3.34Å; I1229-I1231 PolarHBondContact O-N 3.18Å; I1231-T1233 VanDerWaalsContact C-N 3.34Å; I1231-T1233 PolarHBondContact O-N 3.43Å; I1231-Q1234 PolarHBondContact O-N 3.09Å; I1231-I1235 HydrophobicContact CG2-CD1 3.52Å; I1231-I1235 HydrophobicContact CG2-CG1 3.86Å; I1231-I1235 WeakPolarHBondContact O-CA 3.45Å; I1231-I1235 VanDerWaalsContact O-CB 3.25Å; I1231-I1235 WeakPolarHBondContact O-CB 3.36Å; I1231-I1235 WeakPolarHBondContact O-CD1 3.43Å; I1231-I1235 WeakPolarHBondContact O-CG1 3.41Å; I1231-I1235 PolarHBondContact O-N 3.29Å; I1231-L1290 HydrophobicContact CG2-CD2 4.43Å
1232S34Very low35.6Very low49.6 Ų49.680.2 Ų80.235%0.34741%0.413SS..Hα-helixtrans-71.6-31.9175.947.70000112.7S1228 I1229 E1230 N1236S1228-S1232 WeakPolarHBondContact O-CA 3.49Å; S1228-S1232 VanDerWaalsContact O-CB 3.26Å; S1228-S1232 WeakPolarHBondContact O-CB 3.32Å; S1228-S1232 PolarHBondContact O-N 3.37Å; S1228-S1232 PolarHBondContact O-OG 3.21Å; I1229-S1232 WeakPolarHBondContact CA-OG 3.28Å; I1229-S1232 CarbonylContact O-C 3.51Å; I1229-S1232 PolarHBondContact O-N 3.04Å; I1229-S1232 VanDerWaalsContact O-N 3.08Å; I1229-S1232 PolarHBondContact O-OG 3.06Å; I1229-S1232 VanDerWaalsContact O-OG 3.11Å; E1230-S1232 VanDerWaalsContact C-N 3.29Å; E1230-S1232 PolarHBondContact O-N 3.22Å; S1232-N1236 WeakPolarHBondContact O-CA 3.23Å; S1232-N1236 WeakPolarHBondContact O-CB 3.44Å; S1232-N1236 PolarHBondContact O-N 3.25Å; S1232-N1236 PolarHBondContact O-ND2 3.25Å; S1232-N1236 VanDerWaalsContact O-ND2 3.13Å
1233T38.3Very low35.7Very low48 Ų4877.8 Ų77.829%0.29440%0.399SS..Hα-helixtrans-86.5-29.5-179.659.60000112.9I1229 E1230 I1231 I1235 N1236 N1237 R1238I1229-T1233 HydrophobicContact CB-CG2 4.35Å; I1229-T1233 HydrophobicContact CG2-CG2 3.79Å; I1229-T1233 VanDerWaalsContact CG2-CG2 3.48Å; I1229-T1233 VanDerWaalsContact CG2-OG1 3.26Å; I1229-T1233 WeakPolarHBondContact CG2-OG1 3.28Å; I1229-T1233 VanDerWaalsContact O-CA 3.31Å; I1229-T1233 WeakPolarHBondContact O-CA 3.31Å; I1229-T1233 WeakPolarHBondContact O-CB 3.3Å; I1229-T1233 VanDerWaalsContact O-CG2 3.24Å; I1229-T1233 WeakPolarHBondContact O-CG2 3.37Å; I1229-T1233 PolarHBondContact O-N 3.13Å; I1229-T1233 PolarHBondContact O-OG1 3.03Å; E1230-T1233 VanDerWaalsContact CA-OG1 3.32Å; E1230-T1233 WeakPolarHBondContact CA-OG1 3.31Å; E1230-T1233 PolarHBondContact O-N 3.2Å; E1230-T1233 PolarHBondContact O-OG1 3.2Å; E1230-T1233 VanDerWaalsContact O-OG1 3.07Å; I1231-T1233 VanDerWaalsContact C-N 3.34Å; I1231-T1233 PolarHBondContact O-N 3.43Å; T1233-I1235 PolarHBondContact O-N 2.98Å; T1233-I1235 VanDerWaalsContact O-N 3.15Å; T1233-N1236 CarbonylContact O-C 3.5Å; T1233-N1237 VanDerWaalsContact CB-ND2 3.29Å; T1233-N1237 WeakPolarHBondContact CB-ND2 3.49Å; T1233-N1237 WeakPolarHBondContact CG2-ND2 3.23Å; T1233-N1237 CarbonylContact O-C 3.33Å; T1233-N1237 VanDerWaalsContact O-CA 3.27Å; T1233-N1237 WeakPolarHBondContact O-CA 3.18Å; T1233-N1237 WeakPolarHBondContact O-CB 3.17Å; T1233-N1237 VanDerWaalsContact O-CG 3.25Å; T1233-N1237 PolarHBondContact O-N 3.14Å; T1233-N1237 VanDerWaalsContact O-N 3.17Å; T1233-N1237 PolarHBondContact O-ND2 3.24Å; T1233-R1238 HydrophobicContact CG2-CB 3.91Å; T1233-R1238 HydrophobicContact CG2-CG 4.47Å; T1233-R1238 PolarHBondContact O-N 3.07Å
1234Q38.1Very low35.8Very low66.2 Ų66.280.3 Ų80.331%0.30941%0.41SS..Hα-helixtrans-75.1-35.3174.2-88.2-177.15.200111.9N1209 E1230 I1231 N1236 N1237 R1238 K1443N1209-Q1234 PolarHBondContact ND2-NE2 3.1Å; E1230-Q1234 HydrophobicContact CB-CB 4.42Å; E1230-Q1234 WeakPolarHBondContact O-CA 3.32Å; E1230-Q1234 VanDerWaalsContact O-CB 3.26Å; E1230-Q1234 WeakPolarHBondContact O-CB 3.32Å; E1230-Q1234 WeakPolarHBondContact O-CG 3.36Å; E1230-Q1234 PolarHBondContact O-N 3.21Å; E1230-Q1234 PolarHBondContact OE1-NE2 3Å; I1231-Q1234 PolarHBondContact O-N 3.09Å; Q1234-N1236 PolarHBondContact O-N 2.85Å; Q1234-N1237 PolarHBondContact O-N 2.9Å; Q1234-N1237 PolarHBondContact O-OD1 2.84Å; Q1234-N1237 VanDerWaalsContact O-OD1 3.1Å; Q1234-R1238 WeakPolarHBondContact O-CB 3.46Å; Q1234-R1238 VanDerWaalsContact O-CG 3.24Å; Q1234-R1238 WeakPolarHBondContact O-CG 3.33Å; Q1234-R1238 PolarHBondContact O-N 2.96Å; Q1234-K1443 VanDerWaalsContact C-NZ 3.32Å; Q1234-K1443 PolarHBondContact O-NZ 3.45Å
1235I39.6Very low35.9Very low38 Ų3884.9 Ų84.920%0.19543%0.426CS..Hα-helixtrans-72.3-47.7173.7-67176.5000110.1I1231 T1233 N1237 R1238 I1239 H1289 L1290 Y1293 E1364 K1443I1231-I1235 HydrophobicContact CG2-CD1 3.52Å; I1231-I1235 HydrophobicContact CG2-CG1 3.86Å; I1231-I1235 WeakPolarHBondContact O-CA 3.45Å; I1231-I1235 VanDerWaalsContact O-CB 3.25Å; I1231-I1235 WeakPolarHBondContact O-CB 3.36Å; I1231-I1235 WeakPolarHBondContact O-CD1 3.43Å; I1231-I1235 WeakPolarHBondContact O-CG1 3.41Å; I1231-I1235 PolarHBondContact O-N 3.29Å; T1233-I1235 PolarHBondContact O-N 2.98Å; T1233-I1235 VanDerWaalsContact O-N 3.15Å; I1235-N1237 VanDerWaalsContact C-N 3.3Å; I1235-N1237 PolarHBondContact O-N 3.23Å; I1235-R1238 PolarHBondContact O-N 3.07Å; I1235-I1239 HydrophobicContact CG2-CD1 4.06Å; I1235-I1239 HydrophobicContact CG2-CG1 4.04Å; I1235-I1239 WeakPolarHBondContact O-CD1 3.47Å; I1235-I1239 VanDerWaalsContact O-CG1 3.28Å; I1235-I1239 WeakPolarHBondContact O-CG1 3.38Å; I1235-I1239 PolarHBondContact O-N 2.93Å; I1235-H1289 VanDerWaalsContact CG2-CE1 3.42Å; I1235-H1289 WeakPolarHBondContact CG2-CE1 3.38Å; I1235-L1290 HydrophobicContact CD1-CD2 3.79Å; I1235-Y1293 HydrophobicContact CG2-CD2 4.34Å; I1235-Y1293 HydrophobicContact CG2-CE2 4.33Å; I1235-E1364 WeakPolarHBondContact CD1-OE1 3.38Å; I1235-E1364 WeakPolarHBondContact CD1-OE2 2.94Å; I1235-K1443 HydrophobicContact CG1-CD 4.21Å
1236N35.4Very low35.9Very low99 Ų9984.7 Ų84.753%0.52943%0.434SS..Hα-helixtrans-71.2-21.5178.2-71.8-31.4000113.1S1232 T1233 Q1234 R1238 I1239 L1240S1232-N1236 WeakPolarHBondContact O-CA 3.23Å; S1232-N1236 WeakPolarHBondContact O-CB 3.44Å; S1232-N1236 PolarHBondContact O-N 3.25Å; S1232-N1236 PolarHBondContact O-ND2 3.25Å; S1232-N1236 VanDerWaalsContact O-ND2 3.13Å; T1233-N1236 CarbonylContact O-C 3.5Å; Q1234-N1236 PolarHBondContact O-N 2.85Å; N1236-R1238 HydrophobicContact CB-CG 4.29Å; N1236-R1238 PolarHBondContact O-N 3.25Å; N1236-I1239 CarbonylContact O-C 3.58Å; N1236-I1239 PolarHBondContact O-N 3.42Å; N1236-L1240 HydrophobicContact CB-CB 4.26Å; N1236-L1240 HydrophobicContact CB-CD1 4.33Å; N1236-L1240 HydrophobicContact CB-CD2 4.4Å; N1236-L1240 WeakPolarHBondContact O-CA 3.41Å; N1236-L1240 VanDerWaalsContact O-CB 3.28Å; N1236-L1240 WeakPolarHBondContact O-CB 3.4Å; N1236-L1240 PolarHBondContact O-N 3.26Å
1237N35.5Very low35.8Very low83 Ų8387.6 Ų87.644%0.44445%0.446SS..Hα-helixtrans-80.6-1.1-177.6-70.8-32.3000115.5T1233 Q1234 I1235 I1239 L1240 R1241T1233-N1237 VanDerWaalsContact CB-ND2 3.29Å; T1233-N1237 WeakPolarHBondContact CB-ND2 3.49Å; T1233-N1237 WeakPolarHBondContact CG2-ND2 3.23Å; T1233-N1237 CarbonylContact O-C 3.33Å; T1233-N1237 VanDerWaalsContact O-CA 3.27Å; T1233-N1237 WeakPolarHBondContact O-CA 3.18Å; T1233-N1237 WeakPolarHBondContact O-CB 3.17Å; T1233-N1237 VanDerWaalsContact O-CG 3.25Å; T1233-N1237 PolarHBondContact O-N 3.14Å; T1233-N1237 VanDerWaalsContact O-N 3.17Å; T1233-N1237 PolarHBondContact O-ND2 3.24Å; Q1234-N1237 PolarHBondContact O-N 2.9Å; Q1234-N1237 PolarHBondContact O-OD1 2.84Å; Q1234-N1237 VanDerWaalsContact O-OD1 3.1Å; I1235-N1237 VanDerWaalsContact C-N 3.3Å; I1235-N1237 PolarHBondContact O-N 3.23Å; N1237-I1239 VanDerWaalsContact C-N 3.3Å; N1237-I1239 PolarHBondContact O-N 3.12Å; N1237-L1240 VanDerWaalsContact OD1-CB 3.32Å; N1237-L1240 WeakPolarHBondContact OD1-CB 3.02Å; N1237-R1241 HydrophobicContact CB-CB 4.36Å; N1237-R1241 HydrophobicContact CB-CG 3.89Å; N1237-R1241 WeakPolarHBondContact O-CB 3.38Å; N1237-R1241 PolarHBondContact O-N 2.97Å
1238R36.5Very low35.6Very low115 Ų11591.9 Ų91.943%0.43448%0.479SS..Hα-helixtrans-97.43.7179-80-175.8173.6165.7-2114.3E1207 N1209 T1233 Q1234 I1235 N1236 L1240 R1241 T1242 Y1293E1207-R1238 IonicContact OE2-CZ 2.78Å; E1207-R1238 VanDerWaalsContact OE2-CZ 3.29Å; E1207-R1238 IonicContact OE2-NE 2.65Å; E1207-R1238 IonicContact OE2-NH1 3.28Å; E1207-R1238 PolarHBondContact OE2-NH1 3.1Å; E1207-R1238 IonicContact OE2-NH2 3.66Å; E1207-R1238 PolarHBondContact OE2-NH2 3.34Å; N1209-R1238 PolarHBondContact ND2-NH2 2.71Å; T1233-R1238 HydrophobicContact CG2-CB 3.91Å; T1233-R1238 HydrophobicContact CG2-CG 4.47Å; T1233-R1238 PolarHBondContact O-N 3.07Å; Q1234-R1238 WeakPolarHBondContact O-CB 3.46Å; Q1234-R1238 VanDerWaalsContact O-CG 3.24Å; Q1234-R1238 WeakPolarHBondContact O-CG 3.33Å; Q1234-R1238 PolarHBondContact O-N 2.96Å; I1235-R1238 PolarHBondContact O-N 3.07Å; N1236-R1238 HydrophobicContact CB-CG 4.29Å; N1236-R1238 PolarHBondContact O-N 3.25Å; R1238-L1240 PolarHBondContact O-N 3.29Å; R1238-L1240 VanDerWaalsContact O-N 3.16Å; R1238-R1241 HydrophobicContact CG-CB 4.14Å; R1238-R1241 HydrophobicContact CG-CG 4.22Å; R1238-R1241 VanDerWaalsContact CZ-NH1 3.29Å; R1238-R1241 PolarHBondContact O-N 3Å; R1238-R1241 VanDerWaalsContact O-N 3.13Å; R1238-T1242 HydrophobicContact CB-CG2 4.1Å; R1238-T1242 HydrophobicContact CG-CG2 4.16Å; R1238-T1242 PolarHBondContact O-N 3.29Å; R1238-T1242 PolarHBondContact O-OG1 3.05Å; R1238-Y1293 PolarHBondContact O-OH 3.43Å; R1238-Y1293 VanDerWaalsContact O-OH 3.05Å
1239I40.7Very low35.9Very low43.2 Ų43.293.3 Ų93.322%0.22249%0.489CS..THydrogen-bonded Turntrans-69.3-28.2164.1-64.2172000110I1235 N1236 N1237 R1241 T1242 Y1293 L1297 E1325 W1329I1235-I1239 HydrophobicContact CG2-CD1 4.06Å; I1235-I1239 HydrophobicContact CG2-CG1 4.04Å; I1235-I1239 WeakPolarHBondContact O-CD1 3.47Å; I1235-I1239 VanDerWaalsContact O-CG1 3.28Å; I1235-I1239 WeakPolarHBondContact O-CG1 3.38Å; I1235-I1239 PolarHBondContact O-N 2.93Å; N1236-I1239 CarbonylContact O-C 3.58Å; N1236-I1239 PolarHBondContact O-N 3.42Å; N1237-I1239 VanDerWaalsContact C-N 3.3Å; N1237-I1239 PolarHBondContact O-N 3.12Å; I1239-R1241 VanDerWaalsContact C-N 3.31Å; I1239-R1241 PolarHBondContact O-N 3.37Å; I1239-T1242 PolarHBondContact O-N 3.02Å; I1239-T1242 PolarHBondContact O-OG1 3.3Å; I1239-Y1293 HydrophobicContact CD1-CE2 4.02Å; I1239-Y1293 WeakPolarHBondContact CD1-OH 3.36Å; I1239-Y1293 HydrophobicContact CG1-CD2 4.4Å; I1239-Y1293 HydrophobicContact CG1-CE2 4.02Å; I1239-L1297 HydrophobicContact CG2-CD2 4.31Å; I1239-E1325 HydrophobicContact CD1-CG 4.47Å; I1239-E1325 WeakPolarHBondContact CD1-OE1 3.29Å; I1239-E1325 VanDerWaalsContact CG2-OE1 3.23Å; I1239-E1325 WeakPolarHBondContact CG2-OE1 3.22Å; I1239-W1329 HydrophobicContact CB-CZ2 4.1Å; I1239-W1329 HydrophobicContact CD1-CZ2 4.09Å; I1239-W1329 HydrophobicContact CG1-CZ2 4.42Å; I1239-W1329 HydrophobicContact CG2-CH2 3.81Å; I1239-W1329 HydrophobicContact CG2-CZ2 3.55Å
1240L33.2Very low36.6Very low115.4 Ų115.492.4 Ų92.460%0.60449%0.491SS*.THydrogen-bonded Turntrans-673.4-178.5-119.784.1000115.5N1236 N1237 R1238 T1242 M1243 D1244N1236-L1240 HydrophobicContact CB-CB 4.26Å; N1236-L1240 HydrophobicContact CB-CD1 4.33Å; N1236-L1240 HydrophobicContact CB-CD2 4.4Å; N1236-L1240 WeakPolarHBondContact O-CA 3.41Å; N1236-L1240 VanDerWaalsContact O-CB 3.28Å; N1236-L1240 WeakPolarHBondContact O-CB 3.4Å; N1236-L1240 PolarHBondContact O-N 3.26Å; N1237-L1240 VanDerWaalsContact OD1-CB 3.32Å; N1237-L1240 WeakPolarHBondContact OD1-CB 3.02Å; R1238-L1240 PolarHBondContact O-N 3.29Å; R1238-L1240 VanDerWaalsContact O-N 3.16Å; L1240-T1242 WeakPolarHBondContact CD2-OG1 3.47Å; L1240-T1242 PolarHBondContact O-N 3.19Å; L1240-M1243 PolarHBondContact O-N 3.41Å; L1240-D1244 HydrophobicContact CD2-CB 4.16Å; L1240-D1244 VanDerWaalsContact CD2-OD2 3.31Å; L1240-D1244 WeakPolarHBondContact CD2-OD2 3.1Å; L1240-D1244 HydrophobicContact CG-CB 4.35Å
1241R32.1Very low37.7Very low182.4 Ų182.489.2 Ų89.269%0.68848%0.476SS*.THydrogen-bonded Turntrans-98.7-7178.5-79.6-171.7-178.9-175.82114.9N1237 R1238 I1239 M1243 D1244N1237-R1241 HydrophobicContact CB-CB 4.36Å; N1237-R1241 HydrophobicContact CB-CG 3.89Å; N1237-R1241 WeakPolarHBondContact O-CB 3.38Å; N1237-R1241 PolarHBondContact O-N 2.97Å; R1238-R1241 HydrophobicContact CG-CB 4.14Å; R1238-R1241 HydrophobicContact CG-CG 4.22Å; R1238-R1241 VanDerWaalsContact CZ-NH1 3.29Å; R1238-R1241 PolarHBondContact O-N 3Å; R1238-R1241 VanDerWaalsContact O-N 3.13Å; I1239-R1241 VanDerWaalsContact C-N 3.31Å; I1239-R1241 PolarHBondContact O-N 3.37Å; R1241-M1243 PolarHBondContact O-N 3.1Å; R1241-D1244 PolarHBondContact O-N 3.38Å
1242T35.5Very low39.1Very low64.6 Ų64.690.2 Ų90.240%0.39649%0.485SS..THydrogen-bonded Turntrans-89.7-3.5176.359.50000113.8H1208 R1238 I1239 L1240H1208-T1242 WeakPolarHBondContact CD2-CG2 3.12Å; R1238-T1242 HydrophobicContact CB-CG2 4.1Å; R1238-T1242 HydrophobicContact CG-CG2 4.16Å; R1238-T1242 PolarHBondContact O-N 3.29Å; R1238-T1242 PolarHBondContact O-OG1 3.05Å; I1239-T1242 PolarHBondContact O-N 3.02Å; I1239-T1242 PolarHBondContact O-OG1 3.3Å; L1240-T1242 WeakPolarHBondContact CD2-OG1 3.47Å; L1240-T1242 PolarHBondContact O-N 3.19Å
1243M34.3Very low41Very low88.2 Ų88.289.9 Ų89.943%0.43448%0.478SS..SBendtrans-103.72.5-175.8-70.5-63-157.500115.1C1204 L1240 R1241 K1245 F1253 L1297 Y1300C1204-M1243 WeakPolarHBondContact O-CE 3.5Å; L1240-M1243 PolarHBondContact O-N 3.41Å; R1241-M1243 PolarHBondContact O-N 3.1Å; M1243-K1245 PolarHBondContact O-N 3.1Å; M1243-F1253 HydrophobicContact CE-CB 4.28Å; M1243-F1253 HydrophobicContact CE-CD2 4.08Å; M1243-F1253 HydrophobicContact CE-CG 4.14Å; M1243-L1297 HydrophobicContact CE-CD2 3.64Å; M1243-Y1300 HydrophobicContact CB-CE2 4.07Å; M1243-Y1300 HydrophobicContact CE-CD2 3.96Å; M1243-Y1300 HydrophobicContact CE-CE2 4.17Å; M1243-Y1300 HydrophobicContact CE-CG 4.48Å; M1243-Y1300 HydrophobicContact CG-CE2 3.98Å; M1243-Y1300 PolarHBondContact O-OH 2.88Å; M1243-Y1300 VanDerWaalsContact O-OH 3.13Å; M1243-Y1300 HydrophobicContact SD-CD2 4.11Å; M1243-Y1300 HydrophobicContact SD-CE1 4.49Å; M1243-Y1300 HydrophobicContact SD-CE2 3.75Å
1244D31.6Very low42.8Very low119.6 Ų119.694.1 Ų94.164%0.6449%0.494SS*.SBendtrans-83.994.7172.3-97.8-13.7000110.9L1240 R1241 S1246 L1247L1240-D1244 HydrophobicContact CD2-CB 4.16Å; L1240-D1244 VanDerWaalsContact CD2-OD2 3.31Å; L1240-D1244 WeakPolarHBondContact CD2-OD2 3.1Å; L1240-D1244 HydrophobicContact CG-CB 4.35Å; R1241-D1244 PolarHBondContact O-N 3.38Å; D1244-S1246 PolarHBondContact O-N 2.99Å; D1244-L1247 PolarHBondContact O-N 3.23Å
1245K35.4Very low44.6Very low192 Ų19293.6 Ų93.684%0.83549%0.492SS*.SBendtrans-25.579.3167.9-67.6175.7179174.50114.7M1243 L1247M1243-K1245 PolarHBondContact O-N 3.1Å; K1245-L1247 VanDerWaalsContact C-N 3.35Å; K1245-L1247 PolarHBondContact O-N 3.1Å
1246S33.9Very low46.4Very low107.2 Ų107.292 Ų9275%0.7548%0.483SS*.  trans-33.265.317261.70000114.3D1244 S1248D1244-S1246 PolarHBondContact O-N 2.99Å; S1246-S1248 PolarHBondContact O-N 3.15Å
1247L33.3Very low48.5Very low134.2 Ų134.287.3 Ų87.370%0.70346%0.458SS*.  trans-120103.9165.6-75.3152.1000110.4D1244 K1245 S1249D1244-L1247 PolarHBondContact O-N 3.23Å; K1245-L1247 VanDerWaalsContact C-N 3.35Å; K1245-L1247 PolarHBondContact O-N 3.1Å; L1247-S1249 PolarHBondContact O-N 2.95Å
1248S31.8Very low50.6Low126.2 Ų126.285.8 Ų85.888%0.88345%0.448SS*.  trans-46.289.6167.7-103.50000112.9S1246 S1250S1246-S1248 PolarHBondContact O-N 3.15Å; S1248-S1250 PolarHBondContact O-N 3.49Å
1249S41.8Very low52.7Low64 Ų6480.4 Ų80.445%0.44843%0.428SS..  trans-110.2139.3154.365.70000110.1L1247 F1251L1247-S1249 PolarHBondContact O-N 2.95Å; S1249-F1251 VanDerWaalsContact C-N 3.3Å; S1249-F1251 PolarHBondContact O-N 3.04Å; S1249-F1251 VanDerWaalsContact O-N 3.14Å; S1249-F1251 PolarHBondContact OG-O 3.05Å; S1249-F1251 VanDerWaalsContact OG-O 3.08Å
1250S52.9Low54.6Low77.6 Ų77.678.4 Ų78.454%0.54342%0.418SS..SBendtrans-57.73.2-177.6-177.70000114.9T1148 S1248T1148-S1250 WeakPolarHBondContact CG2-OG 3.34Å; T1148-S1250 PolarHBondContact OG1-OG 2.85Å; S1248-S1250 PolarHBondContact O-N 3.49Å
1251F58.8Low56.9Low17 Ų1774.9 Ų74.98%0.07540%0.397CS..SBendtrans-148.5118.7179.2-154.2-103.6000111.2L1144 G1149 I1152 L1206 S1249 F1253 Q1255 I1256 L1259L1144-F1251 HydrophobicContact CD2-CE2 4.33Å; L1144-F1251 HydrophobicContact CD2-CZ 3.97Å; G1149-F1251 VanDerWaalsContact CA-CE2 3.47Å; I1152-F1251 HydrophobicContact CD1-CB 4.09Å; I1152-F1251 HydrophobicContact CD1-CD1 3.98Å; I1152-F1251 HydrophobicContact CD1-CG 4.12Å; L1206-F1251 HydrophobicContact CD1-CB 4.33Å; L1206-F1251 WeakPolarHBondContact CD1-O 3.41Å; S1249-F1251 VanDerWaalsContact C-N 3.3Å; S1249-F1251 PolarHBondContact O-N 3.04Å; S1249-F1251 VanDerWaalsContact O-N 3.14Å; S1249-F1251 PolarHBondContact OG-O 3.05Å; S1249-F1251 VanDerWaalsContact OG-O 3.08Å; F1251-F1253 PolarHBondContact O-N 3.41Å; F1251-Q1255 HydrophobicContact CD1-CB 4.35Å; F1251-Q1255 HydrophobicContact CE1-CB 3.69Å; F1251-Q1255 HydrophobicContact CE2-CB 4.49Å; F1251-Q1255 VanDerWaalsContact CE2-OE1 3.23Å; F1251-Q1255 HydrophobicContact CZ-CB 3.78Å; F1251-Q1255 VanDerWaalsContact CZ-OE1 3.3Å; F1251-I1256 HydrophobicContact CD1-CD1 4.23Å; F1251-I1256 HydrophobicContact CD1-CG1 3.65Å; F1251-I1256 HydrophobicContact CE1-CG1 3.93Å; F1251-L1259 HydrophobicContact CE1-CD1 4.03Å; F1251-L1259 HydrophobicContact CZ-CD1 4.21Å
1252P68.7Low59.2Low63.8 Ų63.867.7 Ų67.741%0.41437%0.371SS..  trans-65138.9-176.5-3.47.1000112.7E1254 Q1255 I1256P1252-E1254 VanDerWaalsContact C-N 3.32Å; P1252-E1254 PolarHBondContact O-N 3.19Å; P1252-E1254 VanDerWaalsContact O-N 3.12Å; P1252-Q1255 HydrophobicContact CB-CB 4.43Å; P1252-Q1255 HydrophobicContact CB-CG 4.15Å; P1252-Q1255 HydrophobicContact CG-CB 4.04Å; P1252-Q1255 VanDerWaalsContact CG-CD 3.46Å; P1252-Q1255 HydrophobicContact CG-CG 4.04Å; P1252-Q1255 WeakPolarHBondContact O-CB 3.28Å; P1252-Q1255 PolarHBondContact O-N 3.11Å; P1252-Q1255 VanDerWaalsContact O-N 3.1Å; P1252-I1256 PolarHBondContact O-N 3.1Å
1253F73.7Confident61.3Low43.2 Ų43.266 Ų6619%0.18936%0.359CS..Hα-helixtrans-60.5-36.2-179.8-177.6-116000113.2C1204 M1243 F1251 Q1255 I1256 Q1257 L1297 Y1300C1204-F1253 HydrophobicContact CB-CE2 4.01Å; C1204-F1253 WeakPolarHBondContact O-CD2 3.19Å; C1204-F1253 WeakPolarHBondContact O-CE2 3.26Å; M1243-F1253 HydrophobicContact CE-CB 4.28Å; M1243-F1253 HydrophobicContact CE-CD2 4.08Å; M1243-F1253 HydrophobicContact CE-CG 4.14Å; F1251-F1253 PolarHBondContact O-N 3.41Å; F1253-Q1255 VanDerWaalsContact C-N 3.3Å; F1253-Q1255 PolarHBondContact O-N 3.22Å; F1253-I1256 WeakPolarHBondContact O-CA 3.35Å; F1253-I1256 WeakPolarHBondContact O-CB 3.36Å; F1253-I1256 PolarHBondContact O-N 3.22Å; F1253-I1256 VanDerWaalsContact O-N 3.09Å; F1253-Q1257 VanDerWaalsContact CD1-CD 3.41Å; F1253-Q1257 HydrophobicContact CD1-CG 4.19Å; F1253-Q1257 VanDerWaalsContact CD1-OE1 3.24Å; F1253-Q1257 HydrophobicContact CE1-CG 3.84Å; F1253-Q1257 VanDerWaalsContact CE1-NE2 3.26Å; F1253-Q1257 HydrophobicContact CE2-CG 4.32Å; F1253-Q1257 HydrophobicContact CZ-CG 3.93Å; F1253-Q1257 WeakPolarHBondContact O-CG 3.32Å; F1253-Q1257 PolarHBondContact O-N 2.93Å; F1253-L1297 HydrophobicContact CZ-CB 4.24Å; F1253-L1297 HydrophobicContact CZ-CD2 4.28Å; F1253-L1297 VanDerWaalsContact CZ-O 3.3Å; F1253-L1297 WeakPolarHBondContact CZ-O 3.29Å; F1253-Y1300 HydrophobicContact CD1-CD1 4.28Å; F1253-Y1300 AromaticContact CE1-CD1 3.87Å; F1253-Y1300 HydrophobicContact CE1-CD1 3.87Å; F1253-Y1300 HydrophobicContact CE1-CG 4.34Å
1254E75.5Confident63.5Low136.6 Ų136.662.2 Ų62.264%0.63834%0.343SS*.Hα-helixtrans-57.9-38174.7-66.3176-172.600112.4P1252 I1256 Q1257 Q1258P1252-E1254 VanDerWaalsContact C-N 3.32Å; P1252-E1254 PolarHBondContact O-N 3.19Å; P1252-E1254 VanDerWaalsContact O-N 3.12Å; E1254-I1256 VanDerWaalsContact C-N 3.32Å; E1254-I1256 PolarHBondContact O-N 3.28Å; E1254-Q1257 PolarHBondContact O-N 3.13Å; E1254-Q1258 WeakPolarHBondContact O-CB 3.34Å; E1254-Q1258 PolarHBondContact O-N 3.1Å
1255Q76.3Confident65.9Low55.6 Ų55.656.7 Ų56.726%0.2631%0.313SS..Hα-helixtrans-68.8-31.8176.2-72.4-175.4-5.900111.8Q1142 F1251 P1252 F1253 L1259 E1710Q1142-Q1255 PolarHBondContact NE2-O 3.2Å; F1251-Q1255 HydrophobicContact CD1-CB 4.35Å; F1251-Q1255 HydrophobicContact CE1-CB 3.69Å; F1251-Q1255 HydrophobicContact CE2-CB 4.49Å; F1251-Q1255 VanDerWaalsContact CE2-OE1 3.23Å; F1251-Q1255 HydrophobicContact CZ-CB 3.78Å; F1251-Q1255 VanDerWaalsContact CZ-OE1 3.3Å; P1252-Q1255 HydrophobicContact CB-CB 4.43Å; P1252-Q1255 HydrophobicContact CB-CG 4.15Å; P1252-Q1255 HydrophobicContact CG-CB 4.04Å; P1252-Q1255 VanDerWaalsContact CG-CD 3.46Å; P1252-Q1255 HydrophobicContact CG-CG 4.04Å; P1252-Q1255 WeakPolarHBondContact O-CB 3.28Å; P1252-Q1255 PolarHBondContact O-N 3.11Å; P1252-Q1255 VanDerWaalsContact O-N 3.1Å; F1253-Q1255 VanDerWaalsContact C-N 3.3Å; F1253-Q1255 PolarHBondContact O-N 3.22Å; Q1255-L1259 VanDerWaalsContact O-CB 3.29Å; Q1255-L1259 WeakPolarHBondContact O-CB 3.28Å; Q1255-L1259 WeakPolarHBondContact O-CG 3.19Å; Q1255-L1259 PolarHBondContact O-N 3.1Å; Q1255-L1259 VanDerWaalsContact O-N 3.1Å; Q1255-E1710 PolarHBondContact NE2-OE1 3.04Å
1256I77.1Confident68.1Low3.4 Ų3.449 Ų492%0.01728%0.28CS..Hα-helixtrans-69.5-45.9173.3-58.5177.3000110L1156 L1203 L1206 F1251 P1252 F1253 E1254 Q1258 L1259 L1260L1156-I1256 HydrophobicContact CD1-CG2 4.45Å; L1203-I1256 WeakPolarHBondContact O-CD1 3.35Å; L1206-I1256 HydrophobicContact CD1-CD1 4.13Å; F1251-I1256 HydrophobicContact CD1-CD1 4.23Å; F1251-I1256 HydrophobicContact CD1-CG1 3.65Å; F1251-I1256 HydrophobicContact CE1-CG1 3.93Å; P1252-I1256 PolarHBondContact O-N 3.1Å; F1253-I1256 WeakPolarHBondContact O-CA 3.35Å; F1253-I1256 WeakPolarHBondContact O-CB 3.36Å; F1253-I1256 PolarHBondContact O-N 3.22Å; F1253-I1256 VanDerWaalsContact O-N 3.09Å; E1254-I1256 VanDerWaalsContact C-N 3.32Å; E1254-I1256 PolarHBondContact O-N 3.28Å; I1256-Q1258 VanDerWaalsContact C-N 3.29Å; I1256-Q1258 PolarHBondContact O-N 3.13Å; I1256-L1259 CarbonylContact O-C 3.43Å; I1256-L1259 WeakPolarHBondContact O-CA 3.39Å; I1256-L1259 VanDerWaalsContact O-CB 3.31Å; I1256-L1259 WeakPolarHBondContact O-CB 3.21Å; I1256-L1259 PolarHBondContact O-N 3.11Å; I1256-L1259 VanDerWaalsContact O-N 3.13Å; I1256-L1260 HydrophobicContact CG2-CD1 4.26Å; I1256-L1260 HydrophobicContact CG2-CG 4.34Å; I1256-L1260 VanDerWaalsContact O-CG 3.3Å; I1256-L1260 WeakPolarHBondContact O-CG 3.38Å; I1256-L1260 PolarHBondContact O-N 3.23Å
1257Q80.5Confident70.3Confident1.6 Ų1.646.3 Ų46.31%0.00726%0.259CS..Hα-helixtrans-59.7-39.7176.6-70.2177.8-41.900112.3F1253 E1254 L1259 L1260 R1261 L1297 F1298 Y1300 N1302F1253-Q1257 VanDerWaalsContact CD1-CD 3.41Å; F1253-Q1257 HydrophobicContact CD1-CG 4.19Å; F1253-Q1257 VanDerWaalsContact CD1-OE1 3.24Å; F1253-Q1257 HydrophobicContact CE1-CG 3.84Å; F1253-Q1257 VanDerWaalsContact CE1-NE2 3.26Å; F1253-Q1257 HydrophobicContact CE2-CG 4.32Å; F1253-Q1257 HydrophobicContact CZ-CG 3.93Å; F1253-Q1257 WeakPolarHBondContact O-CG 3.32Å; F1253-Q1257 PolarHBondContact O-N 2.93Å; E1254-Q1257 PolarHBondContact O-N 3.13Å; Q1257-L1259 VanDerWaalsContact C-N 3.34Å; Q1257-L1260 PolarHBondContact O-N 3.28Å; Q1257-R1261 WeakPolarHBondContact O-CB 3.32Å; Q1257-R1261 PolarHBondContact O-N 3.21Å; Q1257-L1297 PolarHBondContact NE2-O 3.08Å; Q1257-F1298 PolarHBondContact NE2-O 3Å; Q1257-Y1300 PolarHBondContact NE2-O 3.26Å; Q1257-N1302 VanDerWaalsContact CB-ND2 3.31Å; Q1257-N1302 WeakPolarHBondContact CB-ND2 3.36Å; Q1257-N1302 PolarHBondContact NE2-ND2 3.2Å; Q1257-N1302 PolarHBondContact OE1-ND2 2.96Å
1258Q80.1Confident72.5Confident50.4 Ų50.440 Ų4024%0.23623%0.226CC..Hα-helixtrans-63.6-41.3172.3178166.816.200111.9Q1140 E1254 I1256 R1261 H1262Q1140-Q1258 PolarHBondContact O-NE2 3.07Å; E1254-Q1258 WeakPolarHBondContact O-CB 3.34Å; E1254-Q1258 PolarHBondContact O-N 3.1Å; I1256-Q1258 VanDerWaalsContact C-N 3.29Å; I1256-Q1258 PolarHBondContact O-N 3.13Å; Q1258-R1261 VanDerWaalsContact CG-NH2 3.32Å; Q1258-R1261 WeakPolarHBondContact O-CB 3.32Å; Q1258-R1261 PolarHBondContact O-N 3.03Å; Q1258-H1262 WeakPolarHBondContact CG-CE1 3.21Å; Q1258-H1262 PolarHBondContact NE2-CE1 3.13Å; Q1258-H1262 VanDerWaalsContact NE2-CE1 3.34Å; Q1258-H1262 VanDerWaalsContact O-CG 3.24Å; Q1258-H1262 PolarHBondContact O-N 3.02Å; Q1258-H1262 PolarHBondContact O-ND1 3.1Å
1259L80Confident74.8Confident1.8 Ų1.834 Ų341%0.00919%0.185CC..Hα-helixtrans-63.9-44.2176.2-150.789000112.2A868 Q1142 L1144 I1152 Y1153 L1156 F1251 Q1255 I1256 Q1257 R1261 H1262 L1263A868-L1259 HydrophobicContact CB-CD1 3.72Å; A868-L1259 HydrophobicContact CB-CD2 3.9Å; Q1142-L1259 VanDerWaalsContact OE1-CD2 3.23Å; L1144-L1259 HydrophobicContact CD1-CD1 4.35Å; L1144-L1259 HydrophobicContact CD1-CD2 4.12Å; L1144-L1259 HydrophobicContact CD2-CD1 4.25Å; L1144-L1259 HydrophobicContact CD2-CD2 4.24Å; I1152-L1259 HydrophobicContact CG2-CD2 4.38Å; Y1153-L1259 HydrophobicContact CD2-CD1 3.53Å; Y1153-L1259 HydrophobicContact CD2-CD2 4.16Å; Y1153-L1259 HydrophobicContact CD2-CG 4.13Å; Y1153-L1259 HydrophobicContact CE2-CD1 4.18Å; Y1153-L1259 HydrophobicContact CG-CD1 4.44Å; L1156-L1259 HydrophobicContact CD1-CD2 3.92Å; L1156-L1259 HydrophobicContact CD1-CG 4.46Å; F1251-L1259 HydrophobicContact CE1-CD1 4.03Å; F1251-L1259 HydrophobicContact CZ-CD1 4.21Å; Q1255-L1259 VanDerWaalsContact O-CB 3.29Å; Q1255-L1259 WeakPolarHBondContact O-CB 3.28Å; Q1255-L1259 WeakPolarHBondContact O-CG 3.19Å; Q1255-L1259 PolarHBondContact O-N 3.1Å; Q1255-L1259 VanDerWaalsContact O-N 3.1Å; I1256-L1259 CarbonylContact O-C 3.43Å; I1256-L1259 WeakPolarHBondContact O-CA 3.39Å; I1256-L1259 VanDerWaalsContact O-CB 3.31Å; I1256-L1259 WeakPolarHBondContact O-CB 3.21Å; I1256-L1259 PolarHBondContact O-N 3.11Å; I1256-L1259 VanDerWaalsContact O-N 3.13Å; Q1257-L1259 VanDerWaalsContact C-N 3.34Å; L1259-R1261 VanDerWaalsContact C-N 3.26Å; L1259-R1261 PolarHBondContact O-N 2.95Å; L1259-H1262 PolarHBondContact O-N 3.15Å; L1259-L1263 HydrophobicContact CD2-CD1 3.86Å; L1259-L1263 HydrophobicContact CG-CD1 4.21Å; L1259-L1263 WeakPolarHBondContact O-CB 3.24Å; L1259-L1263 WeakPolarHBondContact O-CG 3.31Å; L1259-L1263 PolarHBondContact O-N 3.31Å
1260L80.8Confident76.6Confident1.4 Ų1.434.5 Ų34.51%0.00718%0.178CC..Hα-helixtrans-60.7-37.3174.3-65.3172.4000111.2L1156 I1200 I1256 Q1257 G1264 V1265 F1298L1156-L1260 HydrophobicContact CD1-CD2 3.99Å; L1156-L1260 HydrophobicContact CD2-CD2 3.92Å; L1156-L1260 HydrophobicContact CG-CD2 4.47Å; I1200-L1260 HydrophobicContact CG2-CD2 4.42Å; I1256-L1260 HydrophobicContact CG2-CD1 4.26Å; I1256-L1260 HydrophobicContact CG2-CG 4.34Å; I1256-L1260 VanDerWaalsContact O-CG 3.3Å; I1256-L1260 WeakPolarHBondContact O-CG 3.38Å; I1256-L1260 PolarHBondContact O-N 3.23Å; Q1257-L1260 PolarHBondContact O-N 3.28Å; L1260-G1264 PolarHBondContact O-N 3.04Å; L1260-V1265 HydrophobicContact CB-CB 4.25Å; L1260-V1265 HydrophobicContact CB-CG2 3.87Å; L1260-V1265 HydrophobicContact CD2-CB 4.49Å; L1260-V1265 HydrophobicContact CD2-CG2 3.68Å; L1260-V1265 HydrophobicContact CG-CG2 4.36Å; L1260-V1265 WeakPolarHBondContact O-CB 3.35Å; L1260-V1265 VanDerWaalsContact O-CG2 3.26Å; L1260-V1265 WeakPolarHBondContact O-CG2 3.3Å; L1260-V1265 PolarHBondContact O-N 3.2Å; L1260-V1265 VanDerWaalsContact O-N 3.07Å; L1260-F1298 HydrophobicContact CB-CD2 4.06Å; L1260-F1298 HydrophobicContact CB-CE2 4.25Å
1261R81.6Confident77.7Confident42.6 Ų42.634.9 Ų34.916%0.16117%0.172CC..Hα-helixtrans-63.9-49.4174.5178.1179.658.6-122.410.3110.9Q1257 Q1258 L1259 L1263 G1264 F1298 N1305 L1308Q1257-R1261 WeakPolarHBondContact O-CB 3.32Å; Q1257-R1261 PolarHBondContact O-N 3.21Å; Q1258-R1261 VanDerWaalsContact CG-NH2 3.32Å; Q1258-R1261 WeakPolarHBondContact O-CB 3.32Å; Q1258-R1261 PolarHBondContact O-N 3.03Å; L1259-R1261 VanDerWaalsContact C-N 3.26Å; L1259-R1261 PolarHBondContact O-N 2.95Å; R1261-L1263 VanDerWaalsContact C-N 3.3Å; R1261-L1263 PolarHBondContact O-N 3.22Å; R1261-G1264 PolarHBondContact O-N 3.15Å; R1261-G1264 VanDerWaalsContact O-N 3.11Å; R1261-F1298 HydrophobicContact CB-CE2 3.89Å; R1261-F1298 HydrophobicContact CB-CZ 4.08Å; R1261-F1298 HydrophobicContact CG-CZ 4.45Å; R1261-N1305 VanDerWaalsContact CD-OD1 3.3Å; R1261-N1305 WeakPolarHBondContact CD-OD1 3.3Å; R1261-N1305 PolarHBondContact NH1-OD1 3.05Å; R1261-L1308 HydrophobicContact CG-CD1 3.73Å
1262H79.9Confident78.7Confident31 Ų3134.3 Ų34.314%0.14417%0.169CC..Hα-helixtrans-65.2-31.8-179.7-64.1160.6000113.1Q863 Q1140 Q1258 L1259 G1264Q863-H1262 PolarHBondContact OE1-O 3.3Å; Q1140-H1262 PolarHBondContact O-CE1 2.98Å; Q1140-H1262 PolarHBondContact O-NE2 3.15Å; Q1140-H1262 VanDerWaalsContact O-NE2 3.16Å; Q1258-H1262 WeakPolarHBondContact CG-CE1 3.21Å; Q1258-H1262 PolarHBondContact NE2-CE1 3.13Å; Q1258-H1262 VanDerWaalsContact NE2-CE1 3.34Å; Q1258-H1262 VanDerWaalsContact O-CG 3.24Å; Q1258-H1262 PolarHBondContact O-N 3.02Å; Q1258-H1262 PolarHBondContact O-ND1 3.1Å; L1259-H1262 PolarHBondContact O-N 3.15Å; H1262-G1264 VanDerWaalsContact C-N 3.27Å; H1262-G1264 PolarHBondContact O-N 3.16Å
1263L80.3Confident79Confident28.6 Ų28.633.3 Ų33.315%0.1516%0.16CC..THydrogen-bonded Turntrans-78.7-5.2175-69.5171.2000113.6Y1153 L1156 K1157 L1160 L1259 R1261 V1265Y1153-L1263 HydrophobicContact CD2-CD1 4.38Å; Y1153-L1263 HydrophobicContact CD2-CD2 4.46Å; Y1153-L1263 HydrophobicContact CE2-CD1 4.48Å; Y1153-L1263 HydrophobicContact CE2-CD2 3.82Å; Y1153-L1263 HydrophobicContact CE2-CG 4.43Å; L1156-L1263 HydrophobicContact CB-CD1 3.82Å; K1157-L1263 HydrophobicContact CB-CD2 4.22Å; K1157-L1263 HydrophobicContact CG-CD2 4.32Å; L1160-L1263 HydrophobicContact CD1-CB 3.65Å; L1160-L1263 HydrophobicContact CD1-CD1 3.82Å; L1160-L1263 HydrophobicContact CD1-CG 4.32Å; L1259-L1263 HydrophobicContact CD2-CD1 3.86Å; L1259-L1263 HydrophobicContact CG-CD1 4.21Å; L1259-L1263 WeakPolarHBondContact O-CB 3.24Å; L1259-L1263 WeakPolarHBondContact O-CG 3.31Å; L1259-L1263 PolarHBondContact O-N 3.31Å; R1261-L1263 VanDerWaalsContact C-N 3.3Å; R1261-L1263 PolarHBondContact O-N 3.22Å; L1263-V1265 HydrophobicContact CB-CG2 4.4Å
1264G80Confident79.1Confident9.4 Ų9.435.2 Ų35.210%0.09717%0.173CC..THydrogen-bonded Turntrans73.830177.700000114.1L1260 R1261 H1262 H1266 T1267 I1268L1260-G1264 PolarHBondContact O-N 3.04Å; R1261-G1264 PolarHBondContact O-N 3.15Å; R1261-G1264 VanDerWaalsContact O-N 3.11Å; H1262-G1264 VanDerWaalsContact C-N 3.27Å; H1262-G1264 PolarHBondContact O-N 3.16Å; G1264-H1266 VanDerWaalsContact C-N 3.27Å; G1264-H1266 PolarHBondContact O-N 3.32Å; G1264-H1266 VanDerWaalsContact O-N 3.16Å; G1264-T1267 WeakPolarHBondContact O-CB 3.49Å; G1264-T1267 PolarHBondContact O-N 3.42Å; G1264-T1267 VanDerWaalsContact O-N 3.11Å; G1264-T1267 PolarHBondContact O-OG1 2.97Å; G1264-I1268 PolarHBondContact O-N 3.25Å
1265V82.4Confident78.8Confident2.2 Ų2.230 Ų301%0.01315%0.149CC..Hα-helixtrans-56.4-41.4-177.1175.70000112.4L1160 L1260 L1263 T1267 I1268 L1269 I1294L1160-V1265 HydrophobicContact CD1-CG2 3.29Å; L1160-V1265 HydrophobicContact CD2-CB 4.42Å; L1160-V1265 HydrophobicContact CD2-CG1 4.31Å; L1160-V1265 HydrophobicContact CD2-CG2 3.63Å; L1160-V1265 HydrophobicContact CG-CG2 4.07Å; L1260-V1265 HydrophobicContact CB-CB 4.25Å; L1260-V1265 HydrophobicContact CB-CG2 3.87Å; L1260-V1265 HydrophobicContact CD2-CB 4.49Å; L1260-V1265 HydrophobicContact CD2-CG2 3.68Å; L1260-V1265 HydrophobicContact CG-CG2 4.36Å; L1260-V1265 WeakPolarHBondContact O-CB 3.35Å; L1260-V1265 VanDerWaalsContact O-CG2 3.26Å; L1260-V1265 WeakPolarHBondContact O-CG2 3.3Å; L1260-V1265 PolarHBondContact O-N 3.2Å; L1260-V1265 VanDerWaalsContact O-N 3.07Å; L1263-V1265 HydrophobicContact CB-CG2 4.4Å; V1265-T1267 VanDerWaalsContact C-N 3.28Å; V1265-T1267 PolarHBondContact O-N 3.01Å; V1265-I1268 PolarHBondContact O-N 3.16Å; V1265-I1268 VanDerWaalsContact O-N 3.12Å; V1265-L1269 HydrophobicContact CG1-CD1 3.64Å; V1265-L1269 HydrophobicContact CG1-CG 3.84Å; V1265-L1269 WeakPolarHBondContact O-CB 3.37Å; V1265-L1269 VanDerWaalsContact O-CG 3.31Å; V1265-L1269 WeakPolarHBondContact O-CG 3.41Å; V1265-L1269 PolarHBondContact O-N 3.02Å; V1265-I1294 HydrophobicContact CG1-CG2 4.31Å
1266H81Confident78.2Confident31.8 Ų31.837.6 Ų37.615%0.14718%0.175CC..Hα-helixtrans-59-30.6179.162.1-79.7000113.5G1264 K1270 F1298 L1308 L1309G1264-H1266 VanDerWaalsContact C-N 3.27Å; G1264-H1266 PolarHBondContact O-N 3.32Å; G1264-H1266 VanDerWaalsContact O-N 3.16Å; H1266-K1270 VanDerWaalsContact O-CB 3.25Å; H1266-K1270 WeakPolarHBondContact O-CB 3.19Å; H1266-K1270 PolarHBondContact O-N 3.2Å; H1266-K1270 VanDerWaalsContact O-N 3.14Å; H1266-F1298 HydrophobicContact CB-CE1 4.26Å; H1266-F1298 HydrophobicContact CB-CZ 4.38Å; H1266-L1308 HydrophobicContact CB-CD2 4.12Å; H1266-L1308 WeakPolarHBondContact CD2-CD2 3.45Å; H1266-L1308 VanDerWaalsContact NE2-CD2 3.31Å; H1266-L1308 WeakPolarHBondContact NE2-CD2 3.49Å; H1266-L1309 HydrophobicContact CB-CD2 4.34Å
1267T80.7Confident77.3Confident49.8 Ų49.840 Ų4031%0.30619%0.186SC..Hα-helixtrans-76.8-41.7175.860.60000111.6G1264 V1265 K1270 E1271G1264-T1267 WeakPolarHBondContact O-CB 3.49Å; G1264-T1267 PolarHBondContact O-N 3.42Å; G1264-T1267 VanDerWaalsContact O-N 3.11Å; G1264-T1267 PolarHBondContact O-OG1 2.97Å; V1265-T1267 VanDerWaalsContact C-N 3.28Å; V1265-T1267 PolarHBondContact O-N 3.01Å; T1267-K1270 WeakPolarHBondContact O-CB 3.19Å; T1267-K1270 PolarHBondContact O-N 3.19Å; T1267-E1271 WeakPolarHBondContact O-CG 3.49Å; T1267-E1271 PolarHBondContact O-N 3.13Å
1268I77.7Confident76.1Confident1.8 Ų1.847.8 Ų47.81%0.00922%0.219CC..Hα-helixtrans-63.5-47.7178-59.2171.1000110.2L1160 L1163 R1164 I1167 G1264 V1265 K1270 E1271 L1272L1160-I1268 HydrophobicContact CB-CD1 3.92Å; L1160-I1268 HydrophobicContact CD2-CD1 4.13Å; L1160-I1268 HydrophobicContact CG-CD1 4.41Å; L1163-I1268 HydrophobicContact CD2-CG2 3.99Å; L1163-I1268 HydrophobicContact CG-CG2 4.12Å; R1164-I1268 HydrophobicContact CB-CD1 4.46Å; I1167-I1268 HydrophobicContact CD1-CG2 3.47Å; I1167-I1268 VanDerWaalsContact CD1-CG2 3.47Å; I1167-I1268 WeakPolarHBondContact CD1-O 3.49Å; G1264-I1268 PolarHBondContact O-N 3.25Å; V1265-I1268 PolarHBondContact O-N 3.16Å; V1265-I1268 VanDerWaalsContact O-N 3.12Å; I1268-K1270 VanDerWaalsContact C-N 3.26Å; I1268-K1270 PolarHBondContact O-N 3.2Å; I1268-E1271 PolarHBondContact O-N 3.23Å; I1268-E1271 VanDerWaalsContact O-N 3.16Å; I1268-L1272 PolarHBondContact O-N 3.23Å
1269L81.7Confident74.6Confident1.4 Ų1.449.5 Ų49.51%0.00724%0.236CC..Hα-helixtrans-64.9-32.3178-63.3-174.5000112L1163 L1197 V1265 L1272 L1273 T1291 I1294 L1295L1163-L1269 HydrophobicContact CD2-CD2 4.22Å; L1197-L1269 HydrophobicContact CD2-CD2 4.12Å; V1265-L1269 HydrophobicContact CG1-CD1 3.64Å; V1265-L1269 HydrophobicContact CG1-CG 3.84Å; V1265-L1269 WeakPolarHBondContact O-CB 3.37Å; V1265-L1269 VanDerWaalsContact O-CG 3.31Å; V1265-L1269 WeakPolarHBondContact O-CG 3.41Å; V1265-L1269 PolarHBondContact O-N 3.02Å; L1269-L1272 HydrophobicContact CD2-CD2 4.48Å; L1269-L1272 WeakPolarHBondContact O-CB 3.03Å; L1269-L1272 PolarHBondContact O-N 3.1Å; L1269-L1273 WeakPolarHBondContact O-CB 3.16Å; L1269-L1273 VanDerWaalsContact O-CG 3.31Å; L1269-L1273 WeakPolarHBondContact O-CG 3.28Å; L1269-L1273 PolarHBondContact O-N 3.07Å; L1269-T1291 HydrophobicContact CB-CG2 3.86Å; L1269-T1291 HydrophobicContact CD1-CG2 4.36Å; L1269-T1291 HydrophobicContact CD2-CG2 3.92Å; L1269-T1291 HydrophobicContact CG-CG2 4.23Å; L1269-I1294 HydrophobicContact CD1-CB 3.96Å; L1269-I1294 HydrophobicContact CD1-CG2 3.63Å; L1269-L1295 HydrophobicContact CB-CD2 4.27Å; L1269-L1295 HydrophobicContact CD1-CD2 3.85Å; L1269-L1295 HydrophobicContact CD1-CG 4.06Å
1270K79.4Confident73.4Confident73 Ų7355.5 Ų55.532%0.31727%0.273SS..Hα-helixtrans-64.3-44.8172166.6-169.5173.8-170.10111.6H1266 T1267 I1268 L1272 L1273 N1274 Y1312H1266-K1270 VanDerWaalsContact O-CB 3.25Å; H1266-K1270 WeakPolarHBondContact O-CB 3.19Å; H1266-K1270 PolarHBondContact O-N 3.2Å; H1266-K1270 VanDerWaalsContact O-N 3.14Å; T1267-K1270 WeakPolarHBondContact O-CB 3.19Å; T1267-K1270 PolarHBondContact O-N 3.19Å; I1268-K1270 VanDerWaalsContact C-N 3.26Å; I1268-K1270 PolarHBondContact O-N 3.2Å; K1270-L1272 VanDerWaalsContact C-N 3.31Å; K1270-L1273 PolarHBondContact O-N 3.03Å; K1270-N1274 WeakPolarHBondContact CG-ND2 3.26Å; K1270-N1274 VanDerWaalsContact O-CG 3.28Å; K1270-N1274 PolarHBondContact O-N 3.12Å; K1270-N1274 VanDerWaalsContact O-N 3.09Å; K1270-N1274 PolarHBondContact O-ND2 3.12Å; K1270-Y1312 HydrophobicContact CD-CD1 4.38Å; K1270-Y1312 HydrophobicContact CD-CE1 3.65Å; K1270-Y1312 VanDerWaalsContact CE-CE1 3.48Å; K1270-Y1312 PolarHBondContact NZ-OH 3.23Å; K1270-Y1312 VanDerWaalsContact NZ-OH 3.11Å
1271E76.4Confident72.5Confident86.6 Ų86.658.7 Ų58.741%0.40529%0.29SS..Hα-helixtrans-62.2-43.2177.3-73.6169.3-176.600110.6I1167 T1267 I1268 L1273 N1274 I1275I1167-E1271 HydrophobicContact CG2-CB 3.83Å; T1267-E1271 WeakPolarHBondContact O-CG 3.49Å; T1267-E1271 PolarHBondContact O-N 3.13Å; I1268-E1271 PolarHBondContact O-N 3.23Å; I1268-E1271 VanDerWaalsContact O-N 3.16Å; E1271-L1273 VanDerWaalsContact C-N 3.35Å; E1271-L1273 PolarHBondContact O-N 3.03Å; E1271-N1274 PolarHBondContact O-N 3.2Å; E1271-N1274 VanDerWaalsContact O-N 3.13Å; E1271-I1275 WeakPolarHBondContact O-CG1 3.32Å; E1271-I1275 PolarHBondContact O-N 3.08Å
1272L78.8Confident71.9Confident4.2 Ų4.261.8 Ų61.82%0.02231%0.313CS..Hα-helixtrans-57.5-45.4174.6-173.460.6000112.7L1163 I1167 L1197 I1268 L1269 K1270 N1274 I1275 F1277 I1287 T1291L1163-L1272 HydrophobicContact CD1-CD2 4.47Å; I1167-L1272 HydrophobicContact CD1-CB 3.73Å; I1167-L1272 HydrophobicContact CD1-CD1 4.25Å; I1167-L1272 HydrophobicContact CD1-CG 4.4Å; I1167-L1272 HydrophobicContact CG1-CB 4.09Å; I1167-L1272 HydrophobicContact CG1-CD1 3.81Å; I1167-L1272 HydrophobicContact CG1-CG 4.44Å; L1197-L1272 HydrophobicContact CD1-CD2 4.39Å; L1197-L1272 HydrophobicContact CD2-CD2 4.47Å; I1268-L1272 PolarHBondContact O-N 3.23Å; L1269-L1272 HydrophobicContact CD2-CD2 4.48Å; L1269-L1272 WeakPolarHBondContact O-CB 3.03Å; L1269-L1272 PolarHBondContact O-N 3.1Å; K1270-L1272 VanDerWaalsContact C-N 3.31Å; L1272-N1274 VanDerWaalsContact C-N 3.34Å; L1272-N1274 PolarHBondContact O-N 3.16Å; L1272-I1275 HydrophobicContact CD1-CD1 4.19Å; L1272-I1275 WeakPolarHBondContact O-CB 3.42Å; L1272-I1275 PolarHBondContact O-N 3.14Å; L1272-F1277 WeakPolarHBondContact O-CZ 3.26Å; L1272-I1287 HydrophobicContact CD1-CG2 4.29Å; L1272-I1287 HydrophobicContact CD2-CG2 4.1Å; L1272-I1287 HydrophobicContact CG-CG2 4.37Å; L1272-T1291 HydrophobicContact CD2-CG2 4.25Å; L1272-T1291 VanDerWaalsContact CD2-OG1 3.25Å; L1272-T1291 WeakPolarHBondContact CD2-OG1 3.25Å
1273L75.8Confident71.3Confident43 Ų4362.7 Ų62.723%0.22532%0.321CS..Hα-helixtrans-71.6-24.6179.2-71174.7000113.8L1269 K1270 E1271 I1275 V1288 T1291 K1292 L1295 F1316L1269-L1273 WeakPolarHBondContact O-CB 3.16Å; L1269-L1273 VanDerWaalsContact O-CG 3.31Å; L1269-L1273 WeakPolarHBondContact O-CG 3.28Å; L1269-L1273 PolarHBondContact O-N 3.07Å; K1270-L1273 PolarHBondContact O-N 3.03Å; E1271-L1273 VanDerWaalsContact C-N 3.35Å; E1271-L1273 PolarHBondContact O-N 3.03Å; L1273-I1275 VanDerWaalsContact C-N 3.31Å; L1273-I1275 PolarHBondContact O-N 2.96Å; L1273-V1288 HydrophobicContact CD2-CG1 4.13Å; L1273-T1291 HydrophobicContact CD1-CG2 4.1Å; L1273-T1291 HydrophobicContact CD2-CG2 3.92Å; L1273-T1291 HydrophobicContact CG-CG2 3.78Å; L1273-K1292 HydrophobicContact CD2-CG 4.45Å; L1273-L1295 HydrophobicContact CD1-CD1 3.9Å; L1273-F1316 HydrophobicContact CD1-CE1 3.8Å; L1273-F1316 HydrophobicContact CD1-CZ 4.04Å
1274N75.2Confident70.8Confident84 Ų8462.1 Ų62.145%0.44932%0.317SS..Hα-helixtrans-81.2-9.6178.4-70-49.6000113.1K1270 E1271 L1272 R1276 K1315K1270-N1274 WeakPolarHBondContact CG-ND2 3.26Å; K1270-N1274 VanDerWaalsContact O-CG 3.28Å; K1270-N1274 PolarHBondContact O-N 3.12Å; K1270-N1274 VanDerWaalsContact O-N 3.09Å; K1270-N1274 PolarHBondContact O-ND2 3.12Å; E1271-N1274 PolarHBondContact O-N 3.2Å; E1271-N1274 VanDerWaalsContact O-N 3.13Å; L1272-N1274 VanDerWaalsContact C-N 3.34Å; L1272-N1274 PolarHBondContact O-N 3.16Å; N1274-R1276 PolarHBondContact O-N 3.27Å; N1274-K1315 PolarHBondContact OD1-NZ 3.1Å
1275I69.3Low70.4Confident26.6 Ų26.666.3 Ų66.314%0.13634%0.337CS..SBendtrans-62.1124.1175.4-63.3168.9000108.5I1167 M1174 E1271 L1272 L1273 F1277I1167-I1275 HydrophobicContact CG2-CD1 4.16Å; M1174-I1275 HydrophobicContact CE-CG2 4.4Å; E1271-I1275 WeakPolarHBondContact O-CG1 3.32Å; E1271-I1275 PolarHBondContact O-N 3.08Å; L1272-I1275 HydrophobicContact CD1-CD1 4.19Å; L1272-I1275 WeakPolarHBondContact O-CB 3.42Å; L1272-I1275 PolarHBondContact O-N 3.14Å; L1273-I1275 VanDerWaalsContact C-N 3.31Å; L1273-I1275 PolarHBondContact O-N 2.96Å; I1275-F1277 HydrophobicContact CB-CE1 4.09Å; I1275-F1277 HydrophobicContact CB-CE2 4.17Å; I1275-F1277 HydrophobicContact CB-CZ 3.71Å; I1275-F1277 HydrophobicContact CG2-CD1 4.23Å; I1275-F1277 HydrophobicContact CG2-CD2 3.98Å; I1275-F1277 HydrophobicContact CG2-CE1 3.73Å; I1275-F1277 HydrophobicContact CG2-CE2 3.95Å; I1275-F1277 HydrophobicContact CG2-CZ 3.89Å; I1275-F1277 WeakPolarHBondContact O-CD2 3.38Å; I1275-F1277 WeakPolarHBondContact O-CE2 3.3Å; I1275-F1277 PolarHBondContact O-N 3.28Å; I1275-F1277 VanDerWaalsContact O-N 3.11Å
1276R63.3Low69.9Low215.8 Ų215.869.4 Ų69.481%0.81435%0.351SS*.  trans-79.2103.3-177.6-155.6-178.5-83.8172.71110.3N1274 K1278N1274-R1276 PolarHBondContact O-N 3.27Å; R1276-K1278 PolarHBondContact O-N 2.88Å
1277F58.9Low69.7Low54 Ų5468 Ų6824%0.23735%0.345CS..  trans-84.8134.6177-60.6-81.9000111.8M1174 L1272 I1275 F1284 V1288M1174-F1277 HydrophobicContact CE-CB 4.44Å; M1174-F1277 HydrophobicContact CE-CD1 3.74Å; M1174-F1277 VanDerWaalsContact CE-CD1 3.48Å; M1174-F1277 HydrophobicContact CE-CE1 4.31Å; M1174-F1277 HydrophobicContact CE-CG 4.37Å; M1174-F1277 HydrophobicContact SD-CD1 4.19Å; M1174-F1277 HydrophobicContact SD-CE1 4.27Å; L1272-F1277 WeakPolarHBondContact O-CZ 3.26Å; I1275-F1277 HydrophobicContact CB-CE1 4.09Å; I1275-F1277 HydrophobicContact CB-CE2 4.17Å; I1275-F1277 HydrophobicContact CB-CZ 3.71Å; I1275-F1277 HydrophobicContact CG2-CD1 4.23Å; I1275-F1277 HydrophobicContact CG2-CD2 3.98Å; I1275-F1277 HydrophobicContact CG2-CE1 3.73Å; I1275-F1277 HydrophobicContact CG2-CE2 3.95Å; I1275-F1277 HydrophobicContact CG2-CZ 3.89Å; I1275-F1277 WeakPolarHBondContact O-CD2 3.38Å; I1275-F1277 WeakPolarHBondContact O-CE2 3.3Å; I1275-F1277 PolarHBondContact O-N 3.28Å; I1275-F1277 VanDerWaalsContact O-N 3.11Å; F1277-F1284 HydrophobicContact CB-CD1 4Å; F1277-F1284 HydrophobicContact CB-CE1 3.89Å; F1277-F1284 HydrophobicContact CD1-CB 4.02Å; F1277-F1284 AromaticContact CD1-CD1 3.62Å; F1277-F1284 HydrophobicContact CD1-CD1 3.89Å; F1277-F1284 HydrophobicContact CD1-CD2 4.34Å; F1277-F1284 AromaticContact CD1-CE1 3.86Å; F1277-F1284 HydrophobicContact CD1-CE1 4.01Å; F1277-F1284 AromaticContact CD1-CG 3.83Å; F1277-F1284 HydrophobicContact CD1-CG 4.13Å; F1277-F1284 HydrophobicContact CD1-CZ 4.41Å; F1277-F1284 AromaticContact CD2-CD1 3.5Å; F1277-F1284 HydrophobicContact CD2-CD1 3.5Å; F1277-F1284 AromaticContact CD2-CD2 3.92Å; F1277-F1284 HydrophobicContact CD2-CD2 3.92Å; F1277-F1284 AromaticContact CD2-CE1 3.16Å; F1277-F1284 HydrophobicContact CD2-CE1 3.16Å; F1277-F1284 AromaticContact CD2-CE2 3.62Å; F1277-F1284 HydrophobicContact CD2-CE2 3.62Å; F1277-F1284 AromaticContact CD2-CG 3.85Å; F1277-F1284 HydrophobicContact CD2-CG 3.85Å; F1277-F1284 AromaticContact CD2-CZ 3.22Å; F1277-F1284 HydrophobicContact CD2-CZ 3.22Å; F1277-F1284 HydrophobicContact CE1-CB 3.48Å; F1277-F1284 VanDerWaalsContact CE1-CB 3.48Å; F1277-F1284 AromaticContact CE1-CD1 3.64Å; F1277-F1284 HydrophobicContact CE1-CD1 3.79Å; F1277-F1284 VanDerWaalsContact CE1-CD1 3.47Å; F1277-F1284 AromaticContact CE1-CD2 3.76Å; F1277-F1284 HydrophobicContact CE1-CD2 3.76Å; F1277-F1284 AromaticContact CE1-CE1 3.81Å; F1277-F1284 HydrophobicContact CE1-CE1 4.01Å; F1277-F1284 HydrophobicContact CE1-CE2 4.42Å; F1277-F1284 AromaticContact CE1-CG 3.36Å; F1277-F1284 HydrophobicContact CE1-CG 3.84Å; F1277-F1284 HydrophobicContact CE2-CB 4.47Å; F1277-F1284 AromaticContact CE2-CD1 3.66Å; F1277-F1284 HydrophobicContact CE2-CD1 3.66Å; F1277-F1284 AromaticContact CE2-CD2 3.17Å; F1277-F1284 HydrophobicContact CE2-CD2 3.17Å; F1277-F1284 AromaticContact CE2-CE1 3.51Å; F1277-F1284 HydrophobicContact CE2-CE1 3.51Å; F1277-F1284 AromaticContact CE2-CE2 3Å; F1277-F1284 HydrophobicContact CE2-CE2 3Å; F1277-F1284 AromaticContact CE2-CG 3.49Å; F1277-F1284 HydrophobicContact CE2-CG 3.49Å; F1277-F1284 VanDerWaalsContact CE2-CG 3.49Å; F1277-F1284 AromaticContact CE2-CZ 3.17Å; F1277-F1284 HydrophobicContact CE2-CZ 3.17Å; F1277-F1284 AromaticContact CG-CD1 3.43Å; F1277-F1284 HydrophobicContact CG-CD1 3.43Å; F1277-F1284 VanDerWaalsContact CG-CD1 3.43Å; F1277-F1284 HydrophobicContact CG-CD2 4.44Å; F1277-F1284 AromaticContact CG-CE1 3.47Å; F1277-F1284 HydrophobicContact CG-CE1 3.47Å; F1277-F1284 VanDerWaalsContact CG-CE1 3.47Å; F1277-F1284 HydrophobicContact CG-CE2 4.49Å; F1277-F1284 AromaticContact CG-CG 3.93Å; F1277-F1284 HydrophobicContact CG-CG 3.93Å; F1277-F1284 HydrophobicContact CG-CZ 4.03Å; F1277-F1284 HydrophobicContact CZ-CB 3.67Å; F1277-F1284 AromaticContact CZ-CD1 3.71Å; F1277-F1284 HydrophobicContact CZ-CD1 4.08Å; F1277-F1284 AromaticContact CZ-CD2 3Å; F1277-F1284 HydrophobicContact CZ-CD2 3Å; F1277-F1284 HydrophobicContact CZ-CE1 4.06Å; F1277-F1284 AromaticContact CZ-CE2 3.43Å; F1277-F1284 HydrophobicContact CZ-CE2 3.43Å; F1277-F1284 VanDerWaalsContact CZ-CE2 3.43Å; F1277-F1284 AromaticContact CZ-CG 3.14Å; F1277-F1284 HydrophobicContact CZ-CG 3.14Å; F1277-F1284 AromaticContact CZ-CZ 3.94Å; F1277-F1284 HydrophobicContact CZ-CZ 3.94Å; F1277-V1288 HydrophobicContact CE2-CG2 4.23Å
1278K54.7Low69.6Low163.6 Ų163.666.7 Ų66.771%0.71134%0.337SS*.  trans-88.721.3170.1-74.5177.4-179.3166.40110.5H1175 R1276 T1280H1175-K1278 PolarHBondContact NE2-NZ 3.16Å; R1276-K1278 PolarHBondContact O-N 2.88Å; K1278-T1280 PolarHBondContact O-N 3.24Å
1279C49.6Very low69.5Low87.4 Ų87.469.5 Ų69.559%0.59135%0.35SS*.SBendtrans-90.399.7-169.9-68.90000114.6D1281 F1284C1279-D1281 VanDerWaalsContact CB-OD2 3.29Å; C1279-D1281 WeakPolarHBondContact CB-OD2 3.26Å; C1279-D1281 PolarHBondContact O-N 3.18Å; C1279-F1284 HydrophobicContact CB-CE2 4.46Å
1280T53.1Low69.2Low126.6 Ų126.670.2 Ų70.278%0.77735%0.354SS*.  trans-91.630.3177.850.60000112.7K1278K1278-T1280 PolarHBondContact O-N 3.24Å
1281D62.1Low69.3Low70 Ų7066.7 Ų66.737%0.37434%0.338SS..  trans-90.2130.1-177.1-63.2-31.6000111.5C1279 V1283 F1284 N1285C1279-D1281 VanDerWaalsContact CB-OD2 3.29Å; C1279-D1281 WeakPolarHBondContact CB-OD2 3.26Å; C1279-D1281 PolarHBondContact O-N 3.18Å; D1281-V1283 VanDerWaalsContact C-N 3.3Å; D1281-V1283 PolarHBondContact O-N 3.21Å; D1281-F1284 HydrophobicContact CB-CB 4.32Å; D1281-F1284 HydrophobicContact CB-CD2 3.53Å; D1281-F1284 VanDerWaalsContact CB-CD2 3.4Å; D1281-F1284 HydrophobicContact CB-CE2 4.08Å; D1281-F1284 HydrophobicContact CB-CG 4.38Å; D1281-F1284 PolarHBondContact O-N 3.22Å; D1281-F1284 VanDerWaalsContact O-N 3.11Å; D1281-F1284 WeakPolarHBondContact OD2-CD2 3.38Å; D1281-F1284 VanDerWaalsContact OD2-CE2 3.31Å; D1281-F1284 WeakPolarHBondContact OD2-CE2 3.35Å; D1281-N1285 PolarHBondContact O-N 3.21Å; D1281-N1285 VanDerWaalsContact O-N 3.15Å
1282V69.1Low69.5Low107.4 Ų107.462.9 Ų62.965%0.65132%0.32SS*.Hα-helixtrans-56.2-42.7178.8-179.70000111.5F1284 N1285 E1286V1282-F1284 VanDerWaalsContact C-N 3.3Å; V1282-F1284 PolarHBondContact O-N 3.21Å; V1282-N1285 PolarHBondContact O-N 3.08Å; V1282-E1286 WeakPolarHBondContact O-CG 3.45Å; V1282-E1286 PolarHBondContact O-N 3.15Å; V1282-E1286 VanDerWaalsContact O-N 3.1Å
1283V68.7Low69.5Low49 Ų4963.9 Ų63.930%0.29732%0.324SS..Hα-helixtrans-61.9-36.1-179.8-1780000111.9N1190 I1194 I1224 D1281 E1286 I1287N1190-V1283 HydrophobicContact CB-CG1 3.9Å; I1194-V1283 HydrophobicContact CD1-CB 4.48Å; I1194-V1283 HydrophobicContact CD1-CG1 3.53Å; I1224-V1283 HydrophobicContact CG2-CG2 4.28Å; D1281-V1283 VanDerWaalsContact C-N 3.3Å; D1281-V1283 PolarHBondContact O-N 3.21Å; V1283-E1286 WeakPolarHBondContact O-CB 3.35Å; V1283-E1286 PolarHBondContact O-N 3.3Å; V1283-I1287 HydrophobicContact CG1-CD1 4.49Å; V1283-I1287 WeakPolarHBondContact O-CG1 3.4Å; V1283-I1287 PolarHBondContact O-N 3.27Å; V1283-I1287 VanDerWaalsContact O-N 3.13Å
1284F69.8Low69.7Low17.2 Ų17.261.9 Ų61.98%0.07531%0.314CS..Hα-helixtrans-75.5-39.5179.1-85.7-69000112.3W1173 M1174 F1277 C1279 D1281 V1282 E1286 I1287 V1288W1173-F1284 HydrophobicContact CE3-CE1 4.31Å; W1173-F1284 HydrophobicContact CE3-CZ 4.32Å; W1173-F1284 HydrophobicContact CH2-CE1 4.16Å; W1173-F1284 AromaticContact CZ3-CE1 3.73Å; W1173-F1284 HydrophobicContact CZ3-CE1 3.73Å; W1173-F1284 AromaticContact CZ3-CZ 3.67Å; W1173-F1284 HydrophobicContact CZ3-CZ 4.13Å; M1174-F1284 HydrophobicContact CE-CE1 4.34Å; M1174-F1284 HydrophobicContact CE-CZ 4.43Å; M1174-F1284 HydrophobicContact SD-CE1 3.88Å; M1174-F1284 WeakPolarHBondContact SD-CE1 3.44Å; M1174-F1284 HydrophobicContact SD-CE2 4.14Å; M1174-F1284 HydrophobicContact SD-CZ 3.67Å; M1174-F1284 VanDerWaalsContact SD-CZ 3.59Å; M1174-F1284 WeakPolarHBondContact SD-CZ 3.33Å; F1277-F1284 HydrophobicContact CB-CD1 4Å; F1277-F1284 HydrophobicContact CB-CE1 3.89Å; F1277-F1284 HydrophobicContact CD1-CB 4.02Å; F1277-F1284 AromaticContact CD1-CD1 3.62Å; F1277-F1284 HydrophobicContact CD1-CD1 3.89Å; F1277-F1284 HydrophobicContact CD1-CD2 4.34Å; F1277-F1284 AromaticContact CD1-CE1 3.86Å; F1277-F1284 HydrophobicContact CD1-CE1 4.01Å; F1277-F1284 AromaticContact CD1-CG 3.83Å; F1277-F1284 HydrophobicContact CD1-CG 4.13Å; F1277-F1284 HydrophobicContact CD1-CZ 4.41Å; F1277-F1284 AromaticContact CD2-CD1 3.5Å; F1277-F1284 HydrophobicContact CD2-CD1 3.5Å; F1277-F1284 AromaticContact CD2-CD2 3.92Å; F1277-F1284 HydrophobicContact CD2-CD2 3.92Å; F1277-F1284 AromaticContact CD2-CE1 3.16Å; F1277-F1284 HydrophobicContact CD2-CE1 3.16Å; F1277-F1284 AromaticContact CD2-CE2 3.62Å; F1277-F1284 HydrophobicContact CD2-CE2 3.62Å; F1277-F1284 AromaticContact CD2-CG 3.85Å; F1277-F1284 HydrophobicContact CD2-CG 3.85Å; F1277-F1284 AromaticContact CD2-CZ 3.22Å; F1277-F1284 HydrophobicContact CD2-CZ 3.22Å; F1277-F1284 HydrophobicContact CE1-CB 3.48Å; F1277-F1284 VanDerWaalsContact CE1-CB 3.48Å; F1277-F1284 AromaticContact CE1-CD1 3.64Å; F1277-F1284 HydrophobicContact CE1-CD1 3.79Å; F1277-F1284 VanDerWaalsContact CE1-CD1 3.47Å; F1277-F1284 AromaticContact CE1-CD2 3.76Å; F1277-F1284 HydrophobicContact CE1-CD2 3.76Å; F1277-F1284 AromaticContact CE1-CE1 3.81Å; F1277-F1284 HydrophobicContact CE1-CE1 4.01Å; F1277-F1284 HydrophobicContact CE1-CE2 4.42Å; F1277-F1284 AromaticContact CE1-CG 3.36Å; F1277-F1284 HydrophobicContact CE1-CG 3.84Å; F1277-F1284 HydrophobicContact CE2-CB 4.47Å; F1277-F1284 AromaticContact CE2-CD1 3.66Å; F1277-F1284 HydrophobicContact CE2-CD1 3.66Å; F1277-F1284 AromaticContact CE2-CD2 3.17Å; F1277-F1284 HydrophobicContact CE2-CD2 3.17Å; F1277-F1284 AromaticContact CE2-CE1 3.51Å; F1277-F1284 HydrophobicContact CE2-CE1 3.51Å; F1277-F1284 AromaticContact CE2-CE2 3Å; F1277-F1284 HydrophobicContact CE2-CE2 3Å; F1277-F1284 AromaticContact CE2-CG 3.49Å; F1277-F1284 HydrophobicContact CE2-CG 3.49Å; F1277-F1284 VanDerWaalsContact CE2-CG 3.49Å; F1277-F1284 AromaticContact CE2-CZ 3.17Å; F1277-F1284 HydrophobicContact CE2-CZ 3.17Å; F1277-F1284 AromaticContact CG-CD1 3.43Å; F1277-F1284 HydrophobicContact CG-CD1 3.43Å; F1277-F1284 VanDerWaalsContact CG-CD1 3.43Å; F1277-F1284 HydrophobicContact CG-CD2 4.44Å; F1277-F1284 AromaticContact CG-CE1 3.47Å; F1277-F1284 HydrophobicContact CG-CE1 3.47Å; F1277-F1284 VanDerWaalsContact CG-CE1 3.47Å; F1277-F1284 HydrophobicContact CG-CE2 4.49Å; F1277-F1284 AromaticContact CG-CG 3.93Å; F1277-F1284 HydrophobicContact CG-CG 3.93Å; F1277-F1284 HydrophobicContact CG-CZ 4.03Å; F1277-F1284 HydrophobicContact CZ-CB 3.67Å; F1277-F1284 AromaticContact CZ-CD1 3.71Å; F1277-F1284 HydrophobicContact CZ-CD1 4.08Å; F1277-F1284 AromaticContact CZ-CD2 3Å; F1277-F1284 HydrophobicContact CZ-CD2 3Å; F1277-F1284 HydrophobicContact CZ-CE1 4.06Å; F1277-F1284 AromaticContact CZ-CE2 3.43Å; F1277-F1284 HydrophobicContact CZ-CE2 3.43Å; F1277-F1284 VanDerWaalsContact CZ-CE2 3.43Å; F1277-F1284 AromaticContact CZ-CG 3.14Å; F1277-F1284 HydrophobicContact CZ-CG 3.14Å; F1277-F1284 AromaticContact CZ-CZ 3.94Å; F1277-F1284 HydrophobicContact CZ-CZ 3.94Å; C1279-F1284 HydrophobicContact CB-CE2 4.46Å; D1281-F1284 HydrophobicContact CB-CB 4.32Å; D1281-F1284 HydrophobicContact CB-CD2 3.53Å; D1281-F1284 VanDerWaalsContact CB-CD2 3.4Å; D1281-F1284 HydrophobicContact CB-CE2 4.08Å; D1281-F1284 HydrophobicContact CB-CG 4.38Å; D1281-F1284 PolarHBondContact O-N 3.22Å; D1281-F1284 VanDerWaalsContact O-N 3.11Å; D1281-F1284 WeakPolarHBondContact OD2-CD2 3.38Å; D1281-F1284 VanDerWaalsContact OD2-CE2 3.31Å; D1281-F1284 WeakPolarHBondContact OD2-CE2 3.35Å; V1282-F1284 VanDerWaalsContact C-N 3.3Å; V1282-F1284 PolarHBondContact O-N 3.21Å; F1284-E1286 PolarHBondContact O-N 3.15Å; F1284-I1287 HydrophobicContact CD1-CD1 4.23Å; F1284-I1287 HydrophobicContact CE1-CD1 4.48Å; F1284-I1287 WeakPolarHBondContact O-CB 3.49Å; F1284-I1287 PolarHBondContact O-N 3.16Å; F1284-I1287 VanDerWaalsContact O-N 3.13Å; F1284-V1288 HydrophobicContact CD1-CG2 3.71Å; F1284-V1288 HydrophobicContact CD2-CG2 4.46Å; F1284-V1288 HydrophobicContact CE1-CG2 3.26Å; F1284-V1288 HydrophobicContact CE2-CG2 4.08Å; F1284-V1288 HydrophobicContact CG-CG2 4.31Å; F1284-V1288 HydrophobicContact CZ-CG2 3.48Å; F1284-V1288 VanDerWaalsContact CZ-CG2 3.48Å; F1284-V1288 WeakPolarHBondContact O-CB 3.38Å; F1284-V1288 WeakPolarHBondContact O-CG2 3.37Å; F1284-V1288 PolarHBondContact O-N 3.16Å
1285N70.3Confident70Confident96.4 Ų96.458 Ų5852%0.51629%0.293SS..Hα-helixtrans-59.3-36.5173.1-70.6-16.5000110.9D1281 V1282 V1288 H1289D1281-N1285 PolarHBondContact O-N 3.21Å; D1281-N1285 VanDerWaalsContact O-N 3.15Å; V1282-N1285 PolarHBondContact O-N 3.08Å; N1285-V1288 PolarHBondContact O-N 3.07Å; N1285-H1289 VanDerWaalsContact C-CD2 3.49Å; N1285-H1289 VanDerWaalsContact O-CB 3.28Å; N1285-H1289 WeakPolarHBondContact O-CB 3.3Å; N1285-H1289 PolarHBondContact O-CD2 3.49Å; N1285-H1289 VanDerWaalsContact O-CG 3.25Å; N1285-H1289 PolarHBondContact O-N 3.14Å
1286E73.3Confident70.6Confident67.2 Ų67.257 Ų5731%0.31429%0.288SS..Hα-helixtrans-64.2-45.6172.9-107.8175-179.400112.5I1194 S1228 V1282 V1283 F1284 V1288 H1289 L1290I1194-E1286 HydrophobicContact CD1-CB 4.39Å; I1194-E1286 HydrophobicContact CD1-CG 4.45Å; S1228-E1286 VanDerWaalsContact CA-OE1 3.31Å; S1228-E1286 WeakPolarHBondContact CA-OE1 3.22Å; S1228-E1286 WeakPolarHBondContact CB-OE1 3.47Å; V1282-E1286 WeakPolarHBondContact O-CG 3.45Å; V1282-E1286 PolarHBondContact O-N 3.15Å; V1282-E1286 VanDerWaalsContact O-N 3.1Å; V1283-E1286 WeakPolarHBondContact O-CB 3.35Å; V1283-E1286 PolarHBondContact O-N 3.3Å; F1284-E1286 PolarHBondContact O-N 3.15Å; E1286-V1288 VanDerWaalsContact C-N 3.31Å; E1286-V1288 PolarHBondContact O-N 3.14Å; E1286-H1289 PolarHBondContact O-N 3.23Å; E1286-L1290 HydrophobicContact CG-CD1 4.12Å; E1286-L1290 HydrophobicContact CG-CG 4.45Å; E1286-L1290 WeakPolarHBondContact O-CB 3.46Å; E1286-L1290 VanDerWaalsContact O-CG 3.26Å; E1286-L1290 WeakPolarHBondContact O-CG 3.37Å; E1286-L1290 PolarHBondContact O-N 3.16Å
1287I76Confident71.2Confident3.2 Ų3.247.5 Ų47.52%0.01625%0.254CS..Hα-helixtrans-58.6-44.4175.3-70.3169.2000110.9N1193 I1194 L1197 L1272 V1283 F1284 L1290 T1291N1193-I1287 HydrophobicContact CB-CD1 4.07Å; N1193-I1287 HydrophobicContact CB-CG1 4.48Å; I1194-I1287 HydrophobicContact CD1-CG1 4.19Å; I1194-I1287 HydrophobicContact CG1-CD1 4.16Å; I1194-I1287 HydrophobicContact CG1-CG1 3.52Å; I1194-I1287 VanDerWaalsContact CG1-CG1 3.5Å; L1197-I1287 HydrophobicContact CD1-CB 4.47Å; L1197-I1287 HydrophobicContact CD1-CG2 3.95Å; L1272-I1287 HydrophobicContact CD1-CG2 4.29Å; L1272-I1287 HydrophobicContact CD2-CG2 4.1Å; L1272-I1287 HydrophobicContact CG-CG2 4.37Å; V1283-I1287 HydrophobicContact CG1-CD1 4.49Å; V1283-I1287 WeakPolarHBondContact O-CG1 3.4Å; V1283-I1287 PolarHBondContact O-N 3.27Å; V1283-I1287 VanDerWaalsContact O-N 3.13Å; F1284-I1287 HydrophobicContact CD1-CD1 4.23Å; F1284-I1287 HydrophobicContact CE1-CD1 4.48Å; F1284-I1287 WeakPolarHBondContact O-CB 3.49Å; F1284-I1287 PolarHBondContact O-N 3.16Å; F1284-I1287 VanDerWaalsContact O-N 3.13Å; I1287-L1290 PolarHBondContact O-N 2.93Å; I1287-T1291 VanDerWaalsContact O-CB 3.25Å; I1287-T1291 WeakPolarHBondContact O-CB 3.31Å; I1287-T1291 PolarHBondContact O-N 3.38Å; I1287-T1291 PolarHBondContact O-OG1 3.11Å
1288V77.7Confident72.3Confident21.8 Ų21.845 Ų4513%0.13224%0.243CC..Hα-helixtrans-63.4-46.7178.11720000110.6L1273 F1277 F1284 N1285 E1286 T1291 K1292L1273-V1288 HydrophobicContact CD2-CG1 4.13Å; F1277-V1288 HydrophobicContact CE2-CG2 4.23Å; F1284-V1288 HydrophobicContact CD1-CG2 3.71Å; F1284-V1288 HydrophobicContact CD2-CG2 4.46Å; F1284-V1288 HydrophobicContact CE1-CG2 3.26Å; F1284-V1288 HydrophobicContact CE2-CG2 4.08Å; F1284-V1288 HydrophobicContact CG-CG2 4.31Å; F1284-V1288 HydrophobicContact CZ-CG2 3.48Å; F1284-V1288 VanDerWaalsContact CZ-CG2 3.48Å; F1284-V1288 WeakPolarHBondContact O-CB 3.38Å; F1284-V1288 WeakPolarHBondContact O-CG2 3.37Å; F1284-V1288 PolarHBondContact O-N 3.16Å; N1285-V1288 PolarHBondContact O-N 3.07Å; E1286-V1288 VanDerWaalsContact C-N 3.31Å; E1286-V1288 PolarHBondContact O-N 3.14Å; V1288-T1291 WeakPolarHBondContact O-CB 3.37Å; V1288-T1291 PolarHBondContact O-N 2.91Å; V1288-K1292 HydrophobicContact CG1-CD 4.09Å; V1288-K1292 VanDerWaalsContact CG1-CE 3.42Å; V1288-K1292 WeakPolarHBondContact O-CB 3.45Å; V1288-K1292 VanDerWaalsContact O-CG 3.32Å; V1288-K1292 WeakPolarHBondContact O-CG 3.31Å; V1288-K1292 PolarHBondContact O-N 2.99Å
1289H76.1Confident73.6Confident61.2 Ų61.237.3 Ų37.328%0.28321%0.209SC..Hα-helixtrans-60.9-47.7177.7-162.8-66.6000111.7I1235 N1285 E1286 T1291 K1292 Y1293 D1322I1235-H1289 VanDerWaalsContact CG2-CE1 3.42Å; I1235-H1289 WeakPolarHBondContact CG2-CE1 3.38Å; N1285-H1289 VanDerWaalsContact C-CD2 3.49Å; N1285-H1289 VanDerWaalsContact O-CB 3.28Å; N1285-H1289 WeakPolarHBondContact O-CB 3.3Å; N1285-H1289 PolarHBondContact O-CD2 3.49Å; N1285-H1289 VanDerWaalsContact O-CG 3.25Å; N1285-H1289 PolarHBondContact O-N 3.14Å; E1286-H1289 PolarHBondContact O-N 3.23Å; H1289-T1291 VanDerWaalsContact C-N 3.31Å; H1289-T1291 PolarHBondContact O-N 3.27Å; H1289-K1292 PolarHBondContact O-N 3.21Å; H1289-Y1293 VanDerWaalsContact O-CB 3.31Å; H1289-Y1293 WeakPolarHBondContact O-CB 3.29Å; H1289-Y1293 PolarHBondContact O-N 3.15Å; H1289-D1322 VanDerWaalsContact CD2-CG 3.45Å; H1289-D1322 IonicContact CD2-OD1 2.82Å; H1289-D1322 IonicContact CD2-OD2 2.91Å; H1289-D1322 PolarHBondContact CD2-OD2 3.18Å; H1289-D1322 VanDerWaalsContact CD2-OD2 3.25Å; H1289-D1322 IonicContact CE1-OD1 3.5Å; H1289-D1322 PolarHBondContact CE1-OD1 2.93Å; H1289-D1322 IonicContact CE1-OD2 3.62Å; H1289-D1322 PolarHBondContact CE1-OD2 3.01Å; H1289-D1322 IonicContact CG-OD2 3.06Å; H1289-D1322 IonicContact ND1-OD1 2.78Å; H1289-D1322 PolarHBondContact ND1-OD1 2.78Å; H1289-D1322 IonicContact ND1-OD2 3.53Å; H1289-D1322 PolarHBondContact ND1-OD2 3.16Å; H1289-D1322 IonicContact NE2-OD1 3.31Å; H1289-D1322 IonicContact NE2-OD2 3.95Å
1290L75.4Confident75Confident15.4 Ų15.435.5 Ų35.58%0.08119%0.19CC..Hα-helixtrans-62.8-39177.4-67.6171.5000111.6I1194 L1197 I1201 I1231 I1235 E1286 I1287 Y1293 I1294I1194-L1290 HydrophobicContact CG2-CD1 3.98Å; L1197-L1290 HydrophobicContact CB-CB 4.07Å; L1197-L1290 HydrophobicContact CB-CD1 4.25Å; L1197-L1290 HydrophobicContact CD1-CB 4.16Å; I1201-L1290 HydrophobicContact CD1-CB 4.18Å; I1201-L1290 HydrophobicContact CD1-CD2 3.55Å; I1201-L1290 HydrophobicContact CD1-CG 4.44Å; I1231-L1290 HydrophobicContact CG2-CD2 4.43Å; I1235-L1290 HydrophobicContact CD1-CD2 3.79Å; E1286-L1290 HydrophobicContact CG-CD1 4.12Å; E1286-L1290 HydrophobicContact CG-CG 4.45Å; E1286-L1290 WeakPolarHBondContact O-CB 3.46Å; E1286-L1290 VanDerWaalsContact O-CG 3.26Å; E1286-L1290 WeakPolarHBondContact O-CG 3.37Å; E1286-L1290 PolarHBondContact O-N 3.16Å; I1287-L1290 PolarHBondContact O-N 2.93Å; L1290-Y1293 WeakPolarHBondContact O-CB 3.34Å; L1290-Y1293 PolarHBondContact O-N 3.17Å; L1290-I1294 WeakPolarHBondContact O-CG1 3.42Å; L1290-I1294 PolarHBondContact O-N 3.17Å
1291T82.1Confident76.1Confident0 Ų033.7 Ų33.70%018%0.176CC..Hα-helixtrans-62.7-48.1176.6-63.10000111.5L1269 L1272 L1273 I1287 V1288 H1289 Y1293 I1294 L1295L1269-T1291 HydrophobicContact CB-CG2 3.86Å; L1269-T1291 HydrophobicContact CD1-CG2 4.36Å; L1269-T1291 HydrophobicContact CD2-CG2 3.92Å; L1269-T1291 HydrophobicContact CG-CG2 4.23Å; L1272-T1291 HydrophobicContact CD2-CG2 4.25Å; L1272-T1291 VanDerWaalsContact CD2-OG1 3.25Å; L1272-T1291 WeakPolarHBondContact CD2-OG1 3.25Å; L1273-T1291 HydrophobicContact CD1-CG2 4.1Å; L1273-T1291 HydrophobicContact CD2-CG2 3.92Å; L1273-T1291 HydrophobicContact CG-CG2 3.78Å; I1287-T1291 VanDerWaalsContact O-CB 3.25Å; I1287-T1291 WeakPolarHBondContact O-CB 3.31Å; I1287-T1291 PolarHBondContact O-N 3.38Å; I1287-T1291 PolarHBondContact O-OG1 3.11Å; V1288-T1291 WeakPolarHBondContact O-CB 3.37Å; V1288-T1291 PolarHBondContact O-N 2.91Å; H1289-T1291 VanDerWaalsContact C-N 3.31Å; H1289-T1291 PolarHBondContact O-N 3.27Å; T1291-Y1293 VanDerWaalsContact C-N 3.3Å; T1291-Y1293 PolarHBondContact O-N 3.19Å; T1291-I1294 PolarHBondContact O-N 3.12Å; T1291-L1295 PolarHBondContact O-N 3.01Å; T1291-L1295 VanDerWaalsContact O-N 3.12Å
1292K80.9Confident76.9Confident6.4 Ų6.431.4 Ų31.43%0.02816%0.164CC..Hα-helixtrans-63.1-38.2176.1-70.1177.5-172.8-175.90111.5L1273 V1288 H1289 I1294 L1295 C1296 E1320 D1322 D1323 V1326L1273-K1292 HydrophobicContact CD2-CG 4.45Å; V1288-K1292 HydrophobicContact CG1-CD 4.09Å; V1288-K1292 VanDerWaalsContact CG1-CE 3.42Å; V1288-K1292 WeakPolarHBondContact O-CB 3.45Å; V1288-K1292 VanDerWaalsContact O-CG 3.32Å; V1288-K1292 WeakPolarHBondContact O-CG 3.31Å; V1288-K1292 PolarHBondContact O-N 2.99Å; H1289-K1292 PolarHBondContact O-N 3.21Å; K1292-I1294 VanDerWaalsContact C-N 3.34Å; K1292-I1294 PolarHBondContact O-N 3.23Å; K1292-L1295 WeakPolarHBondContact O-CA 3.39Å; K1292-L1295 WeakPolarHBondContact O-CB 3.3Å; K1292-L1295 PolarHBondContact O-N 3.29Å; K1292-L1295 VanDerWaalsContact O-N 3.1Å; K1292-C1296 PolarHBondContact O-N 3.18Å; K1292-C1296 PolarHBondContact O-SG 3.23Å; K1292-C1296 VanDerWaalsContact O-SG 3.35Å; K1292-E1320 IonicContact NZ-OE2 3.39Å; K1292-E1320 PolarHBondContact NZ-OE2 2.97Å; K1292-D1322 HydrophobicContact CB-CB 4.27Å; K1292-D1322 HydrophobicContact CD-CB 3.46Å; K1292-D1322 VanDerWaalsContact CD-CB 3.45Å; K1292-D1322 HydrophobicContact CG-CB 4.41Å; K1292-D1322 IonicContact NZ-OD2 2.69Å; K1292-D1323 WeakPolarHBondContact CD-OD1 3.49Å; K1292-D1323 WeakPolarHBondContact CE-OD1 3.37Å; K1292-D1323 IonicContact NZ-OD1 3.53Å; K1292-D1323 PolarHBondContact NZ-OD1 3.03Å; K1292-D1323 IonicContact NZ-OD2 3.18Å; K1292-V1326 HydrophobicContact CB-CG2 3.78Å; K1292-V1326 HydrophobicContact CG-CG2 4.23Å
1293Y77.4Confident77.5Confident25.4 Ų25.431.1 Ų31.110%0.116%0.155CC..Hα-helixtrans-62-41.2175.1-169.3-108.1000112.9I1201 Q1205 I1235 R1238 I1239 H1289 L1290 T1291 L1295 C1296 L1297I1201-Y1293 HydrophobicContact CD1-CD1 3.87Å; I1201-Y1293 HydrophobicContact CG1-CD1 4.04Å; I1201-Y1293 HydrophobicContact CG1-CE1 4.49Å; I1201-Y1293 HydrophobicContact CG2-CD1 4.07Å; I1201-Y1293 HydrophobicContact CG2-CE1 3.8Å; Q1205-Y1293 VanDerWaalsContact NE2-CE1 3.28Å; Q1205-Y1293 PolarHBondContact NE2-OH 2.97Å; I1235-Y1293 HydrophobicContact CG2-CD2 4.34Å; I1235-Y1293 HydrophobicContact CG2-CE2 4.33Å; R1238-Y1293 PolarHBondContact O-OH 3.43Å; R1238-Y1293 VanDerWaalsContact O-OH 3.05Å; I1239-Y1293 HydrophobicContact CD1-CE2 4.02Å; I1239-Y1293 WeakPolarHBondContact CD1-OH 3.36Å; I1239-Y1293 HydrophobicContact CG1-CD2 4.4Å; I1239-Y1293 HydrophobicContact CG1-CE2 4.02Å; H1289-Y1293 VanDerWaalsContact O-CB 3.31Å; H1289-Y1293 WeakPolarHBondContact O-CB 3.29Å; H1289-Y1293 PolarHBondContact O-N 3.15Å; L1290-Y1293 WeakPolarHBondContact O-CB 3.34Å; L1290-Y1293 PolarHBondContact O-N 3.17Å; T1291-Y1293 VanDerWaalsContact C-N 3.3Å; T1291-Y1293 PolarHBondContact O-N 3.19Å; Y1293-L1295 VanDerWaalsContact C-N 3.29Å; Y1293-L1295 PolarHBondContact O-N 3Å; Y1293-C1296 WeakPolarHBondContact O-CB 3.32Å; Y1293-C1296 PolarHBondContact O-N 3.14Å; Y1293-L1297 HydrophobicContact CD1-CD1 3.98Å; Y1293-L1297 HydrophobicContact CD1-CG 4.44Å; Y1293-L1297 HydrophobicContact CE1-CD1 3.69Å; Y1293-L1297 HydrophobicContact CE1-CD2 4.45Å; Y1293-L1297 HydrophobicContact CE1-CG 4.15Å; Y1293-L1297 WeakPolarHBondContact O-CG 3.48Å; Y1293-L1297 PolarHBondContact O-N 3.08Å
1294I80.9Confident78.1Confident0.6 Ų0.633.5 Ų33.50%0.00317%0.165CC..Hα-helixtrans-63.2-36.8173.4-65164.6000110.9L1197 I1200 I1201 V1265 L1269 L1290 T1291 K1292 C1296 L1297 F1298L1197-I1294 HydrophobicContact CB-CD1 4.17Å; L1197-I1294 HydrophobicContact CD2-CD1 3.56Å; L1197-I1294 HydrophobicContact CG-CD1 4.47Å; I1200-I1294 HydrophobicContact CB-CD1 4.24Å; I1200-I1294 HydrophobicContact CG2-CD1 4.04Å; I1200-I1294 HydrophobicContact CG2-CG1 4.37Å; I1200-I1294 HydrophobicContact CG2-CG2 4.29Å; I1201-I1294 HydrophobicContact CD1-CD1 4.38Å; I1201-I1294 HydrophobicContact CD1-CG1 4.03Å; I1201-I1294 HydrophobicContact CG1-CD1 4.07Å; I1201-I1294 HydrophobicContact CG1-CG1 3.52Å; I1201-I1294 VanDerWaalsContact CG1-CG1 3.47Å; V1265-I1294 HydrophobicContact CG1-CG2 4.31Å; L1269-I1294 HydrophobicContact CD1-CB 3.96Å; L1269-I1294 HydrophobicContact CD1-CG2 3.63Å; L1290-I1294 WeakPolarHBondContact O-CG1 3.42Å; L1290-I1294 PolarHBondContact O-N 3.17Å; T1291-I1294 PolarHBondContact O-N 3.12Å; K1292-I1294 VanDerWaalsContact C-N 3.34Å; K1292-I1294 PolarHBondContact O-N 3.23Å; I1294-C1296 VanDerWaalsContact C-N 3.35Å; I1294-L1297 PolarHBondContact O-N 3.35Å; I1294-F1298 VanDerWaalsContact O-CB 3.29Å; I1294-F1298 WeakPolarHBondContact O-CB 3.37Å; I1294-F1298 PolarHBondContact O-N 3.11Å
1295L82.5Confident78.9Confident3.8 Ų3.832.7 Ų32.72%0.0216%0.162CC..Hα-helixtrans-64.3-39.4174.1-66.8173.5000112.1L1269 L1273 T1291 K1292 Y1293 F1298 C1299 L1309 F1316 V1326L1269-L1295 HydrophobicContact CB-CD2 4.27Å; L1269-L1295 HydrophobicContact CD1-CD2 3.85Å; L1269-L1295 HydrophobicContact CD1-CG 4.06Å; L1273-L1295 HydrophobicContact CD1-CD1 3.9Å; T1291-L1295 PolarHBondContact O-N 3.01Å; T1291-L1295 VanDerWaalsContact O-N 3.12Å; K1292-L1295 WeakPolarHBondContact O-CA 3.39Å; K1292-L1295 WeakPolarHBondContact O-CB 3.3Å; K1292-L1295 PolarHBondContact O-N 3.29Å; K1292-L1295 VanDerWaalsContact O-N 3.1Å; Y1293-L1295 VanDerWaalsContact C-N 3.29Å; Y1293-L1295 PolarHBondContact O-N 3Å; L1295-F1298 WeakPolarHBondContact O-CB 3.18Å; L1295-F1298 PolarHBondContact O-N 3.12Å; L1295-C1299 PolarHBondContact O-N 3.25Å; L1295-C1299 VanDerWaalsContact O-N 3.11Å; L1295-C1299 PolarHBondContact O-SG 3.18Å; L1295-C1299 VanDerWaalsContact O-SG 3.35Å; L1295-L1309 HydrophobicContact CB-CD2 4.3Å; L1295-L1309 HydrophobicContact CD2-CD1 4.26Å; L1295-L1309 HydrophobicContact CD2-CD2 4.22Å; L1295-F1316 HydrophobicContact CD1-CE1 4.01Å; L1295-F1316 HydrophobicContact CD1-CZ 3.66Å; L1295-V1326 HydrophobicContact CB-CG1 4.4Å; L1295-V1326 HydrophobicContact CB-CG2 4.4Å
1296C81Confident79.6Confident5.6 Ų5.628.3 Ų28.34%0.03814%0.138CC..Hα-helixtrans-59.9-48.3172.7-63.20000111.3K1292 Y1293 I1294 F1298 C1299 Y1300 V1326 W1329K1292-C1296 PolarHBondContact O-N 3.18Å; K1292-C1296 PolarHBondContact O-SG 3.23Å; K1292-C1296 VanDerWaalsContact O-SG 3.35Å; Y1293-C1296 WeakPolarHBondContact O-CB 3.32Å; Y1293-C1296 PolarHBondContact O-N 3.14Å; I1294-C1296 VanDerWaalsContact C-N 3.35Å; C1296-F1298 VanDerWaalsContact C-N 3.28Å; C1296-F1298 PolarHBondContact O-N 3.21Å; C1296-C1299 PolarHBondContact O-N 3.24Å; C1296-Y1300 PolarHBondContact O-N 3.07Å; C1296-Y1300 VanDerWaalsContact O-N 3.07Å; C1296-V1326 VanDerWaalsContact SG-CG2 3.59Å; C1296-W1329 HydrophobicContact CB-CB 4.47Å; C1296-W1329 HydrophobicContact CB-CG 4.16Å
1297L76.3Confident80.1Confident15.8 Ų15.829.2 Ų29.28%0.08314%0.141CC..Hα-helixtrans-61.8-35.7176.1-69.7175000112.3I1201 C1204 Q1205 I1239 M1243 F1253 Q1257 Y1293 I1294 C1299I1201-L1297 HydrophobicContact CG2-CD1 4.33Å; C1204-L1297 HydrophobicContact CB-CD1 3.98Å; Q1205-L1297 HydrophobicContact CG-CD1 4.24Å; I1239-L1297 HydrophobicContact CG2-CD2 4.31Å; M1243-L1297 HydrophobicContact CE-CD2 3.64Å; F1253-L1297 HydrophobicContact CZ-CB 4.24Å; F1253-L1297 HydrophobicContact CZ-CD2 4.28Å; F1253-L1297 VanDerWaalsContact CZ-O 3.3Å; F1253-L1297 WeakPolarHBondContact CZ-O 3.29Å; Q1257-L1297 PolarHBondContact NE2-O 3.08Å; Y1293-L1297 HydrophobicContact CD1-CD1 3.98Å; Y1293-L1297 HydrophobicContact CD1-CG 4.44Å; Y1293-L1297 HydrophobicContact CE1-CD1 3.69Å; Y1293-L1297 HydrophobicContact CE1-CD2 4.45Å; Y1293-L1297 HydrophobicContact CE1-CG 4.15Å; Y1293-L1297 WeakPolarHBondContact O-CG 3.48Å; Y1293-L1297 PolarHBondContact O-N 3.08Å; I1294-L1297 PolarHBondContact O-N 3.35Å; L1297-C1299 VanDerWaalsContact C-N 3.33Å; L1297-C1299 PolarHBondContact O-N 3.23Å
1298F82.5Confident80.3Confident1.8 Ų1.832.2 Ų32.21%0.00816%0.157CC..Hα-helixtrans-64.8-36.4177.5179.6-103.4000112.6Q1257 L1260 R1261 H1266 I1294 L1295 C1296 N1305 L1309Q1257-F1298 PolarHBondContact NE2-O 3Å; L1260-F1298 HydrophobicContact CB-CD2 4.06Å; L1260-F1298 HydrophobicContact CB-CE2 4.25Å; R1261-F1298 HydrophobicContact CB-CE2 3.89Å; R1261-F1298 HydrophobicContact CB-CZ 4.08Å; R1261-F1298 HydrophobicContact CG-CZ 4.45Å; H1266-F1298 HydrophobicContact CB-CE1 4.26Å; H1266-F1298 HydrophobicContact CB-CZ 4.38Å; I1294-F1298 VanDerWaalsContact O-CB 3.29Å; I1294-F1298 WeakPolarHBondContact O-CB 3.37Å; I1294-F1298 PolarHBondContact O-N 3.11Å; L1295-F1298 WeakPolarHBondContact O-CB 3.18Å; L1295-F1298 PolarHBondContact O-N 3.12Å; C1296-F1298 VanDerWaalsContact C-N 3.28Å; C1296-F1298 PolarHBondContact O-N 3.21Å; F1298-N1305 HydrophobicContact CD1-CB 3.9Å; F1298-N1305 HydrophobicContact CE1-CB 3.52Å; F1298-N1305 HydrophobicContact CE2-CB 4.35Å; F1298-N1305 VanDerWaalsContact CE2-ND2 3.32Å; F1298-N1305 WeakPolarHBondContact CE2-ND2 3.4Å; F1298-N1305 HydrophobicContact CG-CB 4.44Å; F1298-N1305 HydrophobicContact CZ-CB 3.77Å; F1298-N1305 VanDerWaalsContact CZ-CG 3.47Å; F1298-N1305 WeakPolarHBondContact CZ-OD1 3.34Å; F1298-N1305 VanDerWaalsContact O-CB 3.25Å; F1298-N1305 WeakPolarHBondContact O-CB 3.38Å; F1298-N1305 PolarHBondContact O-ND2 2.88Å; F1298-L1309 HydrophobicContact CD1-CD1 3.55Å; F1298-L1309 HydrophobicContact CD1-CG 4.37Å; F1298-L1309 HydrophobicContact CE1-CD1 3.98Å; F1298-L1309 HydrophobicContact CE1-CG 4.33Å
1299C81.7Confident80.6Confident0.6 Ų0.631.4 Ų31.40%0.00415%0.152CC..Hα-helixtrans-88.3-15.9-179.4-68.90000114.7L1295 C1296 L1297 N1301 N1302 Q1306 L1309 W1329L1295-C1299 PolarHBondContact O-N 3.25Å; L1295-C1299 VanDerWaalsContact O-N 3.11Å; L1295-C1299 PolarHBondContact O-SG 3.18Å; L1295-C1299 VanDerWaalsContact O-SG 3.35Å; C1296-C1299 PolarHBondContact O-N 3.24Å; L1297-C1299 VanDerWaalsContact C-N 3.33Å; L1297-C1299 PolarHBondContact O-N 3.23Å; C1299-N1301 PolarHBondContact O-N 2.95Å; C1299-N1301 VanDerWaalsContact O-N 3.12Å; C1299-N1302 PolarHBondContact O-N 3.04Å; C1299-N1302 VanDerWaalsContact O-N 3.17Å; C1299-Q1306 HydrophobicContact CB-CG 3.96Å; C1299-Q1306 PolarHBondContact O-NE2 3.11Å; C1299-L1309 WeakPolarHBondContact SG-CD1 3.47Å; C1299-L1309 VanDerWaalsContact SG-CD2 3.56Å; C1299-W1329 HydrophobicContact CB-CB 4.27Å; C1299-W1329 WeakPolarHBondContact CB-O 3.46Å
1300Y79.1Confident80.9Confident50.2 Ų50.230.5 Ų30.520%0.19715%0.146CC..THydrogen-bonded Turntrans-53.4115.9-174.4-177.6-91.2000112.7M1243 F1253 Q1257 C1296 N1302 W1329M1243-Y1300 HydrophobicContact CB-CE2 4.07Å; M1243-Y1300 HydrophobicContact CE-CD2 3.96Å; M1243-Y1300 HydrophobicContact CE-CE2 4.17Å; M1243-Y1300 HydrophobicContact CE-CG 4.48Å; M1243-Y1300 HydrophobicContact CG-CE2 3.98Å; M1243-Y1300 PolarHBondContact O-OH 2.88Å; M1243-Y1300 VanDerWaalsContact O-OH 3.13Å; M1243-Y1300 HydrophobicContact SD-CD2 4.11Å; M1243-Y1300 HydrophobicContact SD-CE1 4.49Å; M1243-Y1300 HydrophobicContact SD-CE2 3.75Å; F1253-Y1300 HydrophobicContact CD1-CD1 4.28Å; F1253-Y1300 AromaticContact CE1-CD1 3.87Å; F1253-Y1300 HydrophobicContact CE1-CD1 3.87Å; F1253-Y1300 HydrophobicContact CE1-CG 4.34Å; Q1257-Y1300 PolarHBondContact NE2-O 3.26Å; C1296-Y1300 PolarHBondContact O-N 3.07Å; C1296-Y1300 VanDerWaalsContact O-N 3.07Å; Y1300-N1302 PolarHBondContact O-N 3.15Å; Y1300-N1302 VanDerWaalsContact O-N 3.09Å; Y1300-W1329 AromaticContact CD2-CE3 3.79Å; Y1300-W1329 HydrophobicContact CD2-CE3 3.79Å; Y1300-W1329 AromaticContact CD2-CH2 3.63Å; Y1300-W1329 HydrophobicContact CD2-CH2 3.63Å; Y1300-W1329 VanDerWaalsContact CD2-CH2 3.5Å; Y1300-W1329 HydrophobicContact CD2-CZ2 4.33Å; Y1300-W1329 AromaticContact CD2-CZ3 3.23Å; Y1300-W1329 HydrophobicContact CD2-CZ3 3.23Å; Y1300-W1329 HydrophobicContact CE2-CE3 4.46Å; Y1300-W1329 AromaticContact CE2-CH2 3.58Å; Y1300-W1329 HydrophobicContact CE2-CH2 3.58Å; Y1300-W1329 VanDerWaalsContact CE2-CH2 3.49Å; Y1300-W1329 HydrophobicContact CE2-CZ2 4.47Å; Y1300-W1329 AromaticContact CE2-CZ3 3.49Å; Y1300-W1329 HydrophobicContact CE2-CZ3 3.49Å; Y1300-W1329 VanDerWaalsContact CE2-CZ3 3.47Å; Y1300-W1329 HydrophobicContact CG-CZ3 4.3Å
1301N74.6Confident81.2Confident88.4 Ų88.434.4 Ų34.447%0.47317%0.172SC..THydrogen-bonded Turntrans49.330.5-180-62.8-1.2000114.9C1299C1299-N1301 PolarHBondContact O-N 2.95Å; C1299-N1301 VanDerWaalsContact O-N 3.12Å
1302N80.2Confident81Confident22.2 Ų22.237 Ų3712%0.11918%0.183CC..  trans-131.394.8-177.1-150.6-41.8000112.2Q1257 C1299 Y1300 I1304 N1305 Q1306Q1257-N1302 VanDerWaalsContact CB-ND2 3.31Å; Q1257-N1302 WeakPolarHBondContact CB-ND2 3.36Å; Q1257-N1302 PolarHBondContact NE2-ND2 3.2Å; Q1257-N1302 PolarHBondContact OE1-ND2 2.96Å; C1299-N1302 PolarHBondContact O-N 3.04Å; C1299-N1302 VanDerWaalsContact O-N 3.17Å; Y1300-N1302 PolarHBondContact O-N 3.15Å; Y1300-N1302 VanDerWaalsContact O-N 3.09Å; N1302-I1304 VanDerWaalsContact C-N 3.27Å; N1302-I1304 PolarHBondContact O-N 3.17Å; N1302-I1304 PolarHBondContact OD1-N 3.3Å; N1302-N1305 HydrophobicContact CB-CB 4.11Å; N1302-N1305 PolarHBondContact O-N 3.33Å; N1302-N1305 VanDerWaalsContact O-N 3.13Å; N1302-N1305 PolarHBondContact OD1-N 3.17Å; N1302-Q1306 VanDerWaalsContact O-CG 3.31Å; N1302-Q1306 WeakPolarHBondContact O-CG 3.38Å; N1302-Q1306 PolarHBondContact O-N 3.17Å
1303E81.6Confident80.9Confident100.2 Ų100.237.2 Ų37.247%0.46818%0.184SC..Hα-helixtrans-58.3-35.4-177-64.8-177.9-177.300113.7Q1306 K1307E1303-Q1306 PolarHBondContact O-N 3.27Å; E1303-K1307 WeakPolarHBondContact O-CB 3.43Å; E1303-K1307 VanDerWaalsContact O-CG 3.31Å; E1303-K1307 WeakPolarHBondContact O-CG 3.43Å; E1303-K1307 PolarHBondContact O-N 3.08Å
1304I81.9Confident80.9Confident100.8 Ų100.839.9 Ų39.952%0.51720%0.2SC..Hα-helixtrans-66.3-43.7-179.7-58172.5000109.9N1302 K1307 L1308N1302-I1304 VanDerWaalsContact C-N 3.27Å; N1302-I1304 PolarHBondContact O-N 3.17Å; N1302-I1304 PolarHBondContact OD1-N 3.3Å; I1304-K1307 PolarHBondContact O-N 2.97Å; I1304-L1308 WeakPolarHBondContact O-CG 3.35Å; I1304-L1308 PolarHBondContact O-N 3.15Å; I1304-L1308 VanDerWaalsContact O-N 3.15Å
1305N84.7Confident80.8Confident0 Ų045.3 Ų45.30%022%0.223CC..Hα-helixtrans-70.4-37.8179.1-75.5-2.1000111.9R1261 F1298 N1302 L1308 L1309R1261-N1305 VanDerWaalsContact CD-OD1 3.3Å; R1261-N1305 WeakPolarHBondContact CD-OD1 3.3Å; R1261-N1305 PolarHBondContact NH1-OD1 3.05Å; F1298-N1305 HydrophobicContact CD1-CB 3.9Å; F1298-N1305 HydrophobicContact CE1-CB 3.52Å; F1298-N1305 HydrophobicContact CE2-CB 4.35Å; F1298-N1305 VanDerWaalsContact CE2-ND2 3.32Å; F1298-N1305 WeakPolarHBondContact CE2-ND2 3.4Å; F1298-N1305 HydrophobicContact CG-CB 4.44Å; F1298-N1305 HydrophobicContact CZ-CB 3.77Å; F1298-N1305 VanDerWaalsContact CZ-CG 3.47Å; F1298-N1305 WeakPolarHBondContact CZ-OD1 3.34Å; F1298-N1305 VanDerWaalsContact O-CB 3.25Å; F1298-N1305 WeakPolarHBondContact O-CB 3.38Å; F1298-N1305 PolarHBondContact O-ND2 2.88Å; N1302-N1305 HydrophobicContact CB-CB 4.11Å; N1302-N1305 PolarHBondContact O-N 3.33Å; N1302-N1305 VanDerWaalsContact O-N 3.13Å; N1302-N1305 PolarHBondContact OD1-N 3.17Å; N1305-L1308 WeakPolarHBondContact O-CB 3.44Å; N1305-L1308 PolarHBondContact O-N 3.22Å; N1305-L1309 PolarHBondContact O-N 3.29Å; N1305-L1309 VanDerWaalsContact O-N 3.11Å
1306Q85.1Confident80.5Confident2.8 Ų2.846 Ų461%0.01323%0.226CC..Hα-helixtrans-59.3-46.7172.8-71.1171.7-17.400111.5C1299 N1302 E1303 L1308 L1309 Y1310 W1329 M1330 K1332 N1334 L1337C1299-Q1306 HydrophobicContact CB-CG 3.96Å; C1299-Q1306 PolarHBondContact O-NE2 3.11Å; N1302-Q1306 VanDerWaalsContact O-CG 3.31Å; N1302-Q1306 WeakPolarHBondContact O-CG 3.38Å; N1302-Q1306 PolarHBondContact O-N 3.17Å; E1303-Q1306 PolarHBondContact O-N 3.27Å; Q1306-L1308 VanDerWaalsContact C-N 3.28Å; Q1306-L1308 PolarHBondContact O-N 3.08Å; Q1306-L1309 PolarHBondContact O-N 3.08Å; Q1306-L1309 VanDerWaalsContact O-N 3.11Å; Q1306-Y1310 PolarHBondContact O-N 3.07Å; Q1306-W1329 PolarHBondContact NE2-O 3.19Å; Q1306-W1329 VanDerWaalsContact NE2-O 3.11Å; Q1306-M1330 WeakPolarHBondContact CB-O 3.41Å; Q1306-M1330 WeakPolarHBondContact CG-O 3.29Å; Q1306-K1332 PolarHBondContact NE2-O 3.15Å; Q1306-N1334 VanDerWaalsContact OE1-CB 3.29Å; Q1306-N1334 PolarHBondContact OE1-ND2 3.28Å; Q1306-L1337 HydrophobicContact CB-CD1 3.71Å
1307K83.7Confident80.2Confident86.8 Ų86.846.4 Ų46.438%0.37723%0.228SC..Hα-helixtrans-59.1-36.7175.7-76.6172.5177.5175.40112.4E1303 I1304 P1311 E1336 L1337E1303-K1307 WeakPolarHBondContact O-CB 3.43Å; E1303-K1307 VanDerWaalsContact O-CG 3.31Å; E1303-K1307 WeakPolarHBondContact O-CG 3.43Å; E1303-K1307 PolarHBondContact O-N 3.08Å; I1304-K1307 PolarHBondContact O-N 2.97Å; K1307-P1311 WeakPolarHBondContact O-CD 3.47Å; K1307-E1336 WeakPolarHBondContact CE-OE2 3.28Å; K1307-E1336 IonicContact NZ-OE1 2.78Å; K1307-E1336 IonicContact NZ-OE2 2.99Å; K1307-E1336 PolarHBondContact NZ-OE2 3.16Å; K1307-L1337 HydrophobicContact CG-CD1 4.25Å; K1307-L1337 HydrophobicContact CG-CD2 3.96Å; K1307-L1337 HydrophobicContact CG-CG 4.23Å
1308L81.3Confident80Confident66.2 Ų66.247.9 Ų47.935%0.34724%0.238SC..Hα-helixtrans-68.6-34.9176.5-86.2170.4000113R1261 H1266 I1304 N1305 Q1306 P1311R1261-L1308 HydrophobicContact CG-CD1 3.73Å; H1266-L1308 HydrophobicContact CB-CD2 4.12Å; H1266-L1308 WeakPolarHBondContact CD2-CD2 3.45Å; H1266-L1308 VanDerWaalsContact NE2-CD2 3.31Å; H1266-L1308 WeakPolarHBondContact NE2-CD2 3.49Å; I1304-L1308 WeakPolarHBondContact O-CG 3.35Å; I1304-L1308 PolarHBondContact O-N 3.15Å; I1304-L1308 VanDerWaalsContact O-N 3.15Å; N1305-L1308 WeakPolarHBondContact O-CB 3.44Å; N1305-L1308 PolarHBondContact O-N 3.22Å; Q1306-L1308 VanDerWaalsContact C-N 3.28Å; Q1306-L1308 PolarHBondContact O-N 3.08Å; L1308-P1311 WeakPolarHBondContact O-CD 3.41Å
1309L84Confident79Confident4.8 Ų4.852 Ų523%0.02526%0.26CS..Hα-helixtrans-85.3-22.5179.6-150.375.4000112.9H1266 L1295 F1298 C1299 N1305 Q1306 P1311 Y1312 F1316 V1326 M1330H1266-L1309 HydrophobicContact CB-CD2 4.34Å; L1295-L1309 HydrophobicContact CB-CD2 4.3Å; L1295-L1309 HydrophobicContact CD2-CD1 4.26Å; L1295-L1309 HydrophobicContact CD2-CD2 4.22Å; F1298-L1309 HydrophobicContact CD1-CD1 3.55Å; F1298-L1309 HydrophobicContact CD1-CG 4.37Å; F1298-L1309 HydrophobicContact CE1-CD1 3.98Å; F1298-L1309 HydrophobicContact CE1-CG 4.33Å; C1299-L1309 WeakPolarHBondContact SG-CD1 3.47Å; C1299-L1309 VanDerWaalsContact SG-CD2 3.56Å; N1305-L1309 PolarHBondContact O-N 3.29Å; N1305-L1309 VanDerWaalsContact O-N 3.11Å; Q1306-L1309 PolarHBondContact O-N 3.08Å; Q1306-L1309 VanDerWaalsContact O-N 3.11Å; L1309-P1311 VanDerWaalsContact C-CD 3.42Å; L1309-Y1312 HydrophobicContact CD1-CD2 4.01Å; L1309-Y1312 HydrophobicContact CD2-CD2 4.21Å; L1309-Y1312 WeakPolarHBondContact O-CA 3.42Å; L1309-Y1312 WeakPolarHBondContact O-CB 3.39Å; L1309-Y1312 WeakPolarHBondContact O-CD2 3.44Å; L1309-Y1312 PolarHBondContact O-N 3.31Å; L1309-F1316 HydrophobicContact CD1-CE2 4.28Å; L1309-F1316 HydrophobicContact CG-CE2 4.43Å; L1309-V1326 HydrophobicContact CD2-CG1 4.28Å; L1309-M1330 VanDerWaalsContact C-CE 3.46Å; L1309-M1330 HydrophobicContact CB-CE 4.12Å; L1309-M1330 HydrophobicContact CB-CG 4.35Å; L1309-M1330 HydrophobicContact CB-SD 4.37Å; L1309-M1330 HydrophobicContact CD2-CE 4.43Å; L1309-M1330 HydrophobicContact CD2-CG 3.66Å; L1309-M1330 HydrophobicContact CD2-SD 3.72Å; L1309-M1330 HydrophobicContact CG-CE 3.9Å; L1309-M1330 HydrophobicContact CG-CG 4.1Å; L1309-M1330 HydrophobicContact CG-SD 3.81Å; L1309-M1330 VanDerWaalsContact O-CE 3.24Å; L1309-M1330 WeakPolarHBondContact O-CE 3.39Å
1310Y82.8Confident78.5Confident42.2 Ų42.256.6 Ų56.617%0.16528%0.281CS..G310 helixtrans-50.8-41.7-175.9-175.3-99.2000115.8Q1306 Y1312 L1313 L1331 L1337 M1340 V1341Q1306-Y1310 PolarHBondContact O-N 3.07Å; Y1310-Y1312 PolarHBondContact O-N 3.26Å; Y1310-L1313 HydrophobicContact CD2-CD1 4.04Å; Y1310-L1313 HydrophobicContact CD2-CD2 4.41Å; Y1310-L1313 HydrophobicContact CE2-CD1 3.87Å; Y1310-L1313 HydrophobicContact CE2-CD2 3.89Å; Y1310-L1313 VanDerWaalsContact O-CB 3.24Å; Y1310-L1313 WeakPolarHBondContact O-CB 3.4Å; Y1310-L1313 PolarHBondContact O-N 3.2Å; Y1310-L1331 HydrophobicContact CD2-CD2 4.18Å; Y1310-L1331 HydrophobicContact CE2-CD2 4.01Å; Y1310-L1337 HydrophobicContact CD1-CD2 4.15Å; Y1310-L1337 HydrophobicContact CD2-CB 4.17Å; Y1310-L1337 HydrophobicContact CD2-CD1 4.2Å; Y1310-L1337 HydrophobicContact CD2-CD2 3.78Å; Y1310-L1337 HydrophobicContact CD2-CG 4.28Å; Y1310-L1337 HydrophobicContact CE2-CB 4.3Å; Y1310-L1337 HydrophobicContact CE2-CD2 4.32Å; Y1310-L1337 WeakPolarHBondContact CE2-O 3.32Å; Y1310-L1337 HydrophobicContact CG-CD1 4.47Å; Y1310-L1337 HydrophobicContact CG-CD2 3.68Å; Y1310-M1340 HydrophobicContact CE1-CB 4.17Å; Y1310-M1340 WeakPolarHBondContact OH-CB 3.45Å; Y1310-M1340 PolarHBondContact OH-O 3.21Å; Y1310-V1341 HydrophobicContact CE2-CG2 4.39Å; Y1310-V1341 VanDerWaalsContact OH-CA 3.29Å; Y1310-V1341 WeakPolarHBondContact OH-CA 3.47Å; Y1310-V1341 PolarHBondContact OH-N 3.19Å; Y1310-V1341 VanDerWaalsContact OH-N 3.11Å
1311P81.2Confident78Confident97.4 Ų97.456.7 Ų56.763%0.63229%0.287SS*.G310 helixtrans-58.5-15.9176.9-25.135.5000114.3K1307 L1308 L1309K1307-P1311 WeakPolarHBondContact O-CD 3.47Å; L1308-P1311 WeakPolarHBondContact O-CD 3.41Å; L1309-P1311 VanDerWaalsContact C-CD 3.42Å
1312Y77.8Confident77.7Confident55.8 Ų55.853.8 Ų53.822%0.21927%0.272CS..G310 helixtrans-97.4-1.2179-54.7-70.1000113.8K1270 L1309 Y1310 D1314 K1315 F1316K1270-Y1312 HydrophobicContact CD-CD1 4.38Å; K1270-Y1312 HydrophobicContact CD-CE1 3.65Å; K1270-Y1312 VanDerWaalsContact CE-CE1 3.48Å; K1270-Y1312 PolarHBondContact NZ-OH 3.23Å; K1270-Y1312 VanDerWaalsContact NZ-OH 3.11Å; L1309-Y1312 HydrophobicContact CD1-CD2 4.01Å; L1309-Y1312 HydrophobicContact CD2-CD2 4.21Å; L1309-Y1312 WeakPolarHBondContact O-CA 3.42Å; L1309-Y1312 WeakPolarHBondContact O-CB 3.39Å; L1309-Y1312 WeakPolarHBondContact O-CD2 3.44Å; L1309-Y1312 PolarHBondContact O-N 3.31Å; Y1310-Y1312 PolarHBondContact O-N 3.26Å; Y1312-D1314 VanDerWaalsContact C-N 3.27Å; Y1312-D1314 PolarHBondContact O-N 3.3Å; Y1312-D1314 VanDerWaalsContact O-N 3.14Å; Y1312-K1315 WeakPolarHBondContact O-CB 3.33Å; Y1312-K1315 PolarHBondContact O-N 3.25Å; Y1312-F1316 VanDerWaalsContact O-CD2 3.31Å; Y1312-F1316 WeakPolarHBondContact O-CD2 3.39Å; Y1312-F1316 PolarHBondContact O-N 3.4Å
1313L79.7Confident77.6Confident9.4 Ų9.453.1 Ų53.15%0.04927%0.268CS..Hα-helixtrans-49.9-45-178.4-177.182.7000111.5Y1310 K1315 F1316 I1317 C1327 M1330 L1331 T1345Y1310-L1313 HydrophobicContact CD2-CD1 4.04Å; Y1310-L1313 HydrophobicContact CD2-CD2 4.41Å; Y1310-L1313 HydrophobicContact CE2-CD1 3.87Å; Y1310-L1313 HydrophobicContact CE2-CD2 3.89Å; Y1310-L1313 VanDerWaalsContact O-CB 3.24Å; Y1310-L1313 WeakPolarHBondContact O-CB 3.4Å; Y1310-L1313 PolarHBondContact O-N 3.2Å; L1313-K1315 PolarHBondContact O-N 3.2Å; L1313-K1315 VanDerWaalsContact O-N 3.12Å; L1313-F1316 PolarHBondContact O-N 3.24Å; L1313-I1317 HydrophobicContact CD2-CD1 3.8Å; L1313-I1317 HydrophobicContact CD2-CG1 4.12Å; L1313-I1317 HydrophobicContact CG-CD1 4.29Å; L1313-I1317 VanDerWaalsContact O-CG1 3.3Å; L1313-I1317 WeakPolarHBondContact O-CG1 3.31Å; L1313-I1317 PolarHBondContact O-N 3.37Å; L1313-C1327 HydrophobicContact CD1-CB 4.2Å; L1313-M1330 HydrophobicContact CB-CE 3.91Å; L1313-M1330 HydrophobicContact CD1-CE 3.97Å; L1313-M1330 HydrophobicContact CD1-SD 4.39Å; L1313-L1331 HydrophobicContact CD1-CD1 4.23Å; L1313-L1331 HydrophobicContact CD1-CD2 3.95Å; L1313-L1331 HydrophobicContact CD1-CG 4.19Å; L1313-L1331 HydrophobicContact CD2-CD1 4.43Å; L1313-T1345 HydrophobicContact CD2-CG2 4.1Å
1314D77.3Confident77.2Confident82.8 Ų82.848.3 Ų48.344%0.44325%0.246SC..Hα-helixtrans-60.8-24.7-178-129.18.3000114.2Y1312 T1345 K1348Y1312-D1314 VanDerWaalsContact C-N 3.27Å; Y1312-D1314 PolarHBondContact O-N 3.3Å; Y1312-D1314 VanDerWaalsContact O-N 3.14Å; D1314-T1345 WeakPolarHBondContact OD1-CG2 3.44Å; D1314-K1348 IonicContact OD1-NZ 3.24Å; D1314-K1348 PolarHBondContact OD1-NZ 3.23Å; D1314-K1348 IonicContact OD2-NZ 3.14Å; D1314-K1348 PolarHBondContact OD2-NZ 3.21Å; D1314-K1348 VanDerWaalsContact OD2-NZ 3.08Å
1315K77.1Confident76.9Confident114.2 Ų114.245.5 Ų45.550%0.49723%0.23SC..Hα-helixtrans-80.1-29.7176.4-69.2-170.6171.1-166.90113N1274 Y1312 L1313 I1317 T1318N1274-K1315 PolarHBondContact OD1-NZ 3.1Å; Y1312-K1315 WeakPolarHBondContact O-CB 3.33Å; Y1312-K1315 PolarHBondContact O-N 3.25Å; L1313-K1315 PolarHBondContact O-N 3.2Å; L1313-K1315 VanDerWaalsContact O-N 3.12Å; K1315-I1317 VanDerWaalsContact C-N 3.3Å; K1315-T1318 WeakPolarHBondContact O-CG2 3.37Å
1316F77.7Confident76.7Confident17.8 Ų17.845.6 Ų45.68%0.07823%0.231CC..Hα-helixtrans-84.1-3.9178.2-65.7-72.3000112.4L1273 L1295 L1309 Y1312 L1313 T1318 D1323 V1326 M1330L1273-F1316 HydrophobicContact CD1-CE1 3.8Å; L1273-F1316 HydrophobicContact CD1-CZ 4.04Å; L1295-F1316 HydrophobicContact CD1-CE1 4.01Å; L1295-F1316 HydrophobicContact CD1-CZ 3.66Å; L1309-F1316 HydrophobicContact CD1-CE2 4.28Å; L1309-F1316 HydrophobicContact CG-CE2 4.43Å; Y1312-F1316 VanDerWaalsContact O-CD2 3.31Å; Y1312-F1316 WeakPolarHBondContact O-CD2 3.39Å; Y1312-F1316 PolarHBondContact O-N 3.4Å; L1313-F1316 PolarHBondContact O-N 3.24Å; F1316-T1318 VanDerWaalsContact C-N 3.26Å; F1316-T1318 PolarHBondContact O-N 3Å; F1316-D1323 HydrophobicContact CB-CB 4.26Å; F1316-D1323 WeakPolarHBondContact O-CB 3.36Å; F1316-V1326 HydrophobicContact CD1-CB 4.46Å; F1316-V1326 HydrophobicContact CD1-CG1 4.1Å; F1316-V1326 HydrophobicContact CD2-CG1 4.24Å; F1316-V1326 HydrophobicContact CE1-CG1 4.17Å; F1316-V1326 HydrophobicContact CE2-CG1 4.3Å; F1316-V1326 HydrophobicContact CG-CG1 4.15Å; F1316-V1326 HydrophobicContact CZ-CG1 4.28Å; F1316-M1330 HydrophobicContact CD2-SD 4.11Å; F1316-M1330 HydrophobicContact CE2-SD 4.42Å
1317I73.9Confident76.4Confident14.2 Ų14.245.5 Ų45.57%0.07323%0.23CC..  trans-81.572.9175.3-47.3178.3000109.8L1313 K1315 T1345 K1348 L1349 F1352 W1362L1313-I1317 HydrophobicContact CD2-CD1 3.8Å; L1313-I1317 HydrophobicContact CD2-CG1 4.12Å; L1313-I1317 HydrophobicContact CG-CD1 4.29Å; L1313-I1317 VanDerWaalsContact O-CG1 3.3Å; L1313-I1317 WeakPolarHBondContact O-CG1 3.31Å; L1313-I1317 PolarHBondContact O-N 3.37Å; K1315-I1317 VanDerWaalsContact C-N 3.3Å; I1317-T1345 HydrophobicContact CD1-CG2 3.97Å; I1317-K1348 HydrophobicContact CD1-CB 4.38Å; I1317-K1348 HydrophobicContact CD1-CD 4.28Å; I1317-K1348 HydrophobicContact CG2-CB 3.97Å; I1317-K1348 HydrophobicContact CG2-CD 4.38Å; I1317-L1349 HydrophobicContact CD1-CD2 4.39Å; I1317-L1349 HydrophobicContact CG1-CD2 4.19Å; I1317-L1349 HydrophobicContact CG2-CD2 4.11Å; I1317-L1349 HydrophobicContact CG2-CG 4.45Å; I1317-F1352 HydrophobicContact CB-CE2 4.25Å; I1317-F1352 HydrophobicContact CG2-CD2 3.73Å; I1317-F1352 VanDerWaalsContact CG2-CD2 3.4Å; I1317-F1352 HydrophobicContact CG2-CE2 3.34Å; I1317-F1352 VanDerWaalsContact CG2-CE2 3.44Å; I1317-F1352 HydrophobicContact CG2-CZ 4.26Å; I1317-F1352 VanDerWaalsContact O-CE2 3.22Å; I1317-F1352 WeakPolarHBondContact O-CE2 3.42Å; I1317-F1352 WeakPolarHBondContact O-CZ 3.33Å; I1317-W1362 HydrophobicContact CG2-CH2 4.17Å; I1317-W1362 HydrophobicContact CG2-CZ3 4.32Å
1318T71.7Confident76.1Confident47.2 Ų47.242.2 Ų42.229%0.2922%0.217SC..SBendtrans-120.8-173.9177.590.70000113K1315 F1316 E1320 D1323 F1352 W1362K1315-T1318 WeakPolarHBondContact O-CG2 3.37Å; F1316-T1318 VanDerWaalsContact C-N 3.26Å; F1316-T1318 PolarHBondContact O-N 3Å; T1318-E1320 VanDerWaalsContact C-N 3.27Å; T1318-E1320 PolarHBondContact O-N 3.04Å; T1318-E1320 PolarHBondContact OG1-N 3.19Å; T1318-D1323 VanDerWaalsContact CB-OD2 3.31Å; T1318-D1323 WeakPolarHBondContact CB-OD2 3.34Å; T1318-D1323 VanDerWaalsContact CG2-OD2 3.27Å; T1318-D1323 WeakPolarHBondContact CG2-OD2 3.31Å; T1318-D1323 PolarHBondContact OG1-OD2 3.11Å; T1318-F1352 VanDerWaalsContact C-CE1 3.44Å; T1318-F1352 VanDerWaalsContact O-CE1 3.25Å; T1318-F1352 WeakPolarHBondContact O-CE1 3.44Å; T1318-W1362 VanDerWaalsContact O-CZ2 3.22Å; T1318-W1362 WeakPolarHBondContact O-CZ2 3.27Å
1319N62.8Low75.8Confident87.8 Ų87.840.2 Ų40.247%0.4721%0.205SC..SBendtrans-79.6-2.3180-81.5-13.7000113.9F1352 K1355 S1356 P1358 Y1359N1319-F1352 VanDerWaalsContact OD1-CD1 3.25Å; N1319-F1352 WeakPolarHBondContact OD1-CD1 3.31Å; N1319-F1352 WeakPolarHBondContact OD1-CE1 3.35Å; N1319-K1355 VanDerWaalsContact CG-NZ 3.34Å; N1319-K1355 PolarHBondContact ND2-NZ 2.85Å; N1319-K1355 VanDerWaalsContact OD1-CD 3.25Å; N1319-K1355 WeakPolarHBondContact OD1-CD 3.35Å; N1319-K1355 WeakPolarHBondContact OD1-CE 3.47Å; N1319-K1355 PolarHBondContact OD1-NZ 3.24Å; N1319-S1356 WeakPolarHBondContact OD1-CB 3.25Å; N1319-P1358 WeakPolarHBondContact O-CD 3.34Å; N1319-Y1359 VanDerWaalsContact O-CE2 3.23Å; N1319-Y1359 WeakPolarHBondContact O-CE2 3.33Å
1320E70.2Confident75.6Confident97.6 Ų97.640 Ų4046%0.45620%0.204SC..  trans-84.4147-172.9-62.7-178179.600111.8K1292 T1318 D1322 D1323K1292-E1320 IonicContact NZ-OE2 3.39Å; K1292-E1320 PolarHBondContact NZ-OE2 2.97Å; T1318-E1320 VanDerWaalsContact C-N 3.27Å; T1318-E1320 PolarHBondContact O-N 3.04Å; T1318-E1320 PolarHBondContact OG1-N 3.19Å; E1320-D1322 VanDerWaalsContact C-N 3.33Å; E1320-D1322 PolarHBondContact O-N 3.04Å; E1320-D1323 HydrophobicContact CB-CB 4.22Å; E1320-D1323 WeakPolarHBondContact O-CB 3.34Å; E1320-D1323 PolarHBondContact O-N 3.35Å
1321T68.1Low75.4Confident52.2 Ų52.238.1 Ų38.132%0.3220%0.196SC..Hα-helixtrans-65.8-44.1-179.641.10000112.4D1323 A1324 E1325 P1358 Y1359T1321-D1323 PolarHBondContact O-N 3.29Å; T1321-A1324 WeakPolarHBondContact O-CB 3.25Å; T1321-A1324 PolarHBondContact O-N 3.3Å; T1321-A1324 VanDerWaalsContact O-N 3.12Å; T1321-E1325 PolarHBondContact O-N 3.21Å; T1321-P1358 HydrophobicContact CG2-CB 3.75Å; T1321-P1358 HydrophobicContact CG2-CG 3.43Å; T1321-P1358 VanDerWaalsContact CG2-CG 3.43Å; T1321-Y1359 HydrophobicContact CG2-CD1 3.5Å; T1321-Y1359 VanDerWaalsContact CG2-CD1 3.46Å; T1321-Y1359 HydrophobicContact CG2-CD2 4.37Å; T1321-Y1359 HydrophobicContact CG2-CE1 3.3Å; T1321-Y1359 HydrophobicContact CG2-CE2 4.36Å; T1321-Y1359 HydrophobicContact CG2-CG 4.07Å
1322D69.7Low75.3Confident28.4 Ų28.435.9 Ų35.915%0.15218%0.177CC..Hα-helixtrans-68.3-27.1-173.1-46.2-11.4000110.9H1289 K1292 E1320 A1324 E1325 V1326H1289-D1322 VanDerWaalsContact CD2-CG 3.45Å; H1289-D1322 IonicContact CD2-OD1 2.82Å; H1289-D1322 IonicContact CD2-OD2 2.91Å; H1289-D1322 PolarHBondContact CD2-OD2 3.18Å; H1289-D1322 VanDerWaalsContact CD2-OD2 3.25Å; H1289-D1322 IonicContact CE1-OD1 3.5Å; H1289-D1322 PolarHBondContact CE1-OD1 2.93Å; H1289-D1322 IonicContact CE1-OD2 3.62Å; H1289-D1322 PolarHBondContact CE1-OD2 3.01Å; H1289-D1322 IonicContact CG-OD2 3.06Å; H1289-D1322 IonicContact ND1-OD1 2.78Å; H1289-D1322 PolarHBondContact ND1-OD1 2.78Å; H1289-D1322 IonicContact ND1-OD2 3.53Å; H1289-D1322 PolarHBondContact ND1-OD2 3.16Å; H1289-D1322 IonicContact NE2-OD1 3.31Å; H1289-D1322 IonicContact NE2-OD2 3.95Å; K1292-D1322 HydrophobicContact CB-CB 4.27Å; K1292-D1322 HydrophobicContact CD-CB 3.46Å; K1292-D1322 VanDerWaalsContact CD-CB 3.45Å; K1292-D1322 HydrophobicContact CG-CB 4.41Å; K1292-D1322 IonicContact NZ-OD2 2.69Å; E1320-D1322 VanDerWaalsContact C-N 3.33Å; E1320-D1322 PolarHBondContact O-N 3.04Å; D1322-A1324 VanDerWaalsContact C-N 3.3Å; D1322-A1324 PolarHBondContact O-N 3.24Å; D1322-E1325 WeakPolarHBondContact O-CB 3.3Å; D1322-E1325 PolarHBondContact O-N 3.23Å; D1322-E1325 VanDerWaalsContact O-N 3.15Å; D1322-V1326 WeakPolarHBondContact O-CG2 3.27Å; D1322-V1326 PolarHBondContact O-N 3.14Å; D1322-V1326 VanDerWaalsContact O-N 3.16Å
1323D77.8Confident75.2Confident6.6 Ų6.636 Ų364%0.03518%0.181CC..Hα-helixtrans-66.8-38.8175.5-86.77.3000112.2K1292 F1316 T1318 E1320 T1321 E1325 V1326 C1327 W1362K1292-D1323 WeakPolarHBondContact CD-OD1 3.49Å; K1292-D1323 WeakPolarHBondContact CE-OD1 3.37Å; K1292-D1323 IonicContact NZ-OD1 3.53Å; K1292-D1323 PolarHBondContact NZ-OD1 3.03Å; K1292-D1323 IonicContact NZ-OD2 3.18Å; F1316-D1323 HydrophobicContact CB-CB 4.26Å; F1316-D1323 WeakPolarHBondContact O-CB 3.36Å; T1318-D1323 VanDerWaalsContact CB-OD2 3.31Å; T1318-D1323 WeakPolarHBondContact CB-OD2 3.34Å; T1318-D1323 VanDerWaalsContact CG2-OD2 3.27Å; T1318-D1323 WeakPolarHBondContact CG2-OD2 3.31Å; T1318-D1323 PolarHBondContact OG1-OD2 3.11Å; E1320-D1323 HydrophobicContact CB-CB 4.22Å; E1320-D1323 WeakPolarHBondContact O-CB 3.34Å; E1320-D1323 PolarHBondContact O-N 3.35Å; T1321-D1323 PolarHBondContact O-N 3.29Å; D1323-E1325 VanDerWaalsContact C-N 3.3Å; D1323-E1325 PolarHBondContact O-N 3.29Å; D1323-V1326 PolarHBondContact O-N 3.02Å; D1323-C1327 WeakPolarHBondContact O-CB 3.3Å; D1323-C1327 PolarHBondContact O-N 3.33Å; D1323-C1327 PolarHBondContact O-SG 3.21Å; D1323-C1327 VanDerWaalsContact O-SG 3.34Å; D1323-W1362 HydrophobicContact CB-CZ2 4.48Å
1324A73.3Confident75.2Confident0 Ų035.6 Ų35.60%018%0.179CC..Hα-helixtrans-65.3-37.5174.200000111.2T1321 D1322 C1327 L1328 H1361 W1362 V1365T1321-A1324 WeakPolarHBondContact O-CB 3.25Å; T1321-A1324 PolarHBondContact O-N 3.3Å; T1321-A1324 VanDerWaalsContact O-N 3.12Å; D1322-A1324 VanDerWaalsContact C-N 3.3Å; D1322-A1324 PolarHBondContact O-N 3.24Å; A1324-C1327 PolarHBondContact O-N 3.17Å; A1324-L1328 WeakPolarHBondContact O-CB 3.35Å; A1324-L1328 PolarHBondContact O-N 3.17Å; A1324-H1361 HydrophobicContact CB-CB 3.55Å; A1324-H1361 VanDerWaalsContact CB-CB 3.49Å; A1324-W1362 HydrophobicContact CB-CD2 3.74Å; A1324-W1362 HydrophobicContact CB-CE3 4Å; A1324-W1362 HydrophobicContact CB-CG 4.26Å; A1324-W1362 HydrophobicContact CB-CH2 4.05Å; A1324-W1362 HydrophobicContact CB-CZ2 3.78Å; A1324-W1362 HydrophobicContact CB-CZ3 4.16Å; A1324-V1365 VanDerWaalsContact O-CG2 3.28Å; A1324-V1365 WeakPolarHBondContact O-CG2 3.39Å
1325E75.1Confident75.3Confident41.2 Ų41.233.9 Ų33.919%0.19317%0.172CC..Hα-helixtrans-66.4-44176.2-129.9-177.817700111.6I1239 T1321 D1322 D1323 C1327 L1328 W1329 H1361I1239-E1325 HydrophobicContact CD1-CG 4.47Å; I1239-E1325 WeakPolarHBondContact CD1-OE1 3.29Å; I1239-E1325 VanDerWaalsContact CG2-OE1 3.23Å; I1239-E1325 WeakPolarHBondContact CG2-OE1 3.22Å; T1321-E1325 PolarHBondContact O-N 3.21Å; D1322-E1325 WeakPolarHBondContact O-CB 3.3Å; D1322-E1325 PolarHBondContact O-N 3.23Å; D1322-E1325 VanDerWaalsContact O-N 3.15Å; D1323-E1325 VanDerWaalsContact C-N 3.3Å; D1323-E1325 PolarHBondContact O-N 3.29Å; E1325-C1327 VanDerWaalsContact C-N 3.33Å; E1325-C1327 PolarHBondContact O-N 3.07Å; E1325-L1328 WeakPolarHBondContact O-CB 3.21Å; E1325-L1328 PolarHBondContact O-N 3.04Å; E1325-L1328 VanDerWaalsContact O-N 3.17Å; E1325-W1329 PolarHBondContact O-N 3.04Å; E1325-H1361 IonicContact OE1-NE2 3.21Å
1326V79.9Confident75.5Confident1.2 Ų1.233.1 Ų33.11%0.00717%0.17CC..Hα-helixtrans-59.1-46.9173.8174.50000110.4K1292 L1295 C1296 L1309 F1316 D1322 D1323 L1328 W1329 M1330K1292-V1326 HydrophobicContact CB-CG2 3.78Å; K1292-V1326 HydrophobicContact CG-CG2 4.23Å; L1295-V1326 HydrophobicContact CB-CG1 4.4Å; L1295-V1326 HydrophobicContact CB-CG2 4.4Å; C1296-V1326 VanDerWaalsContact SG-CG2 3.59Å; L1309-V1326 HydrophobicContact CD2-CG1 4.28Å; F1316-V1326 HydrophobicContact CD1-CB 4.46Å; F1316-V1326 HydrophobicContact CD1-CG1 4.1Å; F1316-V1326 HydrophobicContact CD2-CG1 4.24Å; F1316-V1326 HydrophobicContact CE1-CG1 4.17Å; F1316-V1326 HydrophobicContact CE2-CG1 4.3Å; F1316-V1326 HydrophobicContact CG-CG1 4.15Å; F1316-V1326 HydrophobicContact CZ-CG1 4.28Å; D1322-V1326 WeakPolarHBondContact O-CG2 3.27Å; D1322-V1326 PolarHBondContact O-N 3.14Å; D1322-V1326 VanDerWaalsContact O-N 3.16Å; D1323-V1326 PolarHBondContact O-N 3.02Å; V1326-L1328 VanDerWaalsContact C-N 3.29Å; V1326-L1328 PolarHBondContact O-N 3.22Å; V1326-W1329 PolarHBondContact O-N 3.11Å; V1326-M1330 HydrophobicContact CG1-CG 4.25Å; V1326-M1330 HydrophobicContact CG1-SD 3.75Å; V1326-M1330 WeakPolarHBondContact O-CB 3.43Å; V1326-M1330 WeakPolarHBondContact O-CG 3.35Å; V1326-M1330 PolarHBondContact O-N 3.16Å
1327C80.3Confident75.7Confident1 Ų132.5 Ų32.51%0.00717%0.167CC..Hα-helixtrans-59.5-39.2176.4-68.90000112.6L1313 D1323 A1324 E1325 M1330 L1331 W1362 V1365L1313-C1327 HydrophobicContact CD1-CB 4.2Å; D1323-C1327 WeakPolarHBondContact O-CB 3.3Å; D1323-C1327 PolarHBondContact O-N 3.33Å; D1323-C1327 PolarHBondContact O-SG 3.21Å; D1323-C1327 VanDerWaalsContact O-SG 3.34Å; A1324-C1327 PolarHBondContact O-N 3.17Å; E1325-C1327 VanDerWaalsContact C-N 3.33Å; E1325-C1327 PolarHBondContact O-N 3.07Å; C1327-M1330 PolarHBondContact O-N 3.26Å; C1327-L1331 WeakPolarHBondContact O-CG 3.36Å; C1327-L1331 PolarHBondContact O-N 3.18Å; C1327-W1362 HydrophobicContact CB-CZ3 4.2Å; C1327-V1365 HydrophobicContact CB-CG1 4.41Å; C1327-V1365 HydrophobicContact CB-CG2 4.14Å
1328L77.6Confident76Confident19.2 Ų19.231.8 Ų31.810%0.10116%0.164CC..Hα-helixtrans-60.4-53.5176.9-178.283.2000110.2A1324 E1325 V1326 M1330 L1331 K1332 E1364 V1365 T1368A1324-L1328 WeakPolarHBondContact O-CB 3.35Å; A1324-L1328 PolarHBondContact O-N 3.17Å; E1325-L1328 WeakPolarHBondContact O-CB 3.21Å; E1325-L1328 PolarHBondContact O-N 3.04Å; E1325-L1328 VanDerWaalsContact O-N 3.17Å; V1326-L1328 VanDerWaalsContact C-N 3.29Å; V1326-L1328 PolarHBondContact O-N 3.22Å; L1328-M1330 VanDerWaalsContact C-N 3.3Å; L1328-M1330 PolarHBondContact O-N 3.21Å; L1328-L1331 PolarHBondContact O-N 3.22Å; L1328-L1331 VanDerWaalsContact O-N 3.14Å; L1328-K1332 VanDerWaalsContact O-CB 3.29Å; L1328-K1332 WeakPolarHBondContact O-CB 3.39Å; L1328-K1332 PolarHBondContact O-N 3.34Å; L1328-E1364 HydrophobicContact CD1-CB 4.03Å; L1328-E1364 HydrophobicContact CD1-CG 4.4Å; L1328-V1365 HydrophobicContact CB-CG2 3.93Å; L1328-V1365 HydrophobicContact CD1-CG2 4.41Å; L1328-T1368 HydrophobicContact CD1-CG2 4.34Å; L1328-T1368 VanDerWaalsContact CD1-OG1 3.26Å; L1328-T1368 WeakPolarHBondContact CD1-OG1 3.28Å; L1328-T1368 HydrophobicContact CG-CG2 4.34Å
1329W74.7Confident76.4Confident23.6 Ų23.634 Ų349%0.08917%0.172CC..Hα-helixtrans-69.5-26.1-178.4-69.3110.5000113.7I1239 C1296 C1299 Y1300 Q1306 E1325 V1326 L1331 K1332I1239-W1329 HydrophobicContact CB-CZ2 4.1Å; I1239-W1329 HydrophobicContact CD1-CZ2 4.09Å; I1239-W1329 HydrophobicContact CG1-CZ2 4.42Å; I1239-W1329 HydrophobicContact CG2-CH2 3.81Å; I1239-W1329 HydrophobicContact CG2-CZ2 3.55Å; C1296-W1329 HydrophobicContact CB-CB 4.47Å; C1296-W1329 HydrophobicContact CB-CG 4.16Å; C1299-W1329 HydrophobicContact CB-CB 4.27Å; C1299-W1329 WeakPolarHBondContact CB-O 3.46Å; Y1300-W1329 AromaticContact CD2-CE3 3.79Å; Y1300-W1329 HydrophobicContact CD2-CE3 3.79Å; Y1300-W1329 AromaticContact CD2-CH2 3.63Å; Y1300-W1329 HydrophobicContact CD2-CH2 3.63Å; Y1300-W1329 VanDerWaalsContact CD2-CH2 3.5Å; Y1300-W1329 HydrophobicContact CD2-CZ2 4.33Å; Y1300-W1329 AromaticContact CD2-CZ3 3.23Å; Y1300-W1329 HydrophobicContact CD2-CZ3 3.23Å; Y1300-W1329 HydrophobicContact CE2-CE3 4.46Å; Y1300-W1329 AromaticContact CE2-CH2 3.58Å; Y1300-W1329 HydrophobicContact CE2-CH2 3.58Å; Y1300-W1329 VanDerWaalsContact CE2-CH2 3.49Å; Y1300-W1329 HydrophobicContact CE2-CZ2 4.47Å; Y1300-W1329 AromaticContact CE2-CZ3 3.49Å; Y1300-W1329 HydrophobicContact CE2-CZ3 3.49Å; Y1300-W1329 VanDerWaalsContact CE2-CZ3 3.47Å; Y1300-W1329 HydrophobicContact CG-CZ3 4.3Å; Q1306-W1329 PolarHBondContact NE2-O 3.19Å; Q1306-W1329 VanDerWaalsContact NE2-O 3.11Å; E1325-W1329 PolarHBondContact O-N 3.04Å; V1326-W1329 PolarHBondContact O-N 3.11Å; W1329-L1331 VanDerWaalsContact C-N 3.31Å; W1329-L1331 PolarHBondContact O-N 3.18Å; W1329-K1332 HydrophobicContact CE3-CD 3.75Å; W1329-K1332 HydrophobicContact CH2-CD 4.2Å; W1329-K1332 VanDerWaalsContact CH2-NZ 3.31Å; W1329-K1332 HydrophobicContact CZ3-CD 3.49Å; W1329-K1332 VanDerWaalsContact CZ3-CD 3.46Å; W1329-K1332 VanDerWaalsContact CZ3-NZ 3.35Å
1330M79Confident77.3Confident0.4 Ų0.435.6 Ų35.60%0.00218%0.178CC..Hα-helixtrans-65-32.5171.6-76.8174.264.500113.1Q1306 L1309 L1313 F1316 V1326 C1327 L1328Q1306-M1330 WeakPolarHBondContact CB-O 3.41Å; Q1306-M1330 WeakPolarHBondContact CG-O 3.29Å; L1309-M1330 VanDerWaalsContact C-CE 3.46Å; L1309-M1330 HydrophobicContact CB-CE 4.12Å; L1309-M1330 HydrophobicContact CB-CG 4.35Å; L1309-M1330 HydrophobicContact CB-SD 4.37Å; L1309-M1330 HydrophobicContact CD2-CE 4.43Å; L1309-M1330 HydrophobicContact CD2-CG 3.66Å; L1309-M1330 HydrophobicContact CD2-SD 3.72Å; L1309-M1330 HydrophobicContact CG-CE 3.9Å; L1309-M1330 HydrophobicContact CG-CG 4.1Å; L1309-M1330 HydrophobicContact CG-SD 3.81Å; L1309-M1330 VanDerWaalsContact O-CE 3.24Å; L1309-M1330 WeakPolarHBondContact O-CE 3.39Å; L1313-M1330 HydrophobicContact CB-CE 3.91Å; L1313-M1330 HydrophobicContact CD1-CE 3.97Å; L1313-M1330 HydrophobicContact CD1-SD 4.39Å; F1316-M1330 HydrophobicContact CD2-SD 4.11Å; F1316-M1330 HydrophobicContact CE2-SD 4.42Å; V1326-M1330 HydrophobicContact CG1-CG 4.25Å; V1326-M1330 HydrophobicContact CG1-SD 3.75Å; V1326-M1330 WeakPolarHBondContact O-CB 3.43Å; V1326-M1330 WeakPolarHBondContact O-CG 3.35Å; V1326-M1330 PolarHBondContact O-N 3.16Å; C1327-M1330 PolarHBondContact O-N 3.26Å; L1328-M1330 VanDerWaalsContact C-N 3.3Å; L1328-M1330 PolarHBondContact O-N 3.21Å
1331L79.7Confident77.9Confident2.8 Ų2.831.3 Ų31.32%0.01516%0.158CC..Hα-helixtrans-108-15.8-173-63.9170.7000113.5Y1310 L1313 C1327 L1328 W1329 D1333 N1334 L1337 C1338 V1341 V1365 V1369Y1310-L1331 HydrophobicContact CD2-CD2 4.18Å; Y1310-L1331 HydrophobicContact CE2-CD2 4.01Å; L1313-L1331 HydrophobicContact CD1-CD1 4.23Å; L1313-L1331 HydrophobicContact CD1-CD2 3.95Å; L1313-L1331 HydrophobicContact CD1-CG 4.19Å; L1313-L1331 HydrophobicContact CD2-CD1 4.43Å; C1327-L1331 WeakPolarHBondContact O-CG 3.36Å; C1327-L1331 PolarHBondContact O-N 3.18Å; L1328-L1331 PolarHBondContact O-N 3.22Å; L1328-L1331 VanDerWaalsContact O-N 3.14Å; W1329-L1331 VanDerWaalsContact C-N 3.31Å; W1329-L1331 PolarHBondContact O-N 3.18Å; L1331-D1333 PolarHBondContact O-N 3.23Å; L1331-N1334 PolarHBondContact O-N 3.28Å; L1331-L1337 HydrophobicContact CD2-CB 4.08Å; L1331-C1338 PolarHBondContact O-SG 3.22Å; L1331-V1341 HydrophobicContact CD1-CG2 4.48Å; L1331-V1341 HydrophobicContact CD2-CG2 4.25Å; L1331-V1365 HydrophobicContact CD1-CG1 4.32Å; L1331-V1369 HydrophobicContact CB-CG2 4.48Å; L1331-V1369 HydrophobicContact CD1-CG2 3.58Å
1332K77.6Confident78.6Confident50 Ų5032.4 Ų32.422%0.21716%0.162CC..THydrogen-bonded Turntrans-58.4131.1-177.2-166.7-178176.2-172.50111.8Q1306 L1328 W1329 N1334 T1368Q1306-K1332 PolarHBondContact NE2-O 3.15Å; L1328-K1332 VanDerWaalsContact O-CB 3.29Å; L1328-K1332 WeakPolarHBondContact O-CB 3.39Å; L1328-K1332 PolarHBondContact O-N 3.34Å; W1329-K1332 HydrophobicContact CE3-CD 3.75Å; W1329-K1332 HydrophobicContact CH2-CD 4.2Å; W1329-K1332 VanDerWaalsContact CH2-NZ 3.31Å; W1329-K1332 HydrophobicContact CZ3-CD 3.49Å; W1329-K1332 VanDerWaalsContact CZ3-CD 3.46Å; W1329-K1332 VanDerWaalsContact CZ3-NZ 3.35Å; K1332-N1334 PolarHBondContact O-N 3.22Å; K1332-N1334 VanDerWaalsContact O-N 3.11Å; K1332-T1368 VanDerWaalsContact CA-CG2 3.48Å; K1332-T1368 HydrophobicContact CB-CG2 4.11Å; K1332-T1368 HydrophobicContact CG-CG2 4.31Å
1333D75.9Confident79.2Confident57.8 Ų57.838.6 Ų38.631%0.30918%0.184SC..THydrogen-bonded Turntrans6114.6176-53.6-25.9000115L1331 P1372 N1373L1331-D1333 PolarHBondContact O-N 3.23Å; D1333-P1372 VanDerWaalsContact CA-O 3.29Å; D1333-P1372 WeakPolarHBondContact CA-O 3.44Å; D1333-P1372 PolarHBondContact N-O 3.35Å; D1333-N1373 VanDerWaalsContact CA-OD1 3.23Å; D1333-N1373 WeakPolarHBondContact CA-OD1 3.41Å; D1333-N1373 VanDerWaalsContact CB-OD1 3.29Å; D1333-N1373 WeakPolarHBondContact CB-OD1 3.31Å; D1333-N1373 VanDerWaalsContact CG-OD1 3.32Å; D1333-N1373 PolarHBondContact O-ND2 3.2Å; D1333-N1373 VanDerWaalsContact O-ND2 3.1Å; D1333-N1373 PolarHBondContact O-OD1 3.17Å; D1333-N1373 PolarHBondContact OD1-OD1 2.88Å
1334N80.6Confident79.4Confident1.2 Ų1.240.9 Ų40.91%0.00620%0.2CC..  trans-11592.7-178.3-162.8-38.3000112.2Q1306 L1331 K1332 E1336 L1337 C1338Q1306-N1334 VanDerWaalsContact OE1-CB 3.29Å; Q1306-N1334 PolarHBondContact OE1-ND2 3.28Å; L1331-N1334 PolarHBondContact O-N 3.28Å; K1332-N1334 PolarHBondContact O-N 3.22Å; K1332-N1334 VanDerWaalsContact O-N 3.11Å; N1334-E1336 VanDerWaalsContact C-N 3.32Å; N1334-E1336 PolarHBondContact O-N 3.08Å; N1334-E1336 PolarHBondContact OD1-N 3.19Å; N1334-L1337 HydrophobicContact CB-CB 4.26Å; N1334-L1337 HydrophobicContact CB-CD1 4.35Å; N1334-L1337 HydrophobicContact CB-CG 4.43Å; N1334-L1337 VanDerWaalsContact ND2-CD1 3.32Å; N1334-L1337 WeakPolarHBondContact ND2-CD1 3.33Å; N1334-L1337 PolarHBondContact O-N 3.08Å; N1334-L1337 WeakPolarHBondContact OD1-CG 3.28Å; N1334-L1337 PolarHBondContact OD1-N 3.28Å; N1334-C1338 WeakPolarHBondContact O-CB 3.34Å; N1334-C1338 PolarHBondContact O-N 3.12Å; N1334-C1338 VanDerWaalsContact O-N 3.11Å; N1334-C1338 PolarHBondContact O-SG 3.12Å; N1334-C1338 VanDerWaalsContact O-SG 3.35Å
1335T79.6Confident79.9Confident46.8 Ų46.841.3 Ų41.329%0.28720%0.202SC..Hα-helixtrans-61.1-38.9-178.853.80000112.4C1338 M1339 P1372 N1373T1335-C1338 PolarHBondContact O-N 2.9Å; T1335-M1339 WeakPolarHBondContact O-CB 3.4Å; T1335-M1339 VanDerWaalsContact O-CG 3.29Å; T1335-M1339 WeakPolarHBondContact O-CG 3.3Å; T1335-M1339 PolarHBondContact O-N 3.13Å; T1335-M1339 VanDerWaalsContact O-N 3.12Å; T1335-P1372 HydrophobicContact CG2-CB 4.21Å; T1335-P1372 HydrophobicContact CG2-CG 3.85Å; T1335-N1373 HydrophobicContact CG2-CB 4.49Å
1336E81.2Confident80.3Confident98.4 Ų98.439.3 Ų39.346%0.4619%0.193SC..Hα-helixtrans-64.4-47.2-179.4-66-174.4174.500112K1307 N1334 C1338 M1339 M1340K1307-E1336 WeakPolarHBondContact CE-OE2 3.28Å; K1307-E1336 IonicContact NZ-OE1 2.78Å; K1307-E1336 IonicContact NZ-OE2 2.99Å; K1307-E1336 PolarHBondContact NZ-OE2 3.16Å; N1334-E1336 VanDerWaalsContact C-N 3.32Å; N1334-E1336 PolarHBondContact O-N 3.08Å; N1334-E1336 PolarHBondContact OD1-N 3.19Å; E1336-C1338 PolarHBondContact O-N 2.83Å; E1336-M1339 WeakPolarHBondContact O-CB 3.27Å; E1336-M1339 PolarHBondContact O-N 3.07Å; E1336-M1340 WeakPolarHBondContact O-CG 3.39Å; E1336-M1340 PolarHBondContact O-N 3.06Å; E1336-M1340 VanDerWaalsContact O-N 3.11Å
1337L80.6Confident80.3Confident4.4 Ų4.445.3 Ų45.32%0.02322%0.216CC..Hα-helixtrans-67.7-39.4179.4-69.2-176.9000112Q1306 K1307 Y1310 L1331 N1334 M1339 M1340 V1341Q1306-L1337 HydrophobicContact CB-CD1 3.71Å; K1307-L1337 HydrophobicContact CG-CD1 4.25Å; K1307-L1337 HydrophobicContact CG-CD2 3.96Å; K1307-L1337 HydrophobicContact CG-CG 4.23Å; Y1310-L1337 HydrophobicContact CD1-CD2 4.15Å; Y1310-L1337 HydrophobicContact CD2-CB 4.17Å; Y1310-L1337 HydrophobicContact CD2-CD1 4.2Å; Y1310-L1337 HydrophobicContact CD2-CD2 3.78Å; Y1310-L1337 HydrophobicContact CD2-CG 4.28Å; Y1310-L1337 HydrophobicContact CE2-CB 4.3Å; Y1310-L1337 HydrophobicContact CE2-CD2 4.32Å; Y1310-L1337 WeakPolarHBondContact CE2-O 3.32Å; Y1310-L1337 HydrophobicContact CG-CD1 4.47Å; Y1310-L1337 HydrophobicContact CG-CD2 3.68Å; L1331-L1337 HydrophobicContact CD2-CB 4.08Å; N1334-L1337 HydrophobicContact CB-CB 4.26Å; N1334-L1337 HydrophobicContact CB-CD1 4.35Å; N1334-L1337 HydrophobicContact CB-CG 4.43Å; N1334-L1337 VanDerWaalsContact ND2-CD1 3.32Å; N1334-L1337 WeakPolarHBondContact ND2-CD1 3.33Å; N1334-L1337 PolarHBondContact O-N 3.08Å; N1334-L1337 WeakPolarHBondContact OD1-CG 3.28Å; N1334-L1337 PolarHBondContact OD1-N 3.28Å; L1337-M1339 VanDerWaalsContact C-N 3.27Å; L1337-M1339 PolarHBondContact O-N 3.11Å; L1337-M1340 HydrophobicContact CD2-SD 4.36Å; L1337-M1340 WeakPolarHBondContact O-CB 3.27Å; L1337-M1340 PolarHBondContact O-N 3Å; L1337-V1341 WeakPolarHBondContact O-CG2 3.35Å; L1337-V1341 PolarHBondContact O-N 3.02Å
1338C80.3Confident80.4Confident0 Ų049 Ų490%023%0.232CC..Hα-helixtrans-60-35.2175.1-69.20000112.2L1331 N1334 T1335 E1336 M1340 V1341 P1372 L1377 V1380L1331-C1338 PolarHBondContact O-SG 3.22Å; N1334-C1338 WeakPolarHBondContact O-CB 3.34Å; N1334-C1338 PolarHBondContact O-N 3.12Å; N1334-C1338 VanDerWaalsContact O-N 3.11Å; N1334-C1338 PolarHBondContact O-SG 3.12Å; N1334-C1338 VanDerWaalsContact O-SG 3.35Å; T1335-C1338 PolarHBondContact O-N 2.9Å; E1336-C1338 PolarHBondContact O-N 2.83Å; C1338-M1340 VanDerWaalsContact C-N 3.34Å; C1338-V1341 WeakPolarHBondContact O-CB 3.24Å; C1338-V1341 WeakPolarHBondContact O-CG2 3.37Å; C1338-V1341 PolarHBondContact O-N 3.35Å; C1338-P1372 HydrophobicContact CB-CG 4.19Å; C1338-L1377 HydrophobicContact CB-CD1 3.58Å; C1338-V1380 WeakPolarHBondContact O-CG2 3.45Å
1339M79.9Confident80.4Confident94.4 Ų94.448.4 Ų48.447%0.46523%0.228SC..Hα-helixtrans-72.4-25.5174.9-73.2-67-6600113.6T1335 E1336 L1337 V1341 L1377 P1379 V1380T1335-M1339 WeakPolarHBondContact O-CB 3.4Å; T1335-M1339 VanDerWaalsContact O-CG 3.29Å; T1335-M1339 WeakPolarHBondContact O-CG 3.3Å; T1335-M1339 PolarHBondContact O-N 3.13Å; T1335-M1339 VanDerWaalsContact O-N 3.12Å; E1336-M1339 WeakPolarHBondContact O-CB 3.27Å; E1336-M1339 PolarHBondContact O-N 3.07Å; L1337-M1339 VanDerWaalsContact C-N 3.27Å; L1337-M1339 PolarHBondContact O-N 3.11Å; M1339-V1341 VanDerWaalsContact C-N 3.31Å; M1339-L1377 HydrophobicContact CG-CD1 3.97Å; M1339-L1377 HydrophobicContact CG-CD2 4.21Å; M1339-L1377 HydrophobicContact SD-CB 4.19Å; M1339-L1377 HydrophobicContact SD-CD1 3.97Å; M1339-L1377 HydrophobicContact SD-CD2 3.95Å; M1339-L1377 HydrophobicContact SD-CG 4.26Å; M1339-P1379 HydrophobicContact CE-CG 4.05Å; M1339-P1379 HydrophobicContact SD-CG 3.88Å; M1339-V1380 HydrophobicContact SD-CG2 4.05Å
1340M83.3Confident80.5Confident120.6 Ų120.647.3 Ų47.359%0.59422%0.224SC*.Hα-helixtrans-80.3-9.5176.3-69.9-175.417800113.5Y1310 E1336 L1337 C1338 D1342Y1310-M1340 HydrophobicContact CE1-CB 4.17Å; Y1310-M1340 WeakPolarHBondContact OH-CB 3.45Å; Y1310-M1340 PolarHBondContact OH-O 3.21Å; E1336-M1340 WeakPolarHBondContact O-CG 3.39Å; E1336-M1340 PolarHBondContact O-N 3.06Å; E1336-M1340 VanDerWaalsContact O-N 3.11Å; L1337-M1340 HydrophobicContact CD2-SD 4.36Å; L1337-M1340 WeakPolarHBondContact O-CB 3.27Å; L1337-M1340 PolarHBondContact O-N 3Å; C1338-M1340 VanDerWaalsContact C-N 3.34Å; M1340-D1342 PolarHBondContact O-N 3.13Å; M1340-D1342 VanDerWaalsContact O-N 3.15Å
1341V82.2Confident80.3Confident6.6 Ų6.651.4 Ų51.44%0.0424%0.242CC..  trans-66121.5-179.7-1780000109.9Y1310 L1331 L1337 C1338 M1339 T1345 I1346 M1383Y1310-V1341 HydrophobicContact CE2-CG2 4.39Å; Y1310-V1341 VanDerWaalsContact OH-CA 3.29Å; Y1310-V1341 WeakPolarHBondContact OH-CA 3.47Å; Y1310-V1341 PolarHBondContact OH-N 3.19Å; Y1310-V1341 VanDerWaalsContact OH-N 3.11Å; L1331-V1341 HydrophobicContact CD1-CG2 4.48Å; L1331-V1341 HydrophobicContact CD2-CG2 4.25Å; L1337-V1341 WeakPolarHBondContact O-CG2 3.35Å; L1337-V1341 PolarHBondContact O-N 3.02Å; C1338-V1341 WeakPolarHBondContact O-CB 3.24Å; C1338-V1341 WeakPolarHBondContact O-CG2 3.37Å; C1338-V1341 PolarHBondContact O-N 3.35Å; M1339-V1341 VanDerWaalsContact C-N 3.31Å; V1341-T1345 WeakPolarHBondContact CG1-OG1 3.4Å; V1341-I1346 HydrophobicContact CG1-CD1 4.07Å; V1341-I1346 HydrophobicContact CG1-CG1 3.68Å; V1341-M1383 WeakPolarHBondContact O-CE 3.38Å
1342D83Confident80Confident75.6 Ų75.652.5 Ų52.540%0.40425%0.247SC..  trans-82.9162.9-176.364.8-42.2000113.1M1340 S1344 T1345 I1346M1340-D1342 PolarHBondContact O-N 3.13Å; M1340-D1342 VanDerWaalsContact O-N 3.15Å; D1342-S1344 WeakPolarHBondContact CB-OG 2.87Å; D1342-S1344 PolarHBondContact O-N 3.16Å; D1342-S1344 VanDerWaalsContact O-N 3.14Å; D1342-S1344 WeakPolarHBondContact OD2-CB 3.45Å; D1342-S1344 PolarHBondContact OD2-N 3.08Å; D1342-S1344 VanDerWaalsContact OD2-N 3.12Å; D1342-S1344 PolarHBondContact OD2-OG 3.4Å; D1342-T1345 PolarHBondContact N-OG1 3.11Å; D1342-T1345 PolarHBondContact O-N 3.27Å; D1342-T1345 PolarHBondContact O-OG1 3.06Å; D1342-T1345 VanDerWaalsContact OD1-CB 3.24Å; D1342-T1345 WeakPolarHBondContact OD1-CB 3.27Å; D1342-T1345 WeakPolarHBondContact OD1-CG2 3.34Å; D1342-T1345 PolarHBondContact OD1-N 3.24Å; D1342-T1345 PolarHBondContact OD1-OG1 3.05Å; D1342-I1346 WeakPolarHBondContact O-CG1 3.42Å; D1342-I1346 PolarHBondContact O-N 3.2Å
1343R81.3Confident79.6Confident159 Ų15950.5 Ų50.560%0.624%0.239SC*.Hα-helixtrans-57.6-31.2175.7-75.7-175.7-178.9-167.30.6113R1347 M1383R1343-R1347 WeakPolarHBondContact O-CB 3.38Å; R1343-R1347 WeakPolarHBondContact O-CG 3.42Å; R1343-R1347 PolarHBondContact O-N 3.03Å; R1343-R1347 VanDerWaalsContact O-N 3.14Å; R1343-M1383 HydrophobicContact CB-CE 4.2Å; R1343-M1383 HydrophobicContact CB-SD 4.07Å; R1343-M1383 HydrophobicContact CG-CB 4.45Å; R1343-M1383 HydrophobicContact CG-CE 3.32Å; R1343-M1383 HydrophobicContact CG-CG 3.76Å; R1343-M1383 HydrophobicContact CG-SD 3.25Å; R1343-M1383 VanDerWaalsContact CG-SD 3.51Å; R1343-M1383 WeakPolarHBondContact CG-SD 3.38Å; R1343-M1383 PolarHBondContact NE-SD 3.35Å; R1343-M1383 VanDerWaalsContact NE-SD 3.42Å
1344S83.4Confident79.3Confident55.4 Ų55.450.8 Ų50.839%0.38724%0.238SC..Hα-helixtrans-73.1-40.2-175.682.40000112.3D1342 R1347 K1348D1342-S1344 WeakPolarHBondContact CB-OG 2.87Å; D1342-S1344 PolarHBondContact O-N 3.16Å; D1342-S1344 VanDerWaalsContact O-N 3.14Å; D1342-S1344 WeakPolarHBondContact OD2-CB 3.45Å; D1342-S1344 PolarHBondContact OD2-N 3.08Å; D1342-S1344 VanDerWaalsContact OD2-N 3.12Å; D1342-S1344 PolarHBondContact OD2-OG 3.4Å; S1344-R1347 WeakPolarHBondContact O-CB 3.34Å; S1344-R1347 PolarHBondContact O-N 3.13Å; S1344-K1348 WeakPolarHBondContact O-CG 3.35Å; S1344-K1348 PolarHBondContact O-N 2.95Å; S1344-K1348 VanDerWaalsContact O-N 3.09Å
1345T83.7Confident78.5Confident7.4 Ų7.456 Ų565%0.04526%0.261CS..Hα-helixtrans-66.3-43.7174.751.50000110.9L1313 D1314 I1317 V1341 D1342 R1347 K1348 L1349L1313-T1345 HydrophobicContact CD2-CG2 4.1Å; D1314-T1345 WeakPolarHBondContact OD1-CG2 3.44Å; I1317-T1345 HydrophobicContact CD1-CG2 3.97Å; V1341-T1345 WeakPolarHBondContact CG1-OG1 3.4Å; D1342-T1345 PolarHBondContact N-OG1 3.11Å; D1342-T1345 PolarHBondContact O-N 3.27Å; D1342-T1345 PolarHBondContact O-OG1 3.06Å; D1342-T1345 VanDerWaalsContact OD1-CB 3.24Å; D1342-T1345 WeakPolarHBondContact OD1-CB 3.27Å; D1342-T1345 WeakPolarHBondContact OD1-CG2 3.34Å; D1342-T1345 PolarHBondContact OD1-N 3.24Å; D1342-T1345 PolarHBondContact OD1-OG1 3.05Å; T1345-R1347 VanDerWaalsContact C-N 3.32Å; T1345-R1347 PolarHBondContact O-N 3.06Å; T1345-K1348 WeakPolarHBondContact O-CA 3.3Å; T1345-K1348 WeakPolarHBondContact O-CB 3.39Å; T1345-K1348 PolarHBondContact O-N 3.1Å; T1345-K1348 VanDerWaalsContact O-N 3.1Å; T1345-L1349 VanDerWaalsContact O-CG 3.3Å; T1345-L1349 WeakPolarHBondContact O-CG 3.33Å; T1345-L1349 PolarHBondContact O-N 3.15Å
1346I81.5Confident77.4Confident0.2 Ų0.256.9 Ų56.90%0.00127%0.269CS..Hα-helixtrans-59.3-43175.4-64.2-167.7000111.6V1341 D1342 K1348 L1349 C1350 V1380 M1383 I1384 E1387V1341-I1346 HydrophobicContact CG1-CD1 4.07Å; V1341-I1346 HydrophobicContact CG1-CG1 3.68Å; D1342-I1346 WeakPolarHBondContact O-CG1 3.42Å; D1342-I1346 PolarHBondContact O-N 3.2Å; I1346-K1348 VanDerWaalsContact C-N 3.3Å; I1346-K1348 PolarHBondContact O-N 3.13Å; I1346-L1349 WeakPolarHBondContact O-CB 3.31Å; I1346-L1349 PolarHBondContact O-N 3.19Å; I1346-C1350 WeakPolarHBondContact O-CB 3.38Å; I1346-C1350 PolarHBondContact O-N 3.18Å; I1346-C1350 PolarHBondContact O-SG 3.1Å; I1346-C1350 VanDerWaalsContact O-SG 3.33Å; I1346-V1380 HydrophobicContact CD1-CG1 4.24Å; I1346-M1383 HydrophobicContact CD1-CB 4.31Å; I1346-M1383 HydrophobicContact CD1-CE 3.2Å; I1346-M1383 HydrophobicContact CD1-CG 3.99Å; I1346-M1383 HydrophobicContact CD1-SD 4.1Å; I1346-M1383 VanDerWaalsContact CD1-SD 3.57Å; I1346-M1383 HydrophobicContact CG1-CE 3.83Å; I1346-I1384 HydrophobicContact CD1-CD1 3.99Å; I1346-I1384 HydrophobicContact CD1-CG1 3.78Å; I1346-I1384 HydrophobicContact CG1-CG1 4.36Å; I1346-I1384 HydrophobicContact CG2-CG1 3.69Å; I1346-E1387 HydrophobicContact CG2-CB 4.38Å; I1346-E1387 HydrophobicContact CG2-CG 4.34Å
1347R81.4Confident76.3Confident127.4 Ų127.460.7 Ų60.748%0.48128%0.279SS..Hα-helixtrans-58.9-42174.3-140.1176.3-175.1127.60.9112.5R1343 S1344 T1345 C1350 F1351 E1387 M1391R1343-R1347 WeakPolarHBondContact O-CB 3.38Å; R1343-R1347 WeakPolarHBondContact O-CG 3.42Å; R1343-R1347 PolarHBondContact O-N 3.03Å; R1343-R1347 VanDerWaalsContact O-N 3.14Å; S1344-R1347 WeakPolarHBondContact O-CB 3.34Å; S1344-R1347 PolarHBondContact O-N 3.13Å; T1345-R1347 VanDerWaalsContact C-N 3.32Å; T1345-R1347 PolarHBondContact O-N 3.06Å; R1347-C1350 PolarHBondContact O-N 3.08Å; R1347-F1351 VanDerWaalsContact O-CB 3.29Å; R1347-F1351 WeakPolarHBondContact O-CB 3.28Å; R1347-F1351 PolarHBondContact O-N 3.11Å; R1347-E1387 HydrophobicContact CB-CG 4.26Å; R1347-E1387 WeakPolarHBondContact CB-OE1 3.47Å; R1347-E1387 VanDerWaalsContact CD-OE1 3.27Å; R1347-E1387 WeakPolarHBondContact CD-OE1 3.38Å; R1347-E1387 HydrophobicContact CG-CG 4.03Å; R1347-E1387 VanDerWaalsContact CG-OE1 3.23Å; R1347-E1387 WeakPolarHBondContact CG-OE1 3.32Å; R1347-E1387 WeakPolarHBondContact CG-OE2 3.41Å; R1347-E1387 IonicContact CZ-OE1 2.92Å; R1347-E1387 IonicContact CZ-OE2 3Å; R1347-E1387 VanDerWaalsContact NE-CD 3.26Å; R1347-E1387 IonicContact NE-OE1 3.21Å; R1347-E1387 PolarHBondContact NE-OE1 2.88Å; R1347-E1387 IonicContact NE-OE2 3.87Å; R1347-E1387 PolarHBondContact NE-OE2 3.14Å; R1347-E1387 VanDerWaalsContact NE-OE2 3.16Å; R1347-E1387 IonicContact NH1-OE1 3.43Å; R1347-E1387 PolarHBondContact NH1-OE1 3.27Å; R1347-E1387 IonicContact NH1-OE2 3.36Å; R1347-E1387 PolarHBondContact NH1-OE2 3.39Å; R1347-E1387 IonicContact NH2-OE1 2.68Å; R1347-E1387 PolarHBondContact NH2-OE1 3.32Å; R1347-E1387 IonicContact NH2-OE2 2.66Å; R1347-E1387 PolarHBondContact NH2-OE2 3.34Å; R1347-M1391 HydrophobicContact CG-CE 4.38Å; R1347-M1391 HydrophobicContact CG-SD 4Å; R1347-M1391 VanDerWaalsContact CG-SD 3.55Å
1348K80.9Confident75.1Confident77.6 Ų77.661.5 Ų61.534%0.33728%0.284SS..Hα-helixtrans-63.1-48.4175-67.1172.3-168.3175.30110.6D1314 I1317 S1344 T1345 I1346 C1350 F1351 F1352D1314-K1348 IonicContact OD1-NZ 3.24Å; D1314-K1348 PolarHBondContact OD1-NZ 3.23Å; D1314-K1348 IonicContact OD2-NZ 3.14Å; D1314-K1348 PolarHBondContact OD2-NZ 3.21Å; D1314-K1348 VanDerWaalsContact OD2-NZ 3.08Å; I1317-K1348 HydrophobicContact CD1-CB 4.38Å; I1317-K1348 HydrophobicContact CD1-CD 4.28Å; I1317-K1348 HydrophobicContact CG2-CB 3.97Å; I1317-K1348 HydrophobicContact CG2-CD 4.38Å; S1344-K1348 WeakPolarHBondContact O-CG 3.35Å; S1344-K1348 PolarHBondContact O-N 2.95Å; S1344-K1348 VanDerWaalsContact O-N 3.09Å; T1345-K1348 WeakPolarHBondContact O-CA 3.3Å; T1345-K1348 WeakPolarHBondContact O-CB 3.39Å; T1345-K1348 PolarHBondContact O-N 3.1Å; T1345-K1348 VanDerWaalsContact O-N 3.1Å; I1346-K1348 VanDerWaalsContact C-N 3.3Å; I1346-K1348 PolarHBondContact O-N 3.13Å; K1348-C1350 VanDerWaalsContact C-N 3.33Å; K1348-C1350 PolarHBondContact O-N 3.09Å; K1348-F1351 WeakPolarHBondContact O-CA 3.27Å; K1348-F1351 VanDerWaalsContact O-CB 3.3Å; K1348-F1351 WeakPolarHBondContact O-CB 3.31Å; K1348-F1351 PolarHBondContact O-N 3.19Å; K1348-F1351 VanDerWaalsContact O-N 3.12Å; K1348-F1352 HydrophobicContact CB-CD2 4.39Å; K1348-F1352 HydrophobicContact CB-CE2 4.31Å; K1348-F1352 WeakPolarHBondContact O-CD2 3.4Å; K1348-F1352 WeakPolarHBondContact O-CE2 3.21Å; K1348-F1352 WeakPolarHBondContact O-CG 3.34Å; K1348-F1352 PolarHBondContact O-N 3.26Å; K1348-F1352 VanDerWaalsContact O-N 3.15Å
1349L79.1Confident74.4Confident6.4 Ų6.465 Ų653%0.03430%0.298CS..Hα-helixtrans-56.2-47.5176.9-66172.7000111.6I1317 T1345 I1346 F1351 F1352 L1353 W1362 V1365 L1366I1317-L1349 HydrophobicContact CD1-CD2 4.39Å; I1317-L1349 HydrophobicContact CG1-CD2 4.19Å; I1317-L1349 HydrophobicContact CG2-CD2 4.11Å; I1317-L1349 HydrophobicContact CG2-CG 4.45Å; T1345-L1349 VanDerWaalsContact O-CG 3.3Å; T1345-L1349 WeakPolarHBondContact O-CG 3.33Å; T1345-L1349 PolarHBondContact O-N 3.15Å; I1346-L1349 WeakPolarHBondContact O-CB 3.31Å; I1346-L1349 PolarHBondContact O-N 3.19Å; L1349-F1351 VanDerWaalsContact C-N 3.31Å; L1349-F1351 PolarHBondContact O-N 3.01Å; L1349-F1352 PolarHBondContact O-N 3.21Å; L1349-L1353 WeakPolarHBondContact O-CG 3.42Å; L1349-L1353 PolarHBondContact O-N 2.96Å; L1349-W1362 HydrophobicContact CD2-CD2 4.45Å; L1349-W1362 HydrophobicContact CD2-CE3 3.36Å; L1349-W1362 VanDerWaalsContact CD2-CE3 3.46Å; L1349-W1362 HydrophobicContact CD2-CH2 4.33Å; L1349-W1362 HydrophobicContact CD2-CZ3 3.26Å; L1349-V1365 HydrophobicContact CD1-CG1 4.38Å; L1349-V1365 HydrophobicContact CD2-CG1 4.42Å; L1349-L1366 HydrophobicContact CB-CD2 4.21Å; L1349-L1366 HydrophobicContact CD1-CD2 4.19Å
1350C75.9Confident73.9Confident0.2 Ų0.260.7 Ų60.70%0.00128%0.278CS..Hα-helixtrans-62.9-35.6175.5-68.80000112.6I1346 R1347 K1348 F1352 L1353 Q1354 E1387 M1391 F1392I1346-C1350 WeakPolarHBondContact O-CB 3.38Å; I1346-C1350 PolarHBondContact O-N 3.18Å; I1346-C1350 PolarHBondContact O-SG 3.1Å; I1346-C1350 VanDerWaalsContact O-SG 3.33Å; R1347-C1350 PolarHBondContact O-N 3.08Å; K1348-C1350 VanDerWaalsContact C-N 3.33Å; K1348-C1350 PolarHBondContact O-N 3.09Å; C1350-F1352 VanDerWaalsContact C-N 3.31Å; C1350-F1352 PolarHBondContact O-N 3.22Å; C1350-L1353 VanDerWaalsContact O-CB 3.3Å; C1350-L1353 WeakPolarHBondContact O-CB 3.42Å; C1350-L1353 PolarHBondContact O-N 3.38Å; C1350-L1353 VanDerWaalsContact O-N 3.15Å; C1350-Q1354 PolarHBondContact O-N 2.98Å; C1350-E1387 HydrophobicContact CB-CG 4.41Å; C1350-M1391 HydrophobicContact CB-SD 3.61Å; C1350-M1391 VanDerWaalsContact CB-SD 3.51Å; C1350-M1391 WeakPolarHBondContact CB-SD 3.47Å; C1350-F1392 HydrophobicContact CB-CE2 4.31Å; C1350-F1392 HydrophobicContact CB-CZ 4.06Å; C1350-F1392 VanDerWaalsContact O-CZ 3.25Å; C1350-F1392 WeakPolarHBondContact O-CZ 3.42Å
1351F75.8Confident73.5Confident86.8 Ų86.857.6 Ų57.638%0.38126%0.262SS..Hα-helixtrans-65.4-36.9175179.6-101.6000112.7R1347 K1348 L1349 L1353 Q1354 K1355 M1391R1347-F1351 VanDerWaalsContact O-CB 3.29Å; R1347-F1351 WeakPolarHBondContact O-CB 3.28Å; R1347-F1351 PolarHBondContact O-N 3.11Å; K1348-F1351 WeakPolarHBondContact O-CA 3.27Å; K1348-F1351 VanDerWaalsContact O-CB 3.3Å; K1348-F1351 WeakPolarHBondContact O-CB 3.31Å; K1348-F1351 PolarHBondContact O-N 3.19Å; K1348-F1351 VanDerWaalsContact O-N 3.12Å; L1349-F1351 VanDerWaalsContact C-N 3.31Å; L1349-F1351 PolarHBondContact O-N 3.01Å; F1351-L1353 VanDerWaalsContact C-N 3.3Å; F1351-L1353 PolarHBondContact O-N 3.27Å; F1351-Q1354 VanDerWaalsContact O-CB 3.28Å; F1351-Q1354 WeakPolarHBondContact O-CB 3.26Å; F1351-Q1354 PolarHBondContact O-N 3.31Å; F1351-Q1354 VanDerWaalsContact O-N 3.11Å; F1351-K1355 HydrophobicContact CD1-CD 4.34Å; F1351-K1355 HydrophobicContact CE1-CD 3.57Å; F1351-K1355 VanDerWaalsContact CE1-CD 3.45Å; F1351-K1355 VanDerWaalsContact CE1-CE 3.48Å; F1351-K1355 HydrophobicContact CE1-CG 4.26Å; F1351-K1355 HydrophobicContact CE2-CD 4.14Å; F1351-K1355 HydrophobicContact CE2-CG 4.47Å; F1351-K1355 HydrophobicContact CZ-CD 3.56Å; F1351-K1355 HydrophobicContact CZ-CG 4.18Å; F1351-K1355 PolarHBondContact O-N 3.13Å; F1351-M1391 HydrophobicContact CB-CE 3.91Å; F1351-M1391 HydrophobicContact CB-SD 4.44Å; F1351-M1391 HydrophobicContact CD2-CE 4.1Å; F1351-M1391 HydrophobicContact CG-CE 4.49Å
1352F72.1Confident73.3Confident25.8 Ų25.857.4 Ų57.411%0.11326%0.26CS..Hα-helixtrans-66.7-28.1175.1-71-71.7000112.6I1317 T1318 N1319 K1348 L1349 C1350 Q1354 K1355 S1356 W1362I1317-F1352 HydrophobicContact CB-CE2 4.25Å; I1317-F1352 HydrophobicContact CG2-CD2 3.73Å; I1317-F1352 VanDerWaalsContact CG2-CD2 3.4Å; I1317-F1352 HydrophobicContact CG2-CE2 3.34Å; I1317-F1352 VanDerWaalsContact CG2-CE2 3.44Å; I1317-F1352 HydrophobicContact CG2-CZ 4.26Å; I1317-F1352 VanDerWaalsContact O-CE2 3.22Å; I1317-F1352 WeakPolarHBondContact O-CE2 3.42Å; I1317-F1352 WeakPolarHBondContact O-CZ 3.33Å; T1318-F1352 VanDerWaalsContact C-CE1 3.44Å; T1318-F1352 VanDerWaalsContact O-CE1 3.25Å; T1318-F1352 WeakPolarHBondContact O-CE1 3.44Å; N1319-F1352 VanDerWaalsContact OD1-CD1 3.25Å; N1319-F1352 WeakPolarHBondContact OD1-CD1 3.31Å; N1319-F1352 WeakPolarHBondContact OD1-CE1 3.35Å; K1348-F1352 HydrophobicContact CB-CD2 4.39Å; K1348-F1352 HydrophobicContact CB-CE2 4.31Å; K1348-F1352 WeakPolarHBondContact O-CD2 3.4Å; K1348-F1352 WeakPolarHBondContact O-CE2 3.21Å; K1348-F1352 WeakPolarHBondContact O-CG 3.34Å; K1348-F1352 PolarHBondContact O-N 3.26Å; K1348-F1352 VanDerWaalsContact O-N 3.15Å; L1349-F1352 PolarHBondContact O-N 3.21Å; C1350-F1352 VanDerWaalsContact C-N 3.31Å; C1350-F1352 PolarHBondContact O-N 3.22Å; F1352-Q1354 VanDerWaalsContact C-N 3.27Å; F1352-Q1354 PolarHBondContact O-N 3.2Å; F1352-K1355 HydrophobicContact CD1-CD 4.38Å; F1352-K1355 PolarHBondContact O-N 3.22Å; F1352-S1356 WeakPolarHBondContact CD1-OG 3.26Å; F1352-S1356 WeakPolarHBondContact O-CB 3.47Å; F1352-S1356 PolarHBondContact O-N 3.32Å; F1352-S1356 PolarHBondContact O-OG 3.32Å; F1352-W1362 HydrophobicContact CB-CG 4.38Å
1353L70.8Confident73.1Confident7.8 Ų7.853.8 Ų53.84%0.04124%0.241CC..Hα-helixtrans-63.5-24.9171.1-63.2178.2000113.1L1349 C1350 F1351 Y1359 W1362 L1363 L1366 L1388 F1392 L1396 M1399 F1440L1349-L1353 WeakPolarHBondContact O-CG 3.42Å; L1349-L1353 PolarHBondContact O-N 2.96Å; C1350-L1353 VanDerWaalsContact O-CB 3.3Å; C1350-L1353 WeakPolarHBondContact O-CB 3.42Å; C1350-L1353 PolarHBondContact O-N 3.38Å; C1350-L1353 VanDerWaalsContact O-N 3.15Å; F1351-L1353 VanDerWaalsContact C-N 3.3Å; F1351-L1353 PolarHBondContact O-N 3.27Å; L1353-Y1359 WeakPolarHBondContact O-CD1 3.39Å; L1353-W1362 HydrophobicContact CD2-CB 3.91Å; L1353-W1362 HydrophobicContact CG-CB 4.25Å; L1353-L1363 HydrophobicContact CD1-CD2 3.98Å; L1353-L1363 HydrophobicContact CD2-CD2 3.8Å; L1353-L1363 HydrophobicContact CD2-CG 3.8Å; L1353-L1363 HydrophobicContact CG-CD2 4.48Å; L1353-L1366 HydrophobicContact CD1-CD1 3.58Å; L1353-L1366 VanDerWaalsContact CD1-CD1 3.44Å; L1353-L1366 HydrophobicContact CG-CD1 4.33Å; L1353-L1388 HydrophobicContact CD1-CD2 4.27Å; L1353-F1392 HydrophobicContact CB-CE1 4.38Å; L1353-F1392 HydrophobicContact CB-CZ 4.19Å; L1353-F1392 HydrophobicContact CD1-CZ 4.33Å; L1353-L1396 HydrophobicContact CB-CD1 4.22Å; L1353-L1396 WeakPolarHBondContact O-CD2 3.44Å; L1353-M1399 WeakPolarHBondContact O-CE 3.41Å; L1353-F1440 HydrophobicContact CD2-CE2 4.34Å; L1353-F1440 HydrophobicContact CD2-CZ 4.44Å
1354Q67.6Low72.9Confident63.8 Ų63.847.9 Ų47.930%0.29822%0.22SC..Hα-helixtrans-84.9-29.3-179.6-96.2-176.26.300113.5C1350 F1351 F1352 M1391 F1392 T1395C1350-Q1354 PolarHBondContact O-N 2.98Å; F1351-Q1354 VanDerWaalsContact O-CB 3.28Å; F1351-Q1354 WeakPolarHBondContact O-CB 3.26Å; F1351-Q1354 PolarHBondContact O-N 3.31Å; F1351-Q1354 VanDerWaalsContact O-N 3.11Å; F1352-Q1354 VanDerWaalsContact C-N 3.27Å; F1352-Q1354 PolarHBondContact O-N 3.2Å; Q1354-M1391 HydrophobicContact CG-CE 4.34Å; Q1354-M1391 PolarHBondContact NE2-O 3.26Å; Q1354-F1392 HydrophobicContact CB-CE1 4.21Å; Q1354-F1392 HydrophobicContact CG-CD1 4.1Å; Q1354-F1392 HydrophobicContact CG-CE1 3.6Å; Q1354-F1392 HydrophobicContact CG-CZ 4.12Å; Q1354-F1392 VanDerWaalsContact NE2-CE1 3.34Å; Q1354-T1395 VanDerWaalsContact NE2-CG2 3.26Å; Q1354-T1395 PolarHBondContact NE2-OG1 3.2Å; Q1354-T1395 VanDerWaalsContact NE2-OG1 3.11Å
1355K65.6Low72.8Confident112 Ų11245.3 Ų45.349%0.48720%0.202SC..Hα-helixtrans-81.1-27.7-169.5-86.8-167.2179.1179.90113.3N1319 F1351 F1352 R1357 P1358 M1399N1319-K1355 VanDerWaalsContact CG-NZ 3.34Å; N1319-K1355 PolarHBondContact ND2-NZ 2.85Å; N1319-K1355 VanDerWaalsContact OD1-CD 3.25Å; N1319-K1355 WeakPolarHBondContact OD1-CD 3.35Å; N1319-K1355 WeakPolarHBondContact OD1-CE 3.47Å; N1319-K1355 PolarHBondContact OD1-NZ 3.24Å; F1351-K1355 HydrophobicContact CD1-CD 4.34Å; F1351-K1355 HydrophobicContact CE1-CD 3.57Å; F1351-K1355 VanDerWaalsContact CE1-CD 3.45Å; F1351-K1355 VanDerWaalsContact CE1-CE 3.48Å; F1351-K1355 HydrophobicContact CE1-CG 4.26Å; F1351-K1355 HydrophobicContact CE2-CD 4.14Å; F1351-K1355 HydrophobicContact CE2-CG 4.47Å; F1351-K1355 HydrophobicContact CZ-CD 3.56Å; F1351-K1355 HydrophobicContact CZ-CG 4.18Å; F1351-K1355 PolarHBondContact O-N 3.13Å; F1352-K1355 HydrophobicContact CD1-CD 4.38Å; F1352-K1355 PolarHBondContact O-N 3.22Å; K1355-R1357 PolarHBondContact O-N 3.42Å; K1355-P1358 WeakPolarHBondContact O-CD 3.27Å; K1355-M1399 WeakPolarHBondContact O-CE 3.21Å
1356S55.6Low72.7Confident66 Ų6644.9 Ų44.946%0.46220%0.2SC..SBendtrans-94.1118.7-170.656.10000113.2N1319 F1352 Y1359N1319-S1356 WeakPolarHBondContact OD1-CB 3.25Å; F1352-S1356 WeakPolarHBondContact CD1-OG 3.26Å; F1352-S1356 WeakPolarHBondContact O-CB 3.47Å; F1352-S1356 PolarHBondContact O-N 3.32Å; F1352-S1356 PolarHBondContact O-OG 3.32Å; S1356-Y1359 WeakPolarHBondContact O-CD1 3.36Å; S1356-Y1359 WeakPolarHBondContact O-CE1 3.31Å
1357R57.8Low72.7Confident177.6 Ų177.645.9 Ų45.967%0.6721%0.205SC*.SBendtrans-79.5118.1168.8-128.3-175.5175.2156.5-2109.4K1355 Y1359K1355-R1357 PolarHBondContact O-N 3.42Å; R1357-Y1359 VanDerWaalsContact C-N 3.32Å; R1357-Y1359 HydrophobicContact CB-CE2 4.25Å; R1357-Y1359 HydrophobicContact CG-CD2 4.06Å; R1357-Y1359 HydrophobicContact CG-CE2 3.23Å; R1357-Y1359 WeakPolarHBondContact CG-OH 3.17Å; R1357-Y1359 VanDerWaalsContact O-CD2 3.31Å; R1357-Y1359 WeakPolarHBondContact O-CD2 3.43Å; R1357-Y1359 PolarHBondContact O-N 3.23Å
1358P56Low72.6Confident20.4 Ų20.440.9 Ų40.913%0.13219%0.188CC..  trans-76.4107.7177.631.6-33.6000111.5N1319 T1321 K1355 V1360 M1399 F1440N1319-P1358 WeakPolarHBondContact O-CD 3.34Å; T1321-P1358 HydrophobicContact CG2-CB 3.75Å; T1321-P1358 HydrophobicContact CG2-CG 3.43Å; T1321-P1358 VanDerWaalsContact CG2-CG 3.43Å; K1355-P1358 WeakPolarHBondContact O-CD 3.27Å; P1358-V1360 VanDerWaalsContact C-N 3.27Å; P1358-V1360 PolarHBondContact O-N 3.31Å; P1358-V1360 VanDerWaalsContact O-N 3.16Å; P1358-M1399 HydrophobicContact CB-CE 3.99Å; P1358-M1399 VanDerWaalsContact CD-CE 3.42Å; P1358-M1399 HydrophobicContact CG-CE 3.71Å; P1358-M1399 HydrophobicContact CG-SD 4.05Å; P1358-F1440 HydrophobicContact CB-CB 3.68Å; P1358-F1440 HydrophobicContact CB-CD1 3.91Å; P1358-F1440 HydrophobicContact CB-CD2 3.53Å; P1358-F1440 HydrophobicContact CB-CE1 4.28Å; P1358-F1440 HydrophobicContact CB-CE2 3.67Å; P1358-F1440 HydrophobicContact CB-CG 3.35Å; P1358-F1440 VanDerWaalsContact CB-CG 3.4Å; P1358-F1440 HydrophobicContact CB-CZ 4.03Å; P1358-F1440 VanDerWaalsContact CB-CZ 3.46Å; P1358-F1440 HydrophobicContact CG-CD1 3.9Å; P1358-F1440 HydrophobicContact CG-CD2 3.83Å; P1358-F1440 HydrophobicContact CG-CE1 3.67Å; P1358-F1440 HydrophobicContact CG-CE2 3.61Å; P1358-F1440 HydrophobicContact CG-CG 3.99Å; P1358-F1440 HydrophobicContact CG-CZ 3.53Å
1359Y64.3Low72.8Confident73 Ų7337.3 Ų37.329%0.28617%0.172SC..  trans-78.6107.7176.7-59.3-68.6000110.1N1319 T1321 L1353 S1356 R1357 H1361 W1362 L1363 M1399 F1440N1319-Y1359 VanDerWaalsContact O-CE2 3.23Å; N1319-Y1359 WeakPolarHBondContact O-CE2 3.33Å; T1321-Y1359 HydrophobicContact CG2-CD1 3.5Å; T1321-Y1359 VanDerWaalsContact CG2-CD1 3.46Å; T1321-Y1359 HydrophobicContact CG2-CD2 4.37Å; T1321-Y1359 HydrophobicContact CG2-CE1 3.3Å; T1321-Y1359 HydrophobicContact CG2-CE2 4.36Å; T1321-Y1359 HydrophobicContact CG2-CG 4.07Å; L1353-Y1359 WeakPolarHBondContact O-CD1 3.39Å; S1356-Y1359 WeakPolarHBondContact O-CD1 3.36Å; S1356-Y1359 WeakPolarHBondContact O-CE1 3.31Å; R1357-Y1359 VanDerWaalsContact C-N 3.32Å; R1357-Y1359 HydrophobicContact CB-CE2 4.25Å; R1357-Y1359 HydrophobicContact CG-CD2 4.06Å; R1357-Y1359 HydrophobicContact CG-CE2 3.23Å; R1357-Y1359 WeakPolarHBondContact CG-OH 3.17Å; R1357-Y1359 VanDerWaalsContact O-CD2 3.31Å; R1357-Y1359 WeakPolarHBondContact O-CD2 3.43Å; R1357-Y1359 PolarHBondContact O-N 3.23Å; Y1359-H1361 PolarHBondContact O-N 3.17Å; Y1359-H1361 VanDerWaalsContact O-N 3.11Å; Y1359-W1362 PolarHBondContact O-N 3.23Å; Y1359-L1363 PolarHBondContact O-N 3.28Å; Y1359-L1363 VanDerWaalsContact O-N 3.16Å; Y1359-M1399 HydrophobicContact CD2-CE 3.69Å; Y1359-M1399 HydrophobicContact CD2-SD 4.36Å; Y1359-M1399 HydrophobicContact CE1-SD 4.42Å; Y1359-M1399 HydrophobicContact CE2-CE 3.5Å; Y1359-M1399 VanDerWaalsContact CE2-CE 3.5Å; Y1359-M1399 HydrophobicContact CE2-SD 3.92Å; Y1359-M1399 HydrophobicContact CG-CE 4.48Å; Y1359-F1440 HydrophobicContact CG-CD2 4.34Å; Y1359-F1440 HydrophobicContact CG-CE2 4.23Å
1360V69.4Low72.9Confident5.8 Ų5.837 Ų374%0.03517%0.171CC..Hα-helixtrans-55.9-37.5177.9178.10000111.6P1358 W1362 L1363 E1364 L1439 F1440 K1443P1358-V1360 VanDerWaalsContact C-N 3.27Å; P1358-V1360 PolarHBondContact O-N 3.31Å; P1358-V1360 VanDerWaalsContact O-N 3.16Å; V1360-W1362 VanDerWaalsContact C-N 3.3Å; V1360-W1362 PolarHBondContact O-N 3.16Å; V1360-L1363 WeakPolarHBondContact O-CB 3.39Å; V1360-L1363 PolarHBondContact O-N 3.22Å; V1360-L1363 VanDerWaalsContact O-N 3.11Å; V1360-E1364 HydrophobicContact CG1-CG 4.4Å; V1360-E1364 WeakPolarHBondContact O-CG 3.32Å; V1360-E1364 PolarHBondContact O-N 3.13Å; V1360-E1364 VanDerWaalsContact O-N 3.16Å; V1360-L1439 HydrophobicContact CB-CD2 4.26Å; V1360-L1439 HydrophobicContact CG1-CD2 3.73Å; V1360-L1439 HydrophobicContact CG1-CG 3.82Å; V1360-L1439 HydrophobicContact CG2-CB 4.36Å; V1360-L1439 HydrophobicContact CG2-CD2 3.91Å; V1360-L1439 VanDerWaalsContact CG2-CD2 3.47Å; V1360-L1439 HydrophobicContact CG2-CG 4.13Å; V1360-F1440 HydrophobicContact CG2-CB 4.18Å; V1360-K1443 HydrophobicContact CG1-CB 4.4Å; V1360-K1443 HydrophobicContact CG1-CD 3.59Å; V1360-K1443 HydrophobicContact CG1-CG 4.08Å
1361H75.2Confident73Confident55.2 Ų55.240 Ų4026%0.25618%0.184SC..Hα-helixtrans-60.5-37.8-177.9-52.9106.6000113.2A1324 E1325 Y1359 L1363 E1364 V1365A1324-H1361 HydrophobicContact CB-CB 3.55Å; A1324-H1361 VanDerWaalsContact CB-CB 3.49Å; E1325-H1361 IonicContact OE1-NE2 3.21Å; Y1359-H1361 PolarHBondContact O-N 3.17Å; Y1359-H1361 VanDerWaalsContact O-N 3.11Å; H1361-L1363 VanDerWaalsContact C-N 3.3Å; H1361-L1363 PolarHBondContact O-N 3.26Å; H1361-E1364 IonicContact CD2-OE2 3.04Å; H1361-E1364 PolarHBondContact CD2-OE2 3.41Å; H1361-E1364 VanDerWaalsContact CD2-OE2 3.31Å; H1361-E1364 CarbonylContact O-C 3.56Å; H1361-E1364 WeakPolarHBondContact O-CA 3.46Å; H1361-E1364 WeakPolarHBondContact O-CB 3.36Å; H1361-E1364 PolarHBondContact O-N 3.3Å; H1361-E1364 VanDerWaalsContact O-N 3.1Å; H1361-V1365 WeakPolarHBondContact O-CG2 3.35Å; H1361-V1365 PolarHBondContact O-N 3.08Å
1362W78.2Confident72.8Confident1.4 Ų1.436 Ų361%0.00517%0.167CC..Hα-helixtrans-67.4-31.3176.7-70.4118.3000112.7I1317 T1318 D1323 A1324 C1327 L1349 F1352 L1353 Y1359 V1360 E1364 V1365 L1366I1317-W1362 HydrophobicContact CG2-CH2 4.17Å; I1317-W1362 HydrophobicContact CG2-CZ3 4.32Å; T1318-W1362 VanDerWaalsContact O-CZ2 3.22Å; T1318-W1362 WeakPolarHBondContact O-CZ2 3.27Å; D1323-W1362 HydrophobicContact CB-CZ2 4.48Å; A1324-W1362 HydrophobicContact CB-CD2 3.74Å; A1324-W1362 HydrophobicContact CB-CE3 4Å; A1324-W1362 HydrophobicContact CB-CG 4.26Å; A1324-W1362 HydrophobicContact CB-CH2 4.05Å; A1324-W1362 HydrophobicContact CB-CZ2 3.78Å; A1324-W1362 HydrophobicContact CB-CZ3 4.16Å; C1327-W1362 HydrophobicContact CB-CZ3 4.2Å; L1349-W1362 HydrophobicContact CD2-CD2 4.45Å; L1349-W1362 HydrophobicContact CD2-CE3 3.36Å; L1349-W1362 VanDerWaalsContact CD2-CE3 3.46Å; L1349-W1362 HydrophobicContact CD2-CH2 4.33Å; L1349-W1362 HydrophobicContact CD2-CZ3 3.26Å; F1352-W1362 HydrophobicContact CB-CG 4.38Å; L1353-W1362 HydrophobicContact CD2-CB 3.91Å; L1353-W1362 HydrophobicContact CG-CB 4.25Å; Y1359-W1362 PolarHBondContact O-N 3.23Å; V1360-W1362 VanDerWaalsContact C-N 3.3Å; V1360-W1362 PolarHBondContact O-N 3.16Å; W1362-E1364 VanDerWaalsContact C-N 3.32Å; W1362-V1365 HydrophobicContact CE3-CB 4.45Å; W1362-V1365 HydrophobicContact CE3-CG2 4.3Å; W1362-V1365 HydrophobicContact CZ3-CG2 4.5Å; W1362-L1366 WeakPolarHBondContact O-CG 3.42Å; W1362-L1366 PolarHBondContact O-N 3.21Å; W1362-L1366 VanDerWaalsContact O-N 3.11Å
1363L78.6Confident72.7Confident0.2 Ų0.238.4 Ų38.40%0.00118%0.181CC..Hα-helixtrans-68.7-38.1170.2-72.9172.9000111.3L1353 Y1359 V1360 H1361 V1365 L1366 I1367 F1440 K1443 F1444 L1447L1353-L1363 HydrophobicContact CD1-CD2 3.98Å; L1353-L1363 HydrophobicContact CD2-CD2 3.8Å; L1353-L1363 HydrophobicContact CD2-CG 3.8Å; L1353-L1363 HydrophobicContact CG-CD2 4.48Å; Y1359-L1363 PolarHBondContact O-N 3.28Å; Y1359-L1363 VanDerWaalsContact O-N 3.16Å; V1360-L1363 WeakPolarHBondContact O-CB 3.39Å; V1360-L1363 PolarHBondContact O-N 3.22Å; V1360-L1363 VanDerWaalsContact O-N 3.11Å; H1361-L1363 VanDerWaalsContact C-N 3.3Å; H1361-L1363 PolarHBondContact O-N 3.26Å; L1363-V1365 VanDerWaalsContact C-N 3.33Å; L1363-L1366 PolarHBondContact O-N 3.33Å; L1363-I1367 WeakPolarHBondContact O-CB 3.25Å; L1363-I1367 WeakPolarHBondContact O-CD1 3.39Å; L1363-I1367 VanDerWaalsContact O-CG1 3.27Å; L1363-I1367 WeakPolarHBondContact O-CG1 3.37Å; L1363-I1367 PolarHBondContact O-N 3.36Å; L1363-F1440 HydrophobicContact CD1-CD1 4.46Å; L1363-F1440 HydrophobicContact CD1-CD2 3.37Å; L1363-F1440 VanDerWaalsContact CD1-CD2 3.44Å; L1363-F1440 HydrophobicContact CD1-CE1 4.46Å; L1363-F1440 HydrophobicContact CD1-CE2 3.3Å; L1363-F1440 HydrophobicContact CD1-CG 4.06Å; L1363-F1440 HydrophobicContact CD1-CZ 3.94Å; L1363-F1440 WeakPolarHBondContact CD1-O 3.45Å; L1363-F1440 HydrophobicContact CG-CD2 4.32Å; L1363-F1440 HydrophobicContact CG-CE2 3.91Å; L1363-F1440 HydrophobicContact CG-CZ 4.41Å; L1363-K1443 HydrophobicContact CB-CB 4.16Å; L1363-K1443 HydrophobicContact CD1-CB 4.02Å; L1363-F1444 HydrophobicContact CD1-CB 3.97Å; L1363-F1444 HydrophobicContact CD2-CB 4.5Å; L1363-F1444 HydrophobicContact CD2-CD2 4.11Å; L1363-L1447 HydrophobicContact CD2-CD2 3.95Å
1364E77.7Confident72.7Confident35 Ų3544.2 Ų44.216%0.16421%0.212CC..Hα-helixtrans-63.2-41.5175.4-66-178.3148.600111.6I1235 L1328 V1360 H1361 W1362 L1366 I1367 T1368 K1443I1235-E1364 WeakPolarHBondContact CD1-OE1 3.38Å; I1235-E1364 WeakPolarHBondContact CD1-OE2 2.94Å; L1328-E1364 HydrophobicContact CD1-CB 4.03Å; L1328-E1364 HydrophobicContact CD1-CG 4.4Å; V1360-E1364 HydrophobicContact CG1-CG 4.4Å; V1360-E1364 WeakPolarHBondContact O-CG 3.32Å; V1360-E1364 PolarHBondContact O-N 3.13Å; V1360-E1364 VanDerWaalsContact O-N 3.16Å; H1361-E1364 IonicContact CD2-OE2 3.04Å; H1361-E1364 PolarHBondContact CD2-OE2 3.41Å; H1361-E1364 VanDerWaalsContact CD2-OE2 3.31Å; H1361-E1364 CarbonylContact O-C 3.56Å; H1361-E1364 WeakPolarHBondContact O-CA 3.46Å; H1361-E1364 WeakPolarHBondContact O-CB 3.36Å; H1361-E1364 PolarHBondContact O-N 3.3Å; H1361-E1364 VanDerWaalsContact O-N 3.1Å; W1362-E1364 VanDerWaalsContact C-N 3.32Å; E1364-L1366 VanDerWaalsContact C-N 3.32Å; E1364-L1366 PolarHBondContact O-N 3.11Å; E1364-I1367 PolarHBondContact O-N 3.15Å; E1364-I1367 VanDerWaalsContact O-N 3.14Å; E1364-T1368 VanDerWaalsContact O-CB 3.32Å; E1364-T1368 WeakPolarHBondContact O-CB 3.35Å; E1364-T1368 WeakPolarHBondContact O-CG2 3.34Å; E1364-T1368 PolarHBondContact O-N 3.01Å; E1364-T1368 PolarHBondContact O-OG1 3.16Å; E1364-T1368 VanDerWaalsContact O-OG1 3.1Å; E1364-K1443 HydrophobicContact CG-CD 4.1Å; E1364-K1443 VanDerWaalsContact OE1-CE 3.26Å; E1364-K1443 WeakPolarHBondContact OE1-CE 3.36Å; E1364-K1443 IonicContact OE1-NZ 3.07Å; E1364-K1443 PolarHBondContact OE1-NZ 3.2Å; E1364-K1443 IonicContact OE2-NZ 2.78Å
1365V81.3Confident73.1Confident1 Ų147.5 Ų47.51%0.00623%0.227CC..Hα-helixtrans-57.2-47.6172.1175.90000110.5A1324 C1327 L1328 L1331 L1349 H1361 W1362 L1363 I1367 T1368 V1369A1324-V1365 VanDerWaalsContact O-CG2 3.28Å; A1324-V1365 WeakPolarHBondContact O-CG2 3.39Å; C1327-V1365 HydrophobicContact CB-CG1 4.41Å; C1327-V1365 HydrophobicContact CB-CG2 4.14Å; L1328-V1365 HydrophobicContact CB-CG2 3.93Å; L1328-V1365 HydrophobicContact CD1-CG2 4.41Å; L1331-V1365 HydrophobicContact CD1-CG1 4.32Å; L1349-V1365 HydrophobicContact CD1-CG1 4.38Å; L1349-V1365 HydrophobicContact CD2-CG1 4.42Å; H1361-V1365 WeakPolarHBondContact O-CG2 3.35Å; H1361-V1365 PolarHBondContact O-N 3.08Å; W1362-V1365 HydrophobicContact CE3-CB 4.45Å; W1362-V1365 HydrophobicContact CE3-CG2 4.3Å; W1362-V1365 HydrophobicContact CZ3-CG2 4.5Å; L1363-V1365 VanDerWaalsContact C-N 3.33Å; V1365-I1367 PolarHBondContact O-N 3.08Å; V1365-T1368 WeakPolarHBondContact CA-OG1 3.48Å; V1365-T1368 PolarHBondContact O-N 3.4Å; V1365-T1368 PolarHBondContact O-OG1 2.92Å; V1365-V1369 HydrophobicContact CG1-CG2 4.32Å; V1365-V1369 VanDerWaalsContact O-CB 3.31Å; V1365-V1369 WeakPolarHBondContact O-CB 3.41Å; V1365-V1369 VanDerWaalsContact O-CG2 3.23Å; V1365-V1369 WeakPolarHBondContact O-CG2 3.45Å; V1365-V1369 PolarHBondContact O-N 2.96Å
1366L81.8Confident73.6Confident0 Ų044.9 Ų44.90%022%0.22CC..Hα-helixtrans-64.8-39178.2-72.2172.7000112.9L1349 L1353 W1362 L1363 E1364 T1368 V1369 V1370 I1384 L1447L1349-L1366 HydrophobicContact CB-CD2 4.21Å; L1349-L1366 HydrophobicContact CD1-CD2 4.19Å; L1353-L1366 HydrophobicContact CD1-CD1 3.58Å; L1353-L1366 VanDerWaalsContact CD1-CD1 3.44Å; L1353-L1366 HydrophobicContact CG-CD1 4.33Å; W1362-L1366 WeakPolarHBondContact O-CG 3.42Å; W1362-L1366 PolarHBondContact O-N 3.21Å; W1362-L1366 VanDerWaalsContact O-N 3.11Å; L1363-L1366 PolarHBondContact O-N 3.33Å; E1364-L1366 VanDerWaalsContact C-N 3.32Å; E1364-L1366 PolarHBondContact O-N 3.11Å; L1366-T1368 VanDerWaalsContact C-N 3.34Å; L1366-V1369 PolarHBondContact O-N 3.23Å; L1366-V1370 VanDerWaalsContact O-CG2 3.29Å; L1366-V1370 WeakPolarHBondContact O-CG2 3.25Å; L1366-V1370 PolarHBondContact O-N 3Å; L1366-I1384 HydrophobicContact CD2-CD1 4Å; L1366-I1384 HydrophobicContact CD2-CG1 4.35Å; L1366-L1447 HydrophobicContact CB-CD1 4.17Å; L1366-L1447 VanDerWaalsContact CB-CD1 3.43Å; L1366-L1447 HydrophobicContact CB-CD2 4.07Å; L1366-L1447 HydrophobicContact CD1-CD1 4.17Å; L1366-L1447 HydrophobicContact CD1-CD2 4.26Å; L1366-L1447 HydrophobicContact CG-CD1 4.47Å
1367I81.6Confident74.7Confident21.4 Ų21.442.9 Ų42.911%0.1121%0.205CC..Hα-helixtrans-61.9-47.1175.6-69.4158.4000109.9L1363 E1364 V1365 V1369 V1370 K1371 K1443 L1447 I1450L1363-I1367 WeakPolarHBondContact O-CB 3.25Å; L1363-I1367 WeakPolarHBondContact O-CD1 3.39Å; L1363-I1367 VanDerWaalsContact O-CG1 3.27Å; L1363-I1367 WeakPolarHBondContact O-CG1 3.37Å; L1363-I1367 PolarHBondContact O-N 3.36Å; E1364-I1367 PolarHBondContact O-N 3.15Å; E1364-I1367 VanDerWaalsContact O-N 3.14Å; V1365-I1367 PolarHBondContact O-N 3.08Å; I1367-V1369 VanDerWaalsContact C-N 3.33Å; I1367-V1369 PolarHBondContact O-N 3.1Å; I1367-V1370 PolarHBondContact O-N 3.12Å; I1367-K1371 WeakPolarHBondContact O-CB 3.09Å; I1367-K1371 PolarHBondContact O-N 3.34Å; I1367-K1443 HydrophobicContact CD1-CB 4.18Å; I1367-K1443 HydrophobicContact CD1-CD 4.05Å; I1367-L1447 HydrophobicContact CD1-CB 4.39Å; I1367-L1447 HydrophobicContact CG1-CB 3.94Å; I1367-L1447 HydrophobicContact CG1-CD1 4.1Å; I1367-L1447 HydrophobicContact CG1-CG 4.45Å; I1367-I1450 HydrophobicContact CG2-CD1 3.99Å
1368T80.2Confident75.7Confident22.4 Ų22.435.6 Ų35.614%0.13719%0.185CC..Hα-helixtrans-64-37.6178-47.70000112.1L1328 K1332 E1364 V1365 L1366 V1370 K1371 P1372L1328-T1368 HydrophobicContact CD1-CG2 4.34Å; L1328-T1368 VanDerWaalsContact CD1-OG1 3.26Å; L1328-T1368 WeakPolarHBondContact CD1-OG1 3.28Å; L1328-T1368 HydrophobicContact CG-CG2 4.34Å; K1332-T1368 VanDerWaalsContact CA-CG2 3.48Å; K1332-T1368 HydrophobicContact CB-CG2 4.11Å; K1332-T1368 HydrophobicContact CG-CG2 4.31Å; E1364-T1368 VanDerWaalsContact O-CB 3.32Å; E1364-T1368 WeakPolarHBondContact O-CB 3.35Å; E1364-T1368 WeakPolarHBondContact O-CG2 3.34Å; E1364-T1368 PolarHBondContact O-N 3.01Å; E1364-T1368 PolarHBondContact O-OG1 3.16Å; E1364-T1368 VanDerWaalsContact O-OG1 3.1Å; V1365-T1368 WeakPolarHBondContact CA-OG1 3.48Å; V1365-T1368 PolarHBondContact O-N 3.4Å; V1365-T1368 PolarHBondContact O-OG1 2.92Å; L1366-T1368 VanDerWaalsContact C-N 3.34Å; T1368-V1370 VanDerWaalsContact C-N 3.33Å; T1368-V1370 PolarHBondContact O-N 3.09Å; T1368-K1371 CarbonylContact O-C 3.56Å; T1368-K1371 VanDerWaalsContact O-C 3.27Å; T1368-K1371 PolarHBondContact O-N 3.22Å; T1368-P1372 VanDerWaalsContact O-CA 3.27Å; T1368-P1372 WeakPolarHBondContact O-CA 3.33Å; T1368-P1372 VanDerWaalsContact O-CD 3.31Å; T1368-P1372 WeakPolarHBondContact O-CD 3.26Å; T1368-P1372 VanDerWaalsContact O-N 3.11Å
1369V83.2Confident76.8Confident0.2 Ų0.238.4 Ų38.40%0.00120%0.203CC..Hα-helixtrans-66.4-37.8176.4166.10000112.3L1331 V1365 L1366 I1367 V1380 I1384L1331-V1369 HydrophobicContact CB-CG2 4.48Å; L1331-V1369 HydrophobicContact CD1-CG2 3.58Å; V1365-V1369 HydrophobicContact CG1-CG2 4.32Å; V1365-V1369 VanDerWaalsContact O-CB 3.31Å; V1365-V1369 WeakPolarHBondContact O-CB 3.41Å; V1365-V1369 VanDerWaalsContact O-CG2 3.23Å; V1365-V1369 WeakPolarHBondContact O-CG2 3.45Å; V1365-V1369 PolarHBondContact O-N 2.96Å; L1366-V1369 PolarHBondContact O-N 3.23Å; I1367-V1369 VanDerWaalsContact C-N 3.33Å; I1367-V1369 PolarHBondContact O-N 3.1Å; V1369-V1380 HydrophobicContact CG1-CG1 3.46Å; V1369-V1380 VanDerWaalsContact CG1-CG1 3.46Å; V1369-I1384 HydrophobicContact CG1-CD1 4.14Å
1370V81.8Confident77.7Confident0.2 Ų0.235.1 Ų35.10%0.00119%0.19CC..Hα-helixtrans-76-36177177.80000111.6L1366 I1367 T1368 P1372 V1376 L1377 R1381 I1384 L1447 I1450 L1451L1366-V1370 VanDerWaalsContact O-CG2 3.29Å; L1366-V1370 WeakPolarHBondContact O-CG2 3.25Å; L1366-V1370 PolarHBondContact O-N 3Å; I1367-V1370 PolarHBondContact O-N 3.12Å; T1368-V1370 VanDerWaalsContact C-N 3.33Å; T1368-V1370 PolarHBondContact O-N 3.09Å; V1370-P1372 VanDerWaalsContact C-CD 3.48Å; V1370-V1376 HydrophobicContact CG1-CG1 4Å; V1370-V1376 WeakPolarHBondContact O-CA 3.41Å; V1370-L1377 PolarHBondContact O-N 2.97Å; V1370-R1381 HydrophobicContact CG1-CB 4.3Å; V1370-R1381 HydrophobicContact CG1-CG 4.45Å; V1370-I1384 HydrophobicContact CG2-CD1 3.3Å; V1370-I1384 HydrophobicContact CG2-CG1 4.47Å; V1370-L1447 HydrophobicContact CG2-CD1 4.19Å; V1370-I1450 HydrophobicContact CB-CG2 4.41Å; V1370-I1450 HydrophobicContact CG1-CG2 3.42Å; V1370-I1450 VanDerWaalsContact CG1-CG2 3.44Å; V1370-L1451 HydrophobicContact CG1-CD2 4.4Å; V1370-L1451 HydrophobicContact CG2-CD2 4.31Å
1371K79Confident78.3Confident64.4 Ų64.435.6 Ų35.628%0.2819%0.191SC..  trans-132.866.8-170.5-161.2-167.3-171.5-150.20112.5I1367 T1368 D1374 E1375 V1376 I1450I1367-K1371 WeakPolarHBondContact O-CB 3.09Å; I1367-K1371 PolarHBondContact O-N 3.34Å; T1368-K1371 CarbonylContact O-C 3.56Å; T1368-K1371 VanDerWaalsContact O-C 3.27Å; T1368-K1371 PolarHBondContact O-N 3.22Å; K1371-D1374 VanDerWaalsContact CE-C 3.48Å; K1371-D1374 VanDerWaalsContact CE-CA 3.47Å; K1371-D1374 WeakPolarHBondContact CE-O 3.31Å; K1371-D1374 WeakPolarHBondContact CE-OD1 3.38Å; K1371-D1374 IonicContact NZ-OD1 3.35Å; K1371-D1374 PolarHBondContact NZ-OD1 3.12Å; K1371-E1375 WeakPolarHBondContact CA-O 3.3Å; K1371-V1376 HydrophobicContact CD-CG2 4.44Å; K1371-V1376 HydrophobicContact CG-CG2 4.22Å; K1371-I1450 HydrophobicContact CD-CD1 4.36Å
1372P72.1Confident78.6Confident1.8 Ų1.837.9 Ų37.91%0.01220%0.202CC..G310 helixtrans-69.4107.317525.7-30.5000111.5D1333 T1335 C1338 T1368 V1370 D1374 E1375 L1377D1333-P1372 VanDerWaalsContact CA-O 3.29Å; D1333-P1372 WeakPolarHBondContact CA-O 3.44Å; D1333-P1372 PolarHBondContact N-O 3.35Å; T1335-P1372 HydrophobicContact CG2-CB 4.21Å; T1335-P1372 HydrophobicContact CG2-CG 3.85Å; C1338-P1372 HydrophobicContact CB-CG 4.19Å; T1368-P1372 VanDerWaalsContact O-CA 3.27Å; T1368-P1372 WeakPolarHBondContact O-CA 3.33Å; T1368-P1372 VanDerWaalsContact O-CD 3.31Å; T1368-P1372 WeakPolarHBondContact O-CD 3.26Å; T1368-P1372 VanDerWaalsContact O-N 3.11Å; V1370-P1372 VanDerWaalsContact C-CD 3.48Å; P1372-D1374 VanDerWaalsContact C-N 3.27Å; P1372-D1374 PolarHBondContact O-N 3.06Å; P1372-E1375 PolarHBondContact O-N 3.15Å; P1372-E1375 VanDerWaalsContact O-N 3.1Å; P1372-L1377 HydrophobicContact CG-CD1 3.73Å; P1372-L1377 HydrophobicContact CG-CD2 4.48Å; P1372-L1377 HydrophobicContact CG-CG 4.1Å
1373N68.5Low78.7Confident77.2 Ų77.239 Ų3941%0.41321%0.208SC..G310 helixtrans75.438.1179.3-65.4-34.4000114.3D1333 T1335 E1375D1333-N1373 VanDerWaalsContact CA-OD1 3.23Å; D1333-N1373 WeakPolarHBondContact CA-OD1 3.41Å; D1333-N1373 VanDerWaalsContact CB-OD1 3.29Å; D1333-N1373 WeakPolarHBondContact CB-OD1 3.31Å; D1333-N1373 VanDerWaalsContact CG-OD1 3.32Å; D1333-N1373 PolarHBondContact O-ND2 3.2Å; D1333-N1373 VanDerWaalsContact O-ND2 3.1Å; D1333-N1373 PolarHBondContact O-OD1 3.17Å; D1333-N1373 PolarHBondContact OD1-OD1 2.88Å; T1335-N1373 HydrophobicContact CG2-CB 4.49Å; N1373-E1375 PolarHBondContact O-N 3.1Å; N1373-E1375 VanDerWaalsContact O-N 3.14Å
1374D70.8Confident79Confident129.2 Ų129.239 Ų3969%0.69121%0.208SC*.G310 helixtrans627.6-173.3-72.5-49.7000116K1371 P1372K1371-D1374 VanDerWaalsContact CE-C 3.48Å; K1371-D1374 VanDerWaalsContact CE-CA 3.47Å; K1371-D1374 WeakPolarHBondContact CE-O 3.31Å; K1371-D1374 WeakPolarHBondContact CE-OD1 3.38Å; K1371-D1374 IonicContact NZ-OD1 3.35Å; K1371-D1374 PolarHBondContact NZ-OD1 3.12Å; P1372-D1374 VanDerWaalsContact C-N 3.27Å; P1372-D1374 PolarHBondContact O-N 3.06Å
1375E76.8Confident79Confident133.2 Ų133.237.5 Ų37.562%0.62220%0.201SC*.  trans-104130.7174.7-65.8-173.9169.400111.3K1371 P1372 N1373K1371-E1375 WeakPolarHBondContact CA-O 3.3Å; P1372-E1375 PolarHBondContact O-N 3.15Å; P1372-E1375 VanDerWaalsContact O-N 3.1Å; N1373-E1375 PolarHBondContact O-N 3.1Å; N1373-E1375 VanDerWaalsContact O-N 3.14Å
1376V75.6Confident79Confident57 Ų5740.6 Ų40.635%0.34522%0.217SC..  trans-86120.6-176.7-179.50000110.7V1370 K1371 G1378 R1381 I1450V1370-V1376 HydrophobicContact CG1-CG1 4Å; V1370-V1376 WeakPolarHBondContact O-CA 3.41Å; K1371-V1376 HydrophobicContact CD-CG2 4.44Å; K1371-V1376 HydrophobicContact CG-CG2 4.22Å; V1376-G1378 PolarHBondContact O-N 2.95Å; V1376-R1381 HydrophobicContact CG1-CB 4.43Å; V1376-I1450 HydrophobicContact CG1-CG2 4.22Å; V1376-I1450 HydrophobicContact CG2-CG2 3.93Å
1377L78.2Confident78.9Confident24.4 Ų24.441.7 Ų41.713%0.12822%0.222CC..  trans-80.6104177.3-63.1178.9000111.2C1338 M1339 V1370 P1372 V1380 R1381C1338-L1377 HydrophobicContact CB-CD1 3.58Å; M1339-L1377 HydrophobicContact CG-CD1 3.97Å; M1339-L1377 HydrophobicContact CG-CD2 4.21Å; M1339-L1377 HydrophobicContact SD-CB 4.19Å; M1339-L1377 HydrophobicContact SD-CD1 3.97Å; M1339-L1377 HydrophobicContact SD-CD2 3.95Å; M1339-L1377 HydrophobicContact SD-CG 4.26Å; V1370-L1377 PolarHBondContact O-N 2.97Å; P1372-L1377 HydrophobicContact CG-CD1 3.73Å; P1372-L1377 HydrophobicContact CG-CD2 4.48Å; P1372-L1377 HydrophobicContact CG-CG 4.1Å; L1377-V1380 HydrophobicContact CB-CB 4.08Å; L1377-V1380 HydrophobicContact CB-CG2 4.13Å; L1377-V1380 HydrophobicContact CD1-CG2 4.25Å; L1377-V1380 PolarHBondContact O-N 3.07Å; L1377-R1381 VanDerWaalsContact O-CB 3.28Å; L1377-R1381 WeakPolarHBondContact O-CB 3.34Å; L1377-R1381 PolarHBondContact O-N 3.24Å
1378G79Confident78.7Confident24.2 Ų24.240.8 Ų40.825%0.24922%0.218CC..Hα-helixtrans-50-52.5-178.200000115.6V1376 V1380 R1381 E1382V1376-G1378 PolarHBondContact O-N 2.95Å; G1378-V1380 PolarHBondContact O-N 3.33Å; G1378-R1381 WeakPolarHBondContact O-CB 3.33Å; G1378-R1381 PolarHBondContact O-N 3Å; G1378-E1382 PolarHBondContact O-N 3.15Å; G1378-E1382 VanDerWaalsContact O-N 3.08Å
1379P80Confident78.5Confident78.6 Ų78.640 Ų4051%0.5121%0.213SC..Hα-helixtrans-65.7-40.1-177.9-15.924.4000113.5M1339 E1382 M1383M1339-P1379 HydrophobicContact CE-CG 4.05Å; M1339-P1379 HydrophobicContact SD-CG 3.88Å; P1379-E1382 PolarHBondContact O-N 3.14Å; P1379-M1383 WeakPolarHBondContact O-CB 3.32Å; P1379-M1383 WeakPolarHBondContact O-CG 3.42Å; P1379-M1383 PolarHBondContact O-N 3.11Å; P1379-M1383 VanDerWaalsContact O-N 3.09Å
1380V82.5Confident78.2Confident3.4 Ų3.443.5 Ų43.52%0.02124%0.238CC..Hα-helixtrans-69.4-39179-179.40000110.4C1338 M1339 I1346 V1369 L1377 G1378 E1382 M1383 I1384C1338-V1380 WeakPolarHBondContact O-CG2 3.45Å; M1339-V1380 HydrophobicContact SD-CG2 4.05Å; I1346-V1380 HydrophobicContact CD1-CG1 4.24Å; V1369-V1380 HydrophobicContact CG1-CG1 3.46Å; V1369-V1380 VanDerWaalsContact CG1-CG1 3.46Å; L1377-V1380 HydrophobicContact CB-CB 4.08Å; L1377-V1380 HydrophobicContact CB-CG2 4.13Å; L1377-V1380 HydrophobicContact CD1-CG2 4.25Å; L1377-V1380 PolarHBondContact O-N 3.07Å; G1378-V1380 PolarHBondContact O-N 3.33Å; V1380-E1382 PolarHBondContact O-N 3.42Å; V1380-M1383 HydrophobicContact CB-CE 4.49Å; V1380-M1383 HydrophobicContact CG1-CE 4.43Å; V1380-M1383 HydrophobicContact CG2-CE 4.4Å; V1380-M1383 WeakPolarHBondContact O-CB 3.42Å; V1380-M1383 PolarHBondContact O-N 3.22Å; V1380-I1384 HydrophobicContact CG1-CD1 3.93Å; V1380-I1384 WeakPolarHBondContact O-CG1 3.42Å; V1380-I1384 PolarHBondContact O-N 3.09Å
1381R82.3Confident77.5Confident18.2 Ų18.245.5 Ų45.57%0.06925%0.247CC..Hα-helixtrans-58.9-48.1172.8-178.3-170.964.9-168.7-0.1112.1V1370 V1376 L1377 G1378 M1383 I1384 S1385 L1451 E1454 E1455 N1456V1370-R1381 HydrophobicContact CG1-CB 4.3Å; V1370-R1381 HydrophobicContact CG1-CG 4.45Å; V1376-R1381 HydrophobicContact CG1-CB 4.43Å; L1377-R1381 VanDerWaalsContact O-CB 3.28Å; L1377-R1381 WeakPolarHBondContact O-CB 3.34Å; L1377-R1381 PolarHBondContact O-N 3.24Å; G1378-R1381 WeakPolarHBondContact O-CB 3.33Å; G1378-R1381 PolarHBondContact O-N 3Å; R1381-M1383 VanDerWaalsContact C-N 3.28Å; R1381-M1383 PolarHBondContact O-N 3.24Å; R1381-I1384 PolarHBondContact O-N 3.2Å; R1381-S1385 VanDerWaalsContact O-CB 3.25Å; R1381-S1385 WeakPolarHBondContact O-CB 3.41Å; R1381-S1385 PolarHBondContact O-N 3.07Å; R1381-S1385 PolarHBondContact O-OG 2.93Å; R1381-L1451 HydrophobicContact CB-CD2 4.43Å; R1381-L1451 HydrophobicContact CG-CD2 3.64Å; R1381-E1454 IonicContact CZ-OE1 3.88Å; R1381-E1454 IonicContact CZ-OE2 2.81Å; R1381-E1454 IonicContact NH1-OE1 3.04Å; R1381-E1454 PolarHBondContact NH1-OE1 3.46Å; R1381-E1454 IonicContact NH1-OE2 3.02Å; R1381-E1454 PolarHBondContact NH1-OE2 3.19Å; R1381-E1454 IonicContact NH2-OE1 3.08Å; R1381-E1454 PolarHBondContact NH2-OE1 3.25Å; R1381-E1454 IonicContact NH2-OE2 3.15Å; R1381-E1454 PolarHBondContact NH2-OE2 3.14Å; R1381-E1455 IonicContact NH2-OE2 2.81Å; R1381-N1456 PolarHBondContact NE-ND2 3.09Å
1382E80.5Confident76.9Confident103.2 Ų103.242.6 Ų42.648%0.48224%0.235SC..Hα-helixtrans-61.8-39177-90.1-175-178.400111.8G1378 P1379 V1380 S1385 N1386G1378-E1382 PolarHBondContact O-N 3.15Å; G1378-E1382 VanDerWaalsContact O-N 3.08Å; P1379-E1382 PolarHBondContact O-N 3.14Å; V1380-E1382 PolarHBondContact O-N 3.42Å; E1382-S1385 VanDerWaalsContact CA-OG 3.31Å; E1382-S1385 WeakPolarHBondContact CA-OG 3.4Å; E1382-S1385 PolarHBondContact O-N 3.22Å; E1382-S1385 PolarHBondContact O-OG 3.25Å; E1382-N1386 VanDerWaalsContact O-CB 3.31Å; E1382-N1386 WeakPolarHBondContact O-CB 3.42Å; E1382-N1386 VanDerWaalsContact O-CG 3.23Å; E1382-N1386 PolarHBondContact O-N 3.28Å; E1382-N1386 VanDerWaalsContact O-N 3.13Å; E1382-N1386 PolarHBondContact O-ND2 3.24Å; E1382-N1386 VanDerWaalsContact O-ND2 3.14Å
1383M82.2Confident76.3Confident23.8 Ų23.847.3 Ų47.312%0.11726%0.26CS..Hα-helixtrans-63.7-49.2177.3-161.9164.257.400112V1341 R1343 I1346 P1379 V1380 R1381 N1386 E1387V1341-M1383 WeakPolarHBondContact O-CE 3.38Å; R1343-M1383 HydrophobicContact CB-CE 4.2Å; R1343-M1383 HydrophobicContact CB-SD 4.07Å; R1343-M1383 HydrophobicContact CG-CB 4.45Å; R1343-M1383 HydrophobicContact CG-CE 3.32Å; R1343-M1383 HydrophobicContact CG-CG 3.76Å; R1343-M1383 HydrophobicContact CG-SD 3.25Å; R1343-M1383 VanDerWaalsContact CG-SD 3.51Å; R1343-M1383 WeakPolarHBondContact CG-SD 3.38Å; R1343-M1383 PolarHBondContact NE-SD 3.35Å; R1343-M1383 VanDerWaalsContact NE-SD 3.42Å; I1346-M1383 HydrophobicContact CD1-CB 4.31Å; I1346-M1383 HydrophobicContact CD1-CE 3.2Å; I1346-M1383 HydrophobicContact CD1-CG 3.99Å; I1346-M1383 HydrophobicContact CD1-SD 4.1Å; I1346-M1383 VanDerWaalsContact CD1-SD 3.57Å; I1346-M1383 HydrophobicContact CG1-CE 3.83Å; P1379-M1383 WeakPolarHBondContact O-CB 3.32Å; P1379-M1383 WeakPolarHBondContact O-CG 3.42Å; P1379-M1383 PolarHBondContact O-N 3.11Å; P1379-M1383 VanDerWaalsContact O-N 3.09Å; V1380-M1383 HydrophobicContact CB-CE 4.49Å; V1380-M1383 HydrophobicContact CG1-CE 4.43Å; V1380-M1383 HydrophobicContact CG2-CE 4.4Å; V1380-M1383 WeakPolarHBondContact O-CB 3.42Å; V1380-M1383 PolarHBondContact O-N 3.22Å; R1381-M1383 VanDerWaalsContact C-N 3.28Å; R1381-M1383 PolarHBondContact O-N 3.24Å; M1383-N1386 PolarHBondContact O-N 3.09Å; M1383-E1387 WeakPolarHBondContact O-CB 3.42Å; M1383-E1387 VanDerWaalsContact O-CG 3.31Å; M1383-E1387 WeakPolarHBondContact O-CG 3.32Å; M1383-E1387 PolarHBondContact O-N 3.18Å
1384I83Confident75.6Confident0 Ų050.2 Ų50.20%028%0.275CS..Hα-helixtrans-64.5-43.6176.8-70.4168.1000110.4I1346 L1366 V1369 V1370 V1380 R1381 N1386 E1387 L1388 L1451I1346-I1384 HydrophobicContact CD1-CD1 3.99Å; I1346-I1384 HydrophobicContact CD1-CG1 3.78Å; I1346-I1384 HydrophobicContact CG1-CG1 4.36Å; I1346-I1384 HydrophobicContact CG2-CG1 3.69Å; L1366-I1384 HydrophobicContact CD2-CD1 4Å; L1366-I1384 HydrophobicContact CD2-CG1 4.35Å; V1369-I1384 HydrophobicContact CG1-CD1 4.14Å; V1370-I1384 HydrophobicContact CG2-CD1 3.3Å; V1370-I1384 HydrophobicContact CG2-CG1 4.47Å; V1380-I1384 HydrophobicContact CG1-CD1 3.93Å; V1380-I1384 WeakPolarHBondContact O-CG1 3.42Å; V1380-I1384 PolarHBondContact O-N 3.09Å; R1381-I1384 PolarHBondContact O-N 3.2Å; I1384-N1386 VanDerWaalsContact C-N 3.33Å; I1384-N1386 PolarHBondContact O-N 3.13Å; I1384-E1387 PolarHBondContact O-N 3.15Å; I1384-L1388 HydrophobicContact CG2-CD1 3.68Å; I1384-L1388 VanDerWaalsContact CG2-CD1 3.48Å; I1384-L1388 HydrophobicContact CG2-CG 3.91Å; I1384-L1388 VanDerWaalsContact O-CB 3.28Å; I1384-L1388 WeakPolarHBondContact O-CB 3.34Å; I1384-L1388 VanDerWaalsContact O-CG 3.24Å; I1384-L1388 WeakPolarHBondContact O-CG 3.32Å; I1384-L1388 PolarHBondContact O-N 3.15Å; I1384-L1451 HydrophobicContact CB-CD2 4.4Å; I1384-L1451 HydrophobicContact CG2-CD1 4.13Å; I1384-L1451 HydrophobicContact CG2-CD2 4.15Å
1385S79.2Confident74.8Confident3.2 Ų3.247.3 Ų47.32%0.02226%0.263CS..Hα-helixtrans-56.9-47.1177.1166.30000111.7R1381 E1382 E1387 C1389R1381-S1385 VanDerWaalsContact O-CB 3.25Å; R1381-S1385 WeakPolarHBondContact O-CB 3.41Å; R1381-S1385 PolarHBondContact O-N 3.07Å; R1381-S1385 PolarHBondContact O-OG 2.93Å; E1382-S1385 VanDerWaalsContact CA-OG 3.31Å; E1382-S1385 WeakPolarHBondContact CA-OG 3.4Å; E1382-S1385 PolarHBondContact O-N 3.22Å; E1382-S1385 PolarHBondContact O-OG 3.25Å; S1385-E1387 PolarHBondContact O-N 3.31Å; S1385-C1389 VanDerWaalsContact O-CB 3.29Å; S1385-C1389 WeakPolarHBondContact O-CB 3.34Å; S1385-C1389 PolarHBondContact O-N 2.89Å; S1385-C1389 PolarHBondContact O-SG 3.21Å
1386N81Confident73.7Confident66 Ų6641.7 Ų41.735%0.35324%0.237SC..Hα-helixtrans-66.4-41.1178.6-74.4-37000112.6E1382 M1383 I1384 C1389 S1390E1382-N1386 VanDerWaalsContact O-CB 3.31Å; E1382-N1386 WeakPolarHBondContact O-CB 3.42Å; E1382-N1386 VanDerWaalsContact O-CG 3.23Å; E1382-N1386 PolarHBondContact O-N 3.28Å; E1382-N1386 VanDerWaalsContact O-N 3.13Å; E1382-N1386 PolarHBondContact O-ND2 3.24Å; E1382-N1386 VanDerWaalsContact O-ND2 3.14Å; M1383-N1386 PolarHBondContact O-N 3.09Å; I1384-N1386 VanDerWaalsContact C-N 3.33Å; I1384-N1386 PolarHBondContact O-N 3.13Å; N1386-C1389 CarbonylContact O-C 3.54Å; N1386-C1389 WeakPolarHBondContact O-CB 3.4Å; N1386-C1389 PolarHBondContact O-N 3.08Å; N1386-S1390 VanDerWaalsContact O-CB 3.24Å; N1386-S1390 WeakPolarHBondContact O-CB 3.17Å; N1386-S1390 PolarHBondContact O-N 3.06Å; N1386-S1390 PolarHBondContact O-OG 2.98Å
1387E78.9Confident72.6Confident22.8 Ų22.844.6 Ų44.611%0.10725%0.245CC..Hα-helixtrans-71.6-43.1179.2-104.2-21-178.900111.9I1346 R1347 C1350 M1383 I1384 S1385 C1389 S1390 M1391I1346-E1387 HydrophobicContact CG2-CB 4.38Å; I1346-E1387 HydrophobicContact CG2-CG 4.34Å; R1347-E1387 HydrophobicContact CB-CG 4.26Å; R1347-E1387 WeakPolarHBondContact CB-OE1 3.47Å; R1347-E1387 VanDerWaalsContact CD-OE1 3.27Å; R1347-E1387 WeakPolarHBondContact CD-OE1 3.38Å; R1347-E1387 HydrophobicContact CG-CG 4.03Å; R1347-E1387 VanDerWaalsContact CG-OE1 3.23Å; R1347-E1387 WeakPolarHBondContact CG-OE1 3.32Å; R1347-E1387 WeakPolarHBondContact CG-OE2 3.41Å; R1347-E1387 IonicContact CZ-OE1 2.92Å; R1347-E1387 IonicContact CZ-OE2 3Å; R1347-E1387 VanDerWaalsContact NE-CD 3.26Å; R1347-E1387 IonicContact NE-OE1 3.21Å; R1347-E1387 PolarHBondContact NE-OE1 2.88Å; R1347-E1387 IonicContact NE-OE2 3.87Å; R1347-E1387 PolarHBondContact NE-OE2 3.14Å; R1347-E1387 VanDerWaalsContact NE-OE2 3.16Å; R1347-E1387 IonicContact NH1-OE1 3.43Å; R1347-E1387 PolarHBondContact NH1-OE1 3.27Å; R1347-E1387 IonicContact NH1-OE2 3.36Å; R1347-E1387 PolarHBondContact NH1-OE2 3.39Å; R1347-E1387 IonicContact NH2-OE1 2.68Å; R1347-E1387 PolarHBondContact NH2-OE1 3.32Å; R1347-E1387 IonicContact NH2-OE2 2.66Å; R1347-E1387 PolarHBondContact NH2-OE2 3.34Å; C1350-E1387 HydrophobicContact CB-CG 4.41Å; M1383-E1387 WeakPolarHBondContact O-CB 3.42Å; M1383-E1387 VanDerWaalsContact O-CG 3.31Å; M1383-E1387 WeakPolarHBondContact O-CG 3.32Å; M1383-E1387 PolarHBondContact O-N 3.18Å; I1384-E1387 PolarHBondContact O-N 3.15Å; S1385-E1387 PolarHBondContact O-N 3.31Å; E1387-C1389 VanDerWaalsContact C-N 3.3Å; E1387-C1389 PolarHBondContact O-N 3.3Å; E1387-S1390 PolarHBondContact O-N 2.99Å; E1387-S1390 VanDerWaalsContact O-N 3.13Å; E1387-S1390 PolarHBondContact O-OG 3.19Å; E1387-M1391 HydrophobicContact CG-CG 4.28Å; E1387-M1391 HydrophobicContact CG-SD 4.17Å; E1387-M1391 WeakPolarHBondContact O-CB 3.38Å; E1387-M1391 VanDerWaalsContact O-CG 3.24Å; E1387-M1391 WeakPolarHBondContact O-CG 3.23Å; E1387-M1391 PolarHBondContact O-N 3.39Å
1388L77.7Confident71.3Confident4 Ų449.9 Ų49.92%0.02127%0.273CS..Hα-helixtrans-59-43.1171.1-67.1177.9000110.3L1353 I1384 S1390 M1391 F1392 L1447 L1451 W1466L1353-L1388 HydrophobicContact CD1-CD2 4.27Å; I1384-L1388 HydrophobicContact CG2-CD1 3.68Å; I1384-L1388 VanDerWaalsContact CG2-CD1 3.48Å; I1384-L1388 HydrophobicContact CG2-CG 3.91Å; I1384-L1388 VanDerWaalsContact O-CB 3.28Å; I1384-L1388 WeakPolarHBondContact O-CB 3.34Å; I1384-L1388 VanDerWaalsContact O-CG 3.24Å; I1384-L1388 WeakPolarHBondContact O-CG 3.32Å; I1384-L1388 PolarHBondContact O-N 3.15Å; L1388-S1390 VanDerWaalsContact C-N 3.32Å; L1388-S1390 PolarHBondContact O-N 3.05Å; L1388-M1391 PolarHBondContact O-N 3.17Å; L1388-F1392 HydrophobicContact CB-CD2 4.06Å; L1388-F1392 HydrophobicContact CB-CE2 4.06Å; L1388-F1392 HydrophobicContact CD1-CE2 4.45Å; L1388-F1392 HydrophobicContact CD2-CD2 4.07Å; L1388-F1392 HydrophobicContact CD2-CE2 3.35Å; L1388-F1392 VanDerWaalsContact CD2-CE2 3.42Å; L1388-F1392 HydrophobicContact CD2-CZ 4.06Å; L1388-F1392 HydrophobicContact CG-CD2 4.49Å; L1388-F1392 HydrophobicContact CG-CE2 4.2Å; L1388-F1392 VanDerWaalsContact O-CB 3.25Å; L1388-F1392 WeakPolarHBondContact O-CB 3.41Å; L1388-F1392 WeakPolarHBondContact O-CD2 3.2Å; L1388-F1392 VanDerWaalsContact O-CG 3.27Å; L1388-F1392 WeakPolarHBondContact O-CG 3.33Å; L1388-F1392 PolarHBondContact O-N 3.04Å; L1388-F1392 VanDerWaalsContact O-N 3.12Å; L1388-L1447 HydrophobicContact CD1-CD2 4.26Å; L1388-L1451 HydrophobicContact CD1-CD1 3.45Å; L1388-L1451 VanDerWaalsContact CD1-CD1 3.45Å; L1388-W1466 WeakPolarHBondContact O-CH2 3.42Å
1389C77Confident70Confident5.4 Ų5.451.6 Ų51.64%0.03628%0.275CS..Hα-helixtrans-60.3-46.8174.2-76.80000111.5S1385 N1386 E1387 M1391 I1458 L1459 K1462S1385-C1389 VanDerWaalsContact O-CB 3.29Å; S1385-C1389 WeakPolarHBondContact O-CB 3.34Å; S1385-C1389 PolarHBondContact O-N 2.89Å; S1385-C1389 PolarHBondContact O-SG 3.21Å; N1386-C1389 CarbonylContact O-C 3.54Å; N1386-C1389 WeakPolarHBondContact O-CB 3.4Å; N1386-C1389 PolarHBondContact O-N 3.08Å; E1387-C1389 VanDerWaalsContact C-N 3.3Å; E1387-C1389 PolarHBondContact O-N 3.3Å; C1389-M1391 VanDerWaalsContact C-N 3.27Å; C1389-M1391 PolarHBondContact O-N 3.24Å; C1389-I1458 HydrophobicContact CB-CG2 4.32Å; C1389-L1459 WeakPolarHBondContact SG-CD2 3.44Å; C1389-K1462 HydrophobicContact CB-CD 3.78Å; C1389-K1462 WeakPolarHBondContact O-CE 3.42Å; C1389-K1462 PolarHBondContact O-NZ 3.21Å
1390S75.7Confident69.1Low72.6 Ų72.648 Ų4851%0.50825%0.251SS..Hα-helixtrans-67.5-36.8-176.9168.20000113.3N1386 E1387 L1388N1386-S1390 VanDerWaalsContact O-CB 3.24Å; N1386-S1390 WeakPolarHBondContact O-CB 3.17Å; N1386-S1390 PolarHBondContact O-N 3.06Å; N1386-S1390 PolarHBondContact O-OG 2.98Å; E1387-S1390 PolarHBondContact O-N 2.99Å; E1387-S1390 VanDerWaalsContact O-N 3.13Å; E1387-S1390 PolarHBondContact O-OG 3.19Å; L1388-S1390 VanDerWaalsContact C-N 3.32Å; L1388-S1390 PolarHBondContact O-N 3.05Å
1391M68.7Low68.4Low42 Ų4249.4 Ų49.421%0.20726%0.261CS..Hα-helixtrans-86.2-29.7-171.8-68.9-143.670.900113.7R1347 C1350 F1351 Q1354 E1387 L1388 C1389 D1393 T1395R1347-M1391 HydrophobicContact CG-CE 4.38Å; R1347-M1391 HydrophobicContact CG-SD 4Å; R1347-M1391 VanDerWaalsContact CG-SD 3.55Å; C1350-M1391 HydrophobicContact CB-SD 3.61Å; C1350-M1391 VanDerWaalsContact CB-SD 3.51Å; C1350-M1391 WeakPolarHBondContact CB-SD 3.47Å; F1351-M1391 HydrophobicContact CB-CE 3.91Å; F1351-M1391 HydrophobicContact CB-SD 4.44Å; F1351-M1391 HydrophobicContact CD2-CE 4.1Å; F1351-M1391 HydrophobicContact CG-CE 4.49Å; Q1354-M1391 HydrophobicContact CG-CE 4.34Å; Q1354-M1391 PolarHBondContact NE2-O 3.26Å; E1387-M1391 HydrophobicContact CG-CG 4.28Å; E1387-M1391 HydrophobicContact CG-SD 4.17Å; E1387-M1391 WeakPolarHBondContact O-CB 3.38Å; E1387-M1391 VanDerWaalsContact O-CG 3.24Å; E1387-M1391 WeakPolarHBondContact O-CG 3.23Å; E1387-M1391 PolarHBondContact O-N 3.39Å; L1388-M1391 PolarHBondContact O-N 3.17Å; C1389-M1391 VanDerWaalsContact C-N 3.27Å; C1389-M1391 PolarHBondContact O-N 3.24Å; M1391-D1393 PolarHBondContact O-N 3.25Å; M1391-T1395 PolarHBondContact O-OG1 2.83Å
1392F65.9Low68Low5.4 Ų5.448.8 Ų48.82%0.02426%0.259CS..  trans-101.646.1-169.7-62.3-65.2000113.7C1350 L1353 Q1354 L1388 D1394 L1396 F1397 F1444 K1462 W1466C1350-F1392 HydrophobicContact CB-CE2 4.31Å; C1350-F1392 HydrophobicContact CB-CZ 4.06Å; C1350-F1392 VanDerWaalsContact O-CZ 3.25Å; C1350-F1392 WeakPolarHBondContact O-CZ 3.42Å; L1353-F1392 HydrophobicContact CB-CE1 4.38Å; L1353-F1392 HydrophobicContact CB-CZ 4.19Å; L1353-F1392 HydrophobicContact CD1-CZ 4.33Å; Q1354-F1392 HydrophobicContact CB-CE1 4.21Å; Q1354-F1392 HydrophobicContact CG-CD1 4.1Å; Q1354-F1392 HydrophobicContact CG-CE1 3.6Å; Q1354-F1392 HydrophobicContact CG-CZ 4.12Å; Q1354-F1392 VanDerWaalsContact NE2-CE1 3.34Å; L1388-F1392 HydrophobicContact CB-CD2 4.06Å; L1388-F1392 HydrophobicContact CB-CE2 4.06Å; L1388-F1392 HydrophobicContact CD1-CE2 4.45Å; L1388-F1392 HydrophobicContact CD2-CD2 4.07Å; L1388-F1392 HydrophobicContact CD2-CE2 3.35Å; L1388-F1392 VanDerWaalsContact CD2-CE2 3.42Å; L1388-F1392 HydrophobicContact CD2-CZ 4.06Å; L1388-F1392 HydrophobicContact CG-CD2 4.49Å; L1388-F1392 HydrophobicContact CG-CE2 4.2Å; L1388-F1392 VanDerWaalsContact O-CB 3.25Å; L1388-F1392 WeakPolarHBondContact O-CB 3.41Å; L1388-F1392 WeakPolarHBondContact O-CD2 3.2Å; L1388-F1392 VanDerWaalsContact O-CG 3.27Å; L1388-F1392 WeakPolarHBondContact O-CG 3.33Å; L1388-F1392 PolarHBondContact O-N 3.04Å; L1388-F1392 VanDerWaalsContact O-N 3.12Å; F1392-D1394 PolarHBondContact O-N 3.32Å; F1392-D1394 VanDerWaalsContact O-N 3.09Å; F1392-L1396 HydrophobicContact CB-CB 4.46Å; F1392-L1396 HydrophobicContact CB-CD1 4.02Å; F1392-L1396 HydrophobicContact CB-CG 4.05Å; F1392-L1396 HydrophobicContact CD1-CB 3.77Å; F1392-L1396 HydrophobicContact CD1-CD1 3.29Å; F1392-L1396 VanDerWaalsContact CD1-CD1 3.5Å; F1392-L1396 HydrophobicContact CD1-CD2 4.39Å; F1392-L1396 HydrophobicContact CD1-CG 3.45Å; F1392-L1396 VanDerWaalsContact CD1-CG 3.43Å; F1392-L1396 HydrophobicContact CD2-CD1 3.93Å; F1392-L1396 HydrophobicContact CD2-CG 4.47Å; F1392-L1396 HydrophobicContact CE1-CB 4.32Å; F1392-L1396 HydrophobicContact CE1-CD1 3.31Å; F1392-L1396 HydrophobicContact CE1-CD2 4.17Å; F1392-L1396 HydrophobicContact CE1-CG 3.48Å; F1392-L1396 HydrophobicContact CE2-CD1 4Å; F1392-L1396 HydrophobicContact CG-CB 4.22Å; F1392-L1396 HydrophobicContact CG-CD1 3.72Å; F1392-L1396 HydrophobicContact CG-CG 4.05Å; F1392-L1396 HydrophobicContact CZ-CD1 3.69Å; F1392-L1396 VanDerWaalsContact CZ-CD1 3.47Å; F1392-L1396 HydrophobicContact CZ-CG 4.32Å; F1392-F1397 HydrophobicContact CB-CD2 4.44Å; F1392-F1397 HydrophobicContact CB-CE2 3.6Å; F1392-F1397 HydrophobicContact CB-CZ 4.29Å; F1392-F1444 HydrophobicContact CE2-CE2 4.02Å; F1392-F1444 HydrophobicContact CE2-CZ 4.38Å; F1392-F1444 HydrophobicContact CZ-CE2 4.21Å; F1392-K1462 VanDerWaalsContact O-CE 3.28Å; F1392-K1462 WeakPolarHBondContact O-CE 3.48Å; F1392-W1466 HydrophobicContact CB-CH2 4.04Å; F1392-W1466 HydrophobicContact CB-CZ2 3.66Å; F1392-W1466 HydrophobicContact CD2-CH2 4.33Å; F1392-W1466 VanDerWaalsContact O-CE2 3.27Å; F1392-W1466 WeakPolarHBondContact O-CZ2 3.49Å; F1392-W1466 PolarHBondContact O-NE1 3.37Å; F1392-W1466 VanDerWaalsContact O-NE1 3.15Å
1393D59.6Low67.7Low99.6 Ų99.646.8 Ų46.853%0.53326%0.256SS..THydrogen-bonded Turntrans-64.8-41.1171.7-80.8-33.1000112M1391 T1395 K1462M1391-D1393 PolarHBondContact O-N 3.25Å; D1393-T1395 PolarHBondContact O-N 2.84Å; D1393-K1462 VanDerWaalsContact CG-NZ 3.34Å; D1393-K1462 VanDerWaalsContact OD1-CE 3.3Å; D1393-K1462 WeakPolarHBondContact OD1-CE 3.44Å; D1393-K1462 IonicContact OD1-NZ 3.64Å; D1393-K1462 PolarHBondContact OD1-NZ 3.41Å; D1393-K1462 IonicContact OD2-NZ 3.42Å; D1393-K1462 PolarHBondContact OD2-NZ 3.4Å
1394D54Low67.3Low137.2 Ų137.251 Ų5173%0.73427%0.271SS*.SBendtrans-116.5-19.4-176.5-65.2-40.3000116.2F1392 F1397 L1398F1392-D1394 PolarHBondContact O-N 3.32Å; F1392-D1394 VanDerWaalsContact O-N 3.09Å; D1394-F1397 CarbonylContact O-C 3.57Å; D1394-F1397 PolarHBondContact O-N 3Å; D1394-L1398 VanDerWaalsContact O-CG 3.29Å; D1394-L1398 WeakPolarHBondContact O-CG 3.38Å; D1394-L1398 PolarHBondContact O-N 3.09Å
1395T52.1Low67.1Low69.2 Ų69.251.2 Ų51.243%0.42527%0.272SS..SBendtrans-87.7-32.5-163.252.70000116.1Q1354 M1391 D1393 F1397 L1398Q1354-T1395 VanDerWaalsContact NE2-CG2 3.26Å; Q1354-T1395 PolarHBondContact NE2-OG1 3.2Å; Q1354-T1395 VanDerWaalsContact NE2-OG1 3.11Å; M1391-T1395 PolarHBondContact O-OG1 2.83Å; D1393-T1395 PolarHBondContact O-N 2.84Å; T1395-F1397 VanDerWaalsContact C-N 3.27Å; T1395-F1397 PolarHBondContact O-N 3.18Å; T1395-F1397 VanDerWaalsContact O-N 3.13Å; T1395-L1398 PolarHBondContact O-N 3.08Å
1396L54Low67.1Low15.4 Ų15.455.7 Ų55.78%0.08129%0.289CS..Hα-helixtrans-67.7-21.9178.1-95.3179.5000113.1L1353 F1392 L1398 M1399 N1400 F1440 F1444 W1466L1353-L1396 HydrophobicContact CB-CD1 4.22Å; L1353-L1396 WeakPolarHBondContact O-CD2 3.44Å; F1392-L1396 HydrophobicContact CB-CB 4.46Å; F1392-L1396 HydrophobicContact CB-CD1 4.02Å; F1392-L1396 HydrophobicContact CB-CG 4.05Å; F1392-L1396 HydrophobicContact CD1-CB 3.77Å; F1392-L1396 HydrophobicContact CD1-CD1 3.29Å; F1392-L1396 VanDerWaalsContact CD1-CD1 3.5Å; F1392-L1396 HydrophobicContact CD1-CD2 4.39Å; F1392-L1396 HydrophobicContact CD1-CG 3.45Å; F1392-L1396 VanDerWaalsContact CD1-CG 3.43Å; F1392-L1396 HydrophobicContact CD2-CD1 3.93Å; F1392-L1396 HydrophobicContact CD2-CG 4.47Å; F1392-L1396 HydrophobicContact CE1-CB 4.32Å; F1392-L1396 HydrophobicContact CE1-CD1 3.31Å; F1392-L1396 HydrophobicContact CE1-CD2 4.17Å; F1392-L1396 HydrophobicContact CE1-CG 3.48Å; F1392-L1396 HydrophobicContact CE2-CD1 4Å; F1392-L1396 HydrophobicContact CG-CB 4.22Å; F1392-L1396 HydrophobicContact CG-CD1 3.72Å; F1392-L1396 HydrophobicContact CG-CG 4.05Å; F1392-L1396 HydrophobicContact CZ-CD1 3.69Å; F1392-L1396 VanDerWaalsContact CZ-CD1 3.47Å; F1392-L1396 HydrophobicContact CZ-CG 4.32Å; L1396-L1398 PolarHBondContact O-N 3.26Å; L1396-L1398 VanDerWaalsContact O-N 3.12Å; L1396-M1399 PolarHBondContact O-N 3.27Å; L1396-M1399 VanDerWaalsContact O-N 3.11Å; L1396-N1400 HydrophobicContact CD2-CB 4.41Å; L1396-N1400 PolarHBondContact O-N 3.19Å; L1396-N1400 VanDerWaalsContact O-N 3.17Å; L1396-F1440 HydrophobicContact CD2-CE1 3.93Å; L1396-F1440 HydrophobicContact CD2-CZ 3.72Å; L1396-F1444 HydrophobicContact CD1-CD2 4.44Å; L1396-F1444 HydrophobicContact CD1-CE1 4.17Å; L1396-F1444 HydrophobicContact CD1-CE2 3.88Å; L1396-F1444 HydrophobicContact CD1-CZ 3.63Å; L1396-F1444 VanDerWaalsContact CD1-CZ 3.48Å; L1396-F1444 HydrophobicContact CD2-CE1 4.36Å; L1396-F1444 HydrophobicContact CD2-CZ 4.16Å; L1396-W1466 HydrophobicContact CD1-CB 4.13Å; L1396-W1466 HydrophobicContact CD1-CD2 3.23Å; L1396-W1466 HydrophobicContact CD1-CE3 3.4Å; L1396-W1466 VanDerWaalsContact CD1-CE3 3.4Å; L1396-W1466 HydrophobicContact CD1-CG 3.58Å; L1396-W1466 HydrophobicContact CD1-CH2 4.15Å; L1396-W1466 HydrophobicContact CD1-CZ2 4.03Å; L1396-W1466 HydrophobicContact CD1-CZ3 3.86Å
1397F53.5Low67Low117.2 Ų117.257.6 Ų57.651%0.51430%0.299SS..Hα-helixtrans-60.5-28.9-178.2-152.7-92.8000112.6F1392 D1394 T1395 M1399 N1400 S1401 F1444 W1466 F1467F1392-F1397 HydrophobicContact CB-CD2 4.44Å; F1392-F1397 HydrophobicContact CB-CE2 3.6Å; F1392-F1397 HydrophobicContact CB-CZ 4.29Å; D1394-F1397 CarbonylContact O-C 3.57Å; D1394-F1397 PolarHBondContact O-N 3Å; T1395-F1397 VanDerWaalsContact C-N 3.27Å; T1395-F1397 PolarHBondContact O-N 3.18Å; T1395-F1397 VanDerWaalsContact O-N 3.13Å; F1397-M1399 VanDerWaalsContact C-N 3.29Å; F1397-M1399 PolarHBondContact O-N 3.17Å; F1397-N1400 CarbonylContact O-C 3.6Å; F1397-N1400 PolarHBondContact O-N 3.12Å; F1397-S1401 WeakPolarHBondContact O-CA 3.27Å; F1397-S1401 WeakPolarHBondContact O-CB 3.34Å; F1397-S1401 PolarHBondContact O-N 3.16Å; F1397-F1444 HydrophobicContact CE1-CE1 4.45Å; F1397-F1444 AromaticContact CE1-CZ 3.94Å; F1397-F1444 HydrophobicContact CE1-CZ 3.94Å; F1397-W1466 HydrophobicContact CD1-CB 3.67Å; F1397-W1466 AromaticContact CD1-CD2 3.75Å; F1397-W1466 HydrophobicContact CD1-CD2 3.75Å; F1397-W1466 AromaticContact CD1-CE3 3.96Å; F1397-W1466 HydrophobicContact CD1-CE3 3.96Å; F1397-W1466 AromaticContact CD1-CG 3.65Å; F1397-W1466 HydrophobicContact CD1-CG 3.65Å; F1397-W1466 AromaticContact CD2-CD1 3.77Å; F1397-W1466 AromaticContact CD2-CD2 3.9Å; F1397-W1466 HydrophobicContact CD2-CD2 3.9Å; F1397-W1466 AromaticContact CD2-CE2 3.7Å; F1397-W1466 AromaticContact CD2-CG 3.93Å; F1397-W1466 HydrophobicContact CD2-CG 3.93Å; F1397-W1466 HydrophobicContact CD2-CZ2 4.21Å; F1397-W1466 AromaticContact CD2-NE1 3.63Å; F1397-W1466 WeakPolarHBondContact CD2-O 3.24Å; F1397-W1466 HydrophobicContact CE1-CB 4.1Å; F1397-W1466 AromaticContact CE1-CD2 3.35Å; F1397-W1466 HydrophobicContact CE1-CD2 3.35Å; F1397-W1466 AromaticContact CE1-CE2 3.98Å; F1397-W1466 AromaticContact CE1-CE3 3.15Å; F1397-W1466 HydrophobicContact CE1-CE3 3.15Å; F1397-W1466 AromaticContact CE1-CG 3.81Å; F1397-W1466 HydrophobicContact CE1-CG 3.81Å; F1397-W1466 HydrophobicContact CE1-CH2 4.18Å; F1397-W1466 HydrophobicContact CE1-CZ2 4.35Å; F1397-W1466 AromaticContact CE1-CZ3 3.61Å; F1397-W1466 HydrophobicContact CE1-CZ3 3.61Å; F1397-W1466 AromaticContact CE2-CD2 3.51Å; F1397-W1466 HydrophobicContact CE2-CD2 3.51Å; F1397-W1466 AromaticContact CE2-CE2 3.17Å; F1397-W1466 AromaticContact CE2-CE3 3.9Å; F1397-W1466 HydrophobicContact CE2-CE3 3.9Å; F1397-W1466 HydrophobicContact CE2-CG 4.06Å; F1397-W1466 AromaticContact CE2-CH2 3.67Å; F1397-W1466 HydrophobicContact CE2-CH2 3.67Å; F1397-W1466 AromaticContact CE2-CZ2 3.27Å; F1397-W1466 HydrophobicContact CE2-CZ2 3.27Å; F1397-W1466 AromaticContact CE2-CZ3 3.98Å; F1397-W1466 HydrophobicContact CE2-CZ3 3.98Å; F1397-W1466 AromaticContact CE2-NE1 3.59Å; F1397-W1466 WeakPolarHBondContact CE2-O 3.32Å; F1397-W1466 HydrophobicContact CG-CB 4.02Å; F1397-W1466 AromaticContact CG-CD1 3.89Å; F1397-W1466 HydrophobicContact CG-CD2 4.02Å; F1397-W1466 AromaticContact CG-CG 3.74Å; F1397-W1466 HydrophobicContact CG-CG 3.74Å; F1397-W1466 AromaticContact CZ-CD2 3.25Å; F1397-W1466 HydrophobicContact CZ-CD2 3.25Å; F1397-W1466 AromaticContact CZ-CE2 3.38Å; F1397-W1466 AromaticContact CZ-CE3 3.14Å; F1397-W1466 HydrophobicContact CZ-CE3 3.14Å; F1397-W1466 HydrophobicContact CZ-CG 4.03Å; F1397-W1466 AromaticContact CZ-CH2 3.27Å; F1397-W1466 HydrophobicContact CZ-CH2 3.27Å; F1397-W1466 AromaticContact CZ-CZ2 3.39Å; F1397-W1466 HydrophobicContact CZ-CZ2 3.39Å; F1397-W1466 AromaticContact CZ-CZ3 3.16Å; F1397-W1466 HydrophobicContact CZ-CZ3 3.16Å; F1397-F1467 HydrophobicContact CD1-CE1 4.43Å; F1397-F1467 AromaticContact CD1-CE2 3.76Å; F1397-F1467 HydrophobicContact CD1-CE2 3.76Å; F1397-F1467 AromaticContact CD1-CZ 3.57Å; F1397-F1467 HydrophobicContact CD1-CZ 3.57Å; F1397-F1467 AromaticContact CE1-CE2 3.82Å; F1397-F1467 HydrophobicContact CE1-CE2 3.82Å; F1397-F1467 AromaticContact CE1-CZ 3.99Å; F1397-F1467 HydrophobicContact CE1-CZ 3.99Å
1398L49.9Very low66.9Low135.8 Ų135.857.5 Ų57.571%0.71130%0.298SS*.Hα-helixtrans-77.3-33.6180-74.2167.7000113.6D1394 T1395 L1396 S1401D1394-L1398 VanDerWaalsContact O-CG 3.29Å; D1394-L1398 WeakPolarHBondContact O-CG 3.38Å; D1394-L1398 PolarHBondContact O-N 3.09Å; T1395-L1398 PolarHBondContact O-N 3.08Å; L1396-L1398 PolarHBondContact O-N 3.26Å; L1396-L1398 VanDerWaalsContact O-N 3.12Å; L1398-S1401 WeakPolarHBondContact O-CB 3.34Å; L1398-S1401 PolarHBondContact O-OG 3.44Å
1399M52.7Low66.9Low59.6 Ų59.657.3 Ų57.329%0.29430%0.297SS..THydrogen-bonded Turntrans-89.8-32.6-174.1-70.1-145.151.400113.9L1353 K1355 P1358 Y1359 L1396 F1397 S1401 R1404 F1440L1353-M1399 WeakPolarHBondContact O-CE 3.41Å; K1355-M1399 WeakPolarHBondContact O-CE 3.21Å; P1358-M1399 HydrophobicContact CB-CE 3.99Å; P1358-M1399 VanDerWaalsContact CD-CE 3.42Å; P1358-M1399 HydrophobicContact CG-CE 3.71Å; P1358-M1399 HydrophobicContact CG-SD 4.05Å; Y1359-M1399 HydrophobicContact CD2-CE 3.69Å; Y1359-M1399 HydrophobicContact CD2-SD 4.36Å; Y1359-M1399 HydrophobicContact CE1-SD 4.42Å; Y1359-M1399 HydrophobicContact CE2-CE 3.5Å; Y1359-M1399 VanDerWaalsContact CE2-CE 3.5Å; Y1359-M1399 HydrophobicContact CE2-SD 3.92Å; Y1359-M1399 HydrophobicContact CG-CE 4.48Å; L1396-M1399 PolarHBondContact O-N 3.27Å; L1396-M1399 VanDerWaalsContact O-N 3.11Å; F1397-M1399 VanDerWaalsContact C-N 3.29Å; F1397-M1399 PolarHBondContact O-N 3.17Å; M1399-S1401 VanDerWaalsContact C-N 3.34Å; M1399-R1404 WeakPolarHBondContact O-CD 3.28Å; M1399-F1440 HydrophobicContact CB-CE1 4.36Å; M1399-F1440 HydrophobicContact CE-CD1 4.33Å; M1399-F1440 HydrophobicContact CE-CE1 4.49Å
1400N60.6Low67Low4.2 Ų4.259.8 Ų59.82%0.02231%0.31CS..SBendtrans-113.319.9-176-80.4-28.2000114L1396 F1397 F1402 F1440 N1441 F1444 F1467L1396-N1400 HydrophobicContact CD2-CB 4.41Å; L1396-N1400 PolarHBondContact O-N 3.19Å; L1396-N1400 VanDerWaalsContact O-N 3.17Å; F1397-N1400 CarbonylContact O-C 3.6Å; F1397-N1400 PolarHBondContact O-N 3.12Å; N1400-F1402 PolarHBondContact O-N 3.09Å; N1400-F1440 VanDerWaalsContact ND2-CD1 3.27Å; N1400-F1440 WeakPolarHBondContact ND2-CD1 3.35Å; N1400-F1440 VanDerWaalsContact ND2-CE1 3.3Å; N1400-F1440 WeakPolarHBondContact ND2-CE1 3.38Å; N1400-F1440 WeakPolarHBondContact OD1-CD1 3.46Å; N1400-F1440 WeakPolarHBondContact OD1-CE1 3.44Å; N1400-N1441 WeakPolarHBondContact CA-ND2 3.18Å; N1400-N1441 WeakPolarHBondContact CB-ND2 3.47Å; N1400-N1441 PolarHBondContact OD1-ND2 3.17Å; N1400-F1444 HydrophobicContact CB-CD1 4Å; N1400-F1444 HydrophobicContact CB-CE1 4.08Å; N1400-F1444 VanDerWaalsContact ND2-CD1 3.31Å; N1400-F1444 WeakPolarHBondContact ND2-CD1 3.4Å; N1400-F1444 WeakPolarHBondContact ND2-CE1 3.3Å; N1400-F1444 WeakPolarHBondContact ND2-CG 3.3Å; N1400-F1467 HydrophobicContact CB-CE1 4.2Å; N1400-F1467 HydrophobicContact CB-CZ 4.29Å
1401S67.9Low67Low32.4 Ų32.459.2 Ų59.223%0.22731%0.306CS..  trans-60.213617462.20000110.8F1397 L1398 M1399 S1403 R1404 V1405F1397-S1401 WeakPolarHBondContact O-CA 3.27Å; F1397-S1401 WeakPolarHBondContact O-CB 3.34Å; F1397-S1401 PolarHBondContact O-N 3.16Å; L1398-S1401 WeakPolarHBondContact O-CB 3.34Å; L1398-S1401 PolarHBondContact O-OG 3.44Å; M1399-S1401 VanDerWaalsContact C-N 3.34Å; S1401-S1403 VanDerWaalsContact CB-OG 3.26Å; S1401-S1403 WeakPolarHBondContact CB-OG 3.31Å; S1401-S1403 PolarHBondContact O-N 3.1Å; S1401-S1403 VanDerWaalsContact O-N 3.11Å; S1401-S1403 PolarHBondContact OG-OG 3.07Å; S1401-R1404 WeakPolarHBondContact O-CA 3.35Å; S1401-R1404 WeakPolarHBondContact O-CB 3.37Å; S1401-R1404 PolarHBondContact O-N 3.09Å; S1401-R1404 WeakPolarHBondContact OG-CB 3.27Å; S1401-R1404 PolarHBondContact OG-N 2.9Å; S1401-V1405 PolarHBondContact O-N 3.06Å; S1401-V1405 VanDerWaalsContact O-N 3.09Å
1402F73.1Confident67.3Low6.6 Ų6.657.3 Ų57.33%0.02930%0.297CS..Hα-helixtrans-55.8-27174-67.9-58.4000112.4N1400 R1404 V1405 R1406 F1445 F1467 E1471 L1472 V1475 Y1493N1400-F1402 PolarHBondContact O-N 3.09Å; F1402-R1404 VanDerWaalsContact C-N 3.34Å; F1402-V1405 PolarHBondContact O-N 2.71Å; F1402-R1406 WeakPolarHBondContact O-CB 3.37Å; F1402-R1406 PolarHBondContact O-N 3.18Å; F1402-F1445 HydrophobicContact CD1-CZ 4.38Å; F1402-F1445 AromaticContact CE1-CE1 3.85Å; F1402-F1445 HydrophobicContact CE1-CE1 4.04Å; F1402-F1445 AromaticContact CE1-CE2 3.98Å; F1402-F1445 HydrophobicContact CE1-CE2 4Å; F1402-F1445 AromaticContact CE1-CZ 3.42Å; F1402-F1445 HydrophobicContact CE1-CZ 3.42Å; F1402-F1445 VanDerWaalsContact CE1-CZ 3.45Å; F1402-F1445 HydrophobicContact CE2-CZ 4.44Å; F1402-F1445 AromaticContact CZ-CE1 3.8Å; F1402-F1445 HydrophobicContact CZ-CE1 3.8Å; F1402-F1445 HydrophobicContact CZ-CE2 4.39Å; F1402-F1445 AromaticContact CZ-CZ 3.4Å; F1402-F1445 HydrophobicContact CZ-CZ 3.4Å; F1402-F1467 AromaticContact CD2-CD1 3.92Å; F1402-F1467 HydrophobicContact CD2-CD1 4.02Å; F1402-F1467 HydrophobicContact CE2-CB 3.8Å; F1402-F1467 AromaticContact CE2-CD1 3.39Å; F1402-F1467 HydrophobicContact CE2-CD1 3.39Å; F1402-F1467 VanDerWaalsContact CE2-CD1 3.42Å; F1402-F1467 HydrophobicContact CE2-CE1 4.33Å; F1402-F1467 AromaticContact CE2-CG 3.86Å; F1402-F1467 HydrophobicContact CE2-CG 3.92Å; F1402-F1467 HydrophobicContact CZ-CB 4.37Å; F1402-F1467 AromaticContact CZ-CD1 3.76Å; F1402-F1467 HydrophobicContact CZ-CD1 3.76Å; F1402-F1467 HydrophobicContact CZ-CE1 4.4Å; F1402-F1467 HydrophobicContact CZ-CG 4.27Å; F1402-E1471 HydrophobicContact CB-CB 3.84Å; F1402-E1471 HydrophobicContact CD2-CB 3.76Å; F1402-E1471 HydrophobicContact CG-CB 4.15Å; F1402-L1472 HydrophobicContact CD1-CD1 4.38Å; F1402-L1472 HydrophobicContact CD2-CB 4.28Å; F1402-L1472 HydrophobicContact CE1-CB 4.22Å; F1402-L1472 HydrophobicContact CE1-CD1 3.77Å; F1402-L1472 HydrophobicContact CE1-CG 4.39Å; F1402-L1472 HydrophobicContact CE2-CB 3.83Å; F1402-L1472 HydrophobicContact CE2-CD1 4.38Å; F1402-L1472 HydrophobicContact CE2-CG 4.46Å; F1402-L1472 HydrophobicContact CZ-CB 3.71Å; F1402-L1472 HydrophobicContact CZ-CD1 3.57Å; F1402-L1472 HydrophobicContact CZ-CD2 4.49Å; F1402-L1472 HydrophobicContact CZ-CG 4.12Å; F1402-V1475 HydrophobicContact CB-CG2 3.99Å; F1402-V1475 HydrophobicContact CD1-CB 4.5Å; F1402-V1475 HydrophobicContact CD1-CG2 4.04Å; F1402-V1475 HydrophobicContact CG-CG2 4.36Å; F1402-Y1493 HydrophobicContact CE1-CD1 4.31Å; F1402-Y1493 AromaticContact CE1-CE1 3.94Å; F1402-Y1493 HydrophobicContact CE1-CE1 4.04Å
1403S74.3Confident67.5Low59.6 Ų59.660.3 Ų60.342%0.41731%0.313SS..Hα-helixtrans-62.7-40.1172.156.60000112.7S1401 R1406 N1407S1401-S1403 VanDerWaalsContact CB-OG 3.26Å; S1401-S1403 WeakPolarHBondContact CB-OG 3.31Å; S1401-S1403 PolarHBondContact O-N 3.1Å; S1401-S1403 VanDerWaalsContact O-N 3.11Å; S1401-S1403 PolarHBondContact OG-OG 3.07Å; S1403-R1406 PolarHBondContact O-N 3.3Å; S1403-N1407 WeakPolarHBondContact O-CB 3.24Å; S1403-N1407 PolarHBondContact O-N 3.14Å; S1403-N1407 PolarHBondContact O-ND2 3.25Å; S1403-N1407 PolarHBondContact O-OD1 3.01Å
1404R75.3Confident67.9Low113.6 Ų113.662.5 Ų62.543%0.42932%0.324SS..Hα-helixtrans-69.7-45.6176.1-174.3178.6177.295.60.8111.2M1399 S1401 F1402 R1406 N1407 I1408 D1437M1399-R1404 WeakPolarHBondContact O-CD 3.28Å; S1401-R1404 WeakPolarHBondContact O-CA 3.35Å; S1401-R1404 WeakPolarHBondContact O-CB 3.37Å; S1401-R1404 PolarHBondContact O-N 3.09Å; S1401-R1404 WeakPolarHBondContact OG-CB 3.27Å; S1401-R1404 PolarHBondContact OG-N 2.9Å; F1402-R1404 VanDerWaalsContact C-N 3.34Å; R1404-R1406 VanDerWaalsContact C-N 3.27Å; R1404-R1406 PolarHBondContact O-N 3.18Å; R1404-N1407 PolarHBondContact O-N 3.32Å; R1404-N1407 VanDerWaalsContact O-N 3.17Å; R1404-I1408 HydrophobicContact CG-CD1 4.36Å; R1404-I1408 VanDerWaalsContact O-CG1 3.3Å; R1404-I1408 WeakPolarHBondContact O-CG1 3.29Å; R1404-I1408 PolarHBondContact O-N 3.07Å; R1404-D1437 IonicContact CZ-OD2 3.36Å; R1404-D1437 VanDerWaalsContact CZ-OD2 3.29Å; R1404-D1437 IonicContact NE-OD2 3.31Å; R1404-D1437 PolarHBondContact NE-OD2 3.07Å; R1404-D1437 IonicContact NH2-OD2 3.04Å; R1404-D1437 PolarHBondContact NH2-OD2 3.12Å
1405V78.5Confident68.3Low3.4 Ų3.458.8 Ų58.82%0.02131%0.306CS..Hα-helixtrans-57.1-46.4174.3175.80000109.8S1401 F1402 N1407 I1408 L1409 L1438 N1441 V1475 Y1493S1401-V1405 PolarHBondContact O-N 3.06Å; S1401-V1405 VanDerWaalsContact O-N 3.09Å; F1402-V1405 PolarHBondContact O-N 2.71Å; V1405-N1407 PolarHBondContact O-N 2.89Å; V1405-I1408 WeakPolarHBondContact O-CA 3.45Å; V1405-I1408 WeakPolarHBondContact O-CB 3.33Å; V1405-I1408 PolarHBondContact O-N 3.21Å; V1405-I1408 VanDerWaalsContact O-N 3.17Å; V1405-L1409 HydrophobicContact CG1-CD1 3.92Å; V1405-L1409 HydrophobicContact CG1-CG 4.24Å; V1405-L1409 VanDerWaalsContact O-CG 3.28Å; V1405-L1409 WeakPolarHBondContact O-CG 3.4Å; V1405-L1409 PolarHBondContact O-N 2.98Å; V1405-L1438 HydrophobicContact CG1-CD1 3.99Å; V1405-L1438 HydrophobicContact CG1-CD2 3.97Å; V1405-N1441 HydrophobicContact CG2-CB 4.27Å; V1405-N1441 WeakPolarHBondContact CG2-ND2 3.42Å; V1405-V1475 HydrophobicContact CG1-CG1 4.13Å; V1405-Y1493 WeakPolarHBondContact CG1-OH 3.28Å
1406R77.9Confident68.7Low98.4 Ų98.457.5 Ų57.537%0.37130%0.296SS..Hα-helixtrans-60.3-44.8176.4-177177.5176.2177.33.3112.4F1402 S1403 R1404 I1408 L1409 D1410 V1475F1402-R1406 WeakPolarHBondContact O-CB 3.37Å; F1402-R1406 PolarHBondContact O-N 3.18Å; S1403-R1406 PolarHBondContact O-N 3.3Å; R1404-R1406 VanDerWaalsContact C-N 3.27Å; R1404-R1406 PolarHBondContact O-N 3.18Å; R1406-I1408 VanDerWaalsContact C-N 3.25Å; R1406-I1408 PolarHBondContact O-N 3.27Å; R1406-L1409 CarbonylContact O-C 3.46Å; R1406-L1409 WeakPolarHBondContact O-CA 3.37Å; R1406-L1409 WeakPolarHBondContact O-CB 3.42Å; R1406-L1409 PolarHBondContact O-N 3.08Å; R1406-L1409 VanDerWaalsContact O-N 3.09Å; R1406-D1410 WeakPolarHBondContact CG-OD2 3.41Å; R1406-D1410 IonicContact NE-OD2 2.97Å; R1406-D1410 WeakPolarHBondContact O-CB 3.33Å; R1406-D1410 VanDerWaalsContact O-CG 3.29Å; R1406-D1410 PolarHBondContact O-N 3.04Å; R1406-V1475 HydrophobicContact CB-CG2 4.29Å
1407N78.9Confident68.7Low106 Ų10661.6 Ų61.657%0.56732%0.322SS*.Hα-helixtrans-60.6-37176.3-68.2-12.3000111.9S1403 R1404 V1405 S1411S1403-N1407 WeakPolarHBondContact O-CB 3.24Å; S1403-N1407 PolarHBondContact O-N 3.14Å; S1403-N1407 PolarHBondContact O-ND2 3.25Å; S1403-N1407 PolarHBondContact O-OD1 3.01Å; R1404-N1407 PolarHBondContact O-N 3.32Å; R1404-N1407 VanDerWaalsContact O-N 3.17Å; V1405-N1407 PolarHBondContact O-N 2.89Å; N1407-S1411 WeakPolarHBondContact O-CB 3.44Å; N1407-S1411 PolarHBondContact O-N 3.18Å; N1407-S1411 VanDerWaalsContact O-N 3.07Å; N1407-S1411 PolarHBondContact O-OG 3.37Å
1408I76.9Confident68.5Low19.4 Ų19.466 Ų6610%0.09934%0.337CS..Hα-helixtrans-66.2-44.7173.4-63.3164.9000109.9R1404 V1405 R1406 D1410 S1411 L1412 F1429 D1437 L1438R1404-I1408 HydrophobicContact CG-CD1 4.36Å; R1404-I1408 VanDerWaalsContact O-CG1 3.3Å; R1404-I1408 WeakPolarHBondContact O-CG1 3.29Å; R1404-I1408 PolarHBondContact O-N 3.07Å; V1405-I1408 WeakPolarHBondContact O-CA 3.45Å; V1405-I1408 WeakPolarHBondContact O-CB 3.33Å; V1405-I1408 PolarHBondContact O-N 3.21Å; V1405-I1408 VanDerWaalsContact O-N 3.17Å; R1406-I1408 VanDerWaalsContact C-N 3.25Å; R1406-I1408 PolarHBondContact O-N 3.27Å; I1408-D1410 PolarHBondContact O-N 3.06Å; I1408-S1411 WeakPolarHBondContact CA-OG 3.47Å; I1408-S1411 WeakPolarHBondContact O-CB 3.34Å; I1408-S1411 PolarHBondContact O-N 2.98Å; I1408-S1411 PolarHBondContact O-OG 3.13Å; I1408-L1412 HydrophobicContact CG2-CD1 4.16Å; I1408-L1412 HydrophobicContact CG2-CG 4.46Å; I1408-L1412 WeakPolarHBondContact O-CB 3.44Å; I1408-L1412 WeakPolarHBondContact O-CD1 3.5Å; I1408-L1412 VanDerWaalsContact O-CG 3.32Å; I1408-L1412 WeakPolarHBondContact O-CG 3.28Å; I1408-L1412 PolarHBondContact O-N 3.04Å; I1408-F1429 HydrophobicContact CG2-CE1 4.22Å; I1408-D1437 HydrophobicContact CD1-CB 4.07Å; I1408-L1438 HydrophobicContact CB-CD1 4.44Å; I1408-L1438 HydrophobicContact CD1-CG 4.33Å; I1408-L1438 HydrophobicContact CG2-CD1 3.67Å; I1408-L1438 VanDerWaalsContact CG2-CD1 3.43Å; I1408-L1438 HydrophobicContact CG2-CD2 4.22Å; I1408-L1438 HydrophobicContact CG2-CG 3.98Å
1409L78Confident68.1Low0 Ų062.2 Ų62.20%032%0.322CS..Hα-helixtrans-64.9-39.6177.6-65.5172.7000112.3V1405 R1406 S1411 L1412 L1413 L1438 V1475 H1478 V1480 T1481 L1486 L1489V1405-L1409 HydrophobicContact CG1-CD1 3.92Å; V1405-L1409 HydrophobicContact CG1-CG 4.24Å; V1405-L1409 VanDerWaalsContact O-CG 3.28Å; V1405-L1409 WeakPolarHBondContact O-CG 3.4Å; V1405-L1409 PolarHBondContact O-N 2.98Å; R1406-L1409 CarbonylContact O-C 3.46Å; R1406-L1409 WeakPolarHBondContact O-CA 3.37Å; R1406-L1409 WeakPolarHBondContact O-CB 3.42Å; R1406-L1409 PolarHBondContact O-N 3.08Å; R1406-L1409 VanDerWaalsContact O-N 3.09Å; L1409-S1411 VanDerWaalsContact C-N 3.33Å; L1409-S1411 PolarHBondContact O-N 3.45Å; L1409-L1412 HydrophobicContact CD2-CD1 4.42Å; L1409-L1412 CarbonylContact O-C 3.57Å; L1409-L1412 WeakPolarHBondContact O-CB 3.07Å; L1409-L1412 PolarHBondContact O-N 3.06Å; L1409-L1413 WeakPolarHBondContact O-CB 3.27Å; L1409-L1413 PolarHBondContact O-N 3.38Å; L1409-L1438 HydrophobicContact CD2-CD2 4.5Å; L1409-V1475 HydrophobicContact CD1-CG1 3.91Å; L1409-H1478 HydrophobicContact CD1-CB 4.35Å; L1409-H1478 PolarHBondContact O-CE1 3.09Å; L1409-V1480 HydrophobicContact CB-CB 4.44Å; L1409-V1480 HydrophobicContact CB-CG1 4.3Å; L1409-V1480 HydrophobicContact CD2-CB 4.11Å; L1409-V1480 HydrophobicContact CD2-CG1 3.57Å; L1409-V1480 VanDerWaalsContact CD2-CG1 3.41Å; L1409-V1480 HydrophobicContact CG-CG1 4.41Å; L1409-V1480 WeakPolarHBondContact O-CG2 3.34Å; L1409-T1481 HydrophobicContact CD1-CG2 3.91Å; L1409-T1481 HydrophobicContact CD2-CG2 4.34Å; L1409-L1486 HydrophobicContact CD2-CD1 4.41Å; L1409-L1489 HydrophobicContact CD2-CD2 4.19Å
1410D80.1Confident67.7Low57.4 Ų57.467.1 Ų67.131%0.30735%0.349SS..Hα-helixtrans-64.5-40.4175.3-73.8-33.9000110.2R1406 I1408 L1412 L1413 L1414 H1478R1406-D1410 WeakPolarHBondContact CG-OD2 3.41Å; R1406-D1410 IonicContact NE-OD2 2.97Å; R1406-D1410 WeakPolarHBondContact O-CB 3.33Å; R1406-D1410 VanDerWaalsContact O-CG 3.29Å; R1406-D1410 PolarHBondContact O-N 3.04Å; I1408-D1410 PolarHBondContact O-N 3.06Å; D1410-L1412 VanDerWaalsContact C-N 3.34Å; D1410-L1412 PolarHBondContact O-N 3.2Å; D1410-L1413 VanDerWaalsContact O-CB 3.3Å; D1410-L1413 WeakPolarHBondContact O-CB 3.39Å; D1410-L1413 PolarHBondContact O-N 2.94Å; D1410-L1414 PolarHBondContact O-N 3.23Å; D1410-H1478 IonicContact OD1-CD2 3.2Å; D1410-H1478 IonicContact OD1-NE2 3.19Å; D1410-H1478 PolarHBondContact OD1-NE2 3.21Å; D1410-H1478 VanDerWaalsContact OD1-NE2 3.1Å
1411S76.1Confident66.7Low60 Ų6071.4 Ų71.442%0.4238%0.38SS..Hα-helixtrans-64.5-40.6173.41450000112N1407 I1408 L1409 L1413 L1414 T1415N1407-S1411 WeakPolarHBondContact O-CB 3.44Å; N1407-S1411 PolarHBondContact O-N 3.18Å; N1407-S1411 VanDerWaalsContact O-N 3.07Å; N1407-S1411 PolarHBondContact O-OG 3.37Å; I1408-S1411 WeakPolarHBondContact CA-OG 3.47Å; I1408-S1411 WeakPolarHBondContact O-CB 3.34Å; I1408-S1411 PolarHBondContact O-N 2.98Å; I1408-S1411 PolarHBondContact O-OG 3.13Å; L1409-S1411 VanDerWaalsContact C-N 3.33Å; L1409-S1411 PolarHBondContact O-N 3.45Å; S1411-L1413 VanDerWaalsContact C-N 3.31Å; S1411-L1413 PolarHBondContact O-N 3.5Å; S1411-L1414 WeakPolarHBondContact O-CB 3.18Å; S1411-L1414 PolarHBondContact O-N 3.17Å; S1411-T1415 PolarHBondContact O-N 3.19Å
1412L73.3Confident65.6Low3.8 Ų3.873 Ų732%0.0239%0.391CS..Hα-helixtrans-67.9-34.1175.1-70.9172.9000111.9I1408 L1409 D1410 L1414 T1415 I1416 I1427 F1429 L1438 V1480 L1486I1408-L1412 HydrophobicContact CG2-CD1 4.16Å; I1408-L1412 HydrophobicContact CG2-CG 4.46Å; I1408-L1412 WeakPolarHBondContact O-CB 3.44Å; I1408-L1412 WeakPolarHBondContact O-CD1 3.5Å; I1408-L1412 VanDerWaalsContact O-CG 3.32Å; I1408-L1412 WeakPolarHBondContact O-CG 3.28Å; I1408-L1412 PolarHBondContact O-N 3.04Å; L1409-L1412 HydrophobicContact CD2-CD1 4.42Å; L1409-L1412 CarbonylContact O-C 3.57Å; L1409-L1412 WeakPolarHBondContact O-CB 3.07Å; L1409-L1412 PolarHBondContact O-N 3.06Å; D1410-L1412 VanDerWaalsContact C-N 3.34Å; D1410-L1412 PolarHBondContact O-N 3.2Å; L1412-L1414 VanDerWaalsContact C-N 3.29Å; L1412-L1414 PolarHBondContact O-N 3.11Å; L1412-T1415 WeakPolarHBondContact CA-OG1 3.13Å; L1412-T1415 CarbonylContact O-C 3.51Å; L1412-T1415 WeakPolarHBondContact O-CA 3.4Å; L1412-T1415 WeakPolarHBondContact O-CB 3.42Å; L1412-T1415 PolarHBondContact O-N 3.07Å; L1412-T1415 PolarHBondContact O-OG1 3.11Å; L1412-I1416 HydrophobicContact CB-CD1 4.09Å; L1412-I1416 VanDerWaalsContact O-CG1 3.25Å; L1412-I1416 WeakPolarHBondContact O-CG1 3.25Å; L1412-I1416 PolarHBondContact O-N 3.05Å; L1412-I1416 VanDerWaalsContact O-N 3.09Å; L1412-I1427 HydrophobicContact CB-CG2 4.25Å; L1412-I1427 HydrophobicContact CD1-CG2 4.48Å; L1412-I1427 HydrophobicContact CD2-CG2 3.76Å; L1412-I1427 HydrophobicContact CG-CG2 4.35Å; L1412-F1429 HydrophobicContact CD1-CD1 4.29Å; L1412-F1429 HydrophobicContact CD1-CE1 3.59Å; L1412-F1429 VanDerWaalsContact CD1-CE1 3.45Å; L1412-F1429 HydrophobicContact CD1-CZ 4.04Å; L1412-F1429 HydrophobicContact CD2-CD1 3.78Å; L1412-F1429 HydrophobicContact CD2-CE1 3.9Å; L1412-F1429 HydrophobicContact CD2-CG 4.36Å; L1412-F1429 HydrophobicContact CD2-CZ 4.35Å; L1412-F1429 HydrophobicContact CG-CD1 4.28Å; L1412-F1429 HydrophobicContact CG-CE1 4.15Å; L1412-L1438 HydrophobicContact CD1-CD1 4.01Å; L1412-V1480 HydrophobicContact CB-CG1 4.28Å; L1412-V1480 HydrophobicContact CB-CG2 4.42Å; L1412-V1480 HydrophobicContact CD1-CG1 4.3Å; L1412-L1486 HydrophobicContact CD1-CD1 4.17Å
1413L71Confident64.3Low67 Ų6775.6 Ų75.635%0.35141%0.414SS..Hα-helixtrans-59-40.3176.6-172.690.2000111.4L1409 D1410 S1411 T1415 I1416 T1417 P1479 V1480L1409-L1413 WeakPolarHBondContact O-CB 3.27Å; L1409-L1413 PolarHBondContact O-N 3.38Å; D1410-L1413 VanDerWaalsContact O-CB 3.3Å; D1410-L1413 WeakPolarHBondContact O-CB 3.39Å; D1410-L1413 PolarHBondContact O-N 2.94Å; S1411-L1413 VanDerWaalsContact C-N 3.31Å; S1411-L1413 PolarHBondContact O-N 3.5Å; L1413-T1415 VanDerWaalsContact C-N 3.26Å; L1413-T1415 PolarHBondContact O-N 3.19Å; L1413-T1415 VanDerWaalsContact O-N 3.16Å; L1413-I1416 HydrophobicContact CD1-CD1 4.27Å; L1413-I1416 HydrophobicContact CG-CD1 4.13Å; L1413-I1416 WeakPolarHBondContact O-CB 3.29Å; L1413-I1416 WeakPolarHBondContact O-CG1 3.46Å; L1413-I1416 PolarHBondContact O-N 2.91Å; L1413-I1416 VanDerWaalsContact O-N 3.11Å; L1413-T1417 PolarHBondContact O-N 3.36Å; L1413-P1479 HydrophobicContact CD1-CB 4.38Å; L1413-P1479 HydrophobicContact CD1-CG 3.59Å; L1413-P1479 VanDerWaalsContact CD1-CG 3.46Å; L1413-P1479 HydrophobicContact CD2-CG 3.91Å; L1413-V1480 HydrophobicContact CB-CG2 3.81Å; L1413-V1480 HydrophobicContact CD1-CG2 3.92Å; L1413-V1480 HydrophobicContact CG-CG2 4.35Å
1414L67.6Low62.9Low145.8 Ų145.875.7 Ų75.776%0.76341%0.405SS*.Hα-helixtrans-63.4-25.3175.7-68.4169.8000112.5D1410 S1411 L1412 I1416 T1417 Y1418D1410-L1414 PolarHBondContact O-N 3.23Å; S1411-L1414 WeakPolarHBondContact O-CB 3.18Å; S1411-L1414 PolarHBondContact O-N 3.17Å; L1412-L1414 VanDerWaalsContact C-N 3.29Å; L1412-L1414 PolarHBondContact O-N 3.11Å; L1414-I1416 PolarHBondContact O-N 3.41Å; L1414-T1417 PolarHBondContact O-N 2.73Å; L1414-T1417 PolarHBondContact O-OG1 2.73Å; L1414-Y1418 WeakPolarHBondContact O-CD2 3.41Å
1415T63Low61.7Low59.4 Ų59.472.1 Ų72.136%0.36440%0.397SS..Hα-helixtrans-87.8-15.5179.166.90000114.1S1411 L1412 L1413 T1417S1411-T1415 PolarHBondContact O-N 3.19Å; L1412-T1415 WeakPolarHBondContact CA-OG1 3.13Å; L1412-T1415 CarbonylContact O-C 3.51Å; L1412-T1415 WeakPolarHBondContact O-CA 3.4Å; L1412-T1415 WeakPolarHBondContact O-CB 3.42Å; L1412-T1415 PolarHBondContact O-N 3.07Å; L1412-T1415 PolarHBondContact O-OG1 3.11Å; L1413-T1415 VanDerWaalsContact C-N 3.26Å; L1413-T1415 PolarHBondContact O-N 3.19Å; L1413-T1415 VanDerWaalsContact O-N 3.16Å; T1415-T1417 VanDerWaalsContact C-N 3.3Å; T1415-T1417 PolarHBondContact O-N 3.21Å; T1415-T1417 VanDerWaalsContact O-N 3.08Å
1416I60.1Low60.5Low41.6 Ų41.675 Ų7521%0.21341%0.414CS..  trans-70.591.7179.8-63.6170.5000109.5L1412 L1413 L1414 Y1418 S1419 S1425 I1427 V1480L1412-I1416 HydrophobicContact CB-CD1 4.09Å; L1412-I1416 VanDerWaalsContact O-CG1 3.25Å; L1412-I1416 WeakPolarHBondContact O-CG1 3.25Å; L1412-I1416 PolarHBondContact O-N 3.05Å; L1412-I1416 VanDerWaalsContact O-N 3.09Å; L1413-I1416 HydrophobicContact CD1-CD1 4.27Å; L1413-I1416 HydrophobicContact CG-CD1 4.13Å; L1413-I1416 WeakPolarHBondContact O-CB 3.29Å; L1413-I1416 WeakPolarHBondContact O-CG1 3.46Å; L1413-I1416 PolarHBondContact O-N 2.91Å; L1413-I1416 VanDerWaalsContact O-N 3.11Å; L1414-I1416 PolarHBondContact O-N 3.41Å; I1416-Y1418 PolarHBondContact O-N 3.11Å; I1416-Y1418 VanDerWaalsContact O-N 3.17Å; I1416-S1419 CarbonylContact O-C 3.48Å; I1416-S1419 PolarHBondContact O-N 2.51Å; I1416-S1419 PolarHBondContact O-OG 3.29Å; I1416-S1425 WeakPolarHBondContact CG2-OG 3.36Å; I1416-I1427 HydrophobicContact CD1-CD1 3.95Å; I1416-I1427 HydrophobicContact CD1-CG1 4.11Å; I1416-I1427 HydrophobicContact CG1-CD1 4.32Å; I1416-I1427 HydrophobicContact CG1-CG1 4.09Å; I1416-V1480 HydrophobicContact CD1-CG1 3.76Å; I1416-V1480 HydrophobicContact CD1-CG2 3.96Å; I1416-V1480 HydrophobicContact CG1-CG2 4.34Å
1417T53.1Low59.5Low102.2 Ų102.270.7 Ų70.763%0.62740%0.399SS*.  trans-76.3106.4168.7520000109.7L1413 L1414 T1415 S1419 V1426L1413-T1417 PolarHBondContact O-N 3.36Å; L1414-T1417 PolarHBondContact O-N 2.73Å; L1414-T1417 PolarHBondContact O-OG1 2.73Å; T1415-T1417 VanDerWaalsContact C-N 3.3Å; T1415-T1417 PolarHBondContact O-N 3.21Å; T1415-T1417 VanDerWaalsContact O-N 3.08Å; T1417-S1419 VanDerWaalsContact C-N 3.3Å; T1417-S1419 PolarHBondContact O-N 3.21Å; T1417-V1426 PolarHBondContact N-O 2.96Å; T1417-V1426 VanDerWaalsContact N-O 3.12Å; T1417-V1426 PolarHBondContact O-N 3.09Å; T1417-V1426 VanDerWaalsContact O-N 3.1Å; T1417-V1426 VanDerWaalsContact O-O 3.11Å; T1417-V1426 PolarHBondContact OG1-O 3.19Å
1418Y50.1Low58.5Low209.4 Ų209.472.6 Ų72.682%0.82140%0.402SS*.  trans-5775.2172-79.6-86.4000112L1414 I1416 N1420L1414-Y1418 WeakPolarHBondContact O-CD2 3.41Å; I1416-Y1418 PolarHBondContact O-N 3.11Å; I1416-Y1418 VanDerWaalsContact O-N 3.17Å; Y1418-N1420 PolarHBondContact O-N 2.99Å
1419S42.6Very low57.6Low56.6 Ų56.673.6 Ų73.640%0.39641%0.406SS..  trans-86.3109.1167.867.70000108.7I1416 T1417 S1421 S1422I1416-S1419 CarbonylContact O-C 3.48Å; I1416-S1419 PolarHBondContact O-N 2.51Å; I1416-S1419 PolarHBondContact O-OG 3.29Å; T1417-S1419 VanDerWaalsContact C-N 3.3Å; T1417-S1419 PolarHBondContact O-N 3.21Å; S1419-S1421 PolarHBondContact O-N 2.96Å; S1419-S1422 VanDerWaalsContact O-O 3.1Å; S1419-S1422 PolarHBondContact OG-N 2.76Å; S1419-S1422 PolarHBondContact OG-O 2.84Å; S1419-S1422 PolarHBondContact OG-OG 2.68Å
1420N42.7Very low56.6Low162.4 Ų162.477.9 Ų77.987%0.86844%0.436SS*.THydrogen-bonded Turntrans-66.429.6179.1-77-16.6000113.9Y1418Y1418-N1420 PolarHBondContact O-N 2.99Å
1421S40.6Very low55.8Low94.4 Ų94.479.5 Ų79.566%0.6644%0.444SS*.SBendtrans-132.238.1176.176.30000113.9S1419 N1485S1419-S1421 PolarHBondContact O-N 2.96Å; S1421-N1485 PolarHBondContact O-ND2 3Å; S1421-N1485 PolarHBondContact O-OD1 3.4Å
1422S43.9Very low55.3Low66 Ų6682.8 Ų82.846%0.46246%0.458SS..  trans-123.7116.2171.654.80000112.3S1419 W1424 S1425S1419-S1422 VanDerWaalsContact O-O 3.1Å; S1419-S1422 PolarHBondContact OG-N 2.76Å; S1419-S1422 PolarHBondContact OG-O 2.84Å; S1419-S1422 PolarHBondContact OG-OG 2.68Å; S1422-W1424 PolarHBondContact O-N 3.16Å; S1422-S1425 PolarHBondContact O-N 3.37Å; S1422-S1425 PolarHBondContact O-OG 3.19Å
1423A45.9Very low55.1Low61.4 Ų61.486 Ų8651%0.50748%0.477SS..SBendtrans-72.431.9175.600000113.2S1425 V1426 L1537A1423-S1425 VanDerWaalsContact CB-OG 3.31Å; A1423-S1425 WeakPolarHBondContact CB-OG 3.2Å; A1423-S1425 PolarHBondContact O-N 2.78Å; A1423-V1426 HydrophobicContact CB-CG2 4.25Å; A1423-V1426 PolarHBondContact O-N 3.21Å; A1423-L1537 HydrophobicContact CB-CD2 4.04Å
1424W44.3Very low55.1Low61.4 Ų61.483.6 Ų83.623%0.23347%0.466CS..  trans-108.744.7-175.7-114.338.4000111S1422 V1426 L1439 L1442 K1482 H1484 C1487 S1539 D1541 Y1542 F1545S1422-W1424 PolarHBondContact O-N 3.16Å; W1424-V1426 VanDerWaalsContact C-N 3.29Å; W1424-V1426 PolarHBondContact O-N 3.17Å; W1424-L1439 HydrophobicContact CH2-CD1 3.34Å; W1424-L1439 HydrophobicContact CZ2-CD1 4.16Å; W1424-L1439 HydrophobicContact CZ3-CD1 3.83Å; W1424-L1442 HydrophobicContact CH2-CD1 3.27Å; W1424-L1442 HydrophobicContact CZ2-CD1 3.23Å; W1424-L1442 HydrophobicContact CZ3-CD1 4.47Å; W1424-K1482 PolarHBondContact NE1-O 2.8Å; W1424-H1484 HydrophobicContact CD2-CB 4.12Å; W1424-H1484 AromaticContact CE2-ND1 3.81Å; W1424-H1484 HydrophobicContact CE3-CB 4Å; W1424-H1484 AromaticContact CE3-CD2 3.32Å; W1424-H1484 AromaticContact CE3-CG 3.98Å; W1424-H1484 HydrophobicContact CG-CB 4.19Å; W1424-H1484 AromaticContact CH2-CE1 3.84Å; W1424-H1484 AromaticContact CH2-ND1 3.37Å; W1424-H1484 WeakPolarHBondContact CH2-ND1 3.34Å; W1424-H1484 HydrophobicContact CZ2-CB 4.26Å; W1424-H1484 AromaticContact CZ2-CE1 3.97Å; W1424-H1484 AromaticContact CZ2-CG 3.99Å; W1424-H1484 AromaticContact CZ2-ND1 3.14Å; W1424-H1484 WeakPolarHBondContact CZ2-ND1 3.28Å; W1424-H1484 HydrophobicContact CZ3-CB 4.14Å; W1424-H1484 AromaticContact CZ3-CD2 3.46Å; W1424-H1484 VanDerWaalsContact CZ3-CD2 3.49Å; W1424-H1484 WeakPolarHBondContact CZ3-CD2 3.35Å; W1424-C1487 HydrophobicContact CZ2-CB 4.14Å; W1424-S1539 WeakPolarHBondContact CH2-OG 3.36Å; W1424-S1539 VanDerWaalsContact CZ2-CB 3.46Å; W1424-S1539 WeakPolarHBondContact CZ2-OG 3.33Å; W1424-S1539 PolarHBondContact NE1-OG 3.07Å; W1424-D1541 HydrophobicContact CE3-CB 3.86Å; W1424-D1541 HydrophobicContact CH2-CB 3.91Å; W1424-D1541 VanDerWaalsContact CH2-OD2 3.27Å; W1424-D1541 WeakPolarHBondContact CH2-OD2 3.47Å; W1424-D1541 HydrophobicContact CZ2-CB 3.54Å; W1424-D1541 HydrophobicContact CZ3-CB 3.77Å; W1424-D1541 VanDerWaalsContact CZ3-CB 3.45Å; W1424-Y1542 HydrophobicContact CD2-CD2 4.46Å; W1424-Y1542 AromaticContact CE2-CD2 3.45Å; W1424-Y1542 VanDerWaalsContact CE2-CD2 3.45Å; W1424-Y1542 HydrophobicContact CH2-CD2 4.23Å; W1424-Y1542 HydrophobicContact CH2-CG 4.33Å; W1424-Y1542 AromaticContact CZ2-CD2 3.5Å; W1424-Y1542 HydrophobicContact CZ2-CD2 3.89Å; W1424-Y1542 HydrophobicContact CZ2-CE2 4.37Å; W1424-Y1542 HydrophobicContact CZ2-CG 4.16Å; W1424-Y1542 AromaticContact NE1-CD2 3.27Å; W1424-Y1542 VanDerWaalsContact NE1-CD2 3.27Å; W1424-Y1542 AromaticContact NE1-CE2 3.85Å; W1424-Y1542 AromaticContact NE1-CG 3.93Å; W1424-F1545 HydrophobicContact CH2-CB 4.35Å
1425S51.3Low55.2Low37.2 Ų37.279.7 Ų79.726%0.2644%0.443SS..  trans-71.1126.2176.945.60000112.2I1416 S1422 A1423 I1427 C1483 H1484I1416-S1425 WeakPolarHBondContact CG2-OG 3.36Å; S1422-S1425 PolarHBondContact O-N 3.37Å; S1422-S1425 PolarHBondContact O-OG 3.19Å; A1423-S1425 VanDerWaalsContact CB-OG 3.31Å; A1423-S1425 WeakPolarHBondContact CB-OG 3.2Å; A1423-S1425 PolarHBondContact O-N 2.78Å; S1425-I1427 PolarHBondContact O-N 2.98Å; S1425-C1483 WeakPolarHBondContact O-CA 3.41Å; S1425-C1483 WeakPolarHBondContact O-CB 3.43Å; S1425-C1483 PolarHBondContact OG-SG 2.69Å; S1425-H1484 PolarHBondContact O-N 3.02Å
1426V53.4Low55.6Low65 Ų6580.9 Ų80.939%0.39444%0.444SS..  trans-85.9105.3175.9178.10000109.1I1224 T1417 A1423 W1424 K1428 N1485I1224-V1426 HydrophobicContact CG2-CG1 4.26Å; I1224-V1426 HydrophobicContact CG2-CG2 4.4Å; T1417-V1426 PolarHBondContact N-O 2.96Å; T1417-V1426 VanDerWaalsContact N-O 3.12Å; T1417-V1426 PolarHBondContact O-N 3.09Å; T1417-V1426 VanDerWaalsContact O-N 3.1Å; T1417-V1426 VanDerWaalsContact O-O 3.11Å; T1417-V1426 PolarHBondContact OG1-O 3.19Å; A1423-V1426 HydrophobicContact CB-CG2 4.25Å; A1423-V1426 PolarHBondContact O-N 3.21Å; W1424-V1426 VanDerWaalsContact C-N 3.29Å; W1424-V1426 PolarHBondContact O-N 3.17Å; V1426-K1428 PolarHBondContact O-N 2.79Å; V1426-N1485 WeakPolarHBondContact CG1-ND2 3.46Å
1427I57.5Low56.3Low9 Ų980.3 Ų80.35%0.04644%0.441CS..PPolyproline II helixtrans-81124.2179-58.2173.2000109L1412 I1416 S1425 F1429 V1480 C1483 N1485 L1486L1412-I1427 HydrophobicContact CB-CG2 4.25Å; L1412-I1427 HydrophobicContact CD1-CG2 4.48Å; L1412-I1427 HydrophobicContact CD2-CG2 3.76Å; L1412-I1427 HydrophobicContact CG-CG2 4.35Å; I1416-I1427 HydrophobicContact CD1-CD1 3.95Å; I1416-I1427 HydrophobicContact CD1-CG1 4.11Å; I1416-I1427 HydrophobicContact CG1-CD1 4.32Å; I1416-I1427 HydrophobicContact CG1-CG1 4.09Å; S1425-I1427 PolarHBondContact O-N 2.98Å; I1427-F1429 HydrophobicContact CB-CD2 4.31Å; I1427-F1429 HydrophobicContact CB-CE2 3.91Å; I1427-F1429 HydrophobicContact CG2-CD2 4.05Å; I1427-F1429 HydrophobicContact CG2-CE2 3.78Å; I1427-F1429 HydrophobicContact CG2-CZ 4.13Å; I1427-F1429 VanDerWaalsContact O-CD2 3.31Å; I1427-F1429 WeakPolarHBondContact O-CD2 3.35Å; I1427-F1429 PolarHBondContact O-N 2.77Å; I1427-V1480 HydrophobicContact CD1-CB 4.17Å; I1427-V1480 HydrophobicContact CD1-CG1 3.55Å; I1427-V1480 VanDerWaalsContact CD1-CG1 3.46Å; I1427-V1480 HydrophobicContact CD1-CG2 4.14Å; I1427-C1483 HydrophobicContact CD1-CB 3.9Å; I1427-C1483 HydrophobicContact CG1-CB 4.36Å; I1427-N1485 HydrophobicContact CD1-CB 3.98Å; I1427-N1485 HydrophobicContact CG1-CB 4.48Å; I1427-N1485 PolarHBondContact O-ND2 3.34Å; I1427-L1486 HydrophobicContact CD1-CD1 4.03Å; I1427-L1486 HydrophobicContact CD1-CD2 4.04Å; I1427-L1486 HydrophobicContact CD1-CG 4.19Å
1428K56.7Low57.4Low146 Ų14675.6 Ų75.664%0.63541%0.413SS*.PPolyproline II helixtrans-92114.2170.7-66.5-174.8-179.8178.90109.1V1426 S1430V1426-K1428 PolarHBondContact O-N 2.79Å; K1428-S1430 PolarHBondContact O-N 2.95Å
1429F59.2Low58.6Low40.4 Ų40.467.3 Ų67.318%0.17738%0.382CS..PPolyproline II helixtrans-68.2128.9170.4-69.7-88.5000109.4L1227 I1408 L1412 I1427 D1431 S1434 K1435 L1438 L1486L1227-F1429 HydrophobicContact CD1-CD2 3.77Å; L1227-F1429 HydrophobicContact CD1-CE2 3.85Å; L1227-F1429 HydrophobicContact CD2-CD2 4.35Å; L1227-F1429 HydrophobicContact CD2-CE2 4.38Å; I1408-F1429 HydrophobicContact CG2-CE1 4.22Å; L1412-F1429 HydrophobicContact CD1-CD1 4.29Å; L1412-F1429 HydrophobicContact CD1-CE1 3.59Å; L1412-F1429 VanDerWaalsContact CD1-CE1 3.45Å; L1412-F1429 HydrophobicContact CD1-CZ 4.04Å; L1412-F1429 HydrophobicContact CD2-CD1 3.78Å; L1412-F1429 HydrophobicContact CD2-CE1 3.9Å; L1412-F1429 HydrophobicContact CD2-CG 4.36Å; L1412-F1429 HydrophobicContact CD2-CZ 4.35Å; L1412-F1429 HydrophobicContact CG-CD1 4.28Å; L1412-F1429 HydrophobicContact CG-CE1 4.15Å; I1427-F1429 HydrophobicContact CB-CD2 4.31Å; I1427-F1429 HydrophobicContact CB-CE2 3.91Å; I1427-F1429 HydrophobicContact CG2-CD2 4.05Å; I1427-F1429 HydrophobicContact CG2-CE2 3.78Å; I1427-F1429 HydrophobicContact CG2-CZ 4.13Å; I1427-F1429 VanDerWaalsContact O-CD2 3.31Å; I1427-F1429 WeakPolarHBondContact O-CD2 3.35Å; I1427-F1429 PolarHBondContact O-N 2.77Å; F1429-D1431 PolarHBondContact O-N 3.41Å; F1429-S1434 WeakPolarHBondContact CD1-OG 3.26Å; F1429-K1435 HydrophobicContact CB-CB 4.4Å; F1429-K1435 HydrophobicContact CD1-CB 4.13Å; F1429-K1435 HydrophobicContact CD2-CB 4.01Å; F1429-K1435 HydrophobicContact CD2-CD 4.08Å; F1429-K1435 HydrophobicContact CD2-CG 4.03Å; F1429-K1435 HydrophobicContact CE1-CB 4.43Å; F1429-K1435 HydrophobicContact CE2-CB 4.05Å; F1429-K1435 HydrophobicContact CE2-CD 4.34Å; F1429-K1435 HydrophobicContact CE2-CG 4.02Å; F1429-K1435 HydrophobicContact CG-CB 4.11Å; F1429-K1435 HydrophobicContact CG-CG 4.44Å; F1429-K1435 HydrophobicContact CZ-CB 4.38Å; F1429-K1435 HydrophobicContact CZ-CG 4.42Å; F1429-L1438 HydrophobicContact CE1-CD1 3.65Å; F1429-L1438 VanDerWaalsContact CE1-CD1 3.49Å; F1429-L1438 HydrophobicContact CE1-CD2 4.1Å; F1429-L1438 HydrophobicContact CZ-CD1 4.08Å; F1429-L1438 HydrophobicContact CZ-CD2 3.98Å; F1429-L1486 HydrophobicContact CZ-CD1 4.38Å; F1429-L1486 HydrophobicContact CZ-CD2 4.28Å; F1429-L1486 HydrophobicContact CZ-CG 4.46Å
1430S57.1Low60.2Low90 Ų9065 Ų6563%0.62937%0.365SS*.SBendtrans-69.4-36.2171.255.90000111.5K1428K1428-S1430 PolarHBondContact O-N 2.95Å
1431D62.3Low62Low90.2 Ų90.257.3 Ų57.348%0.48232%0.324SS..  trans-125.3128.7-172.3-60.2-12.2000111.4F1429 T1433 S1434 K1435F1429-D1431 PolarHBondContact O-N 3.41Å; D1431-T1433 VanDerWaalsContact CB-OG1 3.27Å; D1431-T1433 WeakPolarHBondContact CB-OG1 3.4Å; D1431-T1433 PolarHBondContact O-N 3.19Å; D1431-T1433 VanDerWaalsContact O-N 3.1Å; D1431-S1434 PolarHBondContact O-N 3.06Å; D1431-S1434 PolarHBondContact O-OG 3.26Å; D1431-K1435 PolarHBondContact O-N 3Å
1432N64.9Low63.8Low130.6 Ų130.653.5 Ų53.570%0.69830%0.296SS*.Hα-helixtrans-61.2-24.5173.6-84.2-21.6000112.9K1435 Q1436N1432-K1435 PolarHBondContact O-N 3.31Å; N1432-Q1436 WeakPolarHBondContact O-CG 3.44Å; N1432-Q1436 PolarHBondContact O-N 3.18Å; N1432-Q1436 VanDerWaalsContact O-N 3.14Å
1433T69.1Low65.5Low70.6 Ų70.652.2 Ų52.243%0.43328%0.282SS..Hα-helixtrans-65.7-45.9178520000111.7D1431 K1435 Q1436 D1437D1431-T1433 VanDerWaalsContact CB-OG1 3.27Å; D1431-T1433 WeakPolarHBondContact CB-OG1 3.4Å; D1431-T1433 PolarHBondContact O-N 3.19Å; D1431-T1433 VanDerWaalsContact O-N 3.1Å; T1433-K1435 VanDerWaalsContact C-N 3.3Å; T1433-K1435 PolarHBondContact O-N 3.09Å; T1433-Q1436 PolarHBondContact O-N 3.2Å; T1433-D1437 WeakPolarHBondContact O-CB 3.41Å; T1433-D1437 VanDerWaalsContact O-CG 3.25Å; T1433-D1437 PolarHBondContact O-N 3.24Å
1434S70.7Confident67.3Low15.8 Ų15.849.5 Ų49.511%0.1126%0.259CS..Hα-helixtrans-65.2-35.2178.664.30000112.1F1429 D1431 L1438F1429-S1434 WeakPolarHBondContact CD1-OG 3.26Å; D1431-S1434 PolarHBondContact O-N 3.06Å; D1431-S1434 PolarHBondContact O-OG 3.26Å; S1434-L1438 WeakPolarHBondContact O-CB 3.42Å; S1434-L1438 WeakPolarHBondContact O-CG 3.38Å; S1434-L1438 PolarHBondContact O-N 3.26Å; S1434-L1438 VanDerWaalsContact O-N 3.08Å
1435K71.1Confident69Low64.2 Ų64.246.5 Ų46.528%0.27925%0.248SC..Hα-helixtrans-63.1-47.5173.5-177.1-178.3175.5-177.30112L1227 E1230 F1429 D1431 N1432 T1433 L1438 L1439L1227-K1435 HydrophobicContact CD2-CD 4.03Å; L1227-K1435 VanDerWaalsContact CD2-CE 3.48Å; E1230-K1435 IonicContact OE2-NZ 3.53Å; E1230-K1435 PolarHBondContact OE2-NZ 2.83Å; F1429-K1435 HydrophobicContact CB-CB 4.4Å; F1429-K1435 HydrophobicContact CD1-CB 4.13Å; F1429-K1435 HydrophobicContact CD2-CB 4.01Å; F1429-K1435 HydrophobicContact CD2-CD 4.08Å; F1429-K1435 HydrophobicContact CD2-CG 4.03Å; F1429-K1435 HydrophobicContact CE1-CB 4.43Å; F1429-K1435 HydrophobicContact CE2-CB 4.05Å; F1429-K1435 HydrophobicContact CE2-CD 4.34Å; F1429-K1435 HydrophobicContact CE2-CG 4.02Å; F1429-K1435 HydrophobicContact CG-CB 4.11Å; F1429-K1435 HydrophobicContact CG-CG 4.44Å; F1429-K1435 HydrophobicContact CZ-CB 4.38Å; F1429-K1435 HydrophobicContact CZ-CG 4.42Å; D1431-K1435 PolarHBondContact O-N 3Å; N1432-K1435 PolarHBondContact O-N 3.31Å; T1433-K1435 VanDerWaalsContact C-N 3.3Å; T1433-K1435 PolarHBondContact O-N 3.09Å; K1435-L1438 PolarHBondContact O-N 3.23Å; K1435-L1439 VanDerWaalsContact O-CB 3.3Å; K1435-L1439 WeakPolarHBondContact O-CB 3.34Å; K1435-L1439 PolarHBondContact O-N 3.02Å
1436Q70.9Confident70.5Confident85 Ų8547 Ų4740%0.39725%0.245SC..Hα-helixtrans-66.1-40.5178.9-71.1-66.8-23.300111.8N1432 T1433 L1438 L1439 F1440N1432-Q1436 WeakPolarHBondContact O-CG 3.44Å; N1432-Q1436 PolarHBondContact O-N 3.18Å; N1432-Q1436 VanDerWaalsContact O-N 3.14Å; T1433-Q1436 PolarHBondContact O-N 3.2Å; Q1436-L1438 VanDerWaalsContact C-N 3.34Å; Q1436-L1438 PolarHBondContact O-N 3.31Å; Q1436-L1439 PolarHBondContact O-N 3.23Å; Q1436-F1440 VanDerWaalsContact O-CB 3.27Å; Q1436-F1440 WeakPolarHBondContact O-CB 3.34Å; Q1436-F1440 PolarHBondContact O-N 3.16Å
1437D75.8Confident72Confident28.6 Ų28.643.9 Ų43.915%0.15323%0.227CC..Hα-helixtrans-61.5-43.8176-75.10.6000111.4R1404 I1408 T1433 N1441R1404-D1437 IonicContact CZ-OD2 3.36Å; R1404-D1437 VanDerWaalsContact CZ-OD2 3.29Å; R1404-D1437 IonicContact NE-OD2 3.31Å; R1404-D1437 PolarHBondContact NE-OD2 3.07Å; R1404-D1437 IonicContact NH2-OD2 3.04Å; R1404-D1437 PolarHBondContact NH2-OD2 3.12Å; I1408-D1437 HydrophobicContact CD1-CB 4.07Å; T1433-D1437 WeakPolarHBondContact O-CB 3.41Å; T1433-D1437 VanDerWaalsContact O-CG 3.25Å; T1433-D1437 PolarHBondContact O-N 3.24Å; D1437-N1441 WeakPolarHBondContact O-CB 3.34Å; D1437-N1441 PolarHBondContact O-N 3.08Å
1438L75.9Confident73.1Confident4.2 Ų4.243.7 Ų43.72%0.02223%0.226CC..Hα-helixtrans-66.1-42.4175.9-93154.7000112.3V1405 I1408 L1409 L1412 F1429 S1434 K1435 Q1436 F1440 N1441 L1442 L1486 L1489V1405-L1438 HydrophobicContact CG1-CD1 3.99Å; V1405-L1438 HydrophobicContact CG1-CD2 3.97Å; I1408-L1438 HydrophobicContact CB-CD1 4.44Å; I1408-L1438 HydrophobicContact CD1-CG 4.33Å; I1408-L1438 HydrophobicContact CG2-CD1 3.67Å; I1408-L1438 VanDerWaalsContact CG2-CD1 3.43Å; I1408-L1438 HydrophobicContact CG2-CD2 4.22Å; I1408-L1438 HydrophobicContact CG2-CG 3.98Å; L1409-L1438 HydrophobicContact CD2-CD2 4.5Å; L1412-L1438 HydrophobicContact CD1-CD1 4.01Å; F1429-L1438 HydrophobicContact CE1-CD1 3.65Å; F1429-L1438 VanDerWaalsContact CE1-CD1 3.49Å; F1429-L1438 HydrophobicContact CE1-CD2 4.1Å; F1429-L1438 HydrophobicContact CZ-CD1 4.08Å; F1429-L1438 HydrophobicContact CZ-CD2 3.98Å; S1434-L1438 WeakPolarHBondContact O-CB 3.42Å; S1434-L1438 WeakPolarHBondContact O-CG 3.38Å; S1434-L1438 PolarHBondContact O-N 3.26Å; S1434-L1438 VanDerWaalsContact O-N 3.08Å; K1435-L1438 PolarHBondContact O-N 3.23Å; Q1436-L1438 VanDerWaalsContact C-N 3.34Å; Q1436-L1438 PolarHBondContact O-N 3.31Å; L1438-F1440 VanDerWaalsContact C-N 3.34Å; L1438-N1441 WeakPolarHBondContact O-CB 3.27Å; L1438-N1441 PolarHBondContact O-N 3.38Å; L1438-L1442 HydrophobicContact CG-CD1 4.28Å; L1438-L1442 WeakPolarHBondContact O-CB 3.33Å; L1438-L1442 VanDerWaalsContact O-CG 3.3Å; L1438-L1442 WeakPolarHBondContact O-CG 3.41Å; L1438-L1442 PolarHBondContact O-N 3.35Å; L1438-L1486 HydrophobicContact CD1-CD2 4.24Å; L1438-L1486 HydrophobicContact CD2-CD2 4.34Å; L1438-L1489 HydrophobicContact CD1-CD1 3.97Å; L1438-L1489 HydrophobicContact CD1-CD2 4.11Å; L1438-L1489 HydrophobicContact CD2-CD1 4.02Å; L1438-L1489 HydrophobicContact CD2-CD2 4.14Å
1439L74.4Confident74.3Confident34 Ų3436.8 Ų36.818%0.17820%0.196CC..Hα-helixtrans-66.2-39.9179.3-171.396.4000111.6V1360 W1424 K1435 Q1436 L1442 K1443V1360-L1439 HydrophobicContact CB-CD2 4.26Å; V1360-L1439 HydrophobicContact CG1-CD2 3.73Å; V1360-L1439 HydrophobicContact CG1-CG 3.82Å; V1360-L1439 HydrophobicContact CG2-CB 4.36Å; V1360-L1439 HydrophobicContact CG2-CD2 3.91Å; V1360-L1439 VanDerWaalsContact CG2-CD2 3.47Å; V1360-L1439 HydrophobicContact CG2-CG 4.13Å; W1424-L1439 HydrophobicContact CH2-CD1 3.34Å; W1424-L1439 HydrophobicContact CZ2-CD1 4.16Å; W1424-L1439 HydrophobicContact CZ3-CD1 3.83Å; K1435-L1439 VanDerWaalsContact O-CB 3.3Å; K1435-L1439 WeakPolarHBondContact O-CB 3.34Å; K1435-L1439 PolarHBondContact O-N 3.02Å; Q1436-L1439 PolarHBondContact O-N 3.23Å; L1439-L1442 HydrophobicContact CD1-CD1 4.29Å; L1439-L1442 WeakPolarHBondContact O-CB 3.42Å; L1439-L1442 PolarHBondContact O-N 3.21Å; L1439-K1443 HydrophobicContact CD1-CG 4.4Å; L1439-K1443 HydrophobicContact CD2-CD 4.21Å; L1439-K1443 HydrophobicContact CD2-CG 4.21Å; L1439-K1443 WeakPolarHBondContact O-CG 3.29Å; L1439-K1443 PolarHBondContact O-N 3.03Å
1440F76.5Confident75.4Confident8.4 Ų8.435.5 Ų35.54%0.03719%0.19CC..Hα-helixtrans-60.8-47.5172.4-179.4-95.2000111.3L1353 P1358 Y1359 V1360 L1363 L1396 M1399 N1400 Q1436 L1438 L1442 K1443 F1444L1353-F1440 HydrophobicContact CD2-CE2 4.34Å; L1353-F1440 HydrophobicContact CD2-CZ 4.44Å; P1358-F1440 HydrophobicContact CB-CB 3.68Å; P1358-F1440 HydrophobicContact CB-CD1 3.91Å; P1358-F1440 HydrophobicContact CB-CD2 3.53Å; P1358-F1440 HydrophobicContact CB-CE1 4.28Å; P1358-F1440 HydrophobicContact CB-CE2 3.67Å; P1358-F1440 HydrophobicContact CB-CG 3.35Å; P1358-F1440 VanDerWaalsContact CB-CG 3.4Å; P1358-F1440 HydrophobicContact CB-CZ 4.03Å; P1358-F1440 VanDerWaalsContact CB-CZ 3.46Å; P1358-F1440 HydrophobicContact CG-CD1 3.9Å; P1358-F1440 HydrophobicContact CG-CD2 3.83Å; P1358-F1440 HydrophobicContact CG-CE1 3.67Å; P1358-F1440 HydrophobicContact CG-CE2 3.61Å; P1358-F1440 HydrophobicContact CG-CG 3.99Å; P1358-F1440 HydrophobicContact CG-CZ 3.53Å; Y1359-F1440 HydrophobicContact CG-CD2 4.34Å; Y1359-F1440 HydrophobicContact CG-CE2 4.23Å; V1360-F1440 HydrophobicContact CG2-CB 4.18Å; L1363-F1440 HydrophobicContact CD1-CD1 4.46Å; L1363-F1440 HydrophobicContact CD1-CD2 3.37Å; L1363-F1440 VanDerWaalsContact CD1-CD2 3.44Å; L1363-F1440 HydrophobicContact CD1-CE1 4.46Å; L1363-F1440 HydrophobicContact CD1-CE2 3.3Å; L1363-F1440 HydrophobicContact CD1-CG 4.06Å; L1363-F1440 HydrophobicContact CD1-CZ 3.94Å; L1363-F1440 WeakPolarHBondContact CD1-O 3.45Å; L1363-F1440 HydrophobicContact CG-CD2 4.32Å; L1363-F1440 HydrophobicContact CG-CE2 3.91Å; L1363-F1440 HydrophobicContact CG-CZ 4.41Å; L1396-F1440 HydrophobicContact CD2-CE1 3.93Å; L1396-F1440 HydrophobicContact CD2-CZ 3.72Å; M1399-F1440 HydrophobicContact CB-CE1 4.36Å; M1399-F1440 HydrophobicContact CE-CD1 4.33Å; M1399-F1440 HydrophobicContact CE-CE1 4.49Å; N1400-F1440 VanDerWaalsContact ND2-CD1 3.27Å; N1400-F1440 WeakPolarHBondContact ND2-CD1 3.35Å; N1400-F1440 VanDerWaalsContact ND2-CE1 3.3Å; N1400-F1440 WeakPolarHBondContact ND2-CE1 3.38Å; N1400-F1440 WeakPolarHBondContact OD1-CD1 3.46Å; N1400-F1440 WeakPolarHBondContact OD1-CE1 3.44Å; Q1436-F1440 VanDerWaalsContact O-CB 3.27Å; Q1436-F1440 WeakPolarHBondContact O-CB 3.34Å; Q1436-F1440 PolarHBondContact O-N 3.16Å; L1438-F1440 VanDerWaalsContact C-N 3.34Å; F1440-L1442 VanDerWaalsContact C-N 3.31Å; F1440-L1442 PolarHBondContact O-N 3.12Å; F1440-K1443 PolarHBondContact O-N 3.13Å; F1440-F1444 HydrophobicContact CE1-CB 4.39Å; F1440-F1444 VanDerWaalsContact O-CB 3.26Å; F1440-F1444 WeakPolarHBondContact O-CB 3.41Å; F1440-F1444 PolarHBondContact O-N 3.07Å
1441N80.2Confident76.4Confident1 Ų131.2 Ų31.21%0.00516%0.16CC..Hα-helixtrans-60.1-44.6177.7-167.5-90.5000111.6N1400 V1405 D1437 L1438 K1443 F1444 F1445 Y1493N1400-N1441 WeakPolarHBondContact CA-ND2 3.18Å; N1400-N1441 WeakPolarHBondContact CB-ND2 3.47Å; N1400-N1441 PolarHBondContact OD1-ND2 3.17Å; V1405-N1441 HydrophobicContact CG2-CB 4.27Å; V1405-N1441 WeakPolarHBondContact CG2-ND2 3.42Å; D1437-N1441 WeakPolarHBondContact O-CB 3.34Å; D1437-N1441 PolarHBondContact O-N 3.08Å; L1438-N1441 WeakPolarHBondContact O-CB 3.27Å; L1438-N1441 PolarHBondContact O-N 3.38Å; N1441-K1443 PolarHBondContact O-N 3.29Å; N1441-F1444 WeakPolarHBondContact O-CB 3.42Å; N1441-F1444 PolarHBondContact O-N 3.28Å; N1441-F1445 VanDerWaalsContact O-CD2 3.27Å; N1441-F1445 WeakPolarHBondContact O-CD2 3.38Å; N1441-F1445 PolarHBondContact O-N 3.1Å; N1441-F1445 VanDerWaalsContact OD1-CD2 3.24Å; N1441-F1445 WeakPolarHBondContact OD1-CD2 3.39Å; N1441-F1445 WeakPolarHBondContact OD1-CE2 3.18Å; N1441-Y1493 PolarHBondContact OD1-OH 3.2Å
1442L78.8Confident77.1Confident14.8 Ų14.827.4 Ų27.48%0.07714%0.14CC..Hα-helixtrans-55.6-54175.9-112.9174.7000112.2W1424 L1438 L1439 F1440 F1444 F1445 H1446 Y1488 L1489 V1492W1424-L1442 HydrophobicContact CH2-CD1 3.27Å; W1424-L1442 HydrophobicContact CZ2-CD1 3.23Å; W1424-L1442 HydrophobicContact CZ3-CD1 4.47Å; L1438-L1442 HydrophobicContact CG-CD1 4.28Å; L1438-L1442 WeakPolarHBondContact O-CB 3.33Å; L1438-L1442 VanDerWaalsContact O-CG 3.3Å; L1438-L1442 WeakPolarHBondContact O-CG 3.41Å; L1438-L1442 PolarHBondContact O-N 3.35Å; L1439-L1442 HydrophobicContact CD1-CD1 4.29Å; L1439-L1442 WeakPolarHBondContact O-CB 3.42Å; L1439-L1442 PolarHBondContact O-N 3.21Å; F1440-L1442 VanDerWaalsContact C-N 3.31Å; F1440-L1442 PolarHBondContact O-N 3.12Å; L1442-F1444 VanDerWaalsContact C-N 3.29Å; L1442-F1444 PolarHBondContact O-N 3.18Å; L1442-F1445 PolarHBondContact O-N 3.27Å; L1442-H1446 HydrophobicContact CD2-CB 4.46Å; L1442-H1446 WeakPolarHBondContact O-CB 3.4Å; L1442-H1446 PolarHBondContact O-N 3.23Å; L1442-Y1488 HydrophobicContact CD1-CD1 3.81Å; L1442-Y1488 HydrophobicContact CD1-CD2 3.2Å; L1442-Y1488 HydrophobicContact CD1-CE1 4.39Å; L1442-Y1488 HydrophobicContact CD1-CE2 3.27Å; L1442-Y1488 HydrophobicContact CD1-CG 4.24Å; L1442-Y1488 HydrophobicContact CD2-CD1 3.86Å; L1442-Y1488 HydrophobicContact CD2-CE1 3.87Å; L1442-Y1488 HydrophobicContact CG-CD1 4.34Å; L1442-Y1488 HydrophobicContact CG-CD2 3.92Å; L1442-Y1488 HydrophobicContact CG-CE2 4.21Å; L1442-L1489 HydrophobicContact CB-CD1 4.12Å; L1442-L1489 HydrophobicContact CD1-CB 4.03Å; L1442-L1489 HydrophobicContact CD1-CD1 4.14Å; L1442-L1489 HydrophobicContact CD1-CG 4.35Å; L1442-L1489 VanDerWaalsContact CD2-CA 3.46Å; L1442-L1489 HydrophobicContact CD2-CB 3.71Å; L1442-L1489 VanDerWaalsContact CD2-CB 3.49Å; L1442-L1489 HydrophobicContact CD2-CD1 3.43Å; L1442-L1489 VanDerWaalsContact CD2-CD1 3.45Å; L1442-L1489 HydrophobicContact CD2-CG 3.93Å; L1442-L1489 HydrophobicContact CG-CB 4.34Å; L1442-L1489 HydrophobicContact CG-CD1 3.83Å; L1442-L1489 VanDerWaalsContact CG-CD1 3.46Å; L1442-L1489 HydrophobicContact CG-CG 4.39Å; L1442-V1492 HydrophobicContact CD2-CB 4.23Å; L1442-V1492 HydrophobicContact CD2-CG1 4.15Å; L1442-V1492 HydrophobicContact CD2-CG2 4.04Å; L1442-V1492 HydrophobicContact CG-CG2 4.42Å
1443K79.4Confident77.3Confident37.4 Ų37.424.4 Ų24.416%0.16313%0.127CC..Hα-helixtrans-65.6-34.9-179.1-67.8-88.3-172.2154.50111.7Q1234 I1235 V1360 L1363 E1364 I1367 L1439 F1440 N1441 H1446 L1447Q1234-K1443 VanDerWaalsContact C-NZ 3.32Å; Q1234-K1443 PolarHBondContact O-NZ 3.45Å; I1235-K1443 HydrophobicContact CG1-CD 4.21Å; V1360-K1443 HydrophobicContact CG1-CB 4.4Å; V1360-K1443 HydrophobicContact CG1-CD 3.59Å; V1360-K1443 HydrophobicContact CG1-CG 4.08Å; L1363-K1443 HydrophobicContact CB-CB 4.16Å; L1363-K1443 HydrophobicContact CD1-CB 4.02Å; E1364-K1443 HydrophobicContact CG-CD 4.1Å; E1364-K1443 VanDerWaalsContact OE1-CE 3.26Å; E1364-K1443 WeakPolarHBondContact OE1-CE 3.36Å; E1364-K1443 IonicContact OE1-NZ 3.07Å; E1364-K1443 PolarHBondContact OE1-NZ 3.2Å; E1364-K1443 IonicContact OE2-NZ 2.78Å; I1367-K1443 HydrophobicContact CD1-CB 4.18Å; I1367-K1443 HydrophobicContact CD1-CD 4.05Å; L1439-K1443 HydrophobicContact CD1-CG 4.4Å; L1439-K1443 HydrophobicContact CD2-CD 4.21Å; L1439-K1443 HydrophobicContact CD2-CG 4.21Å; L1439-K1443 WeakPolarHBondContact O-CG 3.29Å; L1439-K1443 PolarHBondContact O-N 3.03Å; F1440-K1443 PolarHBondContact O-N 3.13Å; N1441-K1443 PolarHBondContact O-N 3.29Å; K1443-H1446 PolarHBondContact O-N 3.19Å; K1443-L1447 WeakPolarHBondContact O-CB 3.4Å; K1443-L1447 PolarHBondContact O-N 3.34Å
1444F82.9Confident77.1Confident5 Ų526.6 Ų26.62%0.02213%0.132CC..Hα-helixtrans-64.5-45.4175.6-179.2-102.3000111.9L1363 F1392 L1396 F1397 N1400 F1440 N1441 L1442 H1446 L1447 L1448 F1467L1363-F1444 HydrophobicContact CD1-CB 3.97Å; L1363-F1444 HydrophobicContact CD2-CB 4.5Å; L1363-F1444 HydrophobicContact CD2-CD2 4.11Å; F1392-F1444 HydrophobicContact CE2-CE2 4.02Å; F1392-F1444 HydrophobicContact CE2-CZ 4.38Å; F1392-F1444 HydrophobicContact CZ-CE2 4.21Å; L1396-F1444 HydrophobicContact CD1-CD2 4.44Å; L1396-F1444 HydrophobicContact CD1-CE1 4.17Å; L1396-F1444 HydrophobicContact CD1-CE2 3.88Å; L1396-F1444 HydrophobicContact CD1-CZ 3.63Å; L1396-F1444 VanDerWaalsContact CD1-CZ 3.48Å; L1396-F1444 HydrophobicContact CD2-CE1 4.36Å; L1396-F1444 HydrophobicContact CD2-CZ 4.16Å; F1397-F1444 HydrophobicContact CE1-CE1 4.45Å; F1397-F1444 AromaticContact CE1-CZ 3.94Å; F1397-F1444 HydrophobicContact CE1-CZ 3.94Å; N1400-F1444 HydrophobicContact CB-CD1 4Å; N1400-F1444 HydrophobicContact CB-CE1 4.08Å; N1400-F1444 VanDerWaalsContact ND2-CD1 3.31Å; N1400-F1444 WeakPolarHBondContact ND2-CD1 3.4Å; N1400-F1444 WeakPolarHBondContact ND2-CE1 3.3Å; N1400-F1444 WeakPolarHBondContact ND2-CG 3.3Å; F1440-F1444 HydrophobicContact CE1-CB 4.39Å; F1440-F1444 VanDerWaalsContact O-CB 3.26Å; F1440-F1444 WeakPolarHBondContact O-CB 3.41Å; F1440-F1444 PolarHBondContact O-N 3.07Å; N1441-F1444 WeakPolarHBondContact O-CB 3.42Å; N1441-F1444 PolarHBondContact O-N 3.28Å; L1442-F1444 VanDerWaalsContact C-N 3.29Å; L1442-F1444 PolarHBondContact O-N 3.18Å; F1444-H1446 VanDerWaalsContact C-N 3.33Å; F1444-L1447 WeakPolarHBondContact O-CB 3.33Å; F1444-L1447 PolarHBondContact O-N 3.07Å; F1444-L1448 HydrophobicContact CD1-CD1 3.91Å; F1444-L1448 HydrophobicContact CD1-CG 4.45Å; F1444-L1448 HydrophobicContact CE1-CD1 3.42Å; F1444-L1448 VanDerWaalsContact CE1-CD1 3.44Å; F1444-L1448 HydrophobicContact CE1-CG 4.12Å; F1444-L1448 HydrophobicContact CZ-CD1 3.99Å; F1444-L1448 HydrophobicContact CZ-CD2 4.48Å; F1444-L1448 HydrophobicContact CZ-CG 4.31Å; F1444-L1448 PolarHBondContact O-N 3.18Å; F1444-F1467 HydrophobicContact CE1-CE2 4.36Å; F1444-F1467 AromaticContact CE1-CZ 3.97Å; F1444-F1467 HydrophobicContact CE1-CZ 4.14Å
1445F81.8Confident76.7Confident0 Ų032.8 Ų32.80%016%0.159CC..Hα-helixtrans-68.9-33.9175.9-86.6-84000112.5F1402 N1441 L1442 L1448 N1449 Y1463 F1467 L1472 V1492 Y1493 N1496F1402-F1445 HydrophobicContact CD1-CZ 4.38Å; F1402-F1445 AromaticContact CE1-CE1 3.85Å; F1402-F1445 HydrophobicContact CE1-CE1 4.04Å; F1402-F1445 AromaticContact CE1-CE2 3.98Å; F1402-F1445 HydrophobicContact CE1-CE2 4Å; F1402-F1445 AromaticContact CE1-CZ 3.42Å; F1402-F1445 HydrophobicContact CE1-CZ 3.42Å; F1402-F1445 VanDerWaalsContact CE1-CZ 3.45Å; F1402-F1445 HydrophobicContact CE2-CZ 4.44Å; F1402-F1445 AromaticContact CZ-CE1 3.8Å; F1402-F1445 HydrophobicContact CZ-CE1 3.8Å; F1402-F1445 HydrophobicContact CZ-CE2 4.39Å; F1402-F1445 AromaticContact CZ-CZ 3.4Å; F1402-F1445 HydrophobicContact CZ-CZ 3.4Å; N1441-F1445 VanDerWaalsContact O-CD2 3.27Å; N1441-F1445 WeakPolarHBondContact O-CD2 3.38Å; N1441-F1445 PolarHBondContact O-N 3.1Å; N1441-F1445 VanDerWaalsContact OD1-CD2 3.24Å; N1441-F1445 WeakPolarHBondContact OD1-CD2 3.39Å; N1441-F1445 WeakPolarHBondContact OD1-CE2 3.18Å; L1442-F1445 PolarHBondContact O-N 3.27Å; F1445-L1448 HydrophobicContact CD1-CD1 4.22Å; F1445-L1448 HydrophobicContact CE1-CD1 4.35Å; F1445-L1448 WeakPolarHBondContact O-CB 3.41Å; F1445-L1448 PolarHBondContact O-N 3.13Å; F1445-N1449 VanDerWaalsContact O-CG 3.25Å; F1445-N1449 PolarHBondContact O-N 3.17Å; F1445-N1449 PolarHBondContact O-OD1 3.01Å; F1445-N1449 VanDerWaalsContact O-OD1 3.09Å; F1445-Y1463 HydrophobicContact CE1-CE2 4.25Å; F1445-F1467 HydrophobicContact CE1-CE1 4.27Å; F1445-F1467 HydrophobicContact CE1-CE2 4.21Å; F1445-F1467 HydrophobicContact CE1-CZ 4.25Å; F1445-F1467 HydrophobicContact CE2-CE1 4.3Å; F1445-F1467 HydrophobicContact CE2-CZ 4.38Å; F1445-F1467 AromaticContact CZ-CD1 3.98Å; F1445-F1467 HydrophobicContact CZ-CD1 4.08Å; F1445-F1467 AromaticContact CZ-CE1 3.68Å; F1445-F1467 HydrophobicContact CZ-CE1 3.68Å; F1445-F1467 HydrophobicContact CZ-CE2 4.36Å; F1445-F1467 HydrophobicContact CZ-CG 4.43Å; F1445-F1467 AromaticContact CZ-CZ 3.85Å; F1445-F1467 HydrophobicContact CZ-CZ 3.85Å; F1445-L1472 HydrophobicContact CE1-CD1 4.31Å; F1445-V1492 HydrophobicContact CB-CG1 3.61Å; F1445-V1492 VanDerWaalsContact CB-CG1 3.46Å; F1445-Y1493 HydrophobicContact CB-CD1 4.5Å; F1445-Y1493 HydrophobicContact CB-CE1 4.36Å; F1445-Y1493 AromaticContact CD1-CD1 3.95Å; F1445-Y1493 HydrophobicContact CD1-CD1 4.08Å; F1445-Y1493 HydrophobicContact CD1-CE1 4.17Å; F1445-Y1493 HydrophobicContact CD2-CD1 4.41Å; F1445-Y1493 AromaticContact CD2-CE1 3.62Å; F1445-Y1493 HydrophobicContact CD2-CE1 3.62Å; F1445-Y1493 VanDerWaalsContact CD2-CE1 3.44Å; F1445-Y1493 HydrophobicContact CE1-CD1 4.38Å; F1445-Y1493 HydrophobicContact CE1-CE1 4.35Å; F1445-Y1493 AromaticContact CE2-CE1 3.84Å; F1445-Y1493 HydrophobicContact CE2-CE1 3.88Å; F1445-Y1493 HydrophobicContact CG-CD1 4.13Å; F1445-Y1493 AromaticContact CG-CE1 3.78Å; F1445-Y1493 HydrophobicContact CG-CE1 3.78Å; F1445-Y1493 HydrophobicContact CZ-CE1 4.25Å; F1445-N1496 HydrophobicContact CD1-CB 4.27Å; F1445-N1496 WeakPolarHBondContact CD1-ND2 3.38Å
1446H82.5Confident76.5Confident45.8 Ų45.830.9 Ų30.921%0.21215%0.152CC..Hα-helixtrans-62.2-45.4171.9-176.259.1000111.5L1442 K1443 F1444 L1448 N1449 I1450 V1492L1442-H1446 HydrophobicContact CD2-CB 4.46Å; L1442-H1446 WeakPolarHBondContact O-CB 3.4Å; L1442-H1446 PolarHBondContact O-N 3.23Å; K1443-H1446 PolarHBondContact O-N 3.19Å; F1444-H1446 VanDerWaalsContact C-N 3.33Å; H1446-L1448 VanDerWaalsContact C-N 3.33Å; H1446-L1448 PolarHBondContact O-N 3.08Å; H1446-N1449 WeakPolarHBondContact O-CB 3.33Å; H1446-N1449 PolarHBondContact O-N 3.09Å; H1446-N1449 VanDerWaalsContact O-N 3.14Å; H1446-I1450 WeakPolarHBondContact O-CG1 3.28Å; H1446-I1450 PolarHBondContact O-N 3.09Å; H1446-I1450 VanDerWaalsContact O-N 3.15Å; H1446-V1492 HydrophobicContact CB-CG1 4.26Å; H1446-V1492 HydrophobicContact CB-CG2 4.5Å
1447L83.4Confident76.4Confident1.6 Ų1.630.3 Ų30.31%0.00815%0.152CC..Hα-helixtrans-57.5-46.6172178.975.9000111L1363 L1366 I1367 V1370 L1388 K1443 F1444 N1449 I1450 L1451L1363-L1447 HydrophobicContact CD2-CD2 3.95Å; L1366-L1447 HydrophobicContact CB-CD1 4.17Å; L1366-L1447 VanDerWaalsContact CB-CD1 3.43Å; L1366-L1447 HydrophobicContact CB-CD2 4.07Å; L1366-L1447 HydrophobicContact CD1-CD1 4.17Å; L1366-L1447 HydrophobicContact CD1-CD2 4.26Å; L1366-L1447 HydrophobicContact CG-CD1 4.47Å; I1367-L1447 HydrophobicContact CD1-CB 4.39Å; I1367-L1447 HydrophobicContact CG1-CB 3.94Å; I1367-L1447 HydrophobicContact CG1-CD1 4.1Å; I1367-L1447 HydrophobicContact CG1-CG 4.45Å; V1370-L1447 HydrophobicContact CG2-CD1 4.19Å; L1388-L1447 HydrophobicContact CD1-CD2 4.26Å; K1443-L1447 WeakPolarHBondContact O-CB 3.4Å; K1443-L1447 PolarHBondContact O-N 3.34Å; F1444-L1447 WeakPolarHBondContact O-CB 3.33Å; F1444-L1447 PolarHBondContact O-N 3.07Å; L1447-N1449 VanDerWaalsContact C-N 3.31Å; L1447-N1449 PolarHBondContact O-N 3.4Å; L1447-I1450 PolarHBondContact O-N 3.16Å; L1447-I1450 VanDerWaalsContact O-N 3.16Å; L1447-L1451 HydrophobicContact CD1-CD1 4.38Å; L1447-L1451 HydrophobicContact CD1-CG 4.38Å; L1447-L1451 HydrophobicContact CD2-CD1 3.63Å; L1447-L1451 HydrophobicContact CD2-CG 4.27Å; L1447-L1451 HydrophobicContact CG-CD1 4.17Å; L1447-L1451 HydrophobicContact CG-CG 4.44Å; L1447-L1451 VanDerWaalsContact O-CG 3.29Å; L1447-L1451 WeakPolarHBondContact O-CG 3.42Å; L1447-L1451 PolarHBondContact O-N 3.22Å
1448L81.9Confident76.2Confident3.8 Ų3.833.9 Ų33.92%0.0217%0.17CC..Hα-helixtrans-58.7-39.5175.8-78.9173.6000112.8F1444 F1445 H1446 I1450 L1451 L1452 L1459 Y1463 F1467F1444-L1448 HydrophobicContact CD1-CD1 3.91Å; F1444-L1448 HydrophobicContact CD1-CG 4.45Å; F1444-L1448 HydrophobicContact CE1-CD1 3.42Å; F1444-L1448 VanDerWaalsContact CE1-CD1 3.44Å; F1444-L1448 HydrophobicContact CE1-CG 4.12Å; F1444-L1448 HydrophobicContact CZ-CD1 3.99Å; F1444-L1448 HydrophobicContact CZ-CD2 4.48Å; F1444-L1448 HydrophobicContact CZ-CG 4.31Å; F1444-L1448 PolarHBondContact O-N 3.18Å; F1445-L1448 HydrophobicContact CD1-CD1 4.22Å; F1445-L1448 HydrophobicContact CE1-CD1 4.35Å; F1445-L1448 WeakPolarHBondContact O-CB 3.41Å; F1445-L1448 PolarHBondContact O-N 3.13Å; H1446-L1448 VanDerWaalsContact C-N 3.33Å; H1446-L1448 PolarHBondContact O-N 3.08Å; L1448-I1450 VanDerWaalsContact C-N 3.3Å; L1448-I1450 PolarHBondContact O-N 2.95Å; L1448-L1451 CarbonylContact O-C 3.51Å; L1448-L1451 PolarHBondContact O-N 3.18Å; L1448-L1451 VanDerWaalsContact O-N 3.15Å; L1448-L1452 HydrophobicContact CB-CD1 4.3Å; L1448-L1452 HydrophobicContact CD2-CD1 4.37Å; L1448-L1452 HydrophobicContact CD2-CG 4.48Å; L1448-L1452 VanDerWaalsContact O-CB 3.27Å; L1448-L1452 WeakPolarHBondContact O-CB 3.36Å; L1448-L1452 VanDerWaalsContact O-CG 3.23Å; L1448-L1452 WeakPolarHBondContact O-CG 3.3Å; L1448-L1452 PolarHBondContact O-N 3.14Å; L1448-L1459 HydrophobicContact CD2-CD1 4.44Å; L1448-L1459 HydrophobicContact CD2-CD2 4.46Å; L1448-Y1463 HydrophobicContact CD1-CD2 4.33Å; L1448-Y1463 HydrophobicContact CD1-CE2 4.32Å; L1448-F1467 HydrophobicContact CD1-CE2 4.11Å; L1448-F1467 HydrophobicContact CD1-CZ 4.4Å
1449N81.5Confident76.2Confident1.4 Ų1.433.8 Ų33.81%0.00717%0.169CC..Hα-helixtrans-61.4-41178-68.3-4.9000111.5F1445 H1446 L1447 L1451 L1452 T1453 V1492 E1495 N1496 N1499F1445-N1449 VanDerWaalsContact O-CG 3.25Å; F1445-N1449 PolarHBondContact O-N 3.17Å; F1445-N1449 PolarHBondContact O-OD1 3.01Å; F1445-N1449 VanDerWaalsContact O-OD1 3.09Å; H1446-N1449 WeakPolarHBondContact O-CB 3.33Å; H1446-N1449 PolarHBondContact O-N 3.09Å; H1446-N1449 VanDerWaalsContact O-N 3.14Å; L1447-N1449 VanDerWaalsContact C-N 3.31Å; L1447-N1449 PolarHBondContact O-N 3.4Å; N1449-L1451 VanDerWaalsContact C-N 3.32Å; N1449-L1452 PolarHBondContact O-N 3.17Å; N1449-T1453 PolarHBondContact O-N 2.87Å; N1449-T1453 PolarHBondContact O-OG1 3.29Å; N1449-V1492 PolarHBondContact ND2-O 3.17Å; N1449-E1495 HydrophobicContact CB-CG 4.34Å; N1449-E1495 WeakPolarHBondContact ND2-CB 3.42Å; N1449-E1495 PolarHBondContact ND2-OE2 3.18Å; N1449-N1496 PolarHBondContact ND2-N 2.87Å; N1449-N1496 WeakPolarHBondContact OD1-CA 3.3Å; N1449-N1496 WeakPolarHBondContact OD1-CB 3.44Å; N1449-N1496 VanDerWaalsContact OD1-CG 3.25Å; N1449-N1496 PolarHBondContact OD1-N 3.23Å; N1449-N1496 PolarHBondContact OD1-ND2 3.19Å; N1449-N1499 PolarHBondContact O-ND2 3.04Å; N1449-N1499 VanDerWaalsContact O-ND2 3.16Å
1450I81.2Confident76.2Confident12.2 Ų12.232.6 Ų32.66%0.06316%0.163CC..Hα-helixtrans-67-37.5176.1-58.9166.4000110.8I1367 V1370 K1371 V1376 H1446 L1447 L1448 L1452 T1453I1367-I1450 HydrophobicContact CG2-CD1 3.99Å; V1370-I1450 HydrophobicContact CB-CG2 4.41Å; V1370-I1450 HydrophobicContact CG1-CG2 3.42Å; V1370-I1450 VanDerWaalsContact CG1-CG2 3.44Å; K1371-I1450 HydrophobicContact CD-CD1 4.36Å; V1376-I1450 HydrophobicContact CG1-CG2 4.22Å; V1376-I1450 HydrophobicContact CG2-CG2 3.93Å; H1446-I1450 WeakPolarHBondContact O-CG1 3.28Å; H1446-I1450 PolarHBondContact O-N 3.09Å; H1446-I1450 VanDerWaalsContact O-N 3.15Å; L1447-I1450 PolarHBondContact O-N 3.16Å; L1447-I1450 VanDerWaalsContact O-N 3.16Å; L1448-I1450 VanDerWaalsContact C-N 3.3Å; L1448-I1450 PolarHBondContact O-N 2.95Å; I1450-L1452 VanDerWaalsContact C-N 3.32Å; I1450-L1452 PolarHBondContact O-N 3.25Å; I1450-T1453 WeakPolarHBondContact CA-OG1 3.36Å; I1450-T1453 PolarHBondContact O-OG1 3.15Å
1451L79.8Confident76.2Confident0 Ų037.9 Ų37.90%019%0.187CC..Hα-helixtrans-73.9-26.4177.9-62.4178000113.2V1370 R1381 I1384 L1388 L1447 L1448 N1449 T1453 N1456 L1459V1370-L1451 HydrophobicContact CG1-CD2 4.4Å; V1370-L1451 HydrophobicContact CG2-CD2 4.31Å; R1381-L1451 HydrophobicContact CB-CD2 4.43Å; R1381-L1451 HydrophobicContact CG-CD2 3.64Å; I1384-L1451 HydrophobicContact CB-CD2 4.4Å; I1384-L1451 HydrophobicContact CG2-CD1 4.13Å; I1384-L1451 HydrophobicContact CG2-CD2 4.15Å; L1388-L1451 HydrophobicContact CD1-CD1 3.45Å; L1388-L1451 VanDerWaalsContact CD1-CD1 3.45Å; L1447-L1451 HydrophobicContact CD1-CD1 4.38Å; L1447-L1451 HydrophobicContact CD1-CG 4.38Å; L1447-L1451 HydrophobicContact CD2-CD1 3.63Å; L1447-L1451 HydrophobicContact CD2-CG 4.27Å; L1447-L1451 HydrophobicContact CG-CD1 4.17Å; L1447-L1451 HydrophobicContact CG-CG 4.44Å; L1447-L1451 VanDerWaalsContact O-CG 3.29Å; L1447-L1451 WeakPolarHBondContact O-CG 3.42Å; L1447-L1451 PolarHBondContact O-N 3.22Å; L1448-L1451 CarbonylContact O-C 3.51Å; L1448-L1451 PolarHBondContact O-N 3.18Å; L1448-L1451 VanDerWaalsContact O-N 3.15Å; N1449-L1451 VanDerWaalsContact C-N 3.32Å; L1451-T1453 PolarHBondContact O-N 3.07Å; L1451-N1456 PolarHBondContact O-ND2 3.27Å; L1451-N1456 VanDerWaalsContact O-ND2 3.07Å; L1451-L1459 HydrophobicContact CB-CD1 3.95Å; L1451-L1459 HydrophobicContact CB-CD2 3.59Å; L1451-L1459 HydrophobicContact CD1-CD2 4.37Å
1452L76.3Confident75.9Confident11.4 Ų11.439.9 Ų39.96%0.0620%0.195CC..THydrogen-bonded Turntrans-91.911.3-177.8-71.7170.8000113.5L1448 N1449 I1450 E1454 L1459 V1460 Y1463 N1496 N1499L1448-L1452 HydrophobicContact CB-CD1 4.3Å; L1448-L1452 HydrophobicContact CD2-CD1 4.37Å; L1448-L1452 HydrophobicContact CD2-CG 4.48Å; L1448-L1452 VanDerWaalsContact O-CB 3.27Å; L1448-L1452 WeakPolarHBondContact O-CB 3.36Å; L1448-L1452 VanDerWaalsContact O-CG 3.23Å; L1448-L1452 WeakPolarHBondContact O-CG 3.3Å; L1448-L1452 PolarHBondContact O-N 3.14Å; N1449-L1452 PolarHBondContact O-N 3.17Å; I1450-L1452 VanDerWaalsContact C-N 3.32Å; I1450-L1452 PolarHBondContact O-N 3.25Å; L1452-E1454 PolarHBondContact O-N 3.02Å; L1452-L1459 HydrophobicContact CD2-CB 4.15Å; L1452-L1459 HydrophobicContact CD2-CD2 3.86Å; L1452-L1459 HydrophobicContact CD2-CG 4.07Å; L1452-L1459 HydrophobicContact CG-CD2 4.11Å; L1452-V1460 HydrophobicContact CD2-CG2 3.9Å; L1452-Y1463 HydrophobicContact CD1-CD2 4.3Å; L1452-Y1463 HydrophobicContact CD1-CE2 4.05Å; L1452-Y1463 HydrophobicContact CD2-CD2 4.49Å; L1452-N1496 VanDerWaalsContact CD1-ND2 3.35Å; L1452-N1496 WeakPolarHBondContact CD1-ND2 3.26Å; L1452-N1499 HydrophobicContact CB-CB 4.24Å
1453T69.8Low75.8Confident67.2 Ų67.239.5 Ų39.541%0.41219%0.193SC..SBendtrans-75.7-28.9-177.3-6.40000112.9N1449 I1450 L1451 E1455 N1456N1449-T1453 PolarHBondContact O-N 2.87Å; N1449-T1453 PolarHBondContact O-OG1 3.29Å; I1450-T1453 WeakPolarHBondContact CA-OG1 3.36Å; I1450-T1453 PolarHBondContact O-OG1 3.15Å; L1451-T1453 PolarHBondContact O-N 3.07Å; T1453-E1455 PolarHBondContact O-N 3.03Å; T1453-E1455 VanDerWaalsContact O-N 3.15Å; T1453-N1456 PolarHBondContact O-N 3.36Å; T1453-N1456 PolarHBondContact OG1-ND2 3.47Å
1454E64.1Low75.5Confident116.2 Ų116.240.9 Ų40.954%0.54320%0.197SC..SBendtrans-108.5158.6172.5-66.9177-161.400111.4R1381 L1452 N1456R1381-E1454 IonicContact CZ-OE1 3.88Å; R1381-E1454 IonicContact CZ-OE2 2.81Å; R1381-E1454 IonicContact NH1-OE1 3.04Å; R1381-E1454 PolarHBondContact NH1-OE1 3.46Å; R1381-E1454 IonicContact NH1-OE2 3.02Å; R1381-E1454 PolarHBondContact NH1-OE2 3.19Å; R1381-E1454 IonicContact NH2-OE1 3.08Å; R1381-E1454 PolarHBondContact NH2-OE1 3.25Å; R1381-E1454 IonicContact NH2-OE2 3.15Å; R1381-E1454 PolarHBondContact NH2-OE2 3.14Å; L1452-E1454 PolarHBondContact O-N 3.02Å; E1454-N1456 VanDerWaalsContact C-N 3.28Å; E1454-N1456 PolarHBondContact O-N 3.26Å
1455E61.9Low75.1Confident145.8 Ų145.849.1 Ų49.168%0.68123%0.232SC*.  trans-66.956.2-169.7-61.5-175.2160.700114.4R1381 T1453 D1457R1381-E1455 IonicContact NH2-OE2 2.81Å; T1453-E1455 PolarHBondContact O-N 3.03Å; T1453-E1455 VanDerWaalsContact O-N 3.15Å; E1455-D1457 PolarHBondContact O-N 2.95Å; E1455-D1457 VanDerWaalsContact O-N 3.13Å
1456N66.6Low74.7Confident25.4 Ų25.451.1 Ų51.114%0.13624%0.24CC..  trans-87.177.5174.8-77.9-40.5000111.3R1381 L1451 T1453 E1454 I1458 L1459 V1460R1381-N1456 PolarHBondContact NE-ND2 3.09Å; L1451-N1456 PolarHBondContact O-ND2 3.27Å; L1451-N1456 VanDerWaalsContact O-ND2 3.07Å; T1453-N1456 PolarHBondContact O-N 3.36Å; T1453-N1456 PolarHBondContact OG1-ND2 3.47Å; E1454-N1456 VanDerWaalsContact C-N 3.28Å; E1454-N1456 PolarHBondContact O-N 3.26Å; N1456-I1458 PolarHBondContact O-N 3.14Å; N1456-I1458 VanDerWaalsContact O-N 3.11Å; N1456-L1459 HydrophobicContact CB-CB 4.12Å; N1456-L1459 HydrophobicContact CB-CD1 3.97Å; N1456-L1459 HydrophobicContact CB-CG 4.39Å; N1456-L1459 PolarHBondContact O-N 3.07Å; N1456-L1459 VanDerWaalsContact O-N 3.11Å; N1456-V1460 WeakPolarHBondContact O-CG2 3.41Å; N1456-V1460 PolarHBondContact O-N 3.05Å; N1456-V1460 VanDerWaalsContact O-N 3.11Å
1457D69.1Low74.5Confident73 Ų7349.6 Ų49.639%0.3923%0.233SC..Hα-helixtrans-51.1-34.7-179.9-82.8-9.7000113.9E1455 K1461E1455-D1457 PolarHBondContact O-N 2.95Å; E1455-D1457 VanDerWaalsContact O-N 3.13Å; D1457-K1461 WeakPolarHBondContact O-CB 3.33Å; D1457-K1461 VanDerWaalsContact O-CG 3.26Å; D1457-K1461 WeakPolarHBondContact O-CG 3.42Å; D1457-K1461 PolarHBondContact O-N 3.12Å; D1457-K1461 VanDerWaalsContact O-N 3.1Å
1458I72.5Confident74.3Confident102.6 Ų102.656.4 Ų56.453%0.52626%0.262SS..Hα-helixtrans-67.3-47.3-178.9-58.9172.5000110.8C1389 N1456 K1461 K1462C1389-I1458 HydrophobicContact CB-CG2 4.32Å; N1456-I1458 PolarHBondContact O-N 3.14Å; N1456-I1458 VanDerWaalsContact O-N 3.11Å; I1458-K1461 PolarHBondContact O-N 3.28Å; I1458-K1462 PolarHBondContact O-N 2.9Å; I1458-K1462 VanDerWaalsContact O-N 3.14Å
1459L75.4Confident74.2Confident2.6 Ų2.657 Ų571%0.01427%0.266CS..Hα-helixtrans-66.4-41.8179.4-141.7104.1000110.8C1389 L1448 L1451 L1452 N1456 K1461 K1462 Y1463 W1466C1389-L1459 WeakPolarHBondContact SG-CD2 3.44Å; L1448-L1459 HydrophobicContact CD2-CD1 4.44Å; L1448-L1459 HydrophobicContact CD2-CD2 4.46Å; L1451-L1459 HydrophobicContact CB-CD1 3.95Å; L1451-L1459 HydrophobicContact CB-CD2 3.59Å; L1451-L1459 HydrophobicContact CD1-CD2 4.37Å; L1452-L1459 HydrophobicContact CD2-CB 4.15Å; L1452-L1459 HydrophobicContact CD2-CD2 3.86Å; L1452-L1459 HydrophobicContact CD2-CG 4.07Å; L1452-L1459 HydrophobicContact CG-CD2 4.11Å; N1456-L1459 HydrophobicContact CB-CB 4.12Å; N1456-L1459 HydrophobicContact CB-CD1 3.97Å; N1456-L1459 HydrophobicContact CB-CG 4.39Å; N1456-L1459 PolarHBondContact O-N 3.07Å; N1456-L1459 VanDerWaalsContact O-N 3.11Å; L1459-K1461 VanDerWaalsContact C-N 3.33Å; L1459-K1461 PolarHBondContact O-N 3.2Å; L1459-K1462 PolarHBondContact O-N 3.29Å; L1459-Y1463 VanDerWaalsContact O-CB 3.26Å; L1459-Y1463 WeakPolarHBondContact O-CB 3.41Å; L1459-Y1463 PolarHBondContact O-N 3.12Å; L1459-W1466 HydrophobicContact CD1-CZ3 4.25Å
1460V75.4Confident74.2Confident8.8 Ų8.859.1 Ų59.15%0.05328%0.28CS..Hα-helixtrans-60.4-44.4177.8175.60000111.1L1452 N1456 K1462 Y1463 R1464 F1500 D1505L1452-V1460 HydrophobicContact CD2-CG2 3.9Å; N1456-V1460 WeakPolarHBondContact O-CG2 3.41Å; N1456-V1460 PolarHBondContact O-N 3.05Å; N1456-V1460 VanDerWaalsContact O-N 3.11Å; V1460-K1462 VanDerWaalsContact C-N 3.31Å; V1460-K1462 PolarHBondContact O-N 3.2Å; V1460-Y1463 PolarHBondContact O-N 3.26Å; V1460-R1464 PolarHBondContact O-N 3.1Å; V1460-R1464 VanDerWaalsContact O-N 3.12Å; V1460-F1500 HydrophobicContact CG1-CD2 4.39Å; V1460-F1500 HydrophobicContact CG1-CE2 4.25Å; V1460-D1505 HydrophobicContact CG1-CB 4Å
1461K75Confident74.3Confident120.4 Ų120.461.3 Ų61.352%0.52329%0.29SS..Hα-helixtrans-62.5-39.6176.6-76.4170.9-175.21670112.7D1457 I1458 L1459 K1465D1457-K1461 WeakPolarHBondContact O-CB 3.33Å; D1457-K1461 VanDerWaalsContact O-CG 3.26Å; D1457-K1461 WeakPolarHBondContact O-CG 3.42Å; D1457-K1461 PolarHBondContact O-N 3.12Å; D1457-K1461 VanDerWaalsContact O-N 3.1Å; I1458-K1461 PolarHBondContact O-N 3.28Å; L1459-K1461 VanDerWaalsContact C-N 3.33Å; L1459-K1461 PolarHBondContact O-N 3.2Å; K1461-K1465 PolarHBondContact O-N 2.81Å
1462K74.9Confident74.4Confident42.8 Ų42.861.3 Ų61.319%0.18629%0.29CS..Hα-helixtrans-73.6-40.2176.6-86.6-167.7-178.2-171.50112.3C1389 F1392 D1393 I1458 L1459 V1460 R1464 K1465 W1466C1389-K1462 HydrophobicContact CB-CD 3.78Å; C1389-K1462 WeakPolarHBondContact O-CE 3.42Å; C1389-K1462 PolarHBondContact O-NZ 3.21Å; F1392-K1462 VanDerWaalsContact O-CE 3.28Å; F1392-K1462 WeakPolarHBondContact O-CE 3.48Å; D1393-K1462 VanDerWaalsContact CG-NZ 3.34Å; D1393-K1462 VanDerWaalsContact OD1-CE 3.3Å; D1393-K1462 WeakPolarHBondContact OD1-CE 3.44Å; D1393-K1462 IonicContact OD1-NZ 3.64Å; D1393-K1462 PolarHBondContact OD1-NZ 3.41Å; D1393-K1462 IonicContact OD2-NZ 3.42Å; D1393-K1462 PolarHBondContact OD2-NZ 3.4Å; I1458-K1462 PolarHBondContact O-N 2.9Å; I1458-K1462 VanDerWaalsContact O-N 3.14Å; L1459-K1462 PolarHBondContact O-N 3.29Å; V1460-K1462 VanDerWaalsContact C-N 3.31Å; V1460-K1462 PolarHBondContact O-N 3.2Å; K1462-R1464 VanDerWaalsContact C-N 3.27Å; K1462-R1464 PolarHBondContact O-N 3.21Å; K1462-K1465 WeakPolarHBondContact O-CA 3.37Å; K1462-K1465 WeakPolarHBondContact O-CB 3.33Å; K1462-K1465 PolarHBondContact O-N 3.25Å; K1462-W1466 HydrophobicContact CB-CD2 4.38Å; K1462-W1466 HydrophobicContact CB-CE3 4.14Å; K1462-W1466 HydrophobicContact CB-CH2 4.15Å; K1462-W1466 HydrophobicContact CB-CZ2 4.11Å; K1462-W1466 HydrophobicContact CB-CZ3 4.17Å; K1462-W1466 HydrophobicContact CD-CH2 4.19Å; K1462-W1466 HydrophobicContact CD-CZ2 3.95Å; K1462-W1466 HydrophobicContact CG-CD2 4.38Å; K1462-W1466 HydrophobicContact CG-CH2 4.41Å; K1462-W1466 HydrophobicContact CG-CZ2 4.03Å; K1462-W1466 VanDerWaalsContact O-CG 3.22Å; K1462-W1466 PolarHBondContact O-N 3.16Å; K1462-W1466 VanDerWaalsContact O-N 3.09Å
1463Y76.6Confident74.8Confident6 Ų661 Ų612%0.02429%0.288CS..Hα-helixtrans-53.6-42.1174178.9-84.1000111.5F1445 L1448 L1452 L1459 V1460 K1465 W1466 F1467 L1472 N1496 F1500F1445-Y1463 HydrophobicContact CE1-CE2 4.25Å; L1448-Y1463 HydrophobicContact CD1-CD2 4.33Å; L1448-Y1463 HydrophobicContact CD1-CE2 4.32Å; L1452-Y1463 HydrophobicContact CD1-CD2 4.3Å; L1452-Y1463 HydrophobicContact CD1-CE2 4.05Å; L1452-Y1463 HydrophobicContact CD2-CD2 4.49Å; L1459-Y1463 VanDerWaalsContact O-CB 3.26Å; L1459-Y1463 WeakPolarHBondContact O-CB 3.41Å; L1459-Y1463 PolarHBondContact O-N 3.12Å; V1460-Y1463 PolarHBondContact O-N 3.26Å; Y1463-K1465 VanDerWaalsContact C-N 3.29Å; Y1463-K1465 PolarHBondContact O-N 3.33Å; Y1463-W1466 PolarHBondContact O-N 3.18Å; Y1463-W1466 VanDerWaalsContact O-N 3.13Å; Y1463-F1467 HydrophobicContact CD1-CB 4.43Å; Y1463-F1467 HydrophobicContact CD1-CD2 4.4Å; Y1463-F1467 AromaticContact CD2-CD2 3.46Å; Y1463-F1467 HydrophobicContact CD2-CD2 3.46Å; Y1463-F1467 VanDerWaalsContact CD2-CD2 3.46Å; Y1463-F1467 AromaticContact CD2-CE2 3.94Å; Y1463-F1467 HydrophobicContact CD2-CE2 4.02Å; Y1463-F1467 HydrophobicContact CD2-CG 4.45Å; Y1463-F1467 HydrophobicContact CE1-CB 4.01Å; Y1463-F1467 HydrophobicContact CE1-CD2 4.36Å; Y1463-F1467 HydrophobicContact CE2-CB 4.25Å; Y1463-F1467 AromaticContact CE2-CD2 3.4Å; Y1463-F1467 HydrophobicContact CE2-CD2 3.4Å; Y1463-F1467 VanDerWaalsContact CE2-CD2 3.45Å; Y1463-F1467 AromaticContact CE2-CE2 3.91Å; Y1463-F1467 HydrophobicContact CE2-CE2 4.03Å; Y1463-F1467 HydrophobicContact CE2-CG 4.07Å; Y1463-F1467 AromaticContact CG-CD2 3.96Å; Y1463-F1467 HydrophobicContact CG-CD2 4.06Å; Y1463-F1467 AromaticContact CZ-CD2 3.91Å; Y1463-F1467 WeakPolarHBondContact O-CB 3.37Å; Y1463-F1467 PolarHBondContact O-N 3.03Å; Y1463-L1472 WeakPolarHBondContact OH-CD1 3.48Å; Y1463-N1496 WeakPolarHBondContact CE2-OD1 3.22Å; Y1463-N1496 VanDerWaalsContact CZ-OD1 3.27Å; Y1463-N1496 VanDerWaalsContact OH-CG 3.32Å; Y1463-N1496 PolarHBondContact OH-ND2 2.98Å; Y1463-N1496 PolarHBondContact OH-OD1 3.19Å; Y1463-F1500 AromaticContact CD1-CD2 3.59Å; Y1463-F1500 HydrophobicContact CD1-CD2 3.59Å; Y1463-F1500 VanDerWaalsContact CD1-CD2 3.48Å; Y1463-F1500 AromaticContact CD1-CE2 3.72Å; Y1463-F1500 HydrophobicContact CD1-CE2 3.72Å; Y1463-F1500 HydrophobicContact CD1-CG 4.39Å; Y1463-F1500 HydrophobicContact CD1-CZ 4.45Å; Y1463-F1500 HydrophobicContact CE1-CB 4.47Å; Y1463-F1500 AromaticContact CE1-CD2 3.68Å; Y1463-F1500 HydrophobicContact CE1-CD2 3.68Å; Y1463-F1500 AromaticContact CE1-CE2 3.89Å; Y1463-F1500 HydrophobicContact CE1-CE2 4.02Å; Y1463-F1500 HydrophobicContact CE1-CG 4.13Å; Y1463-F1500 HydrophobicContact CG-CD2 4.44Å
1464R72.4Confident75.5Confident67.8 Ų67.862.5 Ų62.526%0.25629%0.29SS..Hα-helixtrans-60-34.5173.8-91.4-177.8171.8-179.5-0.6114.1V1460 K1462 W1466 F1500 D1505 N1509 Q1513 Y1514V1460-R1464 PolarHBondContact O-N 3.1Å; V1460-R1464 VanDerWaalsContact O-N 3.12Å; K1462-R1464 VanDerWaalsContact C-N 3.27Å; K1462-R1464 PolarHBondContact O-N 3.21Å; R1464-W1466 VanDerWaalsContact C-N 3.34Å; R1464-F1500 HydrophobicContact CG-CE2 3.9Å; R1464-F1500 HydrophobicContact CG-CZ 3.95Å; R1464-D1505 VanDerWaalsContact CZ-CB 3.46Å; R1464-D1505 IonicContact CZ-OD1 3.37Å; R1464-D1505 VanDerWaalsContact CZ-OD1 3.32Å; R1464-D1505 IonicContact CZ-OD2 3.22Å; R1464-D1505 IonicContact NE-OD2 3.26Å; R1464-D1505 PolarHBondContact NE-OD2 2.97Å; R1464-D1505 IonicContact NH1-OD1 3.29Å; R1464-D1505 PolarHBondContact NH1-OD1 2.95Å; R1464-D1505 IonicContact NH1-OD2 2.87Å; R1464-D1505 PolarHBondContact NH1-OD2 3.22Å; R1464-D1505 VanDerWaalsContact NH1-OD2 3.08Å; R1464-D1505 VanDerWaalsContact NH2-C 3.28Å; R1464-D1505 VanDerWaalsContact NH2-CB 3.29Å; R1464-D1505 PolarHBondContact NH2-O 3.22Å; R1464-D1505 VanDerWaalsContact NH2-O 3.1Å; R1464-D1505 IonicContact NH2-OD1 3.03Å; R1464-D1505 IonicContact NH2-OD2 2.72Å; R1464-N1509 PolarHBondContact NH1-ND2 3.05Å; R1464-N1509 VanDerWaalsContact NH1-ND2 3.14Å; R1464-N1509 PolarHBondContact NH2-ND2 3.16Å; R1464-N1509 VanDerWaalsContact NH2-ND2 3.11Å; R1464-Q1513 VanDerWaalsContact NH2-CD 3.25Å; R1464-Y1514 PolarHBondContact NE-OH 3.19Å; R1464-Y1514 VanDerWaalsContact NE-OH 3.16Å; R1464-Y1514 PolarHBondContact NH1-OH 2.96Å; R1464-Y1514 PolarHBondContact NH2-OH 2.95Å; R1464-Y1514 VanDerWaalsContact NH2-OH 3.11Å
1465K75.5Confident76.4Confident176 Ų17657.1 Ų57.177%0.76526%0.264SS*.Hα-helixtrans-71.7-36.3176.2-66.6-176.6177-177.20111K1461 K1462 Y1463K1461-K1465 PolarHBondContact O-N 2.81Å; K1462-K1465 WeakPolarHBondContact O-CA 3.37Å; K1462-K1465 WeakPolarHBondContact O-CB 3.33Å; K1462-K1465 PolarHBondContact O-N 3.25Å; Y1463-K1465 VanDerWaalsContact C-N 3.29Å; Y1463-K1465 PolarHBondContact O-N 3.33Å
1466W72.7Confident77.4Confident43.2 Ų43.250.1 Ų50.116%0.16423%0.232CC..Hα-helixtrans-80.3-38.2-176.8-60.7-25000113.3L1388 F1392 L1396 F1397 L1459 K1462 Y1463 R1464L1388-W1466 WeakPolarHBondContact O-CH2 3.42Å; F1392-W1466 HydrophobicContact CB-CH2 4.04Å; F1392-W1466 HydrophobicContact CB-CZ2 3.66Å; F1392-W1466 HydrophobicContact CD2-CH2 4.33Å; F1392-W1466 VanDerWaalsContact O-CE2 3.27Å; F1392-W1466 WeakPolarHBondContact O-CZ2 3.49Å; F1392-W1466 PolarHBondContact O-NE1 3.37Å; F1392-W1466 VanDerWaalsContact O-NE1 3.15Å; L1396-W1466 HydrophobicContact CD1-CB 4.13Å; L1396-W1466 HydrophobicContact CD1-CD2 3.23Å; L1396-W1466 HydrophobicContact CD1-CE3 3.4Å; L1396-W1466 VanDerWaalsContact CD1-CE3 3.4Å; L1396-W1466 HydrophobicContact CD1-CG 3.58Å; L1396-W1466 HydrophobicContact CD1-CH2 4.15Å; L1396-W1466 HydrophobicContact CD1-CZ2 4.03Å; L1396-W1466 HydrophobicContact CD1-CZ3 3.86Å; F1397-W1466 HydrophobicContact CD1-CB 3.67Å; F1397-W1466 AromaticContact CD1-CD2 3.75Å; F1397-W1466 HydrophobicContact CD1-CD2 3.75Å; F1397-W1466 AromaticContact CD1-CE3 3.96Å; F1397-W1466 HydrophobicContact CD1-CE3 3.96Å; F1397-W1466 AromaticContact CD1-CG 3.65Å; F1397-W1466 HydrophobicContact CD1-CG 3.65Å; F1397-W1466 AromaticContact CD2-CD1 3.77Å; F1397-W1466 AromaticContact CD2-CD2 3.9Å; F1397-W1466 HydrophobicContact CD2-CD2 3.9Å; F1397-W1466 AromaticContact CD2-CE2 3.7Å; F1397-W1466 AromaticContact CD2-CG 3.93Å; F1397-W1466 HydrophobicContact CD2-CG 3.93Å; F1397-W1466 HydrophobicContact CD2-CZ2 4.21Å; F1397-W1466 AromaticContact CD2-NE1 3.63Å; F1397-W1466 WeakPolarHBondContact CD2-O 3.24Å; F1397-W1466 HydrophobicContact CE1-CB 4.1Å; F1397-W1466 AromaticContact CE1-CD2 3.35Å; F1397-W1466 HydrophobicContact CE1-CD2 3.35Å; F1397-W1466 AromaticContact CE1-CE2 3.98Å; F1397-W1466 AromaticContact CE1-CE3 3.15Å; F1397-W1466 HydrophobicContact CE1-CE3 3.15Å; F1397-W1466 AromaticContact CE1-CG 3.81Å; F1397-W1466 HydrophobicContact CE1-CG 3.81Å; F1397-W1466 HydrophobicContact CE1-CH2 4.18Å; F1397-W1466 HydrophobicContact CE1-CZ2 4.35Å; F1397-W1466 AromaticContact CE1-CZ3 3.61Å; F1397-W1466 HydrophobicContact CE1-CZ3 3.61Å; F1397-W1466 AromaticContact CE2-CD2 3.51Å; F1397-W1466 HydrophobicContact CE2-CD2 3.51Å; F1397-W1466 AromaticContact CE2-CE2 3.17Å; F1397-W1466 AromaticContact CE2-CE3 3.9Å; F1397-W1466 HydrophobicContact CE2-CE3 3.9Å; F1397-W1466 HydrophobicContact CE2-CG 4.06Å; F1397-W1466 AromaticContact CE2-CH2 3.67Å; F1397-W1466 HydrophobicContact CE2-CH2 3.67Å; F1397-W1466 AromaticContact CE2-CZ2 3.27Å; F1397-W1466 HydrophobicContact CE2-CZ2 3.27Å; F1397-W1466 AromaticContact CE2-CZ3 3.98Å; F1397-W1466 HydrophobicContact CE2-CZ3 3.98Å; F1397-W1466 AromaticContact CE2-NE1 3.59Å; F1397-W1466 WeakPolarHBondContact CE2-O 3.32Å; F1397-W1466 HydrophobicContact CG-CB 4.02Å; F1397-W1466 AromaticContact CG-CD1 3.89Å; F1397-W1466 HydrophobicContact CG-CD2 4.02Å; F1397-W1466 AromaticContact CG-CG 3.74Å; F1397-W1466 HydrophobicContact CG-CG 3.74Å; F1397-W1466 AromaticContact CZ-CD2 3.25Å; F1397-W1466 HydrophobicContact CZ-CD2 3.25Å; F1397-W1466 AromaticContact CZ-CE2 3.38Å; F1397-W1466 AromaticContact CZ-CE3 3.14Å; F1397-W1466 HydrophobicContact CZ-CE3 3.14Å; F1397-W1466 HydrophobicContact CZ-CG 4.03Å; F1397-W1466 AromaticContact CZ-CH2 3.27Å; F1397-W1466 HydrophobicContact CZ-CH2 3.27Å; F1397-W1466 AromaticContact CZ-CZ2 3.39Å; F1397-W1466 HydrophobicContact CZ-CZ2 3.39Å; F1397-W1466 AromaticContact CZ-CZ3 3.16Å; F1397-W1466 HydrophobicContact CZ-CZ3 3.16Å; L1459-W1466 HydrophobicContact CD1-CZ3 4.25Å; K1462-W1466 HydrophobicContact CB-CD2 4.38Å; K1462-W1466 HydrophobicContact CB-CE3 4.14Å; K1462-W1466 HydrophobicContact CB-CH2 4.15Å; K1462-W1466 HydrophobicContact CB-CZ2 4.11Å; K1462-W1466 HydrophobicContact CB-CZ3 4.17Å; K1462-W1466 HydrophobicContact CD-CH2 4.19Å; K1462-W1466 HydrophobicContact CD-CZ2 3.95Å; K1462-W1466 HydrophobicContact CG-CD2 4.38Å; K1462-W1466 HydrophobicContact CG-CH2 4.41Å; K1462-W1466 HydrophobicContact CG-CZ2 4.03Å; K1462-W1466 VanDerWaalsContact O-CG 3.22Å; K1462-W1466 PolarHBondContact O-N 3.16Å; K1462-W1466 VanDerWaalsContact O-N 3.09Å; Y1463-W1466 PolarHBondContact O-N 3.18Å; Y1463-W1466 VanDerWaalsContact O-N 3.13Å; R1464-W1466 VanDerWaalsContact C-N 3.34Å
1467F77.9Confident78.2Confident14.4 Ų14.451 Ų516%0.06324%0.236CC..  trans-128.9124.2-166.7-63.7-63.4000111.9F1397 N1400 F1402 F1444 F1445 L1448 Y1463F1397-F1467 HydrophobicContact CD1-CE1 4.43Å; F1397-F1467 AromaticContact CD1-CE2 3.76Å; F1397-F1467 HydrophobicContact CD1-CE2 3.76Å; F1397-F1467 AromaticContact CD1-CZ 3.57Å; F1397-F1467 HydrophobicContact CD1-CZ 3.57Å; F1397-F1467 AromaticContact CE1-CE2 3.82Å; F1397-F1467 HydrophobicContact CE1-CE2 3.82Å; F1397-F1467 AromaticContact CE1-CZ 3.99Å; F1397-F1467 HydrophobicContact CE1-CZ 3.99Å; N1400-F1467 HydrophobicContact CB-CE1 4.2Å; N1400-F1467 HydrophobicContact CB-CZ 4.29Å; F1402-F1467 AromaticContact CD2-CD1 3.92Å; F1402-F1467 HydrophobicContact CD2-CD1 4.02Å; F1402-F1467 HydrophobicContact CE2-CB 3.8Å; F1402-F1467 AromaticContact CE2-CD1 3.39Å; F1402-F1467 HydrophobicContact CE2-CD1 3.39Å; F1402-F1467 VanDerWaalsContact CE2-CD1 3.42Å; F1402-F1467 HydrophobicContact CE2-CE1 4.33Å; F1402-F1467 AromaticContact CE2-CG 3.86Å; F1402-F1467 HydrophobicContact CE2-CG 3.92Å; F1402-F1467 HydrophobicContact CZ-CB 4.37Å; F1402-F1467 AromaticContact CZ-CD1 3.76Å; F1402-F1467 HydrophobicContact CZ-CD1 3.76Å; F1402-F1467 HydrophobicContact CZ-CE1 4.4Å; F1402-F1467 HydrophobicContact CZ-CG 4.27Å; F1444-F1467 HydrophobicContact CE1-CE2 4.36Å; F1444-F1467 AromaticContact CE1-CZ 3.97Å; F1444-F1467 HydrophobicContact CE1-CZ 4.14Å; F1445-F1467 HydrophobicContact CE1-CE1 4.27Å; F1445-F1467 HydrophobicContact CE1-CE2 4.21Å; F1445-F1467 HydrophobicContact CE1-CZ 4.25Å; F1445-F1467 HydrophobicContact CE2-CE1 4.3Å; F1445-F1467 HydrophobicContact CE2-CZ 4.38Å; F1445-F1467 AromaticContact CZ-CD1 3.98Å; F1445-F1467 HydrophobicContact CZ-CD1 4.08Å; F1445-F1467 AromaticContact CZ-CE1 3.68Å; F1445-F1467 HydrophobicContact CZ-CE1 3.68Å; F1445-F1467 HydrophobicContact CZ-CE2 4.36Å; F1445-F1467 HydrophobicContact CZ-CG 4.43Å; F1445-F1467 AromaticContact CZ-CZ 3.85Å; F1445-F1467 HydrophobicContact CZ-CZ 3.85Å; L1448-F1467 HydrophobicContact CD1-CE2 4.11Å; L1448-F1467 HydrophobicContact CD1-CZ 4.4Å; Y1463-F1467 HydrophobicContact CD1-CB 4.43Å; Y1463-F1467 HydrophobicContact CD1-CD2 4.4Å; Y1463-F1467 AromaticContact CD2-CD2 3.46Å; Y1463-F1467 HydrophobicContact CD2-CD2 3.46Å; Y1463-F1467 VanDerWaalsContact CD2-CD2 3.46Å; Y1463-F1467 AromaticContact CD2-CE2 3.94Å; Y1463-F1467 HydrophobicContact CD2-CE2 4.02Å; Y1463-F1467 HydrophobicContact CD2-CG 4.45Å; Y1463-F1467 HydrophobicContact CE1-CB 4.01Å; Y1463-F1467 HydrophobicContact CE1-CD2 4.36Å; Y1463-F1467 HydrophobicContact CE2-CB 4.25Å; Y1463-F1467 AromaticContact CE2-CD2 3.4Å; Y1463-F1467 HydrophobicContact CE2-CD2 3.4Å; Y1463-F1467 VanDerWaalsContact CE2-CD2 3.45Å; Y1463-F1467 AromaticContact CE2-CE2 3.91Å; Y1463-F1467 HydrophobicContact CE2-CE2 4.03Å; Y1463-F1467 HydrophobicContact CE2-CG 4.07Å; Y1463-F1467 AromaticContact CG-CD2 3.96Å; Y1463-F1467 HydrophobicContact CG-CD2 4.06Å; Y1463-F1467 AromaticContact CZ-CD2 3.91Å; Y1463-F1467 WeakPolarHBondContact O-CB 3.37Å; Y1463-F1467 PolarHBondContact O-N 3.03Å
1468K79.1Confident78.9Confident143.8 Ų143.848.3 Ų48.363%0.62522%0.221SC*.  trans-87125.4171.8-67.2-178.4-179.11770109.6S1470 E1471 L1472K1468-S1470 PolarHBondContact O-N 3.17Å; K1468-E1471 HydrophobicContact CB-CB 4.43Å; K1468-E1471 HydrophobicContact CB-CG 4.14Å; K1468-E1471 WeakPolarHBondContact O-CB 3.38Å; K1468-E1471 PolarHBondContact O-N 3.15Å; K1468-L1472 PolarHBondContact O-N 3.31Å
1469L80.4Confident79Confident16.6 Ų16.646.6 Ų46.69%0.08722%0.217CC..Hα-helixtrans-55.5-37.9178.5-172.871.8000112.3E1471 L1472 I1473 L1497 F1500 Y1514L1469-E1471 VanDerWaalsContact C-N 3.27Å; L1469-E1471 PolarHBondContact O-N 2.99Å; L1469-L1472 HydrophobicContact CD1-CD2 4.3Å; L1469-L1472 PolarHBondContact O-N 3.21Å; L1469-I1473 HydrophobicContact CD1-CD1 4.28Å; L1469-I1473 HydrophobicContact CD1-CG1 4.45Å; L1469-I1473 HydrophobicContact CD2-CD1 4.21Å; L1469-I1473 HydrophobicContact CG-CD1 3.93Å; L1469-I1473 HydrophobicContact CG-CG1 4.43Å; L1469-I1473 WeakPolarHBondContact O-CG1 3.35Å; L1469-I1473 PolarHBondContact O-N 3.2Å; L1469-L1497 HydrophobicContact CD1-CD1 4.11Å; L1469-L1497 HydrophobicContact CD1-CG 4.22Å; L1469-F1500 HydrophobicContact CD1-CD1 4.13Å; L1469-F1500 HydrophobicContact CD1-CE1 4.24Å; L1469-Y1514 HydrophobicContact CB-CD1 4.25Å; L1469-Y1514 HydrophobicContact CB-CE1 4.3Å; L1469-Y1514 HydrophobicContact CD2-CD1 3.33Å; L1469-Y1514 HydrophobicContact CD2-CE1 4.1Å; L1469-Y1514 HydrophobicContact CD2-CG 3.92Å; L1469-Y1514 HydrophobicContact CG-CD1 4.39Å
1470S81.5Confident79Confident45.2 Ų45.246.5 Ų46.532%0.31622%0.216SC..Hα-helixtrans-62.2-28.8177.759.40000113.4K1468 K1474K1468-S1470 PolarHBondContact O-N 3.17Å; S1470-K1474 WeakPolarHBondContact O-CD 3.22Å; S1470-K1474 VanDerWaalsContact O-CG 3.22Å; S1470-K1474 WeakPolarHBondContact O-CG 3.3Å; S1470-K1474 PolarHBondContact O-N 3.04Å
1471E82.4Confident79.1Confident57.2 Ų57.246 Ų4627%0.26721%0.213SC..Hα-helixtrans-80.8-40175.7-66.5-101.2150.700111.6F1402 K1468 L1469 I1473 K1474 V1475F1402-E1471 HydrophobicContact CB-CB 3.84Å; F1402-E1471 HydrophobicContact CD2-CB 3.76Å; F1402-E1471 HydrophobicContact CG-CB 4.15Å; K1468-E1471 HydrophobicContact CB-CB 4.43Å; K1468-E1471 HydrophobicContact CB-CG 4.14Å; K1468-E1471 WeakPolarHBondContact O-CB 3.38Å; K1468-E1471 PolarHBondContact O-N 3.15Å; L1469-E1471 VanDerWaalsContact C-N 3.27Å; L1469-E1471 PolarHBondContact O-N 2.99Å; E1471-I1473 VanDerWaalsContact C-N 3.34Å; E1471-I1473 PolarHBondContact O-N 2.99Å; E1471-K1474 WeakPolarHBondContact O-CB 3.4Å; E1471-K1474 PolarHBondContact O-N 3.15Å; E1471-K1474 IonicContact OE1-NZ 3.08Å; E1471-K1474 PolarHBondContact OE1-NZ 3Å; E1471-V1475 WeakPolarHBondContact O-CG2 3.19Å; E1471-V1475 PolarHBondContact O-N 3.21Å; E1471-V1475 VanDerWaalsContact O-N 3.15Å
1472L83.8Confident79Confident0.8 Ų0.842.1 Ų42.10%0.00420%0.196CC..Hα-helixtrans-57.9-47.3173.8177.390.4000111.2F1402 F1445 Y1463 K1468 L1469 K1474 V1475 I1476 Y1493 N1496 L1497F1402-L1472 HydrophobicContact CD1-CD1 4.38Å; F1402-L1472 HydrophobicContact CD2-CB 4.28Å; F1402-L1472 HydrophobicContact CE1-CB 4.22Å; F1402-L1472 HydrophobicContact CE1-CD1 3.77Å; F1402-L1472 HydrophobicContact CE1-CG 4.39Å; F1402-L1472 HydrophobicContact CE2-CB 3.83Å; F1402-L1472 HydrophobicContact CE2-CD1 4.38Å; F1402-L1472 HydrophobicContact CE2-CG 4.46Å; F1402-L1472 HydrophobicContact CZ-CB 3.71Å; F1402-L1472 HydrophobicContact CZ-CD1 3.57Å; F1402-L1472 HydrophobicContact CZ-CD2 4.49Å; F1402-L1472 HydrophobicContact CZ-CG 4.12Å; F1445-L1472 HydrophobicContact CE1-CD1 4.31Å; Y1463-L1472 WeakPolarHBondContact OH-CD1 3.48Å; K1468-L1472 PolarHBondContact O-N 3.31Å; L1469-L1472 HydrophobicContact CD1-CD2 4.3Å; L1469-L1472 PolarHBondContact O-N 3.21Å; L1472-K1474 VanDerWaalsContact C-N 3.33Å; L1472-K1474 PolarHBondContact O-N 3.25Å; L1472-V1475 WeakPolarHBondContact O-CB 3.3Å; L1472-V1475 PolarHBondContact O-N 3.12Å; L1472-V1475 VanDerWaalsContact O-N 3.09Å; L1472-I1476 HydrophobicContact CD1-CD1 4.22Å; L1472-I1476 HydrophobicContact CD1-CG1 4.3Å; L1472-I1476 HydrophobicContact CD2-CD1 3.51Å; L1472-I1476 HydrophobicContact CG-CD1 4.03Å; L1472-I1476 WeakPolarHBondContact O-CG1 3.41Å; L1472-I1476 PolarHBondContact O-N 3.24Å; L1472-Y1493 HydrophobicContact CD1-CD1 3.84Å; L1472-Y1493 HydrophobicContact CD1-CE1 4.4Å; L1472-Y1493 HydrophobicContact CD1-CG 3.93Å; L1472-N1496 HydrophobicContact CD1-CB 4.46Å; L1472-N1496 WeakPolarHBondContact CD1-OD1 3.36Å; L1472-L1497 HydrophobicContact CD2-CB 3.99Å; L1472-L1497 HydrophobicContact CD2-CD1 4.02Å; L1472-L1497 HydrophobicContact CD2-CG 4.29Å
1473I83.9Confident78.9Confident4.2 Ų4.240.8 Ų40.82%0.02219%0.192CC..Hα-helixtrans-64-37.9179.5-70.4175.5000111.4L1469 E1471 V1475 I1476 I1477 L1497 S1517 L1518 L1521L1469-I1473 HydrophobicContact CD1-CD1 4.28Å; L1469-I1473 HydrophobicContact CD1-CG1 4.45Å; L1469-I1473 HydrophobicContact CD2-CD1 4.21Å; L1469-I1473 HydrophobicContact CG-CD1 3.93Å; L1469-I1473 HydrophobicContact CG-CG1 4.43Å; L1469-I1473 WeakPolarHBondContact O-CG1 3.35Å; L1469-I1473 PolarHBondContact O-N 3.2Å; E1471-I1473 VanDerWaalsContact C-N 3.34Å; E1471-I1473 PolarHBondContact O-N 2.99Å; I1473-V1475 VanDerWaalsContact C-N 3.27Å; I1473-V1475 PolarHBondContact O-N 3.08Å; I1473-I1476 PolarHBondContact O-N 2.94Å; I1473-I1477 HydrophobicContact CG2-CD1 3.5Å; I1473-I1477 VanDerWaalsContact CG2-CD1 3.47Å; I1473-I1477 HydrophobicContact CG2-CG1 4.16Å; I1473-I1477 WeakPolarHBondContact O-CB 3.36Å; I1473-I1477 VanDerWaalsContact O-CG1 3.27Å; I1473-I1477 WeakPolarHBondContact O-CG1 3.35Å; I1473-I1477 PolarHBondContact O-N 3.31Å; I1473-L1497 HydrophobicContact CD1-CD1 4.03Å; I1473-L1497 HydrophobicContact CG1-CD1 3.67Å; I1473-S1517 VanDerWaalsContact CD1-C 3.5Å; I1473-S1517 VanDerWaalsContact CD1-CB 3.48Å; I1473-S1517 WeakPolarHBondContact CD1-O 3.37Å; I1473-L1518 HydrophobicContact CD1-CD2 4.24Å; I1473-L1521 HydrophobicContact CD1-CB 4.38Å; I1473-L1521 HydrophobicContact CG2-CB 4.03Å
1474K83.3Confident78.4Confident100.6 Ų100.644.5 Ų44.544%0.43721%0.209SC..Hα-helixtrans-61.2-35.3173.8-74.5168.5-170.8174.80112.5S1470 E1471 L1472 H1478S1470-K1474 WeakPolarHBondContact O-CD 3.22Å; S1470-K1474 VanDerWaalsContact O-CG 3.22Å; S1470-K1474 WeakPolarHBondContact O-CG 3.3Å; S1470-K1474 PolarHBondContact O-N 3.04Å; E1471-K1474 WeakPolarHBondContact O-CB 3.4Å; E1471-K1474 PolarHBondContact O-N 3.15Å; E1471-K1474 IonicContact OE1-NZ 3.08Å; E1471-K1474 PolarHBondContact OE1-NZ 3Å; L1472-K1474 VanDerWaalsContact C-N 3.33Å; L1472-K1474 PolarHBondContact O-N 3.25Å; K1474-H1478 PolarHBondContact O-N 3.14Å
1475V83.8Confident78.2Confident1 Ų143.1 Ų43.11%0.00621%0.207CC..Hα-helixtrans-71.2-42.1175.3174.80000110.9F1402 V1405 R1406 L1409 E1471 L1472 I1473 I1477 H1478 T1481 Y1493F1402-V1475 HydrophobicContact CB-CG2 3.99Å; F1402-V1475 HydrophobicContact CD1-CB 4.5Å; F1402-V1475 HydrophobicContact CD1-CG2 4.04Å; F1402-V1475 HydrophobicContact CG-CG2 4.36Å; V1405-V1475 HydrophobicContact CG1-CG1 4.13Å; R1406-V1475 HydrophobicContact CB-CG2 4.29Å; L1409-V1475 HydrophobicContact CD1-CG1 3.91Å; E1471-V1475 WeakPolarHBondContact O-CG2 3.19Å; E1471-V1475 PolarHBondContact O-N 3.21Å; E1471-V1475 VanDerWaalsContact O-N 3.15Å; L1472-V1475 WeakPolarHBondContact O-CB 3.3Å; L1472-V1475 PolarHBondContact O-N 3.12Å; L1472-V1475 VanDerWaalsContact O-N 3.09Å; I1473-V1475 VanDerWaalsContact C-N 3.27Å; I1473-V1475 PolarHBondContact O-N 3.08Å; V1475-I1477 VanDerWaalsContact C-N 3.34Å; V1475-I1477 PolarHBondContact O-N 3.04Å; V1475-H1478 VanDerWaalsContact O-CB 3.27Å; V1475-H1478 WeakPolarHBondContact O-CB 3.44Å; V1475-H1478 PolarHBondContact O-N 3.1Å; V1475-T1481 VanDerWaalsContact O-CG2 3.28Å; V1475-T1481 WeakPolarHBondContact O-CG2 3.24Å; V1475-Y1493 HydrophobicContact CG1-CD2 3.93Å; V1475-Y1493 HydrophobicContact CG1-CE2 3.51Å; V1475-Y1493 VanDerWaalsContact CG1-CE2 3.43Å
1476I83.2Confident78.1Confident0 Ų035 Ų350%017%0.172CC..Hα-helixtrans-61.4-43177-67.1168.4000111.6L1472 I1473 H1478 T1481 R1490 M1494 L1497 L1521L1472-I1476 HydrophobicContact CD1-CD1 4.22Å; L1472-I1476 HydrophobicContact CD1-CG1 4.3Å; L1472-I1476 HydrophobicContact CD2-CD1 3.51Å; L1472-I1476 HydrophobicContact CG-CD1 4.03Å; L1472-I1476 WeakPolarHBondContact O-CG1 3.41Å; L1472-I1476 PolarHBondContact O-N 3.24Å; I1473-I1476 PolarHBondContact O-N 2.94Å; I1476-H1478 VanDerWaalsContact C-N 3.26Å; I1476-H1478 PolarHBondContact O-N 3.18Å; I1476-T1481 PolarHBondContact O-OG1 3.21Å; I1476-T1481 VanDerWaalsContact O-OG1 3.1Å; I1476-R1490 HydrophobicContact CG2-CG 4.33Å; I1476-M1494 HydrophobicContact CD1-CG 4.49Å; I1476-M1494 HydrophobicContact CD1-SD 4.05Å; I1476-M1494 HydrophobicContact CG2-CG 4.25Å; I1476-M1494 HydrophobicContact CG2-SD 3.71Å; I1476-L1497 HydrophobicContact CD1-CB 4.42Å; I1476-L1497 HydrophobicContact CD1-CD1 3.87Å; I1476-L1521 HydrophobicContact CB-CD1 4.46Å; I1476-L1521 HydrophobicContact CG2-CD1 3.67Å
1477I83.6Confident78.3Confident45 Ų4534.1 Ų34.123%0.23117%0.172CC..Hα-helixtrans-71.7-20.2-179.3-68.1171.8000111.9I1473 V1475 K1482 F1520 L1521 D1524I1473-I1477 HydrophobicContact CG2-CD1 3.5Å; I1473-I1477 VanDerWaalsContact CG2-CD1 3.47Å; I1473-I1477 HydrophobicContact CG2-CG1 4.16Å; I1473-I1477 WeakPolarHBondContact O-CB 3.36Å; I1473-I1477 VanDerWaalsContact O-CG1 3.27Å; I1473-I1477 WeakPolarHBondContact O-CG1 3.35Å; I1473-I1477 PolarHBondContact O-N 3.31Å; V1475-I1477 VanDerWaalsContact C-N 3.34Å; V1475-I1477 PolarHBondContact O-N 3.04Å; I1477-K1482 VanDerWaalsContact O-CE 3.28Å; I1477-K1482 WeakPolarHBondContact O-CE 3.33Å; I1477-F1520 HydrophobicContact CD1-CB 4.24Å; I1477-L1521 HydrophobicContact CG1-CD1 4.25Å; I1477-D1524 HydrophobicContact CD1-CB 4.27Å; I1477-D1524 HydrophobicContact CG1-CB 3.94Å; I1477-D1524 HydrophobicContact CG2-CB 4.18Å
1478H82.4Confident78.2Confident14.6 Ų14.638.5 Ų38.57%0.06819%0.189CC..  trans-58.6130.5-173-169.5-84.2000111.9L1409 D1410 K1474 V1475 I1476 V1480 T1481L1409-H1478 HydrophobicContact CD1-CB 4.35Å; L1409-H1478 PolarHBondContact O-CE1 3.09Å; D1410-H1478 IonicContact OD1-CD2 3.2Å; D1410-H1478 IonicContact OD1-NE2 3.19Å; D1410-H1478 PolarHBondContact OD1-NE2 3.21Å; D1410-H1478 VanDerWaalsContact OD1-NE2 3.1Å; K1474-H1478 PolarHBondContact O-N 3.14Å; V1475-H1478 VanDerWaalsContact O-CB 3.27Å; V1475-H1478 WeakPolarHBondContact O-CB 3.44Å; V1475-H1478 PolarHBondContact O-N 3.1Å; I1476-H1478 VanDerWaalsContact C-N 3.26Å; I1476-H1478 PolarHBondContact O-N 3.18Å; H1478-V1480 VanDerWaalsContact CE1-CG2 3.46Å; H1478-V1480 WeakPolarHBondContact CE1-CG2 3.39Å; H1478-V1480 WeakPolarHBondContact ND1-CB 3.31Å; H1478-V1480 PolarHBondContact ND1-N 3.23Å; H1478-V1480 PolarHBondContact O-N 3.31Å; H1478-V1480 VanDerWaalsContact O-N 3.09Å; H1478-T1481 HydrophobicContact CB-CG2 4.35Å; H1478-T1481 PolarHBondContact O-N 3.29Å; H1478-T1481 VanDerWaalsContact O-N 3.08Å; H1478-T1481 PolarHBondContact O-OG1 3.16Å
1479P74.9Confident78.2Confident67.4 Ų67.431.7 Ų31.744%0.43816%0.16SC..G310 helixtrans-59.2-28.8-171.122.5-35.6000114.5L1413 T1481 K1482L1413-P1479 HydrophobicContact CD1-CB 4.38Å; L1413-P1479 HydrophobicContact CD1-CG 3.59Å; L1413-P1479 VanDerWaalsContact CD1-CG 3.46Å; L1413-P1479 HydrophobicContact CD2-CG 3.91Å; P1479-T1481 VanDerWaalsContact C-N 3.31Å; P1479-T1481 PolarHBondContact O-N 3.1Å; P1479-K1482 VanDerWaalsContact O-CB 3.3Å; P1479-K1482 WeakPolarHBondContact O-CB 3.39Å; P1479-K1482 PolarHBondContact O-N 3.18Å; P1479-K1482 VanDerWaalsContact O-N 3.17Å
1480V76.6Confident78.4Confident0 Ų030.9 Ų30.90%016%0.156CC..G310 helixtrans-65.3-32.3177.8170.50000113.2L1409 L1412 L1413 I1416 I1427 H1478 K1482 C1483 L1486L1409-V1480 HydrophobicContact CB-CB 4.44Å; L1409-V1480 HydrophobicContact CB-CG1 4.3Å; L1409-V1480 HydrophobicContact CD2-CB 4.11Å; L1409-V1480 HydrophobicContact CD2-CG1 3.57Å; L1409-V1480 VanDerWaalsContact CD2-CG1 3.41Å; L1409-V1480 HydrophobicContact CG-CG1 4.41Å; L1409-V1480 WeakPolarHBondContact O-CG2 3.34Å; L1412-V1480 HydrophobicContact CB-CG1 4.28Å; L1412-V1480 HydrophobicContact CB-CG2 4.42Å; L1412-V1480 HydrophobicContact CD1-CG1 4.3Å; L1413-V1480 HydrophobicContact CB-CG2 3.81Å; L1413-V1480 HydrophobicContact CD1-CG2 3.92Å; L1413-V1480 HydrophobicContact CG-CG2 4.35Å; I1416-V1480 HydrophobicContact CD1-CG1 3.76Å; I1416-V1480 HydrophobicContact CD1-CG2 3.96Å; I1416-V1480 HydrophobicContact CG1-CG2 4.34Å; I1427-V1480 HydrophobicContact CD1-CB 4.17Å; I1427-V1480 HydrophobicContact CD1-CG1 3.55Å; I1427-V1480 VanDerWaalsContact CD1-CG1 3.46Å; I1427-V1480 HydrophobicContact CD1-CG2 4.14Å; H1478-V1480 VanDerWaalsContact CE1-CG2 3.46Å; H1478-V1480 WeakPolarHBondContact CE1-CG2 3.39Å; H1478-V1480 WeakPolarHBondContact ND1-CB 3.31Å; H1478-V1480 PolarHBondContact ND1-N 3.23Å; H1478-V1480 PolarHBondContact O-N 3.31Å; H1478-V1480 VanDerWaalsContact O-N 3.09Å; V1480-K1482 PolarHBondContact O-N 3.2Å; V1480-C1483 VanDerWaalsContact O-CB 3.28Å; V1480-C1483 WeakPolarHBondContact O-CB 3.35Å; V1480-C1483 PolarHBondContact O-N 2.88Å; V1480-C1483 VanDerWaalsContact O-N 3.14Å; V1480-C1483 PolarHBondContact O-SG 2.96Å; V1480-L1486 HydrophobicContact CG1-CD1 3.41Å; V1480-L1486 VanDerWaalsContact CG1-CD1 3.43Å
1481T76.4Confident78.6Confident0 Ų031 Ų310%015%0.152CC..G310 helixtrans-72.2-12.317967.40000112.3L1409 V1475 I1476 H1478 P1479 C1483 L1486 C1487 L1489 R1490L1409-T1481 HydrophobicContact CD1-CG2 3.91Å; L1409-T1481 HydrophobicContact CD2-CG2 4.34Å; V1475-T1481 VanDerWaalsContact O-CG2 3.28Å; V1475-T1481 WeakPolarHBondContact O-CG2 3.24Å; I1476-T1481 PolarHBondContact O-OG1 3.21Å; I1476-T1481 VanDerWaalsContact O-OG1 3.1Å; H1478-T1481 HydrophobicContact CB-CG2 4.35Å; H1478-T1481 PolarHBondContact O-N 3.29Å; H1478-T1481 VanDerWaalsContact O-N 3.08Å; H1478-T1481 PolarHBondContact O-OG1 3.16Å; P1479-T1481 VanDerWaalsContact C-N 3.31Å; P1479-T1481 PolarHBondContact O-N 3.1Å; T1481-C1483 VanDerWaalsContact C-N 3.34Å; T1481-L1486 CarbonylContact O-C 3.52Å; T1481-C1487 WeakPolarHBondContact O-CA 3.41Å; T1481-L1489 HydrophobicContact CG2-CD2 3.72Å; T1481-L1489 VanDerWaalsContact CG2-CD2 3.44Å; T1481-L1489 HydrophobicContact CG2-CG 4.48Å; T1481-R1490 WeakPolarHBondContact O-CB 2.91Å
1482K73.9Confident78.5Confident38 Ų3828.5 Ų28.517%0.16514%0.141CC..G310 helixtrans-85.4-12.9176.3-46.7-177.7-178.7-156.20112.2W1424 I1477 P1479 V1480 D1524 E1528 Y1542W1424-K1482 PolarHBondContact NE1-O 2.8Å; I1477-K1482 VanDerWaalsContact O-CE 3.28Å; I1477-K1482 WeakPolarHBondContact O-CE 3.33Å; P1479-K1482 VanDerWaalsContact O-CB 3.3Å; P1479-K1482 WeakPolarHBondContact O-CB 3.39Å; P1479-K1482 PolarHBondContact O-N 3.18Å; P1479-K1482 VanDerWaalsContact O-N 3.17Å; V1480-K1482 PolarHBondContact O-N 3.2Å; K1482-D1524 IonicContact NZ-OD1 3.44Å; K1482-D1524 PolarHBondContact NZ-OD1 3.14Å; K1482-D1524 IonicContact NZ-OD2 3.19Å; K1482-D1524 PolarHBondContact NZ-OD2 3.16Å; K1482-E1528 VanDerWaalsContact CD-OE1 3.23Å; K1482-E1528 WeakPolarHBondContact CD-OE1 3.35Å; K1482-E1528 WeakPolarHBondContact CE-OE1 3.39Å; K1482-E1528 IonicContact NZ-OE1 3.06Å; K1482-E1528 PolarHBondContact NZ-OE1 3.25Å; K1482-Y1542 WeakPolarHBondContact O-CE2 3.24Å
1483C71.8Confident78.7Confident14.2 Ų14.228.5 Ų28.510%0.09614%0.141CC..SBendtrans-71.3146.5176.7-62.80000111.1S1425 I1427 V1480 T1481 N1485 L1486 C1487S1425-C1483 WeakPolarHBondContact O-CA 3.41Å; S1425-C1483 WeakPolarHBondContact O-CB 3.43Å; S1425-C1483 PolarHBondContact OG-SG 2.69Å; I1427-C1483 HydrophobicContact CD1-CB 3.9Å; I1427-C1483 HydrophobicContact CG1-CB 4.36Å; V1480-C1483 VanDerWaalsContact O-CB 3.28Å; V1480-C1483 WeakPolarHBondContact O-CB 3.35Å; V1480-C1483 PolarHBondContact O-N 2.88Å; V1480-C1483 VanDerWaalsContact O-N 3.14Å; V1480-C1483 PolarHBondContact O-SG 2.96Å; T1481-C1483 VanDerWaalsContact C-N 3.34Å; C1483-N1485 VanDerWaalsContact C-N 3.29Å; C1483-N1485 PolarHBondContact O-N 3.05Å; C1483-N1485 VanDerWaalsContact O-N 3.12Å; C1483-L1486 CarbonylContact O-C 3.54Å; C1483-L1486 PolarHBondContact O-N 2.97Å; C1483-C1487 PolarHBondContact O-N 3.27Å; C1483-C1487 VanDerWaalsContact O-N 3.09Å
1484H65.9Low78.7Confident84 Ų8428.3 Ų28.339%0.38914%0.14SC..G310 helixtrans-50.7-42.4-176.2-177.3-81.3000113.6W1424 S1425 L1486 C1487W1424-H1484 HydrophobicContact CD2-CB 4.12Å; W1424-H1484 AromaticContact CE2-ND1 3.81Å; W1424-H1484 HydrophobicContact CE3-CB 4Å; W1424-H1484 AromaticContact CE3-CD2 3.32Å; W1424-H1484 AromaticContact CE3-CG 3.98Å; W1424-H1484 HydrophobicContact CG-CB 4.19Å; W1424-H1484 AromaticContact CH2-CE1 3.84Å; W1424-H1484 AromaticContact CH2-ND1 3.37Å; W1424-H1484 WeakPolarHBondContact CH2-ND1 3.34Å; W1424-H1484 HydrophobicContact CZ2-CB 4.26Å; W1424-H1484 AromaticContact CZ2-CE1 3.97Å; W1424-H1484 AromaticContact CZ2-CG 3.99Å; W1424-H1484 AromaticContact CZ2-ND1 3.14Å; W1424-H1484 WeakPolarHBondContact CZ2-ND1 3.28Å; W1424-H1484 HydrophobicContact CZ3-CB 4.14Å; W1424-H1484 AromaticContact CZ3-CD2 3.46Å; W1424-H1484 VanDerWaalsContact CZ3-CD2 3.49Å; W1424-H1484 WeakPolarHBondContact CZ3-CD2 3.35Å; S1425-H1484 PolarHBondContact O-N 3.02Å; H1484-L1486 VanDerWaalsContact C-N 3.27Å; H1484-L1486 PolarHBondContact O-N 3.13Å; H1484-L1486 VanDerWaalsContact O-N 3.16Å; H1484-C1487 PolarHBondContact O-SG 3.14Å
1485N68.6Low78.8Confident38.6 Ų38.626.6 Ų26.621%0.20613%0.134CC..G310 helixtrans-72.5-13.4-176.8-65.2-3.4000114.3S1421 V1426 I1427 C1483 Y1488S1421-N1485 PolarHBondContact O-ND2 3Å; S1421-N1485 PolarHBondContact O-OD1 3.4Å; V1426-N1485 WeakPolarHBondContact CG1-ND2 3.46Å; I1427-N1485 HydrophobicContact CD1-CB 3.98Å; I1427-N1485 HydrophobicContact CG1-CB 4.48Å; I1427-N1485 PolarHBondContact O-ND2 3.34Å; C1483-N1485 VanDerWaalsContact C-N 3.29Å; C1483-N1485 PolarHBondContact O-N 3.05Å; C1483-N1485 VanDerWaalsContact O-N 3.12Å; N1485-Y1488 WeakPolarHBondContact O-CE1 3.42Å; N1485-Y1488 VanDerWaalsContact O-CZ 3.24Å; N1485-Y1488 PolarHBondContact O-OH 3.37Å
1486L73.6Confident78.8Confident6.2 Ų6.226.6 Ų26.63%0.03213%0.133CC..G310 helixtrans-126.910.1-175.1-67.8172.8000112.4L1409 L1412 I1427 F1429 L1438 V1480 T1481 C1483 H1484 Y1488 L1489 R1490L1409-L1486 HydrophobicContact CD2-CD1 4.41Å; L1412-L1486 HydrophobicContact CD1-CD1 4.17Å; I1427-L1486 HydrophobicContact CD1-CD1 4.03Å; I1427-L1486 HydrophobicContact CD1-CD2 4.04Å; I1427-L1486 HydrophobicContact CD1-CG 4.19Å; F1429-L1486 HydrophobicContact CZ-CD1 4.38Å; F1429-L1486 HydrophobicContact CZ-CD2 4.28Å; F1429-L1486 HydrophobicContact CZ-CG 4.46Å; L1438-L1486 HydrophobicContact CD1-CD2 4.24Å; L1438-L1486 HydrophobicContact CD2-CD2 4.34Å; V1480-L1486 HydrophobicContact CG1-CD1 3.41Å; V1480-L1486 VanDerWaalsContact CG1-CD1 3.43Å; T1481-L1486 CarbonylContact O-C 3.52Å; C1483-L1486 CarbonylContact O-C 3.54Å; C1483-L1486 PolarHBondContact O-N 2.97Å; H1484-L1486 VanDerWaalsContact C-N 3.27Å; H1484-L1486 PolarHBondContact O-N 3.13Å; H1484-L1486 VanDerWaalsContact O-N 3.16Å; L1486-Y1488 HydrophobicContact CD2-CE2 4.2Å; L1486-Y1488 PolarHBondContact O-N 3.2Å; L1486-L1489 HydrophobicContact CD2-CD1 4.43Å; L1486-L1489 VanDerWaalsContact O-CB 3.24Å; L1486-L1489 WeakPolarHBondContact O-CB 3.38Å; L1486-L1489 PolarHBondContact O-N 3.06Å; L1486-L1489 VanDerWaalsContact O-N 3.09Å; L1486-R1490 PolarHBondContact O-N 3.33Å
1487C76.5Confident78.8Confident25 Ų2526.6 Ų26.617%0.16913%0.133CC..Hα-helixtrans-62.5-32.5176.765.30000112W1424 T1481 C1483 H1484 L1489 R1490 N1491 F1545W1424-C1487 HydrophobicContact CZ2-CB 4.14Å; T1481-C1487 WeakPolarHBondContact O-CA 3.41Å; C1483-C1487 PolarHBondContact O-N 3.27Å; C1483-C1487 VanDerWaalsContact O-N 3.09Å; H1484-C1487 PolarHBondContact O-SG 3.14Å; C1487-L1489 VanDerWaalsContact C-N 3.28Å; C1487-L1489 PolarHBondContact O-N 3.21Å; C1487-R1490 WeakPolarHBondContact O-CA 3.3Å; C1487-R1490 VanDerWaalsContact O-CB 3.3Å; C1487-R1490 WeakPolarHBondContact O-CB 3.31Å; C1487-R1490 PolarHBondContact O-N 3.27Å; C1487-R1490 VanDerWaalsContact O-N 3.13Å; C1487-N1491 PolarHBondContact O-N 2.98Å; C1487-F1545 HydrophobicContact CB-CD1 4.34Å; C1487-F1545 HydrophobicContact CB-CD2 3.98Å; C1487-F1545 HydrophobicContact CB-CE1 4.11Å; C1487-F1545 HydrophobicContact CB-CE2 3.7Å; C1487-F1545 HydrophobicContact CB-CG 4.32Å; C1487-F1545 HydrophobicContact CB-CZ 3.8Å; C1487-F1545 VanDerWaalsContact O-CE2 3.31Å; C1487-F1545 WeakPolarHBondContact O-CE2 3.35Å; C1487-F1545 VanDerWaalsContact O-CZ 3.23Å; C1487-F1545 WeakPolarHBondContact O-CZ 3.39Å
1488Y75.5Confident78.8Confident106.8 Ų106.824.5 Ų24.542%0.41912%0.123SC..Hα-helixtrans-59.5-34.6173.7-162.3-95.9000112.5L1442 N1485 L1486 R1490 N1491 V1492L1442-Y1488 HydrophobicContact CD1-CD1 3.81Å; L1442-Y1488 HydrophobicContact CD1-CD2 3.2Å; L1442-Y1488 HydrophobicContact CD1-CE1 4.39Å; L1442-Y1488 HydrophobicContact CD1-CE2 3.27Å; L1442-Y1488 HydrophobicContact CD1-CG 4.24Å; L1442-Y1488 HydrophobicContact CD2-CD1 3.86Å; L1442-Y1488 HydrophobicContact CD2-CE1 3.87Å; L1442-Y1488 HydrophobicContact CG-CD1 4.34Å; L1442-Y1488 HydrophobicContact CG-CD2 3.92Å; L1442-Y1488 HydrophobicContact CG-CE2 4.21Å; N1485-Y1488 WeakPolarHBondContact O-CE1 3.42Å; N1485-Y1488 VanDerWaalsContact O-CZ 3.24Å; N1485-Y1488 PolarHBondContact O-OH 3.37Å; L1486-Y1488 HydrophobicContact CD2-CE2 4.2Å; L1486-Y1488 PolarHBondContact O-N 3.2Å; Y1488-R1490 VanDerWaalsContact C-N 3.34Å; Y1488-N1491 WeakPolarHBondContact O-CB 3.34Å; Y1488-N1491 PolarHBondContact O-N 3.13Å; Y1488-V1492 HydrophobicContact CD1-CG2 4.15Å; Y1488-V1492 HydrophobicContact CE1-CG2 3.78Å; Y1488-V1492 HydrophobicContact CE2-CG2 4.33Å; Y1488-V1492 WeakPolarHBondContact O-CG2 3.43Å; Y1488-V1492 PolarHBondContact O-N 3.1Å
1489L80.6Confident78.7Confident1 Ų124.3 Ų24.31%0.00512%0.123CC..Hα-helixtrans-64.7-42.1174.9-178.299.3000110.9L1409 L1438 L1442 T1481 L1486 C1487 N1491 V1492 Y1493L1409-L1489 HydrophobicContact CD2-CD2 4.19Å; L1438-L1489 HydrophobicContact CD1-CD1 3.97Å; L1438-L1489 HydrophobicContact CD1-CD2 4.11Å; L1438-L1489 HydrophobicContact CD2-CD1 4.02Å; L1438-L1489 HydrophobicContact CD2-CD2 4.14Å; L1442-L1489 HydrophobicContact CB-CD1 4.12Å; L1442-L1489 HydrophobicContact CD1-CB 4.03Å; L1442-L1489 HydrophobicContact CD1-CD1 4.14Å; L1442-L1489 HydrophobicContact CD1-CG 4.35Å; L1442-L1489 VanDerWaalsContact CD2-CA 3.46Å; L1442-L1489 HydrophobicContact CD2-CB 3.71Å; L1442-L1489 VanDerWaalsContact CD2-CB 3.49Å; L1442-L1489 HydrophobicContact CD2-CD1 3.43Å; L1442-L1489 VanDerWaalsContact CD2-CD1 3.45Å; L1442-L1489 HydrophobicContact CD2-CG 3.93Å; L1442-L1489 HydrophobicContact CG-CB 4.34Å; L1442-L1489 HydrophobicContact CG-CD1 3.83Å; L1442-L1489 VanDerWaalsContact CG-CD1 3.46Å; L1442-L1489 HydrophobicContact CG-CG 4.39Å; T1481-L1489 HydrophobicContact CG2-CD2 3.72Å; T1481-L1489 VanDerWaalsContact CG2-CD2 3.44Å; T1481-L1489 HydrophobicContact CG2-CG 4.48Å; L1486-L1489 HydrophobicContact CD2-CD1 4.43Å; L1486-L1489 VanDerWaalsContact O-CB 3.24Å; L1486-L1489 WeakPolarHBondContact O-CB 3.38Å; L1486-L1489 PolarHBondContact O-N 3.06Å; L1486-L1489 VanDerWaalsContact O-N 3.09Å; C1487-L1489 VanDerWaalsContact C-N 3.28Å; C1487-L1489 PolarHBondContact O-N 3.21Å; L1489-N1491 VanDerWaalsContact C-N 3.34Å; L1489-N1491 PolarHBondContact O-N 3.07Å; L1489-V1492 PolarHBondContact O-N 3.09Å; L1489-Y1493 HydrophobicContact CD1-CD2 4.09Å; L1489-Y1493 HydrophobicContact CD1-CE1 4.47Å; L1489-Y1493 HydrophobicContact CD1-CE2 3.72Å; L1489-Y1493 WeakPolarHBondContact CD1-OH 3.25Å; L1489-Y1493 HydrophobicContact CD2-CD2 3.79Å; L1489-Y1493 HydrophobicContact CD2-CE2 3.77Å; L1489-Y1493 HydrophobicContact CG-CD2 3.98Å; L1489-Y1493 HydrophobicContact CG-CE2 3.41Å; L1489-Y1493 VanDerWaalsContact CG-CE2 3.43Å; L1489-Y1493 WeakPolarHBondContact O-CD2 3.38Å; L1489-Y1493 PolarHBondContact O-N 3.18Å; L1489-Y1493 VanDerWaalsContact O-N 3.13Å
1490R84.9Confident78.9Confident0 Ų021.5 Ų21.50%010%0.103CC..Hα-helixtrans-63.1-40.6173.5-168.7175.2-180-167.63.1111.9I1476 T1481 L1486 C1487 Y1488 Y1493 M1494 D1524 E1528 Y1542 F1545 I1550I1476-R1490 HydrophobicContact CG2-CG 4.33Å; T1481-R1490 WeakPolarHBondContact O-CB 2.91Å; L1486-R1490 PolarHBondContact O-N 3.33Å; C1487-R1490 WeakPolarHBondContact O-CA 3.3Å; C1487-R1490 VanDerWaalsContact O-CB 3.3Å; C1487-R1490 WeakPolarHBondContact O-CB 3.31Å; C1487-R1490 PolarHBondContact O-N 3.27Å; C1487-R1490 VanDerWaalsContact O-N 3.13Å; Y1488-R1490 VanDerWaalsContact C-N 3.34Å; R1490-Y1493 PolarHBondContact O-N 3.14Å; R1490-M1494 HydrophobicContact CG-CG 4.38Å; R1490-M1494 WeakPolarHBondContact O-CB 3.31Å; R1490-M1494 VanDerWaalsContact O-CG 3.26Å; R1490-M1494 WeakPolarHBondContact O-CG 3.21Å; R1490-M1494 PolarHBondContact O-N 3Å; R1490-D1524 IonicContact NH2-OD2 3.23Å; R1490-E1528 IonicContact CZ-OE1 3.13Å; R1490-E1528 VanDerWaalsContact CZ-OE1 3.29Å; R1490-E1528 IonicContact CZ-OE2 3.45Å; R1490-E1528 VanDerWaalsContact NH1-CD 3.35Å; R1490-E1528 IonicContact NH1-OE1 3.49Å; R1490-E1528 PolarHBondContact NH1-OE1 3.16Å; R1490-E1528 VanDerWaalsContact NH1-OE1 3.07Å; R1490-E1528 IonicContact NH1-OE2 3.03Å; R1490-E1528 PolarHBondContact NH1-OE2 3.2Å; R1490-E1528 VanDerWaalsContact NH2-CD 3.3Å; R1490-E1528 IonicContact NH2-OE1 3.77Å; R1490-E1528 PolarHBondContact NH2-OE1 3.24Å; R1490-E1528 VanDerWaalsContact NH2-OE1 3.14Å; R1490-E1528 IonicContact NH2-OE2 3.49Å; R1490-E1528 PolarHBondContact NH2-OE2 3.11Å; R1490-Y1542 PolarHBondContact NH1-OH 3.16Å; R1490-Y1542 VanDerWaalsContact NH1-OH 3.1Å; R1490-F1545 HydrophobicContact CB-CZ 4.19Å; R1490-F1545 HydrophobicContact CG-CZ 4.43Å; R1490-I1550 VanDerWaalsContact CZ-CD1 3.45Å
1491N83.7Confident78.9Confident45.8 Ų45.821.5 Ų21.525%0.24510%0.104CC..Hα-helixtrans-59.5-53.3176.7-175.321.6000111.7C1487 Y1488 L1489 Y1493 M1494 E1495 F1545 S1549C1487-N1491 PolarHBondContact O-N 2.98Å; Y1488-N1491 WeakPolarHBondContact O-CB 3.34Å; Y1488-N1491 PolarHBondContact O-N 3.13Å; L1489-N1491 VanDerWaalsContact C-N 3.34Å; L1489-N1491 PolarHBondContact O-N 3.07Å; N1491-Y1493 VanDerWaalsContact C-N 3.28Å; N1491-Y1493 PolarHBondContact O-N 3.14Å; N1491-M1494 PolarHBondContact O-N 3.18Å; N1491-M1494 VanDerWaalsContact O-N 3.09Å; N1491-E1495 WeakPolarHBondContact O-CB 3.39Å; N1491-E1495 PolarHBondContact O-N 3.29Å; N1491-F1545 HydrophobicContact CB-CE2 4.04Å; N1491-F1545 HydrophobicContact CB-CZ 4.35Å; N1491-S1549 VanDerWaalsContact OD1-CB 3.27Å; N1491-S1549 WeakPolarHBondContact OD1-CB 3.31Å
1492V82.2Confident78.8Confident5.2 Ų5.223 Ų233%0.03211%0.114CC..Hα-helixtrans-58.7-39.8-178.8172.40000111.6L1442 F1445 H1446 N1449 Y1488 L1489 N1496L1442-V1492 HydrophobicContact CD2-CB 4.23Å; L1442-V1492 HydrophobicContact CD2-CG1 4.15Å; L1442-V1492 HydrophobicContact CD2-CG2 4.04Å; L1442-V1492 HydrophobicContact CG-CG2 4.42Å; F1445-V1492 HydrophobicContact CB-CG1 3.61Å; F1445-V1492 VanDerWaalsContact CB-CG1 3.46Å; H1446-V1492 HydrophobicContact CB-CG1 4.26Å; H1446-V1492 HydrophobicContact CB-CG2 4.5Å; N1449-V1492 PolarHBondContact ND2-O 3.17Å; Y1488-V1492 HydrophobicContact CD1-CG2 4.15Å; Y1488-V1492 HydrophobicContact CE1-CG2 3.78Å; Y1488-V1492 HydrophobicContact CE2-CG2 4.33Å; Y1488-V1492 WeakPolarHBondContact O-CG2 3.43Å; Y1488-V1492 PolarHBondContact O-N 3.1Å; L1489-V1492 PolarHBondContact O-N 3.09Å; V1492-N1496 VanDerWaalsContact O-CB 3.3Å; V1492-N1496 WeakPolarHBondContact O-CB 3.33Å; V1492-N1496 PolarHBondContact O-N 2.95Å
1493Y86.2Confident78.8Confident0.2 Ų0.221.6 Ų21.60%0.00111%0.109CC..Hα-helixtrans-72.5-34.7175.9-67.1-47.4000113.9F1402 V1405 N1441 F1445 L1472 V1475 L1489 R1490 N1491 N1496 L1497F1402-Y1493 HydrophobicContact CE1-CD1 4.31Å; F1402-Y1493 AromaticContact CE1-CE1 3.94Å; F1402-Y1493 HydrophobicContact CE1-CE1 4.04Å; V1405-Y1493 WeakPolarHBondContact CG1-OH 3.28Å; N1441-Y1493 PolarHBondContact OD1-OH 3.2Å; F1445-Y1493 HydrophobicContact CB-CD1 4.5Å; F1445-Y1493 HydrophobicContact CB-CE1 4.36Å; F1445-Y1493 AromaticContact CD1-CD1 3.95Å; F1445-Y1493 HydrophobicContact CD1-CD1 4.08Å; F1445-Y1493 HydrophobicContact CD1-CE1 4.17Å; F1445-Y1493 HydrophobicContact CD2-CD1 4.41Å; F1445-Y1493 AromaticContact CD2-CE1 3.62Å; F1445-Y1493 HydrophobicContact CD2-CE1 3.62Å; F1445-Y1493 VanDerWaalsContact CD2-CE1 3.44Å; F1445-Y1493 HydrophobicContact CE1-CD1 4.38Å; F1445-Y1493 HydrophobicContact CE1-CE1 4.35Å; F1445-Y1493 AromaticContact CE2-CE1 3.84Å; F1445-Y1493 HydrophobicContact CE2-CE1 3.88Å; F1445-Y1493 HydrophobicContact CG-CD1 4.13Å; F1445-Y1493 AromaticContact CG-CE1 3.78Å; F1445-Y1493 HydrophobicContact CG-CE1 3.78Å; F1445-Y1493 HydrophobicContact CZ-CE1 4.25Å; L1472-Y1493 HydrophobicContact CD1-CD1 3.84Å; L1472-Y1493 HydrophobicContact CD1-CE1 4.4Å; L1472-Y1493 HydrophobicContact CD1-CG 3.93Å; V1475-Y1493 HydrophobicContact CG1-CD2 3.93Å; V1475-Y1493 HydrophobicContact CG1-CE2 3.51Å; V1475-Y1493 VanDerWaalsContact CG1-CE2 3.43Å; L1489-Y1493 HydrophobicContact CD1-CD2 4.09Å; L1489-Y1493 HydrophobicContact CD1-CE1 4.47Å; L1489-Y1493 HydrophobicContact CD1-CE2 3.72Å; L1489-Y1493 WeakPolarHBondContact CD1-OH 3.25Å; L1489-Y1493 HydrophobicContact CD2-CD2 3.79Å; L1489-Y1493 HydrophobicContact CD2-CE2 3.77Å; L1489-Y1493 HydrophobicContact CG-CD2 3.98Å; L1489-Y1493 HydrophobicContact CG-CE2 3.41Å; L1489-Y1493 VanDerWaalsContact CG-CE2 3.43Å; L1489-Y1493 WeakPolarHBondContact O-CD2 3.38Å; L1489-Y1493 PolarHBondContact O-N 3.18Å; L1489-Y1493 VanDerWaalsContact O-N 3.13Å; R1490-Y1493 PolarHBondContact O-N 3.14Å; N1491-Y1493 VanDerWaalsContact C-N 3.28Å; N1491-Y1493 PolarHBondContact O-N 3.14Å; Y1493-N1496 WeakPolarHBondContact O-CB 3.28Å; Y1493-N1496 PolarHBondContact O-N 3.17Å; Y1493-L1497 WeakPolarHBondContact O-CB 3.35Å; Y1493-L1497 PolarHBondContact O-N 3.05Å
1494M84.8Confident78.6Confident0 Ų023.8 Ų23.80%012%0.122CC..Hα-helixtrans-66.8-42.6174.6-78.9-64.3-59.200111.5I1476 R1490 N1491 N1496 L1497 A1498 L1521 I1550 C1553 V1554I1476-M1494 HydrophobicContact CD1-CG 4.49Å; I1476-M1494 HydrophobicContact CD1-SD 4.05Å; I1476-M1494 HydrophobicContact CG2-CG 4.25Å; I1476-M1494 HydrophobicContact CG2-SD 3.71Å; R1490-M1494 HydrophobicContact CG-CG 4.38Å; R1490-M1494 WeakPolarHBondContact O-CB 3.31Å; R1490-M1494 VanDerWaalsContact O-CG 3.26Å; R1490-M1494 WeakPolarHBondContact O-CG 3.21Å; R1490-M1494 PolarHBondContact O-N 3Å; N1491-M1494 PolarHBondContact O-N 3.18Å; N1491-M1494 VanDerWaalsContact O-N 3.09Å; M1494-N1496 VanDerWaalsContact C-N 3.32Å; M1494-N1496 PolarHBondContact O-N 3.03Å; M1494-L1497 WeakPolarHBondContact O-CB 3.42Å; M1494-L1497 PolarHBondContact O-N 3.34Å; M1494-A1498 WeakPolarHBondContact O-CB 3.29Å; M1494-A1498 PolarHBondContact O-N 3.03Å; M1494-L1521 HydrophobicContact CE-CD2 4.36Å; M1494-L1521 HydrophobicContact SD-CD1 4.38Å; M1494-L1521 HydrophobicContact SD-CD2 4.31Å; M1494-I1550 HydrophobicContact CE-CG2 4.29Å; M1494-I1550 HydrophobicContact CG-CG1 4.43Å; M1494-C1553 HydrophobicContact CB-CB 4.25Å; M1494-C1553 HydrophobicContact CE-CB 3.84Å; M1494-V1554 HydrophobicContact CE-CG2 4.27Å
1495E84.5Confident78.6Confident65.6 Ų65.621.1 Ų21.131%0.30711%0.11SC..Hα-helixtrans-63.5-40.1174.3-175.8-173.8-158.200111N1449 N1491 L1497 A1498 N1499N1449-E1495 HydrophobicContact CB-CG 4.34Å; N1449-E1495 WeakPolarHBondContact ND2-CB 3.42Å; N1449-E1495 PolarHBondContact ND2-OE2 3.18Å; N1491-E1495 WeakPolarHBondContact O-CB 3.39Å; N1491-E1495 PolarHBondContact O-N 3.29Å; E1495-L1497 VanDerWaalsContact C-N 3.33Å; E1495-L1497 PolarHBondContact O-N 3.2Å; E1495-A1498 PolarHBondContact O-N 3.07Å; E1495-N1499 WeakPolarHBondContact O-CB 3.38Å; E1495-N1499 VanDerWaalsContact O-CG 3.32Å; E1495-N1499 PolarHBondContact O-N 3.24Å
1496N84.7Confident78.6Confident0 Ų019.2 Ų19.20%010%0.101CC..Hα-helixtrans-60.1-45.1173.9-167.4-94.3000111.9F1445 N1449 L1452 Y1463 L1472 V1492 Y1493 M1494 A1498 N1499 F1500F1445-N1496 HydrophobicContact CD1-CB 4.27Å; F1445-N1496 WeakPolarHBondContact CD1-ND2 3.38Å; N1449-N1496 PolarHBondContact ND2-N 2.87Å; N1449-N1496 WeakPolarHBondContact OD1-CA 3.3Å; N1449-N1496 WeakPolarHBondContact OD1-CB 3.44Å; N1449-N1496 VanDerWaalsContact OD1-CG 3.25Å; N1449-N1496 PolarHBondContact OD1-N 3.23Å; N1449-N1496 PolarHBondContact OD1-ND2 3.19Å; L1452-N1496 VanDerWaalsContact CD1-ND2 3.35Å; L1452-N1496 WeakPolarHBondContact CD1-ND2 3.26Å; Y1463-N1496 WeakPolarHBondContact CE2-OD1 3.22Å; Y1463-N1496 VanDerWaalsContact CZ-OD1 3.27Å; Y1463-N1496 VanDerWaalsContact OH-CG 3.32Å; Y1463-N1496 PolarHBondContact OH-ND2 2.98Å; Y1463-N1496 PolarHBondContact OH-OD1 3.19Å; L1472-N1496 HydrophobicContact CD1-CB 4.46Å; L1472-N1496 WeakPolarHBondContact CD1-OD1 3.36Å; V1492-N1496 VanDerWaalsContact O-CB 3.3Å; V1492-N1496 WeakPolarHBondContact O-CB 3.33Å; V1492-N1496 PolarHBondContact O-N 2.95Å; Y1493-N1496 WeakPolarHBondContact O-CB 3.28Å; Y1493-N1496 PolarHBondContact O-N 3.17Å; M1494-N1496 VanDerWaalsContact C-N 3.32Å; M1494-N1496 PolarHBondContact O-N 3.03Å; N1496-A1498 VanDerWaalsContact C-N 3.31Å; N1496-A1498 PolarHBondContact O-N 3.33Å; N1496-N1499 PolarHBondContact O-N 3.32Å; N1496-F1500 VanDerWaalsContact O-CB 3.29Å; N1496-F1500 WeakPolarHBondContact O-CB 3.23Å; N1496-F1500 PolarHBondContact O-N 3.2Å
1497L84.2Confident78.4Confident0.2 Ų0.222.2 Ų22.20%0.00111%0.113CC..Hα-helixtrans-62.7-44.5176.6-168.4153.4000110.9L1469 L1472 I1473 I1476 Y1493 M1494 E1495 N1499 F1500 C1501 L1518 L1521 I1557L1469-L1497 HydrophobicContact CD1-CD1 4.11Å; L1469-L1497 HydrophobicContact CD1-CG 4.22Å; L1472-L1497 HydrophobicContact CD2-CB 3.99Å; L1472-L1497 HydrophobicContact CD2-CD1 4.02Å; L1472-L1497 HydrophobicContact CD2-CG 4.29Å; I1473-L1497 HydrophobicContact CD1-CD1 4.03Å; I1473-L1497 HydrophobicContact CG1-CD1 3.67Å; I1476-L1497 HydrophobicContact CD1-CB 4.42Å; I1476-L1497 HydrophobicContact CD1-CD1 3.87Å; Y1493-L1497 WeakPolarHBondContact O-CB 3.35Å; Y1493-L1497 PolarHBondContact O-N 3.05Å; M1494-L1497 WeakPolarHBondContact O-CB 3.42Å; M1494-L1497 PolarHBondContact O-N 3.34Å; E1495-L1497 VanDerWaalsContact C-N 3.33Å; E1495-L1497 PolarHBondContact O-N 3.2Å; L1497-N1499 PolarHBondContact O-N 3.41Å; L1497-F1500 PolarHBondContact O-N 3.21Å; L1497-C1501 WeakPolarHBondContact O-CB 3.41Å; L1497-C1501 PolarHBondContact O-N 3.19Å; L1497-C1501 PolarHBondContact O-SG 3.23Å; L1497-L1518 HydrophobicContact CD1-CD2 4.42Å; L1497-L1518 HydrophobicContact CD2-CD2 4.09Å; L1497-L1521 HydrophobicContact CD1-CD2 4.02Å; L1497-L1521 HydrophobicContact CD2-CD2 4.49Å; L1497-I1557 HydrophobicContact CD2-CD1 3.2Å; L1497-I1557 HydrophobicContact CD2-CG1 3.88Å
1498A82.7Confident78Confident1.6 Ų1.626.9 Ų26.91%0.01314%0.137CC..Hα-helixtrans-64.1-42.2179.100000112.5M1494 E1495 N1496 C1501 S1502 C1553 K1556 I1557M1494-A1498 WeakPolarHBondContact O-CB 3.29Å; M1494-A1498 PolarHBondContact O-N 3.03Å; E1495-A1498 PolarHBondContact O-N 3.07Å; N1496-A1498 VanDerWaalsContact C-N 3.31Å; N1496-A1498 PolarHBondContact O-N 3.33Å; A1498-C1501 PolarHBondContact O-N 3.35Å; A1498-S1502 PolarHBondContact O-N 2.96Å; A1498-S1502 VanDerWaalsContact O-N 3.13Å; A1498-S1502 PolarHBondContact O-OG 3.13Å; A1498-C1553 HydrophobicContact CB-CB 4.08Å; A1498-K1556 HydrophobicContact CB-CB 4.48Å; A1498-K1556 HydrophobicContact CB-CD 4.2Å; A1498-K1556 HydrophobicContact CB-CG 4.48Å; A1498-I1557 HydrophobicContact CB-CD1 4.41Å; A1498-I1557 HydrophobicContact CB-CG1 4.13Å
1499N80.1Confident77.6Confident11.4 Ų11.423.9 Ų23.96%0.06113%0.128CC..Hα-helixtrans-68-37.9176.2-69.9-12000111.7N1449 L1452 E1495 N1496 L1497 C1501 S1502 K1556N1449-N1499 PolarHBondContact O-ND2 3.04Å; N1449-N1499 VanDerWaalsContact O-ND2 3.16Å; L1452-N1499 HydrophobicContact CB-CB 4.24Å; E1495-N1499 WeakPolarHBondContact O-CB 3.38Å; E1495-N1499 VanDerWaalsContact O-CG 3.32Å; E1495-N1499 PolarHBondContact O-N 3.24Å; N1496-N1499 PolarHBondContact O-N 3.32Å; L1497-N1499 PolarHBondContact O-N 3.41Å; N1499-C1501 PolarHBondContact O-N 3.11Å; N1499-S1502 WeakPolarHBondContact CA-OG 3.33Å; N1499-S1502 WeakPolarHBondContact O-CB 3.35Å; N1499-S1502 PolarHBondContact O-N 3.16Å; N1499-S1502 VanDerWaalsContact O-N 3.17Å; N1499-S1502 PolarHBondContact O-OG 3.09Å; N1499-K1556 PolarHBondContact OD1-NZ 3.15Å
1500F79Confident77.1Confident7.2 Ų7.224 Ų243%0.03213%0.128CC..Hα-helixtrans-63.5-42172.7-179.4-100.1000112.1V1460 Y1463 R1464 L1469 N1496 L1497 S1502 S1503 Y1514V1460-F1500 HydrophobicContact CG1-CD2 4.39Å; V1460-F1500 HydrophobicContact CG1-CE2 4.25Å; Y1463-F1500 AromaticContact CD1-CD2 3.59Å; Y1463-F1500 HydrophobicContact CD1-CD2 3.59Å; Y1463-F1500 VanDerWaalsContact CD1-CD2 3.48Å; Y1463-F1500 AromaticContact CD1-CE2 3.72Å; Y1463-F1500 HydrophobicContact CD1-CE2 3.72Å; Y1463-F1500 HydrophobicContact CD1-CG 4.39Å; Y1463-F1500 HydrophobicContact CD1-CZ 4.45Å; Y1463-F1500 HydrophobicContact CE1-CB 4.47Å; Y1463-F1500 AromaticContact CE1-CD2 3.68Å; Y1463-F1500 HydrophobicContact CE1-CD2 3.68Å; Y1463-F1500 AromaticContact CE1-CE2 3.89Å; Y1463-F1500 HydrophobicContact CE1-CE2 4.02Å; Y1463-F1500 HydrophobicContact CE1-CG 4.13Å; Y1463-F1500 HydrophobicContact CG-CD2 4.44Å; R1464-F1500 HydrophobicContact CG-CE2 3.9Å; R1464-F1500 HydrophobicContact CG-CZ 3.95Å; L1469-F1500 HydrophobicContact CD1-CD1 4.13Å; L1469-F1500 HydrophobicContact CD1-CE1 4.24Å; N1496-F1500 VanDerWaalsContact O-CB 3.29Å; N1496-F1500 WeakPolarHBondContact O-CB 3.23Å; N1496-F1500 PolarHBondContact O-N 3.2Å; L1497-F1500 PolarHBondContact O-N 3.21Å; F1500-S1502 VanDerWaalsContact C-N 3.3Å; F1500-S1502 PolarHBondContact O-N 3.21Å; F1500-S1503 WeakPolarHBondContact O-CB 3.35Å; F1500-S1503 PolarHBondContact O-N 2.96Å; F1500-S1503 VanDerWaalsContact O-N 3.16Å; F1500-S1503 PolarHBondContact O-OG 3.14Å; F1500-Y1514 AromaticContact CE1-CE1 3.96Å; F1500-Y1514 HydrophobicContact CE1-CE1 4.03Å; F1500-Y1514 HydrophobicContact CE1-CE2 4.33Å; F1500-Y1514 AromaticContact CE1-CZ 3.87Å; F1500-Y1514 HydrophobicContact CZ-CE1 4.36Å; F1500-Y1514 AromaticContact CZ-CZ 3.9Å; F1500-Y1514 WeakPolarHBondContact CZ-OH 3.36Å
1501C76.9Confident76Confident0.4 Ų0.426.7 Ų26.70%0.00315%0.145CC..Hα-helixtrans-67.2-20.5177.2-72.80000113.9L1497 A1498 N1499 S1503 F1506 I1557 N1560L1497-C1501 WeakPolarHBondContact O-CB 3.41Å; L1497-C1501 PolarHBondContact O-N 3.19Å; L1497-C1501 PolarHBondContact O-SG 3.23Å; A1498-C1501 PolarHBondContact O-N 3.35Å; N1499-C1501 PolarHBondContact O-N 3.11Å; C1501-S1503 VanDerWaalsContact C-N 3.27Å; C1501-S1503 PolarHBondContact O-N 3.15Å; C1501-F1506 HydrophobicContact CB-CD1 4.31Å; C1501-F1506 HydrophobicContact CB-CD2 4.17Å; C1501-F1506 HydrophobicContact CB-CE1 4.3Å; C1501-F1506 HydrophobicContact CB-CE2 4.16Å; C1501-F1506 HydrophobicContact CB-CG 4.23Å; C1501-F1506 HydrophobicContact CB-CZ 4.2Å; C1501-F1506 WeakPolarHBondContact O-CB 3.37Å; C1501-F1506 WeakPolarHBondContact O-CD1 3.39Å; C1501-F1506 VanDerWaalsContact O-CG 3.31Å; C1501-F1506 WeakPolarHBondContact O-CG 3.32Å; C1501-F1506 WeakPolarHBondContact SG-CE2 3.29Å; C1501-I1557 HydrophobicContact CB-CG1 4.08Å; C1501-I1557 HydrophobicContact CB-CG2 4.28Å; C1501-N1560 WeakPolarHBondContact O-CB 3.36Å; C1501-N1560 PolarHBondContact O-ND2 2.89Å
1502S74.5Confident75Confident30.6 Ų30.631.3 Ų31.321%0.21417%0.168CC..THydrogen-bonded Turntrans-75.6-13.2174.4-22.90000113.8A1498 N1499 F1500 K1556 N1560A1498-S1502 PolarHBondContact O-N 2.96Å; A1498-S1502 VanDerWaalsContact O-N 3.13Å; A1498-S1502 PolarHBondContact O-OG 3.13Å; N1499-S1502 WeakPolarHBondContact CA-OG 3.33Å; N1499-S1502 WeakPolarHBondContact O-CB 3.35Å; N1499-S1502 PolarHBondContact O-N 3.16Å; N1499-S1502 VanDerWaalsContact O-N 3.17Å; N1499-S1502 PolarHBondContact O-OG 3.09Å; F1500-S1502 VanDerWaalsContact C-N 3.3Å; F1500-S1502 PolarHBondContact O-N 3.21Å; S1502-K1556 VanDerWaalsContact OG-CE 3.29Å; S1502-K1556 WeakPolarHBondContact OG-CE 3.31Å; S1502-N1560 VanDerWaalsContact CA-ND2 3.27Å; S1502-N1560 WeakPolarHBondContact CA-ND2 3.34Å; S1502-N1560 WeakPolarHBondContact CB-ND2 3.36Å; S1502-N1560 PolarHBondContact N-ND2 2.96Å; S1502-N1560 PolarHBondContact OG-ND2 3.23Å
1503S73Confident74.3Confident9.2 Ų9.236.2 Ų36.26%0.06419%0.19CC..SBendtrans-66.4144.8179.565.90000112.8F1500 C1501 D1505 F1506F1500-S1503 WeakPolarHBondContact O-CB 3.35Å; F1500-S1503 PolarHBondContact O-N 2.96Å; F1500-S1503 VanDerWaalsContact O-N 3.16Å; F1500-S1503 PolarHBondContact O-OG 3.14Å; C1501-S1503 VanDerWaalsContact C-N 3.27Å; C1501-S1503 PolarHBondContact O-N 3.15Å; S1503-D1505 PolarHBondContact O-N 3.2Å; S1503-D1505 VanDerWaalsContact O-N 3.1Å; S1503-F1506 VanDerWaalsContact O-CB 3.28Å; S1503-F1506 WeakPolarHBondContact O-CB 3.35Å; S1503-F1506 PolarHBondContact O-N 3.12Å; S1503-F1506 VanDerWaalsContact O-N 3.07Å; S1503-F1506 PolarHBondContact OG-N 3.29Å
1504T68Low73.8Confident60.4 Ų60.436.6 Ų36.637%0.37119%0.192SC..Hα-helixtrans-52.6-32.2171.354.40000112.1F1506 K1507 N1508T1504-F1506 VanDerWaalsContact C-N 3.35Å; T1504-F1506 PolarHBondContact O-N 3.06Å; T1504-K1507 WeakPolarHBondContact O-CB 3.47Å; T1504-K1507 PolarHBondContact O-N 3.1Å; T1504-N1508 PolarHBondContact O-N 3.05Å
1505D65.6Low73.4Confident26.8 Ų26.836.8 Ų36.814%0.14319%0.194CC..Hα-helixtrans-66.8-33.1178.4-102.9-18.4000113.7V1460 R1464 S1503 K1507 N1508 N1509V1460-D1505 HydrophobicContact CG1-CB 4Å; R1464-D1505 VanDerWaalsContact CZ-CB 3.46Å; R1464-D1505 IonicContact CZ-OD1 3.37Å; R1464-D1505 VanDerWaalsContact CZ-OD1 3.32Å; R1464-D1505 IonicContact CZ-OD2 3.22Å; R1464-D1505 IonicContact NE-OD2 3.26Å; R1464-D1505 PolarHBondContact NE-OD2 2.97Å; R1464-D1505 IonicContact NH1-OD1 3.29Å; R1464-D1505 PolarHBondContact NH1-OD1 2.95Å; R1464-D1505 IonicContact NH1-OD2 2.87Å; R1464-D1505 PolarHBondContact NH1-OD2 3.22Å; R1464-D1505 VanDerWaalsContact NH1-OD2 3.08Å; R1464-D1505 VanDerWaalsContact NH2-C 3.28Å; R1464-D1505 VanDerWaalsContact NH2-CB 3.29Å; R1464-D1505 PolarHBondContact NH2-O 3.22Å; R1464-D1505 VanDerWaalsContact NH2-O 3.1Å; R1464-D1505 IonicContact NH2-OD1 3.03Å; R1464-D1505 IonicContact NH2-OD2 2.72Å; S1503-D1505 PolarHBondContact O-N 3.2Å; S1503-D1505 VanDerWaalsContact O-N 3.1Å; D1505-K1507 VanDerWaalsContact C-N 3.28Å; D1505-K1507 PolarHBondContact O-N 3.07Å; D1505-N1508 PolarHBondContact O-N 3.27Å; D1505-N1509 PolarHBondContact O-N 3.09Å; D1505-N1509 PolarHBondContact O-ND2 3.2Å
1506F70.1Confident73.3Confident0 Ų039.4 Ų39.40%021%0.205CC..Hα-helixtrans-60-41174.3174.9-102.6000110.6C1501 S1503 T1504 N1508 N1509 F1510 Y1514 L1518 N1560 I1561 L1564C1501-F1506 HydrophobicContact CB-CD1 4.31Å; C1501-F1506 HydrophobicContact CB-CD2 4.17Å; C1501-F1506 HydrophobicContact CB-CE1 4.3Å; C1501-F1506 HydrophobicContact CB-CE2 4.16Å; C1501-F1506 HydrophobicContact CB-CG 4.23Å; C1501-F1506 HydrophobicContact CB-CZ 4.2Å; C1501-F1506 WeakPolarHBondContact O-CB 3.37Å; C1501-F1506 WeakPolarHBondContact O-CD1 3.39Å; C1501-F1506 VanDerWaalsContact O-CG 3.31Å; C1501-F1506 WeakPolarHBondContact O-CG 3.32Å; C1501-F1506 WeakPolarHBondContact SG-CE2 3.29Å; S1503-F1506 VanDerWaalsContact O-CB 3.28Å; S1503-F1506 WeakPolarHBondContact O-CB 3.35Å; S1503-F1506 PolarHBondContact O-N 3.12Å; S1503-F1506 VanDerWaalsContact O-N 3.07Å; S1503-F1506 PolarHBondContact OG-N 3.29Å; T1504-F1506 VanDerWaalsContact C-N 3.35Å; T1504-F1506 PolarHBondContact O-N 3.06Å; F1506-N1508 VanDerWaalsContact C-N 3.31Å; F1506-N1508 PolarHBondContact O-N 3.27Å; F1506-N1509 PolarHBondContact O-N 3.02Å; F1506-F1510 AromaticContact CE1-CD2 3.87Å; F1506-F1510 HydrophobicContact CE1-CD2 3.87Å; F1506-F1510 HydrophobicContact CE1-CE2 4.39Å; F1506-F1510 AromaticContact CE2-CD2 3.81Å; F1506-F1510 HydrophobicContact CE2-CD2 3.81Å; F1506-F1510 HydrophobicContact CE2-CE2 4.38Å; F1506-F1510 AromaticContact CZ-CD2 3.36Å; F1506-F1510 HydrophobicContact CZ-CD2 3.36Å; F1506-F1510 AromaticContact CZ-CE2 3.72Å; F1506-F1510 HydrophobicContact CZ-CE2 3.72Å; F1506-F1510 HydrophobicContact CZ-CG 4.46Å; F1506-F1510 WeakPolarHBondContact O-CA 3.49Å; F1506-F1510 WeakPolarHBondContact O-CB 3.32Å; F1506-F1510 PolarHBondContact O-N 3.35Å; F1506-F1510 VanDerWaalsContact O-N 3.1Å; F1506-Y1514 AromaticContact CD2-CD2 3.66Å; F1506-Y1514 HydrophobicContact CD2-CD2 3.66Å; F1506-Y1514 VanDerWaalsContact CD2-CD2 3.49Å; F1506-Y1514 HydrophobicContact CD2-CE2 4.2Å; F1506-Y1514 HydrophobicContact CD2-CG 4.23Å; F1506-Y1514 AromaticContact CE2-CD2 3.85Å; F1506-Y1514 HydrophobicContact CE2-CD2 4.04Å; F1506-Y1514 HydrophobicContact CE2-CG 4.3Å; F1506-Y1514 HydrophobicContact CG-CD2 4.44Å; F1506-L1518 HydrophobicContact CE2-CD1 3.94Å; F1506-L1518 HydrophobicContact CZ-CD1 3.92Å; F1506-N1560 HydrophobicContact CD1-CB 4.46Å; F1506-N1560 HydrophobicContact CE1-CB 4.43Å; F1506-I1561 HydrophobicContact CE1-CG1 3.7Å; F1506-I1561 HydrophobicContact CZ-CD1 4.3Å; F1506-I1561 HydrophobicContact CZ-CG1 3.8Å; F1506-L1564 HydrophobicContact CE1-CD1 4.41Å
1507K69Low73.1Confident68.6 Ų68.640.3 Ų40.330%0.29821%0.212SC..Hα-helixtrans-58.6-42.6179.7-61.7-179.7-176.4174.20111.7T1504 D1505 N1509 L1563 L1564T1504-K1507 WeakPolarHBondContact O-CB 3.47Å; T1504-K1507 PolarHBondContact O-N 3.1Å; D1505-K1507 VanDerWaalsContact C-N 3.28Å; D1505-K1507 PolarHBondContact O-N 3.07Å; K1507-N1509 PolarHBondContact O-N 3.07Å; K1507-L1563 HydrophobicContact CD-CB 4.39Å; K1507-L1563 HydrophobicContact CD-CD1 4.3Å; K1507-L1563 VanDerWaalsContact NZ-CD1 3.29Å; K1507-L1564 VanDerWaalsContact CA-CD2 3.43Å; K1507-L1564 HydrophobicContact CB-CD2 3.88Å; K1507-L1564 HydrophobicContact CB-CG 4.37Å; K1507-L1564 HydrophobicContact CG-CD2 4.23Å; K1507-L1564 HydrophobicContact CG-CG 4.35Å; K1507-L1564 WeakPolarHBondContact O-CD2 3.28Å
1508N67.6Low73.2Confident123.6 Ų123.640.3 Ų40.366%0.66121%0.212SC*.Hα-helixtrans-74.4-30.4-175.7-66.2-23.1000114.4T1504 D1505 F1506T1504-N1508 PolarHBondContact O-N 3.05Å; D1505-N1508 PolarHBondContact O-N 3.27Å; F1506-N1508 VanDerWaalsContact C-N 3.31Å; F1506-N1508 PolarHBondContact O-N 3.27Å
1509N68.2Low73.2Confident44.6 Ų44.640.9 Ų40.924%0.23922%0.216CC..Hα-helixtrans-112.65.4-171.7-68.2-50.6000114.2R1464 D1505 F1506 K1507 V1511 I1512 Q1513 Y1514R1464-N1509 PolarHBondContact NH1-ND2 3.05Å; R1464-N1509 VanDerWaalsContact NH1-ND2 3.14Å; R1464-N1509 PolarHBondContact NH2-ND2 3.16Å; R1464-N1509 VanDerWaalsContact NH2-ND2 3.11Å; D1505-N1509 PolarHBondContact O-N 3.09Å; D1505-N1509 PolarHBondContact O-ND2 3.2Å; F1506-N1509 PolarHBondContact O-N 3.02Å; K1507-N1509 PolarHBondContact O-N 3.07Å; N1509-V1511 VanDerWaalsContact C-N 3.35Å; N1509-V1511 PolarHBondContact O-N 3.28Å; N1509-I1512 PolarHBondContact O-N 3.11Å; N1509-Q1513 PolarHBondContact O-N 3.33Å; N1509-Q1513 VanDerWaalsContact O-N 3.1Å; N1509-Y1514 HydrophobicContact CB-CD2 4.34Å; N1509-Y1514 HydrophobicContact CB-CE2 3.74Å
1510F68.6Low73.4Confident1.8 Ų1.844.7 Ų44.71%0.00823%0.232CC..Iπ-helixtrans-50.3-53.8-176177.9-103.7000113.5F1506 I1512 Y1514 S1515 L1518 I1561 L1564 Q1568 H1572F1506-F1510 AromaticContact CE1-CD2 3.87Å; F1506-F1510 HydrophobicContact CE1-CD2 3.87Å; F1506-F1510 HydrophobicContact CE1-CE2 4.39Å; F1506-F1510 AromaticContact CE2-CD2 3.81Å; F1506-F1510 HydrophobicContact CE2-CD2 3.81Å; F1506-F1510 HydrophobicContact CE2-CE2 4.38Å; F1506-F1510 AromaticContact CZ-CD2 3.36Å; F1506-F1510 HydrophobicContact CZ-CD2 3.36Å; F1506-F1510 AromaticContact CZ-CE2 3.72Å; F1506-F1510 HydrophobicContact CZ-CE2 3.72Å; F1506-F1510 HydrophobicContact CZ-CG 4.46Å; F1506-F1510 WeakPolarHBondContact O-CA 3.49Å; F1506-F1510 WeakPolarHBondContact O-CB 3.32Å; F1506-F1510 PolarHBondContact O-N 3.35Å; F1506-F1510 VanDerWaalsContact O-N 3.1Å; F1510-I1512 VanDerWaalsContact C-N 3.34Å; F1510-I1512 PolarHBondContact O-N 3.23Å; F1510-Y1514 PolarHBondContact O-N 3.27Å; F1510-Y1514 VanDerWaalsContact O-N 3.13Å; F1510-S1515 WeakPolarHBondContact O-CB 3.36Å; F1510-S1515 PolarHBondContact O-N 3.31Å; F1510-S1515 VanDerWaalsContact O-N 3.12Å; F1510-L1518 HydrophobicContact CD2-CD1 4.42Å; F1510-L1518 HydrophobicContact CE2-CD1 3.78Å; F1510-I1561 HydrophobicContact CD2-CG1 4.36Å; F1510-I1561 HydrophobicContact CE1-CG2 4.34Å; F1510-I1561 HydrophobicContact CE2-CD1 3.79Å; F1510-I1561 HydrophobicContact CE2-CG1 3.77Å; F1510-I1561 HydrophobicContact CE2-CG2 4.36Å; F1510-I1561 HydrophobicContact CZ-CD1 4.14Å; F1510-I1561 HydrophobicContact CZ-CG1 4.21Å; F1510-I1561 HydrophobicContact CZ-CG2 4.07Å; F1510-L1564 HydrophobicContact CB-CD1 3.47Å; F1510-L1564 VanDerWaalsContact CB-CD1 3.47Å; F1510-L1564 HydrophobicContact CD1-CD1 3.74Å; F1510-L1564 HydrophobicContact CD2-CD1 4.1Å; F1510-L1564 HydrophobicContact CE1-CD1 4.28Å; F1510-L1564 HydrophobicContact CE2-CD1 4.5Å; F1510-L1564 HydrophobicContact CG-CD1 3.49Å; F1510-Q1568 HydrophobicContact CE1-CB 4.45Å; F1510-Q1568 HydrophobicContact CE1-CG 4.04Å; F1510-H1572 AromaticContact CZ-CE1 3.68Å; F1510-H1572 AromaticContact CZ-ND1 3.92Å; F1510-H1572 AromaticContact CZ-NE2 3.83Å
1511V61.6Low73.8Confident57.4 Ų57.444.4 Ų44.435%0.34823%0.231SC..Iπ-helixtrans-62.1-45.3-173.7-175.70000111.4N1509 S1515 Q1567N1509-V1511 VanDerWaalsContact C-N 3.35Å; N1509-V1511 PolarHBondContact O-N 3.28Å; V1511-S1515 PolarHBondContact O-OG 3.08Å; V1511-Q1567 HydrophobicContact CG1-CB 4.44Å; V1511-Q1567 VanDerWaalsContact CG1-O 3.28Å; V1511-Q1567 WeakPolarHBondContact CG1-O 3.46Å; V1511-Q1567 HydrophobicContact CG2-CB 3.62Å; V1511-Q1567 VanDerWaalsContact CG2-CB 3.48Å; V1511-Q1567 HydrophobicContact CG2-CG 4.49Å; V1511-Q1567 VanDerWaalsContact CG2-O 3.27Å; V1511-Q1567 WeakPolarHBondContact CG2-O 3.35Å
1512I63.1Low74.3Confident142.6 Ų142.644.4 Ų44.473%0.73123%0.231SC*.Iπ-helixtrans-80.4-37.8-168.7-57.3172.9000111.7N1509 F1510N1509-I1512 PolarHBondContact O-N 3.11Å; F1510-I1512 VanDerWaalsContact C-N 3.34Å; F1510-I1512 PolarHBondContact O-N 3.23Å
1513Q67.8Low74.8Confident108 Ų10849.7 Ų49.751%0.50525%0.246SC..Iπ-helixtrans-120.4-28.5-167-82.1-174.4-600115.3R1464 N1509R1464-Q1513 VanDerWaalsContact NH2-CD 3.25Å; N1509-Q1513 PolarHBondContact O-N 3.33Å; N1509-Q1513 VanDerWaalsContact O-N 3.1Å
1514Y75.7Confident75.4Confident9.4 Ų9.450.1 Ų50.14%0.03725%0.248CC..Iπ-helixtrans-109.1-31.5-165.5-54.6-45.2000113.8R1464 L1469 F1500 F1506 N1509 F1510 E1516 S1517 L1518R1464-Y1514 PolarHBondContact NE-OH 3.19Å; R1464-Y1514 VanDerWaalsContact NE-OH 3.16Å; R1464-Y1514 PolarHBondContact NH1-OH 2.96Å; R1464-Y1514 PolarHBondContact NH2-OH 2.95Å; R1464-Y1514 VanDerWaalsContact NH2-OH 3.11Å; L1469-Y1514 HydrophobicContact CB-CD1 4.25Å; L1469-Y1514 HydrophobicContact CB-CE1 4.3Å; L1469-Y1514 HydrophobicContact CD2-CD1 3.33Å; L1469-Y1514 HydrophobicContact CD2-CE1 4.1Å; L1469-Y1514 HydrophobicContact CD2-CG 3.92Å; L1469-Y1514 HydrophobicContact CG-CD1 4.39Å; F1500-Y1514 AromaticContact CE1-CE1 3.96Å; F1500-Y1514 HydrophobicContact CE1-CE1 4.03Å; F1500-Y1514 HydrophobicContact CE1-CE2 4.33Å; F1500-Y1514 AromaticContact CE1-CZ 3.87Å; F1500-Y1514 HydrophobicContact CZ-CE1 4.36Å; F1500-Y1514 AromaticContact CZ-CZ 3.9Å; F1500-Y1514 WeakPolarHBondContact CZ-OH 3.36Å; F1506-Y1514 AromaticContact CD2-CD2 3.66Å; F1506-Y1514 HydrophobicContact CD2-CD2 3.66Å; F1506-Y1514 VanDerWaalsContact CD2-CD2 3.49Å; F1506-Y1514 HydrophobicContact CD2-CE2 4.2Å; F1506-Y1514 HydrophobicContact CD2-CG 4.23Å; F1506-Y1514 AromaticContact CE2-CD2 3.85Å; F1506-Y1514 HydrophobicContact CE2-CD2 4.04Å; F1506-Y1514 HydrophobicContact CE2-CG 4.3Å; F1506-Y1514 HydrophobicContact CG-CD2 4.44Å; N1509-Y1514 HydrophobicContact CB-CD2 4.34Å; N1509-Y1514 HydrophobicContact CB-CE2 3.74Å; F1510-Y1514 PolarHBondContact O-N 3.27Å; F1510-Y1514 VanDerWaalsContact O-N 3.13Å; Y1514-E1516 VanDerWaalsContact C-N 3.33Å; Y1514-E1516 PolarHBondContact O-N 3.12Å; Y1514-S1517 PolarHBondContact O-N 3.05Å; Y1514-S1517 VanDerWaalsContact O-N 3.16Å; Y1514-L1518 WeakPolarHBondContact O-CB 3.3Å; Y1514-L1518 WeakPolarHBondContact O-CG 3.36Å; Y1514-L1518 PolarHBondContact O-N 3.12Å
1515S76.5Confident76.2Confident4.4 Ų4.447.6 Ų47.63%0.03123%0.232CC..Hα-helixtrans-52-46.1-177.662.50000113.5F1510 V1511 S1519 P1569 H1572F1510-S1515 WeakPolarHBondContact O-CB 3.36Å; F1510-S1515 PolarHBondContact O-N 3.31Å; F1510-S1515 VanDerWaalsContact O-N 3.12Å; V1511-S1515 PolarHBondContact O-OG 3.08Å; S1515-S1519 WeakPolarHBondContact O-CB 3.27Å; S1515-S1519 PolarHBondContact O-N 3.09Å; S1515-P1569 VanDerWaalsContact CB-CG 3.48Å; S1515-P1569 WeakPolarHBondContact OG-CG 3.35Å; S1515-H1572 PolarHBondContact O-CD2 3.27Å; S1515-H1572 VanDerWaalsContact O-CD2 3.3Å
1516E81.6Confident77.1Confident119 Ų11946.8 Ų46.856%0.55623%0.228SC*.Hα-helixtrans-64.7-47.7-179.9-172.4-176.5-179.800111.6Y1514 L1518 S1519 F1520 F1571Y1514-E1516 VanDerWaalsContact C-N 3.33Å; Y1514-E1516 PolarHBondContact O-N 3.12Å; E1516-L1518 PolarHBondContact O-N 3.22Å; E1516-S1519 WeakPolarHBondContact O-CB 3.36Å; E1516-S1519 PolarHBondContact O-N 3.18Å; E1516-S1519 PolarHBondContact O-OG 3.02Å; E1516-F1520 HydrophobicContact CG-CD2 4.46Å; E1516-F1520 HydrophobicContact CG-CE2 3.92Å; E1516-F1520 VanDerWaalsContact O-CD2 3.23Å; E1516-F1520 WeakPolarHBondContact O-CD2 3.31Å; E1516-F1520 PolarHBondContact O-N 3.42Å; E1516-F1571 HydrophobicContact CB-CE2 4.17Å; E1516-F1571 HydrophobicContact CB-CZ 4.32Å
1517S81.5Confident77.7Confident18.4 Ų18.451 Ų5113%0.12925%0.247CC..Hα-helixtrans-67.1-39.3-177.5-57.60000111.6I1473 Y1514 S1519 F1520 L1521I1473-S1517 VanDerWaalsContact CD1-C 3.5Å; I1473-S1517 VanDerWaalsContact CD1-CB 3.48Å; I1473-S1517 WeakPolarHBondContact CD1-O 3.37Å; Y1514-S1517 PolarHBondContact O-N 3.05Å; Y1514-S1517 VanDerWaalsContact O-N 3.16Å; S1517-S1519 VanDerWaalsContact C-N 3.32Å; S1517-S1519 PolarHBondContact O-N 2.81Å; S1517-F1520 PolarHBondContact O-N 3.05Å; S1517-L1521 PolarHBondContact O-N 3.26Å
1518L85.1Confident78.2Confident0 Ų047.9 Ų47.90%023%0.234CC..Hα-helixtrans-65.1-36.3174.9-72.6172.1000112.2I1473 L1497 F1506 F1510 Y1514 E1516 F1520 L1521 W1522 I1557 I1561I1473-L1518 HydrophobicContact CD1-CD2 4.24Å; L1497-L1518 HydrophobicContact CD1-CD2 4.42Å; L1497-L1518 HydrophobicContact CD2-CD2 4.09Å; F1506-L1518 HydrophobicContact CE2-CD1 3.94Å; F1506-L1518 HydrophobicContact CZ-CD1 3.92Å; F1510-L1518 HydrophobicContact CD2-CD1 4.42Å; F1510-L1518 HydrophobicContact CE2-CD1 3.78Å; Y1514-L1518 WeakPolarHBondContact O-CB 3.3Å; Y1514-L1518 WeakPolarHBondContact O-CG 3.36Å; Y1514-L1518 PolarHBondContact O-N 3.12Å; E1516-L1518 PolarHBondContact O-N 3.22Å; L1518-F1520 VanDerWaalsContact C-N 3.26Å; L1518-F1520 PolarHBondContact O-N 3.14Å; L1518-L1521 HydrophobicContact CD2-CD2 4.46Å; L1518-L1521 WeakPolarHBondContact O-CB 3.38Å; L1518-L1521 PolarHBondContact O-N 3.2Å; L1518-W1522 HydrophobicContact CB-CZ2 4.35Å; L1518-W1522 HydrophobicContact CD2-CH2 4.44Å; L1518-W1522 HydrophobicContact CD2-CZ2 4.09Å; L1518-W1522 HydrophobicContact CG-CZ2 4.5Å; L1518-W1522 VanDerWaalsContact O-CG 3.24Å; L1518-W1522 PolarHBondContact O-N 3.24Å; L1518-I1557 HydrophobicContact CD2-CG2 4.47Å; L1518-I1561 HydrophobicContact CD1-CD1 4.34Å
1519S83.1Confident78.7Confident15.4 Ų15.442.1 Ų42.111%0.10820%0.203CC..Hα-helixtrans-59.7-35.8176.677.80000112.7S1515 E1516 S1517 W1522 R1523S1515-S1519 WeakPolarHBondContact O-CB 3.27Å; S1515-S1519 PolarHBondContact O-N 3.09Å; E1516-S1519 WeakPolarHBondContact O-CB 3.36Å; E1516-S1519 PolarHBondContact O-N 3.18Å; E1516-S1519 PolarHBondContact O-OG 3.02Å; S1517-S1519 VanDerWaalsContact C-N 3.32Å; S1517-S1519 PolarHBondContact O-N 2.81Å; S1519-W1522 PolarHBondContact O-N 3.32Å; S1519-R1523 WeakPolarHBondContact O-CB 3.39Å; S1519-R1523 PolarHBondContact O-N 3.06Å
1520F84.6Confident79.3Confident91.4 Ų91.442.1 Ų42.140%0.40120%0.203SC..Hα-helixtrans-66.9-39.2173.7-73.1-67.3000112.5I1477 E1516 S1517 L1518 R1523 D1524I1477-F1520 HydrophobicContact CD1-CB 4.24Å; E1516-F1520 HydrophobicContact CG-CD2 4.46Å; E1516-F1520 HydrophobicContact CG-CE2 3.92Å; E1516-F1520 VanDerWaalsContact O-CD2 3.23Å; E1516-F1520 WeakPolarHBondContact O-CD2 3.31Å; E1516-F1520 PolarHBondContact O-N 3.42Å; S1517-F1520 PolarHBondContact O-N 3.05Å; L1518-F1520 VanDerWaalsContact C-N 3.26Å; L1518-F1520 PolarHBondContact O-N 3.14Å; F1520-R1523 PolarHBondContact O-N 3.09Å; F1520-D1524 PolarHBondContact O-N 3.37Å; F1520-D1524 VanDerWaalsContact O-N 3.08Å
1521L87Confident79.7Confident0 Ų046.3 Ų46.30%022%0.221CC..Hα-helixtrans-64.5-45.2175.9-178.264.8000111.1I1473 I1476 I1477 M1494 L1497 S1517 L1518 R1523 D1524 I1525I1473-L1521 HydrophobicContact CD1-CB 4.38Å; I1473-L1521 HydrophobicContact CG2-CB 4.03Å; I1476-L1521 HydrophobicContact CB-CD1 4.46Å; I1476-L1521 HydrophobicContact CG2-CD1 3.67Å; I1477-L1521 HydrophobicContact CG1-CD1 4.25Å; M1494-L1521 HydrophobicContact CE-CD2 4.36Å; M1494-L1521 HydrophobicContact SD-CD1 4.38Å; M1494-L1521 HydrophobicContact SD-CD2 4.31Å; L1497-L1521 HydrophobicContact CD1-CD2 4.02Å; L1497-L1521 HydrophobicContact CD2-CD2 4.49Å; S1517-L1521 PolarHBondContact O-N 3.26Å; L1518-L1521 HydrophobicContact CD2-CD2 4.46Å; L1518-L1521 WeakPolarHBondContact O-CB 3.38Å; L1518-L1521 PolarHBondContact O-N 3.2Å; L1521-R1523 VanDerWaalsContact C-N 3.33Å; L1521-R1523 PolarHBondContact O-N 3.28Å; L1521-D1524 PolarHBondContact O-N 3.18Å; L1521-I1525 HydrophobicContact CD1-CD1 4.17Å; L1521-I1525 HydrophobicContact CD1-CG1 4.44Å; L1521-I1525 HydrophobicContact CG-CD1 3.99Å; L1521-I1525 WeakPolarHBondContact O-CG1 3.38Å; L1521-I1525 PolarHBondContact O-N 3.29Å
1522W87.7Confident80.2Confident0 Ų043.8 Ų43.80%021%0.206CC..Hα-helixtrans-60.1-43.3176.8-54.8147.2000111.8L1518 S1519 D1524 I1525 T1526 V1554 I1557 F1558 I1561 H1572 A1575 L1579L1518-W1522 HydrophobicContact CB-CZ2 4.35Å; L1518-W1522 HydrophobicContact CD2-CH2 4.44Å; L1518-W1522 HydrophobicContact CD2-CZ2 4.09Å; L1518-W1522 HydrophobicContact CG-CZ2 4.5Å; L1518-W1522 VanDerWaalsContact O-CG 3.24Å; L1518-W1522 PolarHBondContact O-N 3.24Å; S1519-W1522 PolarHBondContact O-N 3.32Å; W1522-D1524 PolarHBondContact O-N 3.24Å; W1522-I1525 HydrophobicContact CE3-CD1 4.12Å; W1522-I1525 HydrophobicContact CZ3-CD1 4.17Å; W1522-I1525 PolarHBondContact O-N 3.04Å; W1522-T1526 VanDerWaalsContact O-CB 3.3Å; W1522-T1526 WeakPolarHBondContact O-CB 3.4Å; W1522-T1526 WeakPolarHBondContact O-CG2 3.41Å; W1522-T1526 PolarHBondContact O-N 3.18Å; W1522-T1526 PolarHBondContact O-OG1 2.99Å; W1522-V1554 HydrophobicContact CE3-CG1 4.43Å; W1522-V1554 HydrophobicContact CH2-CB 4.41Å; W1522-V1554 HydrophobicContact CH2-CG1 4.08Å; W1522-V1554 HydrophobicContact CH2-CG2 4.38Å; W1522-V1554 HydrophobicContact CZ3-CB 4.24Å; W1522-V1554 HydrophobicContact CZ3-CG1 3.73Å; W1522-V1554 HydrophobicContact CZ3-CG2 3.76Å; W1522-I1557 HydrophobicContact CH2-CB 4.26Å; W1522-I1557 HydrophobicContact CH2-CD1 4.04Å; W1522-I1557 HydrophobicContact CH2-CG2 3.96Å; W1522-I1557 HydrophobicContact CZ2-CG2 3.91Å; W1522-F1558 AromaticContact CD2-CE2 3.95Å; W1522-F1558 HydrophobicContact CD2-CE2 4Å; W1522-F1558 AromaticContact CD2-CZ 3.98Å; W1522-F1558 HydrophobicContact CD2-CZ 4.08Å; W1522-F1558 AromaticContact CE2-CE2 3.61Å; W1522-F1558 AromaticContact CE2-CZ 3.58Å; W1522-F1558 HydrophobicContact CE3-CE2 4.16Å; W1522-F1558 HydrophobicContact CG-CZ 4.42Å; W1522-F1558 HydrophobicContact CH2-CD2 4.17Å; W1522-F1558 AromaticContact CH2-CE2 3.68Å; W1522-F1558 HydrophobicContact CH2-CE2 3.68Å; W1522-F1558 HydrophobicContact CH2-CZ 4.42Å; W1522-F1558 HydrophobicContact CZ2-CD2 4.12Å; W1522-F1558 AromaticContact CZ2-CE2 3.45Å; W1522-F1558 HydrophobicContact CZ2-CE2 3.45Å; W1522-F1558 VanDerWaalsContact CZ2-CE2 3.46Å; W1522-F1558 AromaticContact CZ2-CZ 3.8Å; W1522-F1558 HydrophobicContact CZ2-CZ 3.8Å; W1522-F1558 AromaticContact CZ3-CE2 3.98Å; W1522-F1558 HydrophobicContact CZ3-CE2 4.04Å; W1522-F1558 AromaticContact NE1-CZ 3.66Å; W1522-I1561 HydrophobicContact CZ2-CD1 4.46Å; W1522-H1572 AromaticContact CD1-CD2 3.99Å; W1522-H1572 AromaticContact CD1-NE2 3.69Å; W1522-H1572 AromaticContact NE1-CD2 3.85Å; W1522-H1572 AromaticContact NE1-CE1 3.89Å; W1522-H1572 AromaticContact NE1-NE2 3.09Å; W1522-H1572 PolarHBondContact NE1-NE2 3.19Å; W1522-H1572 VanDerWaalsContact NE1-NE2 3.13Å; W1522-A1575 HydrophobicContact CB-CB 4.24Å; W1522-L1579 HydrophobicContact CB-CD1 3.95Å; W1522-L1579 HydrophobicContact CB-CD2 4.23Å; W1522-L1579 HydrophobicContact CD2-CD1 4.23Å; W1522-L1579 HydrophobicContact CD2-CD2 4.08Å; W1522-L1579 HydrophobicContact CE3-CD1 3.67Å; W1522-L1579 HydrophobicContact CE3-CD2 3.78Å; W1522-L1579 HydrophobicContact CG-CD1 4.37Å; W1522-L1579 HydrophobicContact CG-CD2 4.28Å; W1522-L1579 HydrophobicContact CZ3-CD2 4.46Å
1523R85.2Confident80.5Confident143 Ų14340.9 Ų40.954%0.5419%0.191SC..Hα-helixtrans-61.5-44.3176.3-169.7176.185.8-173.51.9112.2S1519 F1520 L1521 I1525 T1526 E1527S1519-R1523 WeakPolarHBondContact O-CB 3.39Å; S1519-R1523 PolarHBondContact O-N 3.06Å; F1520-R1523 PolarHBondContact O-N 3.09Å; L1521-R1523 VanDerWaalsContact C-N 3.33Å; L1521-R1523 PolarHBondContact O-N 3.28Å; R1523-I1525 PolarHBondContact O-N 2.91Å; R1523-T1526 WeakPolarHBondContact CA-OG1 3.48Å; R1523-T1526 WeakPolarHBondContact O-CB 3.32Å; R1523-T1526 PolarHBondContact O-N 3.13Å; R1523-T1526 PolarHBondContact O-OG1 3.26Å; R1523-E1527 IonicContact NE-OE1 3.46Å; R1523-E1527 PolarHBondContact NE-OE1 2.98Å; R1523-E1527 WeakPolarHBondContact O-CG 3.31Å; R1523-E1527 PolarHBondContact O-N 3.08Å
1524D85.2Confident80.5Confident18.2 Ų18.241.3 Ų41.310%0.09720%0.196CC..Hα-helixtrans-64-43.5178.2-176.665.3000112.3I1477 K1482 R1490 F1520 L1521 W1522 T1526 E1527 E1528I1477-D1524 HydrophobicContact CD1-CB 4.27Å; I1477-D1524 HydrophobicContact CG1-CB 3.94Å; I1477-D1524 HydrophobicContact CG2-CB 4.18Å; K1482-D1524 IonicContact NZ-OD1 3.44Å; K1482-D1524 PolarHBondContact NZ-OD1 3.14Å; K1482-D1524 IonicContact NZ-OD2 3.19Å; K1482-D1524 PolarHBondContact NZ-OD2 3.16Å; R1490-D1524 IonicContact NH2-OD2 3.23Å; F1520-D1524 PolarHBondContact O-N 3.37Å; F1520-D1524 VanDerWaalsContact O-N 3.08Å; L1521-D1524 PolarHBondContact O-N 3.18Å; W1522-D1524 PolarHBondContact O-N 3.24Å; D1524-T1526 VanDerWaalsContact C-N 3.32Å; D1524-T1526 PolarHBondContact O-N 3.09Å; D1524-E1527 PolarHBondContact O-N 3.21Å; D1524-E1528 WeakPolarHBondContact O-CG 3.35Å; D1524-E1528 PolarHBondContact O-N 3.29Å; D1524-E1528 VanDerWaalsContact O-N 3.09Å
1525I84.6Confident79.9Confident6.4 Ų6.446.6 Ų46.63%0.03323%0.226CC..Hα-helixtrans-63.1-41.5175-65.7171.8000110.3L1521 W1522 R1523 E1527 E1528 L1529 I1550 V1554 L1579L1521-I1525 HydrophobicContact CD1-CD1 4.17Å; L1521-I1525 HydrophobicContact CD1-CG1 4.44Å; L1521-I1525 HydrophobicContact CG-CD1 3.99Å; L1521-I1525 WeakPolarHBondContact O-CG1 3.38Å; L1521-I1525 PolarHBondContact O-N 3.29Å; W1522-I1525 HydrophobicContact CE3-CD1 4.12Å; W1522-I1525 HydrophobicContact CZ3-CD1 4.17Å; W1522-I1525 PolarHBondContact O-N 3.04Å; R1523-I1525 PolarHBondContact O-N 2.91Å; I1525-E1527 VanDerWaalsContact C-N 3.34Å; I1525-E1527 PolarHBondContact O-N 3.17Å; I1525-E1528 WeakPolarHBondContact O-CB 3.37Å; I1525-E1528 PolarHBondContact O-N 3.19Å; I1525-E1528 VanDerWaalsContact O-N 3.13Å; I1525-L1529 HydrophobicContact CG2-CD1 4.2Å; I1525-L1529 HydrophobicContact CG2-CG 4.3Å; I1525-L1529 WeakPolarHBondContact O-CB 3.44Å; I1525-L1529 VanDerWaalsContact O-CG 3.3Å; I1525-L1529 WeakPolarHBondContact O-CG 3.31Å; I1525-L1529 PolarHBondContact O-N 3.02Å; I1525-I1550 HydrophobicContact CD1-CG2 4.14Å; I1525-V1554 HydrophobicContact CD1-CG2 3.94Å; I1525-L1579 HydrophobicContact CB-CD1 4.25Å; I1525-L1579 HydrophobicContact CG2-CD1 3.79Å
1526T84.4Confident78.9Confident10.4 Ų10.453.9 Ų53.96%0.06426%0.257CS..Hα-helixtrans-60.6-43.4176.7-40.90000111.6W1522 R1523 D1524 E1528 L1529 D1530 Y1578 L1579 K1582W1522-T1526 VanDerWaalsContact O-CB 3.3Å; W1522-T1526 WeakPolarHBondContact O-CB 3.4Å; W1522-T1526 WeakPolarHBondContact O-CG2 3.41Å; W1522-T1526 PolarHBondContact O-N 3.18Å; W1522-T1526 PolarHBondContact O-OG1 2.99Å; R1523-T1526 WeakPolarHBondContact CA-OG1 3.48Å; R1523-T1526 WeakPolarHBondContact O-CB 3.32Å; R1523-T1526 PolarHBondContact O-N 3.13Å; R1523-T1526 PolarHBondContact O-OG1 3.26Å; D1524-T1526 VanDerWaalsContact C-N 3.32Å; D1524-T1526 PolarHBondContact O-N 3.09Å; T1526-E1528 VanDerWaalsContact C-N 3.29Å; T1526-E1528 PolarHBondContact O-N 3.37Å; T1526-L1529 PolarHBondContact O-N 3.29Å; T1526-D1530 WeakPolarHBondContact O-CB 3.25Å; T1526-D1530 PolarHBondContact O-N 3.15Å; T1526-Y1578 HydrophobicContact CG2-CD1 3.64Å; T1526-Y1578 HydrophobicContact CG2-CE1 4.31Å; T1526-Y1578 WeakPolarHBondContact OG1-CD1 3.36Å; T1526-L1579 HydrophobicContact CG2-CB 3.48Å; T1526-L1579 VanDerWaalsContact CG2-CB 3.48Å; T1526-L1579 HydrophobicContact CG2-CD1 3.98Å; T1526-L1579 HydrophobicContact CG2-CG 3.91Å; T1526-L1579 WeakPolarHBondContact OG1-CA 3.3Å; T1526-L1579 WeakPolarHBondContact OG1-CB 3.23Å; T1526-K1582 HydrophobicContact CG2-CB 4.27Å; T1526-K1582 HydrophobicContact CG2-CG 3.49Å; T1526-K1582 VanDerWaalsContact CG2-CG 3.48Å
1527E82.9Confident77.7Confident87.6 Ų87.650.1 Ų50.141%0.40924%0.24SC..Hα-helixtrans-64.5-31.2175.3-73.5178.9-158.100112.8R1523 D1524 I1525 K1531R1523-E1527 IonicContact NE-OE1 3.46Å; R1523-E1527 PolarHBondContact NE-OE1 2.98Å; R1523-E1527 WeakPolarHBondContact O-CG 3.31Å; R1523-E1527 PolarHBondContact O-N 3.08Å; D1524-E1527 PolarHBondContact O-N 3.21Å; I1525-E1527 VanDerWaalsContact C-N 3.34Å; I1525-E1527 PolarHBondContact O-N 3.17Å; E1527-K1531 VanDerWaalsContact O-CG 3.31Å; E1527-K1531 WeakPolarHBondContact O-CG 3.33Å; E1527-K1531 PolarHBondContact O-N 3.03Å; E1527-K1531 VanDerWaalsContact O-N 3.12Å
1528E79.3Confident76.3Confident3.8 Ų3.853.9 Ų53.92%0.01827%0.267CS..Hα-helixtrans-70.6-46.3173.2-74.4-177.7-172.700112.3K1482 R1490 D1524 I1525 T1526 D1530 K1531 I1532 Y1542K1482-E1528 VanDerWaalsContact CD-OE1 3.23Å; K1482-E1528 WeakPolarHBondContact CD-OE1 3.35Å; K1482-E1528 WeakPolarHBondContact CE-OE1 3.39Å; K1482-E1528 IonicContact NZ-OE1 3.06Å; K1482-E1528 PolarHBondContact NZ-OE1 3.25Å; R1490-E1528 IonicContact CZ-OE1 3.13Å; R1490-E1528 VanDerWaalsContact CZ-OE1 3.29Å; R1490-E1528 IonicContact CZ-OE2 3.45Å; R1490-E1528 VanDerWaalsContact NH1-CD 3.35Å; R1490-E1528 IonicContact NH1-OE1 3.49Å; R1490-E1528 PolarHBondContact NH1-OE1 3.16Å; R1490-E1528 VanDerWaalsContact NH1-OE1 3.07Å; R1490-E1528 IonicContact NH1-OE2 3.03Å; R1490-E1528 PolarHBondContact NH1-OE2 3.2Å; R1490-E1528 VanDerWaalsContact NH2-CD 3.3Å; R1490-E1528 IonicContact NH2-OE1 3.77Å; R1490-E1528 PolarHBondContact NH2-OE1 3.24Å; R1490-E1528 VanDerWaalsContact NH2-OE1 3.14Å; R1490-E1528 IonicContact NH2-OE2 3.49Å; R1490-E1528 PolarHBondContact NH2-OE2 3.11Å; D1524-E1528 WeakPolarHBondContact O-CG 3.35Å; D1524-E1528 PolarHBondContact O-N 3.29Å; D1524-E1528 VanDerWaalsContact O-N 3.09Å; I1525-E1528 WeakPolarHBondContact O-CB 3.37Å; I1525-E1528 PolarHBondContact O-N 3.19Å; I1525-E1528 VanDerWaalsContact O-N 3.13Å; T1526-E1528 VanDerWaalsContact C-N 3.29Å; T1526-E1528 PolarHBondContact O-N 3.37Å; E1528-D1530 PolarHBondContact O-N 3.25Å; E1528-K1531 WeakPolarHBondContact O-CB 3.45Å; E1528-K1531 PolarHBondContact O-N 3.2Å; E1528-K1531 VanDerWaalsContact O-N 3.1Å; E1528-I1532 WeakPolarHBondContact O-CG1 3.33Å; E1528-I1532 PolarHBondContact O-N 3.13Å; E1528-Y1542 VanDerWaalsContact CD-OH 3.29Å; E1528-Y1542 PolarHBondContact OE1-OH 3.23Å; E1528-Y1542 PolarHBondContact OE2-OH 3.15Å
1529L79.6Confident75.3Confident3 Ų355.2 Ų55.22%0.01628%0.276CS..Hα-helixtrans-58.4-38.1174.6-68.1-179.1000110.7I1525 T1526 I1532 L1533 L1546 L1579 K1582 L1583 I1586I1525-L1529 HydrophobicContact CG2-CD1 4.2Å; I1525-L1529 HydrophobicContact CG2-CG 4.3Å; I1525-L1529 WeakPolarHBondContact O-CB 3.44Å; I1525-L1529 VanDerWaalsContact O-CG 3.3Å; I1525-L1529 WeakPolarHBondContact O-CG 3.31Å; I1525-L1529 PolarHBondContact O-N 3.02Å; T1526-L1529 PolarHBondContact O-N 3.29Å; L1529-I1532 HydrophobicContact CD2-CD1 4.35Å; L1529-I1532 WeakPolarHBondContact O-CB 3.33Å; L1529-I1532 PolarHBondContact O-N 3.14Å; L1529-L1533 WeakPolarHBondContact O-CB 3.45Å; L1529-L1533 PolarHBondContact O-N 3.07Å; L1529-L1546 HydrophobicContact CD2-CD1 4.47Å; L1529-L1579 HydrophobicContact CD1-CD1 3.92Å; L1529-K1582 HydrophobicContact CB-CB 4.32Å; L1529-K1582 HydrophobicContact CD1-CB 4.31Å; L1529-L1583 HydrophobicContact CD1-CD2 3.69Å; L1529-L1583 HydrophobicContact CD1-CG 3.96Å; L1529-I1586 HydrophobicContact CB-CD1 3.59Å; L1529-I1586 HydrophobicContact CD1-CD1 4.24Å; L1529-I1586 HydrophobicContact CD2-CD1 3.61Å; L1529-I1586 HydrophobicContact CG-CD1 3.97Å
1530D80.4Confident74.8Confident43 Ų4359 Ų5923%0.2330%0.295CS..Hα-helixtrans-63.3-41.6172.9-87.2-29.5000113.2T1526 E1528 I1532 L1533 L1534 Y1578 K1582T1526-D1530 WeakPolarHBondContact O-CB 3.25Å; T1526-D1530 PolarHBondContact O-N 3.15Å; E1528-D1530 PolarHBondContact O-N 3.25Å; D1530-I1532 VanDerWaalsContact C-N 3.27Å; D1530-I1532 PolarHBondContact O-N 3.01Å; D1530-L1533 PolarHBondContact O-N 3.15Å; D1530-L1534 WeakPolarHBondContact O-CB 3.32Å; D1530-L1534 WeakPolarHBondContact O-CD1 3.26Å; D1530-L1534 VanDerWaalsContact O-CG 3.31Å; D1530-L1534 WeakPolarHBondContact O-CG 3.33Å; D1530-L1534 PolarHBondContact O-N 3.09Å; D1530-Y1578 PolarHBondContact OD2-OH 3.31Å; D1530-K1582 VanDerWaalsContact OD1-CD 3.27Å; D1530-K1582 WeakPolarHBondContact OD1-CD 3.42Å; D1530-K1582 WeakPolarHBondContact OD1-CE 3.31Å; D1530-K1582 IonicContact OD1-NZ 2.69Å; D1530-K1582 PolarHBondContact OD1-NZ 3.14Å; D1530-K1582 WeakPolarHBondContact OD2-CE 3.44Å; D1530-K1582 IonicContact OD2-NZ 3.42Å
1531K76Confident74.1Confident90.8 Ų90.859 Ų5940%0.39530%0.299SS..Hα-helixtrans-65.5-31.8176-72.4167.1-170.2166.10112.1E1527 E1528 N1535 K1536 L1537E1527-K1531 VanDerWaalsContact O-CG 3.31Å; E1527-K1531 WeakPolarHBondContact O-CG 3.33Å; E1527-K1531 PolarHBondContact O-N 3.03Å; E1527-K1531 VanDerWaalsContact O-N 3.12Å; E1528-K1531 WeakPolarHBondContact O-CB 3.45Å; E1528-K1531 PolarHBondContact O-N 3.2Å; E1528-K1531 VanDerWaalsContact O-N 3.1Å; K1531-N1535 PolarHBondContact O-N 3.44Å; K1531-K1536 WeakPolarHBondContact O-CB 3.44Å; K1531-K1536 PolarHBondContact O-N 3.27Å; K1531-K1536 VanDerWaalsContact O-N 3.09Å; K1531-L1537 HydrophobicContact CB-CD1 3.53Å; K1531-L1537 HydrophobicContact CB-CG 4.11Å; K1531-L1537 HydrophobicContact CD-CD1 4.31Å; K1531-L1537 HydrophobicContact CG-CD1 4.49Å; K1531-L1537 PolarHBondContact O-N 3.38Å
1532I73.3Confident73.5Confident5.8 Ų5.859.6 Ų59.63%0.0330%0.301CS..Hα-helixtrans-70.8-45.7174.3-65.6166.7000110.3E1528 L1529 D1530 L1534 N1535 L1537 Y1542 L1546 L1592E1528-I1532 WeakPolarHBondContact O-CG1 3.33Å; E1528-I1532 PolarHBondContact O-N 3.13Å; L1529-I1532 HydrophobicContact CD2-CD1 4.35Å; L1529-I1532 WeakPolarHBondContact O-CB 3.33Å; L1529-I1532 PolarHBondContact O-N 3.14Å; D1530-I1532 VanDerWaalsContact C-N 3.27Å; D1530-I1532 PolarHBondContact O-N 3.01Å; I1532-L1534 VanDerWaalsContact C-N 3.28Å; I1532-L1534 PolarHBondContact O-N 3.07Å; I1532-N1535 WeakPolarHBondContact O-CA 3.42Å; I1532-N1535 PolarHBondContact O-N 3.24Å; I1532-L1537 HydrophobicContact CG1-CB 4.03Å; I1532-L1537 HydrophobicContact CG1-CD1 4.04Å; I1532-Y1542 HydrophobicContact CD1-CD1 4.29Å; I1532-Y1542 HydrophobicContact CD1-CE1 4.26Å; I1532-L1546 HydrophobicContact CD1-CD1 3.2Å; I1532-L1592 HydrophobicContact CG2-CD1 4.45Å
1533L69.3Low73Confident80.8 Ų80.860.9 Ų60.942%0.42331%0.307SS..Hα-helixtrans-61.4-36.6177.5-155.898.9000112.1L1529 D1530 N1535 Q1585 I1586L1529-L1533 WeakPolarHBondContact O-CB 3.45Å; L1529-L1533 PolarHBondContact O-N 3.07Å; D1530-L1533 PolarHBondContact O-N 3.15Å; L1533-N1535 PolarHBondContact O-N 3.36Å; L1533-N1535 VanDerWaalsContact O-N 3.15Å; L1533-Q1585 HydrophobicContact CD1-CB 4.13Å; L1533-I1586 HydrophobicContact CD1-CD1 4.09Å; L1533-I1586 HydrophobicContact CD1-CG1 3.99Å; L1533-I1586 HydrophobicContact CG-CG1 4.14Å
1534L67.4Low72.6Confident115.6 Ų115.656.9 Ų56.961%0.60530%0.296SS*.THydrogen-bonded Turntrans-75.26.9173.6-71.2166.1000113.6D1530 I1532 K1536D1530-L1534 WeakPolarHBondContact O-CB 3.32Å; D1530-L1534 WeakPolarHBondContact O-CD1 3.26Å; D1530-L1534 VanDerWaalsContact O-CG 3.31Å; D1530-L1534 WeakPolarHBondContact O-CG 3.33Å; D1530-L1534 PolarHBondContact O-N 3.09Å; I1532-L1534 VanDerWaalsContact C-N 3.28Å; I1532-L1534 PolarHBondContact O-N 3.07Å; L1534-K1536 HydrophobicContact CB-CD 4.47Å; L1534-K1536 HydrophobicContact CB-CG 4.32Å; L1534-K1536 PolarHBondContact O-N 3.27Å; L1534-K1536 VanDerWaalsContact O-N 3.1Å
1535N62.6Low72.3Confident122.4 Ų122.457.3 Ų57.366%0.65530%0.297SS*.THydrogen-bonded Turntrans54.122.2-176.4-77.6-21.8000114.8K1531 I1532 L1533 L1537 S1538K1531-N1535 PolarHBondContact O-N 3.44Å; I1532-N1535 WeakPolarHBondContact O-CA 3.42Å; I1532-N1535 PolarHBondContact O-N 3.24Å; L1533-N1535 PolarHBondContact O-N 3.36Å; L1533-N1535 VanDerWaalsContact O-N 3.15Å; N1535-L1537 VanDerWaalsContact C-N 3.32Å; N1535-S1538 PolarHBondContact O-OG 3.18Å
1536K56.9Low72.1Confident157.4 Ų157.457.1 Ų57.168%0.68430%0.295SS*.SBendtrans-78.4-22.4177-70.2-177.3177.7177.50112.9K1531 L1534K1531-K1536 WeakPolarHBondContact O-CB 3.44Å; K1531-K1536 PolarHBondContact O-N 3.27Å; K1531-K1536 VanDerWaalsContact O-N 3.09Å; L1534-K1536 HydrophobicContact CB-CD 4.47Å; L1534-K1536 HydrophobicContact CB-CG 4.32Å; L1534-K1536 PolarHBondContact O-N 3.27Å; L1534-K1536 VanDerWaalsContact O-N 3.1Å
1537L55.4Low71.9Confident39 Ų3960.5 Ų60.520%0.20431%0.307CS..SBendtrans-114.675.3178.8-69.5166.6000109.2A1423 K1531 I1532 N1535 S1539 Y1542A1423-L1537 HydrophobicContact CB-CD2 4.04Å; K1531-L1537 HydrophobicContact CB-CD1 3.53Å; K1531-L1537 HydrophobicContact CB-CG 4.11Å; K1531-L1537 HydrophobicContact CD-CD1 4.31Å; K1531-L1537 HydrophobicContact CG-CD1 4.49Å; K1531-L1537 PolarHBondContact O-N 3.38Å; I1532-L1537 HydrophobicContact CG1-CB 4.03Å; I1532-L1537 HydrophobicContact CG1-CD1 4.04Å; N1535-L1537 VanDerWaalsContact C-N 3.32Å; L1537-S1539 VanDerWaalsContact C-N 3.31Å; L1537-S1539 PolarHBondContact O-N 2.93Å; L1537-Y1542 HydrophobicContact CD1-CE1 4.24Å
1538S52.3Low71.7Confident98.4 Ų98.460.7 Ų60.769%0.68831%0.311SS*.  trans-88.922.1-170.6400000115N1535N1535-S1538 PolarHBondContact O-OG 3.18Å
1539S63.8Low71.8Confident26.8 Ų26.860.9 Ų60.919%0.18731%0.313CS..  trans-92.2118.9176.365.30000111.1W1424 L1537 D1541 Y1542 K1543W1424-S1539 WeakPolarHBondContact CH2-OG 3.36Å; W1424-S1539 VanDerWaalsContact CZ2-CB 3.46Å; W1424-S1539 WeakPolarHBondContact CZ2-OG 3.33Å; W1424-S1539 PolarHBondContact NE1-OG 3.07Å; L1537-S1539 VanDerWaalsContact C-N 3.31Å; L1537-S1539 PolarHBondContact O-N 2.93Å; S1539-D1541 VanDerWaalsContact C-N 3.27Å; S1539-D1541 PolarHBondContact O-N 3.28Å; S1539-Y1542 WeakPolarHBondContact O-CB 3.33Å; S1539-Y1542 PolarHBondContact O-N 3.23Å; S1539-Y1542 VanDerWaalsContact O-N 3.15Å; S1539-Y1542 WeakPolarHBondContact OG-CB 3.3Å; S1539-Y1542 PolarHBondContact OG-N 2.85Å; S1539-Y1542 VanDerWaalsContact OG-N 3.11Å; S1539-K1543 PolarHBondContact O-N 3.18Å
1540N71.8Confident72Confident95.6 Ų95.660.9 Ų60.951%0.51131%0.313SS..Hα-helixtrans-58.9-34175.5-75.7-13.1000112.2Y1542 K1543 I1544 L1591N1540-Y1542 VanDerWaalsContact C-N 3.28Å; N1540-Y1542 PolarHBondContact O-N 3.35Å; N1540-K1543 WeakPolarHBondContact O-CB 3.39Å; N1540-K1543 PolarHBondContact O-N 3.19Å; N1540-K1543 VanDerWaalsContact O-N 3.1Å; N1540-I1544 WeakPolarHBondContact O-CG1 3.32Å; N1540-I1544 PolarHBondContact O-N 3.2Å; N1540-L1591 HydrophobicContact CB-CD1 4.16Å
1541D70.4Confident72.3Confident92 Ų9259.2 Ų59.249%0.49230%0.304SS..Hα-helixtrans-60-36.1178.3-58.1-22.6000112.6W1424 S1539 I1544 F1545W1424-D1541 HydrophobicContact CE3-CB 3.86Å; W1424-D1541 HydrophobicContact CH2-CB 3.91Å; W1424-D1541 VanDerWaalsContact CH2-OD2 3.27Å; W1424-D1541 WeakPolarHBondContact CH2-OD2 3.47Å; W1424-D1541 HydrophobicContact CZ2-CB 3.54Å; W1424-D1541 HydrophobicContact CZ3-CB 3.77Å; W1424-D1541 VanDerWaalsContact CZ3-CB 3.45Å; S1539-D1541 VanDerWaalsContact C-N 3.27Å; S1539-D1541 PolarHBondContact O-N 3.28Å; D1541-I1544 PolarHBondContact O-N 3.17Å; D1541-F1545 WeakPolarHBondContact O-CB 3.18Å; D1541-F1545 PolarHBondContact O-N 2.99Å
1542Y75.2Confident72.7Confident12 Ų1257.7 Ų57.75%0.04730%0.303CS..Hα-helixtrans-71.5-36.3175.6-166.8-110.7000112.4W1424 K1482 R1490 E1528 I1532 L1537 S1539 N1540 I1544 F1545 L1546W1424-Y1542 HydrophobicContact CD2-CD2 4.46Å; W1424-Y1542 AromaticContact CE2-CD2 3.45Å; W1424-Y1542 VanDerWaalsContact CE2-CD2 3.45Å; W1424-Y1542 HydrophobicContact CH2-CD2 4.23Å; W1424-Y1542 HydrophobicContact CH2-CG 4.33Å; W1424-Y1542 AromaticContact CZ2-CD2 3.5Å; W1424-Y1542 HydrophobicContact CZ2-CD2 3.89Å; W1424-Y1542 HydrophobicContact CZ2-CE2 4.37Å; W1424-Y1542 HydrophobicContact CZ2-CG 4.16Å; W1424-Y1542 AromaticContact NE1-CD2 3.27Å; W1424-Y1542 VanDerWaalsContact NE1-CD2 3.27Å; W1424-Y1542 AromaticContact NE1-CE2 3.85Å; W1424-Y1542 AromaticContact NE1-CG 3.93Å; K1482-Y1542 WeakPolarHBondContact O-CE2 3.24Å; R1490-Y1542 PolarHBondContact NH1-OH 3.16Å; R1490-Y1542 VanDerWaalsContact NH1-OH 3.1Å; E1528-Y1542 VanDerWaalsContact CD-OH 3.29Å; E1528-Y1542 PolarHBondContact OE1-OH 3.23Å; E1528-Y1542 PolarHBondContact OE2-OH 3.15Å; I1532-Y1542 HydrophobicContact CD1-CD1 4.29Å; I1532-Y1542 HydrophobicContact CD1-CE1 4.26Å; L1537-Y1542 HydrophobicContact CD1-CE1 4.24Å; S1539-Y1542 WeakPolarHBondContact O-CB 3.33Å; S1539-Y1542 PolarHBondContact O-N 3.23Å; S1539-Y1542 VanDerWaalsContact O-N 3.15Å; S1539-Y1542 WeakPolarHBondContact OG-CB 3.3Å; S1539-Y1542 PolarHBondContact OG-N 2.85Å; S1539-Y1542 VanDerWaalsContact OG-N 3.11Å; N1540-Y1542 VanDerWaalsContact C-N 3.28Å; N1540-Y1542 PolarHBondContact O-N 3.35Å; Y1542-I1544 VanDerWaalsContact C-N 3.31Å; Y1542-I1544 PolarHBondContact O-N 3.35Å; Y1542-F1545 HydrophobicContact CD2-CD1 4.35Å; Y1542-F1545 HydrophobicContact CE2-CD1 4.16Å; Y1542-F1545 WeakPolarHBondContact O-CB 3.47Å; Y1542-F1545 PolarHBondContact O-N 3.14Å; Y1542-L1546 HydrophobicContact CD1-CD1 3.74Å; Y1542-L1546 HydrophobicContact CD1-CG 4.23Å; Y1542-L1546 HydrophobicContact CE1-CD1 3.51Å; Y1542-L1546 VanDerWaalsContact CE1-CD1 3.44Å; Y1542-L1546 HydrophobicContact CE1-CD2 4.32Å; Y1542-L1546 HydrophobicContact CE1-CG 3.98Å; Y1542-L1546 WeakPolarHBondContact O-CB 3.45Å; Y1542-L1546 WeakPolarHBondContact O-CG 3.47Å; Y1542-L1546 PolarHBondContact O-N 3.18Å
1543K77.3Confident73.3Confident26.2 Ų26.258.1 Ų58.111%0.11431%0.306CS..Hα-helixtrans-63.1-41.5173.8-64-173.6175.1-172.40110.7S1539 N1540 L1546 R1547 D1589 L1591 L1592S1539-K1543 PolarHBondContact O-N 3.18Å; N1540-K1543 WeakPolarHBondContact O-CB 3.39Å; N1540-K1543 PolarHBondContact O-N 3.19Å; N1540-K1543 VanDerWaalsContact O-N 3.1Å; K1543-L1546 PolarHBondContact O-N 2.94Å; K1543-R1547 VanDerWaalsContact O-CB 3.28Å; K1543-R1547 WeakPolarHBondContact O-CB 3.4Å; K1543-R1547 PolarHBondContact O-N 3.27Å; K1543-D1589 WeakPolarHBondContact CE-OD2 3.47Å; K1543-D1589 IonicContact NZ-OD1 3.32Å; K1543-D1589 IonicContact NZ-OD2 3.04Å; K1543-D1589 PolarHBondContact NZ-OD2 3.28Å; K1543-L1591 HydrophobicContact CB-CB 4.4Å; K1543-L1591 HydrophobicContact CB-CD1 4.27Å; K1543-L1591 HydrophobicContact CD-CD1 4.09Å; K1543-L1592 HydrophobicContact CB-CD1 3.95Å; K1543-L1592 HydrophobicContact CB-CG 4.24Å; K1543-L1592 HydrophobicContact CD-CD1 4.05Å; K1543-L1592 HydrophobicContact CG-CD1 3.85Å; K1543-L1592 WeakPolarHBondContact O-CD2 3.34Å
1544I76.6Confident74.1Confident60 Ų6054.5 Ų54.531%0.30829%0.288SS..Hα-helixtrans-61.9-46.4174.3-66.1166.1000110.3N1540 D1541 Y1542 L1546 R1547 D1548 L1591N1540-I1544 WeakPolarHBondContact O-CG1 3.32Å; N1540-I1544 PolarHBondContact O-N 3.2Å; D1541-I1544 PolarHBondContact O-N 3.17Å; Y1542-I1544 VanDerWaalsContact C-N 3.31Å; Y1542-I1544 PolarHBondContact O-N 3.35Å; I1544-L1546 PolarHBondContact O-N 3.14Å; I1544-R1547 WeakPolarHBondContact O-CB 3.4Å; I1544-R1547 PolarHBondContact O-N 3.03Å; I1544-D1548 VanDerWaalsContact CG2-OD2 3.31Å; I1544-D1548 WeakPolarHBondContact CG2-OD2 3.36Å; I1544-D1548 WeakPolarHBondContact O-CB 3.3Å; I1544-D1548 PolarHBondContact O-N 2.91Å; I1544-L1591 HydrophobicContact CG1-CD2 4.39Å
1545F79.3Confident74.9Confident26.4 Ų26.449.8 Ų49.812%0.11626%0.264CS..Hα-helixtrans-58.2-46.2175.6175.1-102.5000112.5W1424 C1487 R1490 N1491 D1541 Y1542 R1547 D1548 S1549 I1550W1424-F1545 HydrophobicContact CH2-CB 4.35Å; C1487-F1545 HydrophobicContact CB-CD1 4.34Å; C1487-F1545 HydrophobicContact CB-CD2 3.98Å; C1487-F1545 HydrophobicContact CB-CE1 4.11Å; C1487-F1545 HydrophobicContact CB-CE2 3.7Å; C1487-F1545 HydrophobicContact CB-CG 4.32Å; C1487-F1545 HydrophobicContact CB-CZ 3.8Å; C1487-F1545 VanDerWaalsContact O-CE2 3.31Å; C1487-F1545 WeakPolarHBondContact O-CE2 3.35Å; C1487-F1545 VanDerWaalsContact O-CZ 3.23Å; C1487-F1545 WeakPolarHBondContact O-CZ 3.39Å; R1490-F1545 HydrophobicContact CB-CZ 4.19Å; R1490-F1545 HydrophobicContact CG-CZ 4.43Å; N1491-F1545 HydrophobicContact CB-CE2 4.04Å; N1491-F1545 HydrophobicContact CB-CZ 4.35Å; D1541-F1545 WeakPolarHBondContact O-CB 3.18Å; D1541-F1545 PolarHBondContact O-N 2.99Å; Y1542-F1545 HydrophobicContact CD2-CD1 4.35Å; Y1542-F1545 HydrophobicContact CE2-CD1 4.16Å; Y1542-F1545 WeakPolarHBondContact O-CB 3.47Å; Y1542-F1545 PolarHBondContact O-N 3.14Å; F1545-R1547 VanDerWaalsContact C-N 3.33Å; F1545-R1547 PolarHBondContact O-N 3.16Å; F1545-D1548 PolarHBondContact O-N 3Å; F1545-S1549 WeakPolarHBondContact CD2-OG 3.38Å; F1545-S1549 VanDerWaalsContact CE2-OG 3.25Å; F1545-S1549 WeakPolarHBondContact CE2-OG 3.37Å; F1545-S1549 WeakPolarHBondContact CZ-OG 3.38Å; F1545-S1549 VanDerWaalsContact O-CB 3.27Å; F1545-S1549 WeakPolarHBondContact O-CB 3.37Å; F1545-S1549 PolarHBondContact O-N 3.24Å; F1545-S1549 PolarHBondContact O-OG 3.05Å; F1545-I1550 HydrophobicContact CD1-CD1 4.1Å; F1545-I1550 HydrophobicContact CE1-CD1 3.47Å; F1545-I1550 VanDerWaalsContact CE1-CD1 3.44Å; F1545-I1550 HydrophobicContact CE1-CG1 4.06Å; F1545-I1550 HydrophobicContact CZ-CD1 4.26Å; F1545-I1550 HydrophobicContact CZ-CG1 4.37Å
1546L79.6Confident75.8Confident1.4 Ų1.448 Ų481%0.00725%0.25CS..Iπ-helixtrans-60.5-42.9175.8-79.6167.6000112.1L1529 I1532 Y1542 K1543 I1544 I1550 I1551 L1592L1529-L1546 HydrophobicContact CD2-CD1 4.47Å; I1532-L1546 HydrophobicContact CD1-CD1 3.2Å; Y1542-L1546 HydrophobicContact CD1-CD1 3.74Å; Y1542-L1546 HydrophobicContact CD1-CG 4.23Å; Y1542-L1546 HydrophobicContact CE1-CD1 3.51Å; Y1542-L1546 VanDerWaalsContact CE1-CD1 3.44Å; Y1542-L1546 HydrophobicContact CE1-CD2 4.32Å; Y1542-L1546 HydrophobicContact CE1-CG 3.98Å; Y1542-L1546 WeakPolarHBondContact O-CB 3.45Å; Y1542-L1546 WeakPolarHBondContact O-CG 3.47Å; Y1542-L1546 PolarHBondContact O-N 3.18Å; K1543-L1546 PolarHBondContact O-N 2.94Å; I1544-L1546 PolarHBondContact O-N 3.14Å; L1546-I1550 HydrophobicContact CD2-CB 4.04Å; L1546-I1550 HydrophobicContact CD2-CD1 3.57Å; L1546-I1550 HydrophobicContact CD2-CG1 4.33Å; L1546-I1550 HydrophobicContact CD2-CG2 4.17Å; L1546-I1550 HydrophobicContact CG-CD1 4.47Å; L1546-I1550 PolarHBondContact O-N 3.07Å; L1546-I1551 WeakPolarHBondContact O-CB 3.26Å; L1546-I1551 WeakPolarHBondContact O-CG1 3.3Å; L1546-I1551 PolarHBondContact O-N 3.33Å; L1546-L1592 HydrophobicContact CB-CD2 3.93Å
1547R80.4Confident77.1Confident83.2 Ų83.240.5 Ų40.531%0.31422%0.217SC..Iπ-helixtrans-63.7-44.4178.4-174.5-162.571-169.2-3.9112.5K1543 I1544 F1545 P1552 L1591 L1592 A1595K1543-R1547 VanDerWaalsContact O-CB 3.28Å; K1543-R1547 WeakPolarHBondContact O-CB 3.4Å; K1543-R1547 PolarHBondContact O-N 3.27Å; I1544-R1547 WeakPolarHBondContact O-CB 3.4Å; I1544-R1547 PolarHBondContact O-N 3.03Å; F1545-R1547 VanDerWaalsContact C-N 3.33Å; F1545-R1547 PolarHBondContact O-N 3.16Å; R1547-P1552 WeakPolarHBondContact O-CD 3.35Å; R1547-P1552 VanDerWaalsContact O-CG 3.25Å; R1547-P1552 WeakPolarHBondContact O-CG 3.32Å; R1547-L1591 VanDerWaalsContact CD-O 3.23Å; R1547-L1591 WeakPolarHBondContact CD-O 3.33Å; R1547-L1592 HydrophobicContact CB-CD2 4.25Å; R1547-A1595 HydrophobicContact CG-CB 3.98Å
1548D79.5Confident78.5Confident91.8 Ų91.838.6 Ų38.649%0.49121%0.208SC..Iπ-helixtrans-90.5-26.3-170.1-66.3-15.8000113.4I1544 F1545I1544-D1548 VanDerWaalsContact CG2-OD2 3.31Å; I1544-D1548 WeakPolarHBondContact CG2-OD2 3.36Å; I1544-D1548 WeakPolarHBondContact O-CB 3.3Å; I1544-D1548 PolarHBondContact O-N 2.91Å; F1545-D1548 PolarHBondContact O-N 3Å
1549S80.3Confident79.8Confident8.2 Ų8.235.6 Ų35.66%0.05719%0.189CC..Iπ-helixtrans-114-55.5-174.951.50000113.6N1491 F1545 C1553N1491-S1549 VanDerWaalsContact OD1-CB 3.27Å; N1491-S1549 WeakPolarHBondContact OD1-CB 3.31Å; F1545-S1549 WeakPolarHBondContact CD2-OG 3.38Å; F1545-S1549 VanDerWaalsContact CE2-OG 3.25Å; F1545-S1549 WeakPolarHBondContact CE2-OG 3.37Å; F1545-S1549 WeakPolarHBondContact CZ-OG 3.38Å; F1545-S1549 VanDerWaalsContact O-CB 3.27Å; F1545-S1549 WeakPolarHBondContact O-CB 3.37Å; F1545-S1549 PolarHBondContact O-N 3.24Å; F1545-S1549 PolarHBondContact O-OG 3.05Å; S1549-C1553 WeakPolarHBondContact O-CB 3.4Å; S1549-C1553 PolarHBondContact O-N 2.91Å; S1549-C1553 PolarHBondContact O-SG 3.13Å
1550I84.6Confident80.3Confident1.2 Ų1.235.4 Ų35.41%0.00619%0.186CC..Iπ-helixtrans-78.5-53.9-169.1-67.5172.4000111.2R1490 M1494 I1525 F1545 L1546 C1553 V1554R1490-I1550 VanDerWaalsContact CZ-CD1 3.45Å; M1494-I1550 HydrophobicContact CE-CG2 4.29Å; M1494-I1550 HydrophobicContact CG-CG1 4.43Å; I1525-I1550 HydrophobicContact CD1-CG2 4.14Å; F1545-I1550 HydrophobicContact CD1-CD1 4.1Å; F1545-I1550 HydrophobicContact CE1-CD1 3.47Å; F1545-I1550 VanDerWaalsContact CE1-CD1 3.44Å; F1545-I1550 HydrophobicContact CE1-CG1 4.06Å; F1545-I1550 HydrophobicContact CZ-CD1 4.26Å; F1545-I1550 HydrophobicContact CZ-CG1 4.37Å; L1546-I1550 HydrophobicContact CD2-CB 4.04Å; L1546-I1550 HydrophobicContact CD2-CD1 3.57Å; L1546-I1550 HydrophobicContact CD2-CG1 4.33Å; L1546-I1550 HydrophobicContact CD2-CG2 4.17Å; L1546-I1550 HydrophobicContact CG-CD1 4.47Å; L1546-I1550 PolarHBondContact O-N 3.07Å; I1550-C1553 WeakPolarHBondContact O-CB 3.26Å; I1550-C1553 PolarHBondContact O-N 3.16Å; I1550-C1553 VanDerWaalsContact O-N 3.11Å; I1550-V1554 HydrophobicContact CG2-CG2 4.16Å; I1550-V1554 VanDerWaalsContact O-CG2 3.29Å; I1550-V1554 WeakPolarHBondContact O-CG2 3.26Å; I1550-V1554 PolarHBondContact O-N 3.09Å
1551I85.8Confident80.4Confident8.6 Ų8.630.9 Ų30.94%0.04416%0.161CC..Hα-helixtrans-57.9-44.7-176.5-67.1172.9000111.9L1546 C1553 V1554 T1555 L1583 L1592 A1595 C1599L1546-I1551 WeakPolarHBondContact O-CB 3.26Å; L1546-I1551 WeakPolarHBondContact O-CG1 3.3Å; L1546-I1551 PolarHBondContact O-N 3.33Å; I1551-C1553 VanDerWaalsContact C-N 3.32Å; I1551-C1553 PolarHBondContact O-N 3.28Å; I1551-V1554 WeakPolarHBondContact O-CB 3.24Å; I1551-V1554 PolarHBondContact O-N 3.31Å; I1551-V1554 VanDerWaalsContact O-N 3.11Å; I1551-T1555 HydrophobicContact CG2-CG2 4.21Å; I1551-T1555 WeakPolarHBondContact O-CB 3.19Å; I1551-T1555 VanDerWaalsContact O-CG2 3.25Å; I1551-T1555 WeakPolarHBondContact O-CG2 3.41Å; I1551-T1555 PolarHBondContact O-N 3.33Å; I1551-T1555 PolarHBondContact O-OG1 3.3Å; I1551-L1583 HydrophobicContact CD1-CD2 4.47Å; I1551-L1592 HydrophobicContact CD1-CD2 3.64Å; I1551-A1595 HydrophobicContact CB-CB 4.42Å; I1551-A1595 HydrophobicContact CD1-CB 4.39Å; I1551-A1595 HydrophobicContact CG2-CB 3.87Å; I1551-A1595 VanDerWaalsContact CG2-O 3.3Å; I1551-A1595 WeakPolarHBondContact CG2-O 3.34Å; I1551-C1599 HydrophobicContact CG2-CB 3.73Å
1552P84.9Confident80.4Confident59.8 Ų59.830.2 Ų30.239%0.38816%0.155SC..Hα-helixtrans-62.1-38.5176.3-25.636.8000112.8R1547 T1555 K1556R1547-P1552 WeakPolarHBondContact O-CD 3.35Å; R1547-P1552 VanDerWaalsContact O-CG 3.25Å; R1547-P1552 WeakPolarHBondContact O-CG 3.32Å; P1552-T1555 WeakPolarHBondContact CA-OG1 3.27Å; P1552-T1555 PolarHBondContact O-N 3.08Å; P1552-T1555 PolarHBondContact O-OG1 3.47Å; P1552-K1556 WeakPolarHBondContact O-CB 3.33Å; P1552-K1556 PolarHBondContact O-N 3.15Å; P1552-K1556 VanDerWaalsContact O-N 3.08Å
1553C85.3Confident79.8Confident13.8 Ų13.834.7 Ų34.79%0.09318%0.18CC..Hα-helixtrans-63.6-44174.2-70.70000111.4M1494 A1498 S1549 I1550 I1551 T1555 K1556 I1557M1494-C1553 HydrophobicContact CB-CB 4.25Å; M1494-C1553 HydrophobicContact CE-CB 3.84Å; A1498-C1553 HydrophobicContact CB-CB 4.08Å; S1549-C1553 WeakPolarHBondContact O-CB 3.4Å; S1549-C1553 PolarHBondContact O-N 2.91Å; S1549-C1553 PolarHBondContact O-SG 3.13Å; I1550-C1553 WeakPolarHBondContact O-CB 3.26Å; I1550-C1553 PolarHBondContact O-N 3.16Å; I1550-C1553 VanDerWaalsContact O-N 3.11Å; I1551-C1553 VanDerWaalsContact C-N 3.32Å; I1551-C1553 PolarHBondContact O-N 3.28Å; C1553-T1555 VanDerWaalsContact C-N 3.34Å; C1553-T1555 PolarHBondContact O-N 3.4Å; C1553-K1556 PolarHBondContact O-N 3.21Å; C1553-I1557 VanDerWaalsContact O-CD1 3.24Å; C1553-I1557 WeakPolarHBondContact O-CD1 3.32Å; C1553-I1557 WeakPolarHBondContact O-CG1 3.36Å; C1553-I1557 PolarHBondContact O-N 3.15Å
1554V86.3Confident79Confident4.2 Ų4.235.1 Ų35.13%0.02518%0.183CC..Hα-helixtrans-59.7-48.1175.91780000110.7M1494 W1522 I1525 I1550 I1551 K1556 I1557 F1558 L1579 C1599M1494-V1554 HydrophobicContact CE-CG2 4.27Å; W1522-V1554 HydrophobicContact CE3-CG1 4.43Å; W1522-V1554 HydrophobicContact CH2-CB 4.41Å; W1522-V1554 HydrophobicContact CH2-CG1 4.08Å; W1522-V1554 HydrophobicContact CH2-CG2 4.38Å; W1522-V1554 HydrophobicContact CZ3-CB 4.24Å; W1522-V1554 HydrophobicContact CZ3-CG1 3.73Å; W1522-V1554 HydrophobicContact CZ3-CG2 3.76Å; I1525-V1554 HydrophobicContact CD1-CG2 3.94Å; I1550-V1554 HydrophobicContact CG2-CG2 4.16Å; I1550-V1554 VanDerWaalsContact O-CG2 3.29Å; I1550-V1554 WeakPolarHBondContact O-CG2 3.26Å; I1550-V1554 PolarHBondContact O-N 3.09Å; I1551-V1554 WeakPolarHBondContact O-CB 3.24Å; I1551-V1554 PolarHBondContact O-N 3.31Å; I1551-V1554 VanDerWaalsContact O-N 3.11Å; V1554-K1556 VanDerWaalsContact C-N 3.33Å; V1554-K1556 PolarHBondContact O-N 3.08Å; V1554-I1557 PolarHBondContact O-N 3.11Å; V1554-I1557 VanDerWaalsContact O-N 3.13Å; V1554-F1558 HydrophobicContact CG1-CD2 3.61Å; V1554-F1558 HydrophobicContact CG1-CE2 3.69Å; V1554-F1558 WeakPolarHBondContact O-CD2 3.39Å; V1554-F1558 PolarHBondContact O-N 3.38Å; V1554-L1579 HydrophobicContact CG1-CD2 4.18Å; V1554-C1599 VanDerWaalsContact CG1-SG 3.59Å
1555T84.6Confident78.1Confident16.6 Ų16.639.6 Ų39.610%0.10220%0.202CC..Hα-helixtrans-57.4-46.2177.8-370000111.1I1551 P1552 C1553 I1557 F1558 A1559 E1598 C1599 M1602I1551-T1555 HydrophobicContact CG2-CG2 4.21Å; I1551-T1555 WeakPolarHBondContact O-CB 3.19Å; I1551-T1555 VanDerWaalsContact O-CG2 3.25Å; I1551-T1555 WeakPolarHBondContact O-CG2 3.41Å; I1551-T1555 PolarHBondContact O-N 3.33Å; I1551-T1555 PolarHBondContact O-OG1 3.3Å; P1552-T1555 WeakPolarHBondContact CA-OG1 3.27Å; P1552-T1555 PolarHBondContact O-N 3.08Å; P1552-T1555 PolarHBondContact O-OG1 3.47Å; C1553-T1555 VanDerWaalsContact C-N 3.34Å; C1553-T1555 PolarHBondContact O-N 3.4Å; T1555-I1557 VanDerWaalsContact C-N 3.34Å; T1555-I1557 PolarHBondContact O-N 3.15Å; T1555-F1558 PolarHBondContact O-N 3.14Å; T1555-A1559 WeakPolarHBondContact O-CB 3.38Å; T1555-A1559 PolarHBondContact O-N 3Å; T1555-E1598 HydrophobicContact CG2-CG 4.26Å; T1555-C1599 VanDerWaalsContact CG2-CA 3.46Å; T1555-C1599 HydrophobicContact CG2-CB 3.43Å; T1555-C1599 VanDerWaalsContact CG2-CB 3.43Å; T1555-C1599 WeakPolarHBondContact OG1-CA 3.43Å; T1555-C1599 VanDerWaalsContact OG1-CB 3.26Å; T1555-C1599 WeakPolarHBondContact OG1-CB 3.47Å; T1555-C1599 PolarHBondContact OG1-SG 3.2Å; T1555-C1599 VanDerWaalsContact OG1-SG 3.38Å; T1555-M1602 HydrophobicContact CG2-CB 4.08Å; T1555-M1602 HydrophobicContact CG2-CG 3.77Å
1556K82.5Confident76.9Confident85.2 Ų85.246 Ų4637%0.3723%0.232SC..Hα-helixtrans-61.6-38.8176.9-171.6174.3-179.6-176.10112.4A1498 N1499 S1502 P1552 C1553 V1554 N1560A1498-K1556 HydrophobicContact CB-CB 4.48Å; A1498-K1556 HydrophobicContact CB-CD 4.2Å; A1498-K1556 HydrophobicContact CB-CG 4.48Å; N1499-K1556 PolarHBondContact OD1-NZ 3.15Å; S1502-K1556 VanDerWaalsContact OG-CE 3.29Å; S1502-K1556 WeakPolarHBondContact OG-CE 3.31Å; P1552-K1556 WeakPolarHBondContact O-CB 3.33Å; P1552-K1556 PolarHBondContact O-N 3.15Å; P1552-K1556 VanDerWaalsContact O-N 3.08Å; C1553-K1556 PolarHBondContact O-N 3.21Å; V1554-K1556 VanDerWaalsContact C-N 3.33Å; V1554-K1556 PolarHBondContact O-N 3.08Å; K1556-N1560 PolarHBondContact O-N 3.09Å; K1556-N1560 PolarHBondContact O-ND2 3.27Å
1557I84Confident76.1Confident0 Ų052.7 Ų52.70%026%0.264CS..Hα-helixtrans-67.2-47.6177-65.1154.1000110.6L1497 A1498 C1501 L1518 W1522 C1553 V1554 T1555 A1559 N1560 I1561L1497-I1557 HydrophobicContact CD2-CD1 3.2Å; L1497-I1557 HydrophobicContact CD2-CG1 3.88Å; A1498-I1557 HydrophobicContact CB-CD1 4.41Å; A1498-I1557 HydrophobicContact CB-CG1 4.13Å; C1501-I1557 HydrophobicContact CB-CG1 4.08Å; C1501-I1557 HydrophobicContact CB-CG2 4.28Å; L1518-I1557 HydrophobicContact CD2-CG2 4.47Å; W1522-I1557 HydrophobicContact CH2-CB 4.26Å; W1522-I1557 HydrophobicContact CH2-CD1 4.04Å; W1522-I1557 HydrophobicContact CH2-CG2 3.96Å; W1522-I1557 HydrophobicContact CZ2-CG2 3.91Å; C1553-I1557 VanDerWaalsContact O-CD1 3.24Å; C1553-I1557 WeakPolarHBondContact O-CD1 3.32Å; C1553-I1557 WeakPolarHBondContact O-CG1 3.36Å; C1553-I1557 PolarHBondContact O-N 3.15Å; V1554-I1557 PolarHBondContact O-N 3.11Å; V1554-I1557 VanDerWaalsContact O-N 3.13Å; T1555-I1557 VanDerWaalsContact C-N 3.34Å; T1555-I1557 PolarHBondContact O-N 3.15Å; I1557-A1559 VanDerWaalsContact C-N 3.34Å; I1557-A1559 PolarHBondContact O-N 3.06Å; I1557-N1560 WeakPolarHBondContact O-CB 3.37Å; I1557-N1560 PolarHBondContact O-N 3.22Å; I1557-N1560 VanDerWaalsContact O-N 3.13Å; I1557-I1561 HydrophobicContact CG2-CD1 3.82Å; I1557-I1561 HydrophobicContact CG2-CG1 4.42Å; I1557-I1561 WeakPolarHBondContact O-CG1 3.24Å; I1557-I1561 PolarHBondContact O-N 3.2Å; I1557-I1561 VanDerWaalsContact O-N 3.08Å
1558F82.9Confident75.5Confident0 Ų050.2 Ų50.20%026%0.255CS..Hα-helixtrans-66-34.7179.2-84.3-80000112.8W1522 V1554 T1555 N1560 I1561 Q1562 L1579 M1602 I1603 T1606W1522-F1558 AromaticContact CD2-CE2 3.95Å; W1522-F1558 HydrophobicContact CD2-CE2 4Å; W1522-F1558 AromaticContact CD2-CZ 3.98Å; W1522-F1558 HydrophobicContact CD2-CZ 4.08Å; W1522-F1558 AromaticContact CE2-CE2 3.61Å; W1522-F1558 AromaticContact CE2-CZ 3.58Å; W1522-F1558 HydrophobicContact CE3-CE2 4.16Å; W1522-F1558 HydrophobicContact CG-CZ 4.42Å; W1522-F1558 HydrophobicContact CH2-CD2 4.17Å; W1522-F1558 AromaticContact CH2-CE2 3.68Å; W1522-F1558 HydrophobicContact CH2-CE2 3.68Å; W1522-F1558 HydrophobicContact CH2-CZ 4.42Å; W1522-F1558 HydrophobicContact CZ2-CD2 4.12Å; W1522-F1558 AromaticContact CZ2-CE2 3.45Å; W1522-F1558 HydrophobicContact CZ2-CE2 3.45Å; W1522-F1558 VanDerWaalsContact CZ2-CE2 3.46Å; W1522-F1558 AromaticContact CZ2-CZ 3.8Å; W1522-F1558 HydrophobicContact CZ2-CZ 3.8Å; W1522-F1558 AromaticContact CZ3-CE2 3.98Å; W1522-F1558 HydrophobicContact CZ3-CE2 4.04Å; W1522-F1558 AromaticContact NE1-CZ 3.66Å; V1554-F1558 HydrophobicContact CG1-CD2 3.61Å; V1554-F1558 HydrophobicContact CG1-CE2 3.69Å; V1554-F1558 WeakPolarHBondContact O-CD2 3.39Å; V1554-F1558 PolarHBondContact O-N 3.38Å; T1555-F1558 PolarHBondContact O-N 3.14Å; F1558-N1560 VanDerWaalsContact C-N 3.26Å; F1558-N1560 PolarHBondContact O-N 3.33Å; F1558-I1561 HydrophobicContact CD1-CD1 4.23Å; F1558-I1561 HydrophobicContact CE1-CD1 4.43Å; F1558-I1561 CarbonylContact O-C 3.6Å; F1558-I1561 PolarHBondContact O-N 3.27Å; F1558-I1561 VanDerWaalsContact O-N 3.11Å; F1558-Q1562 PolarHBondContact O-N 3.1Å; F1558-L1579 HydrophobicContact CE2-CD2 4.06Å; F1558-L1579 HydrophobicContact CZ-CD2 4.34Å; F1558-M1602 HydrophobicContact CB-CG 4.17Å; F1558-I1603 HydrophobicContact CB-CG1 4.22Å; F1558-I1603 HydrophobicContact CD1-CB 4.41Å; F1558-I1603 HydrophobicContact CD1-CG1 3.86Å; F1558-I1603 HydrophobicContact CD1-CG2 4.34Å; F1558-I1603 HydrophobicContact CD2-CD1 4.13Å; F1558-I1603 HydrophobicContact CD2-CG1 3.58Å; F1558-I1603 HydrophobicContact CE1-CB 4.49Å; F1558-I1603 HydrophobicContact CE1-CG1 4.06Å; F1558-I1603 HydrophobicContact CE1-CG2 4.08Å; F1558-I1603 HydrophobicContact CE2-CD1 4.01Å; F1558-I1603 HydrophobicContact CE2-CG1 3.79Å; F1558-I1603 HydrophobicContact CG-CB 4.49Å; F1558-I1603 HydrophobicContact CG-CG1 3.61Å; F1558-I1603 HydrophobicContact CZ-CD1 4.4Å; F1558-I1603 HydrophobicContact CZ-CG1 4.03Å; F1558-I1603 HydrophobicContact CZ-CG2 4.41Å; F1558-T1606 HydrophobicContact CB-CG2 4.29Å; F1558-T1606 HydrophobicContact CD1-CG2 4.08Å; F1558-T1606 VanDerWaalsContact O-CG2 3.26Å; F1558-T1606 WeakPolarHBondContact O-CG2 3.44Å
1559A80Confident75.1Confident35.2 Ų35.247.1 Ų47.129%0.29124%0.241SC..Hα-helixtrans-55.9-39.7171.300000112.1T1555 I1557 Q1562 M1602T1555-A1559 WeakPolarHBondContact O-CB 3.38Å; T1555-A1559 PolarHBondContact O-N 3Å; I1557-A1559 VanDerWaalsContact C-N 3.34Å; I1557-A1559 PolarHBondContact O-N 3.06Å; A1559-Q1562 WeakPolarHBondContact O-CB 3.27Å; A1559-Q1562 PolarHBondContact O-N 3.1Å; A1559-M1602 VanDerWaalsContact CA-CE 3.49Å; A1559-M1602 HydrophobicContact CB-CE 3.86Å; A1559-M1602 HydrophobicContact CB-CG 4.38Å; A1559-M1602 HydrophobicContact CB-SD 3.84Å
1560N75.3Confident74.7Confident22.8 Ų22.856.8 Ų56.812%0.12228%0.276CS..Hα-helixtrans-75.3-30.8176.2-69.6-49.2000113.2C1501 S1502 F1506 K1556 I1557 F1558 Q1562 L1563C1501-N1560 WeakPolarHBondContact O-CB 3.36Å; C1501-N1560 PolarHBondContact O-ND2 2.89Å; S1502-N1560 VanDerWaalsContact CA-ND2 3.27Å; S1502-N1560 WeakPolarHBondContact CA-ND2 3.34Å; S1502-N1560 WeakPolarHBondContact CB-ND2 3.36Å; S1502-N1560 PolarHBondContact N-ND2 2.96Å; S1502-N1560 PolarHBondContact OG-ND2 3.23Å; F1506-N1560 HydrophobicContact CD1-CB 4.46Å; F1506-N1560 HydrophobicContact CE1-CB 4.43Å; K1556-N1560 PolarHBondContact O-N 3.09Å; K1556-N1560 PolarHBondContact O-ND2 3.27Å; I1557-N1560 WeakPolarHBondContact O-CB 3.37Å; I1557-N1560 PolarHBondContact O-N 3.22Å; I1557-N1560 VanDerWaalsContact O-N 3.13Å; F1558-N1560 VanDerWaalsContact C-N 3.26Å; F1558-N1560 PolarHBondContact O-N 3.33Å; N1560-Q1562 VanDerWaalsContact C-N 3.33Å; N1560-L1563 PolarHBondContact O-N 2.91Å
1561I74.6Confident74.3Confident0.2 Ų0.261.3 Ų61.30%0.00130%0.296CS..Hα-helixtrans-70.3-33.3174.7-67.4171.1000111.2F1506 F1510 L1518 W1522 I1557 F1558 L1563 L1564 Q1568 T1606F1506-I1561 HydrophobicContact CE1-CG1 3.7Å; F1506-I1561 HydrophobicContact CZ-CD1 4.3Å; F1506-I1561 HydrophobicContact CZ-CG1 3.8Å; F1510-I1561 HydrophobicContact CD2-CG1 4.36Å; F1510-I1561 HydrophobicContact CE1-CG2 4.34Å; F1510-I1561 HydrophobicContact CE2-CD1 3.79Å; F1510-I1561 HydrophobicContact CE2-CG1 3.77Å; F1510-I1561 HydrophobicContact CE2-CG2 4.36Å; F1510-I1561 HydrophobicContact CZ-CD1 4.14Å; F1510-I1561 HydrophobicContact CZ-CG1 4.21Å; F1510-I1561 HydrophobicContact CZ-CG2 4.07Å; L1518-I1561 HydrophobicContact CD1-CD1 4.34Å; W1522-I1561 HydrophobicContact CZ2-CD1 4.46Å; I1557-I1561 HydrophobicContact CG2-CD1 3.82Å; I1557-I1561 HydrophobicContact CG2-CG1 4.42Å; I1557-I1561 WeakPolarHBondContact O-CG1 3.24Å; I1557-I1561 PolarHBondContact O-N 3.2Å; I1557-I1561 VanDerWaalsContact O-N 3.08Å; F1558-I1561 HydrophobicContact CD1-CD1 4.23Å; F1558-I1561 HydrophobicContact CE1-CD1 4.43Å; F1558-I1561 CarbonylContact O-C 3.6Å; F1558-I1561 PolarHBondContact O-N 3.27Å; F1558-I1561 VanDerWaalsContact O-N 3.11Å; I1561-L1563 PolarHBondContact O-N 3.26Å; I1561-L1563 VanDerWaalsContact O-N 3.15Å; I1561-L1564 HydrophobicContact CG2-CD1 4.46Å; I1561-L1564 VanDerWaalsContact O-CB 3.29Å; I1561-L1564 WeakPolarHBondContact O-CB 3.28Å; I1561-L1564 PolarHBondContact O-N 3.13Å; I1561-Q1568 HydrophobicContact CG2-CG 4.48Å; I1561-T1606 HydrophobicContact CG2-CG2 4.44Å
1562Q69.3Low74Confident77 Ų7760.9 Ų60.936%0.3629%0.294SS..Hα-helixtrans-56.3-34.3178.9-164.7-177.6-10.300112.5F1558 A1559 N1560 L1564 E1565 M1602 C1605 T1606F1558-Q1562 PolarHBondContact O-N 3.1Å; A1559-Q1562 WeakPolarHBondContact O-CB 3.27Å; A1559-Q1562 PolarHBondContact O-N 3.1Å; N1560-Q1562 VanDerWaalsContact C-N 3.33Å; Q1562-L1564 PolarHBondContact O-N 3.22Å; Q1562-L1564 VanDerWaalsContact O-N 3.15Å; Q1562-E1565 PolarHBondContact O-N 3.46Å; Q1562-M1602 HydrophobicContact CB-CE 3.81Å; Q1562-M1602 HydrophobicContact CG-CE 4.11Å; Q1562-M1602 VanDerWaalsContact OE1-CE 3.23Å; Q1562-C1605 HydrophobicContact CG-CB 4.47Å; Q1562-T1606 HydrophobicContact CB-CG2 3.7Å; Q1562-T1606 HydrophobicContact CG-CG2 4.15Å
1563L61.9Low73.7Confident107.4 Ų107.459 Ų5956%0.56228%0.28SS*.THydrogen-bonded Turntrans-67.5-2.3178.3-64.4169.2000113.4K1507 N1560 I1561K1507-L1563 HydrophobicContact CD-CB 4.39Å; K1507-L1563 HydrophobicContact CD-CD1 4.3Å; K1507-L1563 VanDerWaalsContact NZ-CD1 3.29Å; N1560-L1563 PolarHBondContact O-N 2.91Å; I1561-L1563 PolarHBondContact O-N 3.26Å; I1561-L1563 VanDerWaalsContact O-N 3.15Å
1564L61.7Low73.4Confident33.6 Ų33.662.2 Ų62.218%0.17630%0.296CS..  trans-103.362.5179.5-61.6169.5000111.4F1506 K1507 F1510 I1561 Q1562 H1566F1506-L1564 HydrophobicContact CE1-CD1 4.41Å; K1507-L1564 VanDerWaalsContact CA-CD2 3.43Å; K1507-L1564 HydrophobicContact CB-CD2 3.88Å; K1507-L1564 HydrophobicContact CB-CG 4.37Å; K1507-L1564 HydrophobicContact CG-CD2 4.23Å; K1507-L1564 HydrophobicContact CG-CG 4.35Å; K1507-L1564 WeakPolarHBondContact O-CD2 3.28Å; F1510-L1564 HydrophobicContact CB-CD1 3.47Å; F1510-L1564 VanDerWaalsContact CB-CD1 3.47Å; F1510-L1564 HydrophobicContact CD1-CD1 3.74Å; F1510-L1564 HydrophobicContact CD2-CD1 4.1Å; F1510-L1564 HydrophobicContact CE1-CD1 4.28Å; F1510-L1564 HydrophobicContact CE2-CD1 4.5Å; F1510-L1564 HydrophobicContact CG-CD1 3.49Å; I1561-L1564 HydrophobicContact CG2-CD1 4.46Å; I1561-L1564 VanDerWaalsContact O-CB 3.29Å; I1561-L1564 WeakPolarHBondContact O-CB 3.28Å; I1561-L1564 PolarHBondContact O-N 3.13Å; Q1562-L1564 PolarHBondContact O-N 3.22Å; Q1562-L1564 VanDerWaalsContact O-N 3.15Å; L1564-H1566 VanDerWaalsContact C-N 3.32Å; L1564-H1566 PolarHBondContact O-N 3.18Å; L1564-H1566 VanDerWaalsContact O-N 3.1Å
1565E57.2Low73.2Confident154 Ų15462.7 Ų62.772%0.7230%0.301SS*.THydrogen-bonded Turntrans-47.3-13.6-176-67-177.6159.500114.9Q1562Q1562-E1565 PolarHBondContact O-N 3.46Å
1566H54.9Low73.1Confident162.2 Ų162.261.9 Ų61.975%0.75130%0.296SS*.THydrogen-bonded Turntrans-143.327-171.5-64.6-44.2000118.3L1564L1564-H1566 VanDerWaalsContact C-N 3.32Å; L1564-H1566 PolarHBondContact O-N 3.18Å; L1564-H1566 VanDerWaalsContact O-N 3.1Å
1567Q61.6Low73.1Confident142.4 Ų142.458.2 Ų58.267%0.66528%0.281SS*.  trans-134.644178.1-61.5-171.3-10.600115.8V1511V1511-Q1567 HydrophobicContact CG1-CB 4.44Å; V1511-Q1567 VanDerWaalsContact CG1-O 3.28Å; V1511-Q1567 WeakPolarHBondContact CG1-O 3.46Å; V1511-Q1567 HydrophobicContact CG2-CB 3.62Å; V1511-Q1567 VanDerWaalsContact CG2-CB 3.48Å; V1511-Q1567 HydrophobicContact CG2-CG 4.49Å; V1511-Q1567 VanDerWaalsContact CG2-O 3.27Å; V1511-Q1567 WeakPolarHBondContact CG2-O 3.35Å
1568Q68.4Low72.9Confident29.4 Ų29.463.5 Ų63.514%0.13730%0.302CS..  trans-83.1130.6173.2-60.1-152.315.400111.9F1510 I1561 H1572 L1573 T1606F1510-Q1568 HydrophobicContact CE1-CB 4.45Å; F1510-Q1568 HydrophobicContact CE1-CG 4.04Å; I1561-Q1568 HydrophobicContact CG2-CG 4.48Å; Q1568-H1572 PolarHBondContact OE1-CE1 2.96Å; Q1568-H1572 VanDerWaalsContact OE1-CE1 3.3Å; Q1568-H1572 PolarHBondContact OE1-ND1 3.26Å; Q1568-L1573 HydrophobicContact CB-CD1 3.96Å; Q1568-L1573 HydrophobicContact CB-CD2 4.02Å; Q1568-L1573 HydrophobicContact CB-CG 3.84Å; Q1568-L1573 HydrophobicContact CG-CD2 4.4Å; Q1568-L1573 WeakPolarHBondContact O-CD1 3.43Å; Q1568-L1573 VanDerWaalsContact OE1-CD2 3.31Å; Q1568-T1606 PolarHBondContact NE2-O 3.37Å
1569P71.2Confident73.1Confident27.6 Ų27.663.6 Ų63.618%0.17930%0.302CS..  trans-70.4145.2174.128.1-31.7000111.1S1515 F1571 H1572 L1573S1515-P1569 VanDerWaalsContact CB-CG 3.48Å; S1515-P1569 WeakPolarHBondContact OG-CG 3.35Å; P1569-F1571 VanDerWaalsContact C-N 3.31Å; P1569-F1571 HydrophobicContact CB-CD1 3.86Å; P1569-F1571 HydrophobicContact CB-CE1 3.34Å; P1569-F1571 HydrophobicContact CB-CE2 4.3Å; P1569-F1571 HydrophobicContact CB-CG 4.5Å; P1569-F1571 HydrophobicContact CB-CZ 3.58Å; P1569-F1571 HydrophobicContact CG-CD1 4.39Å; P1569-F1571 HydrophobicContact CG-CD2 4.48Å; P1569-F1571 HydrophobicContact CG-CE1 3.69Å; P1569-F1571 HydrophobicContact CG-CE2 3.78Å; P1569-F1571 HydrophobicContact CG-CZ 3.31Å; P1569-F1571 PolarHBondContact O-N 3.21Å; P1569-H1572 HydrophobicContact CG-CB 4.07Å; P1569-H1572 WeakPolarHBondContact O-CB 3.32Å; P1569-H1572 PolarHBondContact O-N 3.21Å; P1569-L1573 PolarHBondContact O-N 3.3Å; P1569-L1573 VanDerWaalsContact O-N 3.17Å
1570R72.1Confident73.3Confident210.8 Ų210.862.4 Ų62.480%0.79529%0.29SS*.Hα-helixtrans-53.3-42.3-173.7-70.2-176.1179.7178-1.3113.9H1572 L1573 D1574R1570-H1572 VanDerWaalsContact C-N 3.26Å; R1570-H1572 PolarHBondContact O-N 3.03Å; R1570-L1573 WeakPolarHBondContact O-CB 3.44Å; R1570-L1573 PolarHBondContact O-N 3.29Å; R1570-L1573 VanDerWaalsContact O-N 3.13Å; R1570-D1574 VanDerWaalsContact O-CG 3.22Å; R1570-D1574 PolarHBondContact O-N 2.95Å
1571F76.5Confident73.6Confident97.2 Ų97.264.1 Ų64.143%0.42630%0.297SS..Hα-helixtrans-60.7-33.1179.361.9-102000113.1E1516 P1569 A1575E1516-F1571 HydrophobicContact CB-CE2 4.17Å; E1516-F1571 HydrophobicContact CB-CZ 4.32Å; P1569-F1571 VanDerWaalsContact C-N 3.31Å; P1569-F1571 HydrophobicContact CB-CD1 3.86Å; P1569-F1571 HydrophobicContact CB-CE1 3.34Å; P1569-F1571 HydrophobicContact CB-CE2 4.3Å; P1569-F1571 HydrophobicContact CB-CG 4.5Å; P1569-F1571 HydrophobicContact CB-CZ 3.58Å; P1569-F1571 HydrophobicContact CG-CD1 4.39Å; P1569-F1571 HydrophobicContact CG-CD2 4.48Å; P1569-F1571 HydrophobicContact CG-CE1 3.69Å; P1569-F1571 HydrophobicContact CG-CE2 3.78Å; P1569-F1571 HydrophobicContact CG-CZ 3.31Å; P1569-F1571 PolarHBondContact O-N 3.21Å; F1571-A1575 WeakPolarHBondContact O-CB 3.42Å; F1571-A1575 PolarHBondContact O-N 3.24Å
1572H79.4Confident73.9Confident0 Ų066 Ų660%031%0.306CS..Hα-helixtrans-74.9-41.8177.3179.6-87.3000110.3F1510 S1515 W1522 Q1568 P1569 R1570 D1574 A1575 S1576F1510-H1572 AromaticContact CZ-CE1 3.68Å; F1510-H1572 AromaticContact CZ-ND1 3.92Å; F1510-H1572 AromaticContact CZ-NE2 3.83Å; S1515-H1572 PolarHBondContact O-CD2 3.27Å; S1515-H1572 VanDerWaalsContact O-CD2 3.3Å; W1522-H1572 AromaticContact CD1-CD2 3.99Å; W1522-H1572 AromaticContact CD1-NE2 3.69Å; W1522-H1572 AromaticContact NE1-CD2 3.85Å; W1522-H1572 AromaticContact NE1-CE1 3.89Å; W1522-H1572 AromaticContact NE1-NE2 3.09Å; W1522-H1572 PolarHBondContact NE1-NE2 3.19Å; W1522-H1572 VanDerWaalsContact NE1-NE2 3.13Å; Q1568-H1572 PolarHBondContact OE1-CE1 2.96Å; Q1568-H1572 VanDerWaalsContact OE1-CE1 3.3Å; Q1568-H1572 PolarHBondContact OE1-ND1 3.26Å; P1569-H1572 HydrophobicContact CG-CB 4.07Å; P1569-H1572 WeakPolarHBondContact O-CB 3.32Å; P1569-H1572 PolarHBondContact O-N 3.21Å; R1570-H1572 VanDerWaalsContact C-N 3.26Å; R1570-H1572 PolarHBondContact O-N 3.03Å; H1572-D1574 VanDerWaalsContact C-N 3.34Å; H1572-A1575 PolarHBondContact O-N 3.08Å; H1572-S1576 WeakPolarHBondContact O-CB 3.28Å; H1572-S1576 PolarHBondContact O-N 3.14Å; H1572-S1576 PolarHBondContact O-OG 3.1Å
1573L78.2Confident74.6Confident19.4 Ų19.462.5 Ų62.510%0.10229%0.29CS..Hα-helixtrans-57.9-48.4173.6-77.7161.3000111.3Q1568 P1569 R1570 A1575 S1576 C1577 I1607 P1608Q1568-L1573 HydrophobicContact CB-CD1 3.96Å; Q1568-L1573 HydrophobicContact CB-CD2 4.02Å; Q1568-L1573 HydrophobicContact CB-CG 3.84Å; Q1568-L1573 HydrophobicContact CG-CD2 4.4Å; Q1568-L1573 WeakPolarHBondContact O-CD1 3.43Å; Q1568-L1573 VanDerWaalsContact OE1-CD2 3.31Å; P1569-L1573 PolarHBondContact O-N 3.3Å; P1569-L1573 VanDerWaalsContact O-N 3.17Å; R1570-L1573 WeakPolarHBondContact O-CB 3.44Å; R1570-L1573 PolarHBondContact O-N 3.29Å; R1570-L1573 VanDerWaalsContact O-N 3.13Å; L1573-A1575 VanDerWaalsContact C-N 3.35Å; L1573-A1575 PolarHBondContact O-N 3.29Å; L1573-S1576 WeakPolarHBondContact CA-OG 3.21Å; L1573-S1576 PolarHBondContact O-N 2.96Å; L1573-S1576 VanDerWaalsContact O-N 3.12Å; L1573-S1576 PolarHBondContact O-OG 3.13Å; L1573-C1577 WeakPolarHBondContact O-CB 3.42Å; L1573-C1577 PolarHBondContact O-N 3.09Å; L1573-C1577 PolarHBondContact O-SG 3.11Å; L1573-I1607 HydrophobicContact CD2-CB 4.4Å; L1573-I1607 HydrophobicContact CD2-CG1 4.42Å; L1573-I1607 HydrophobicContact CD2-CG2 4.31Å; L1573-P1608 HydrophobicContact CD2-CG 4.36Å
1574D79.4Confident75.5Confident80.6 Ų80.660.9 Ų60.943%0.43128%0.28SS..Hα-helixtrans-58.2-48.6178.4-63.9-26.1000110.8R1570 H1572 S1576 C1577 Y1578R1570-D1574 VanDerWaalsContact O-CG 3.22Å; R1570-D1574 PolarHBondContact O-N 2.95Å; H1572-D1574 VanDerWaalsContact C-N 3.34Å; D1574-S1576 VanDerWaalsContact C-N 3.33Å; D1574-S1576 PolarHBondContact O-N 3.23Å; D1574-C1577 WeakPolarHBondContact O-CB 3.42Å; D1574-C1577 PolarHBondContact O-N 3.2Å; D1574-Y1578 HydrophobicContact CB-CE2 4.39Å; D1574-Y1578 WeakPolarHBondContact O-CD2 3.37Å; D1574-Y1578 PolarHBondContact O-N 3.25Å
1575A80.7Confident76.4Confident15 Ų1563 Ų6312%0.12429%0.289CS..Hα-helixtrans-61.3-39.9177.200000112.7W1522 F1571 H1572 L1573 Y1578 L1579W1522-A1575 HydrophobicContact CB-CB 4.24Å; F1571-A1575 WeakPolarHBondContact O-CB 3.42Å; F1571-A1575 PolarHBondContact O-N 3.24Å; H1572-A1575 PolarHBondContact O-N 3.08Å; L1573-A1575 VanDerWaalsContact C-N 3.35Å; L1573-A1575 PolarHBondContact O-N 3.29Å; A1575-Y1578 PolarHBondContact O-N 3.07Å; A1575-L1579 WeakPolarHBondContact O-CB 3.36Å; A1575-L1579 PolarHBondContact O-N 2.94Å; A1575-L1579 VanDerWaalsContact O-N 3.09Å
1576S83.2Confident77.3Confident0 Ų056.1 Ų56.10%026%0.257CS..Hα-helixtrans-67.9-39.4176.668.80000112.5H1572 L1573 D1574 L1579 M1580H1572-S1576 WeakPolarHBondContact O-CB 3.28Å; H1572-S1576 PolarHBondContact O-N 3.14Å; H1572-S1576 PolarHBondContact O-OG 3.1Å; L1573-S1576 WeakPolarHBondContact CA-OG 3.21Å; L1573-S1576 PolarHBondContact O-N 2.96Å; L1573-S1576 VanDerWaalsContact O-N 3.12Å; L1573-S1576 PolarHBondContact O-OG 3.13Å; D1574-S1576 VanDerWaalsContact C-N 3.33Å; D1574-S1576 PolarHBondContact O-N 3.23Å; S1576-L1579 PolarHBondContact O-N 3.14Å; S1576-M1580 VanDerWaalsContact O-CB 3.27Å; S1576-M1580 WeakPolarHBondContact O-CB 3.34Å; S1576-M1580 PolarHBondContact O-N 3.15Å
1577C81.9Confident78.2Confident8.4 Ų8.450.6 Ų50.66%0.05723%0.233CC..Hα-helixtrans-62.1-44174.1-70.70000111.2L1573 D1574 L1579 M1580 H1581 L1615L1573-C1577 WeakPolarHBondContact O-CB 3.42Å; L1573-C1577 PolarHBondContact O-N 3.09Å; L1573-C1577 PolarHBondContact O-SG 3.11Å; D1574-C1577 WeakPolarHBondContact O-CB 3.42Å; D1574-C1577 PolarHBondContact O-N 3.2Å; C1577-L1579 VanDerWaalsContact C-N 3.35Å; C1577-L1579 PolarHBondContact O-N 3.11Å; C1577-M1580 WeakPolarHBondContact O-CB 3.4Å; C1577-M1580 PolarHBondContact O-N 2.95Å; C1577-H1581 WeakPolarHBondContact O-CB 3.22Å; C1577-H1581 PolarHBondContact O-CD2 2.93Å; C1577-H1581 VanDerWaalsContact O-CD2 3.23Å; C1577-H1581 PolarHBondContact O-N 3.06Å; C1577-L1615 HydrophobicContact CB-CD1 3.83Å
1578Y81.3Confident78.7Confident111.2 Ų111.250.9 Ų50.944%0.43624%0.239SC..Hα-helixtrans-61.6-46176.2-90.4-71.8000111.8T1526 D1530 D1574 A1575 M1580 H1581 K1582 L1615 F1618T1526-Y1578 HydrophobicContact CG2-CD1 3.64Å; T1526-Y1578 HydrophobicContact CG2-CE1 4.31Å; T1526-Y1578 WeakPolarHBondContact OG1-CD1 3.36Å; D1530-Y1578 PolarHBondContact OD2-OH 3.31Å; D1574-Y1578 HydrophobicContact CB-CE2 4.39Å; D1574-Y1578 WeakPolarHBondContact O-CD2 3.37Å; D1574-Y1578 PolarHBondContact O-N 3.25Å; A1575-Y1578 PolarHBondContact O-N 3.07Å; Y1578-M1580 VanDerWaalsContact C-N 3.35Å; Y1578-M1580 PolarHBondContact O-N 3.05Å; Y1578-H1581 PolarHBondContact O-N 3.21Å; Y1578-K1582 HydrophobicContact CD1-CG 4.27Å; Y1578-K1582 HydrophobicContact CE1-CG 4.03Å; Y1578-K1582 VanDerWaalsContact CZ-CE 3.42Å; Y1578-K1582 VanDerWaalsContact O-CG 3.29Å; Y1578-K1582 WeakPolarHBondContact O-CG 3.35Å; Y1578-K1582 PolarHBondContact O-N 3.13Å; Y1578-K1582 VanDerWaalsContact O-N 3.08Å; Y1578-K1582 VanDerWaalsContact OH-CE 3.25Å; Y1578-K1582 WeakPolarHBondContact OH-CE 3.35Å; Y1578-L1615 HydrophobicContact CD1-CD2 4.5Å; Y1578-L1615 HydrophobicContact CE1-CD2 4.01Å; Y1578-F1618 HydrophobicContact CD1-CE1 4.39Å; Y1578-F1618 AromaticContact CD1-CZ 3.8Å; Y1578-F1618 HydrophobicContact CD1-CZ 3.8Å; Y1578-F1618 AromaticContact CE1-CZ 3.69Å; Y1578-F1618 HydrophobicContact CE1-CZ 3.69Å
1579L85.7Confident79Confident1.2 Ų1.250.9 Ų50.91%0.00624%0.24CC..Hα-helixtrans-59.9-46.9177.2-179.275.7000111.7W1522 I1525 T1526 L1529 V1554 F1558 A1575 S1576 C1577 H1581 K1582 L1583 I1603W1522-L1579 HydrophobicContact CB-CD1 3.95Å; W1522-L1579 HydrophobicContact CB-CD2 4.23Å; W1522-L1579 HydrophobicContact CD2-CD1 4.23Å; W1522-L1579 HydrophobicContact CD2-CD2 4.08Å; W1522-L1579 HydrophobicContact CE3-CD1 3.67Å; W1522-L1579 HydrophobicContact CE3-CD2 3.78Å; W1522-L1579 HydrophobicContact CG-CD1 4.37Å; W1522-L1579 HydrophobicContact CG-CD2 4.28Å; W1522-L1579 HydrophobicContact CZ3-CD2 4.46Å; I1525-L1579 HydrophobicContact CB-CD1 4.25Å; I1525-L1579 HydrophobicContact CG2-CD1 3.79Å; T1526-L1579 HydrophobicContact CG2-CB 3.48Å; T1526-L1579 VanDerWaalsContact CG2-CB 3.48Å; T1526-L1579 HydrophobicContact CG2-CD1 3.98Å; T1526-L1579 HydrophobicContact CG2-CG 3.91Å; T1526-L1579 WeakPolarHBondContact OG1-CA 3.3Å; T1526-L1579 WeakPolarHBondContact OG1-CB 3.23Å; L1529-L1579 HydrophobicContact CD1-CD1 3.92Å; V1554-L1579 HydrophobicContact CG1-CD2 4.18Å; F1558-L1579 HydrophobicContact CE2-CD2 4.06Å; F1558-L1579 HydrophobicContact CZ-CD2 4.34Å; A1575-L1579 WeakPolarHBondContact O-CB 3.36Å; A1575-L1579 PolarHBondContact O-N 2.94Å; A1575-L1579 VanDerWaalsContact O-N 3.09Å; S1576-L1579 PolarHBondContact O-N 3.14Å; C1577-L1579 VanDerWaalsContact C-N 3.35Å; C1577-L1579 PolarHBondContact O-N 3.11Å; L1579-H1581 PolarHBondContact O-N 3.28Å; L1579-K1582 PolarHBondContact O-N 3.05Å; L1579-L1583 HydrophobicContact CD1-CD1 4.28Å; L1579-L1583 HydrophobicContact CD1-CG 4.41Å; L1579-L1583 HydrophobicContact CD2-CD1 3.51Å; L1579-L1583 HydrophobicContact CD2-CG 4.26Å; L1579-L1583 HydrophobicContact CG-CD1 4.1Å; L1579-L1583 WeakPolarHBondContact O-CB 3.14Å; L1579-L1583 WeakPolarHBondContact O-CG 3.43Å; L1579-L1583 PolarHBondContact O-N 3.33Å; L1579-I1603 HydrophobicContact CD2-CD1 3.78Å; L1579-I1603 HydrophobicContact CG-CD1 4.1Å
1580M84.7Confident79.1Confident9.2 Ų9.255.2 Ų55.25%0.04527%0.268CS..Hα-helixtrans-57.3-49176.2-179.6-167.381.700112S1576 C1577 Y1578 K1582 L1583 M1584 I1603 M1604 I1607 L1612S1576-M1580 VanDerWaalsContact O-CB 3.27Å; S1576-M1580 WeakPolarHBondContact O-CB 3.34Å; S1576-M1580 PolarHBondContact O-N 3.15Å; C1577-M1580 WeakPolarHBondContact O-CB 3.4Å; C1577-M1580 PolarHBondContact O-N 2.95Å; Y1578-M1580 VanDerWaalsContact C-N 3.35Å; Y1578-M1580 PolarHBondContact O-N 3.05Å; M1580-K1582 VanDerWaalsContact C-N 3.31Å; M1580-K1582 PolarHBondContact O-N 3.17Å; M1580-L1583 PolarHBondContact O-N 3.38Å; M1580-M1584 HydrophobicContact CG-SD 4.45Å; M1580-M1584 WeakPolarHBondContact O-CB 3.37Å; M1580-M1584 VanDerWaalsContact O-CG 3.3Å; M1580-M1584 WeakPolarHBondContact O-CG 3.45Å; M1580-M1584 PolarHBondContact O-N 3.09Å; M1580-I1603 HydrophobicContact CB-CB 4.31Å; M1580-I1603 HydrophobicContact CB-CG2 3.8Å; M1580-I1603 HydrophobicContact CG-CB 4.42Å; M1580-I1603 HydrophobicContact CG-CG2 4.28Å; M1580-I1603 HydrophobicContact SD-CG2 4.43Å; M1580-M1604 HydrophobicContact CE-SD 3.66Å; M1580-M1604 VanDerWaalsContact CE-SD 3.55Å; M1580-M1604 HydrophobicContact CG-CG 4.03Å; M1580-M1604 HydrophobicContact CG-SD 4.25Å; M1580-M1604 HydrophobicContact SD-CB 4.18Å; M1580-M1604 HydrophobicContact SD-CE 4.08Å; M1580-M1604 HydrophobicContact SD-CG 3.6Å; M1580-M1604 WeakPolarHBondContact SD-CG 3.41Å; M1580-M1604 HydrophobicContact SD-SD 3.19Å; M1580-I1607 HydrophobicContact CE-CD1 4.34Å; M1580-I1607 HydrophobicContact SD-CD1 3.73Å; M1580-I1607 VanDerWaalsContact SD-CD1 3.58Å; M1580-L1612 HydrophobicContact CE-CD2 4.16Å
1581H81.9Confident79.2Confident58.6 Ų58.647.3 Ų47.327%0.27124%0.242SC..Hα-helixtrans-60.8-39.6178.3-117.4-79000112.1C1577 Y1578 L1579 M1584 Q1585 F1618C1577-H1581 WeakPolarHBondContact O-CB 3.22Å; C1577-H1581 PolarHBondContact O-CD2 2.93Å; C1577-H1581 VanDerWaalsContact O-CD2 3.23Å; C1577-H1581 PolarHBondContact O-N 3.06Å; Y1578-H1581 PolarHBondContact O-N 3.21Å; L1579-H1581 PolarHBondContact O-N 3.28Å; H1581-M1584 PolarHBondContact O-N 3.32Å; H1581-Q1585 PolarHBondContact CE1-NE2 3.04Å; H1581-Q1585 WeakPolarHBondContact O-CG 3.31Å; H1581-Q1585 PolarHBondContact O-N 3.19Å; H1581-F1618 HydrophobicContact CB-CD1 4.03Å; H1581-F1618 HydrophobicContact CB-CE1 3.73Å; H1581-F1618 AromaticContact CD2-CD1 3.52Å; H1581-F1618 AromaticContact CE1-CD1 3.93Å; H1581-F1618 AromaticContact CG-CD1 3.56Å; H1581-F1618 AromaticContact CG-CE1 3.56Å; H1581-F1618 AromaticContact ND1-CD1 3.85Å; H1581-F1618 AromaticContact ND1-CE1 3.66Å; H1581-F1618 AromaticContact NE2-CD1 3.79Å
1582K81Confident79.2Confident39.8 Ų39.842.7 Ų42.717%0.17322%0.221CC..Hα-helixtrans-69.6-40.2176.8-66.5-54.7-178.9167.10113.1T1526 L1529 D1530 Y1578 L1579 M1580 M1584 Q1585 I1586T1526-K1582 HydrophobicContact CG2-CB 4.27Å; T1526-K1582 HydrophobicContact CG2-CG 3.49Å; T1526-K1582 VanDerWaalsContact CG2-CG 3.48Å; L1529-K1582 HydrophobicContact CB-CB 4.32Å; L1529-K1582 HydrophobicContact CD1-CB 4.31Å; D1530-K1582 VanDerWaalsContact OD1-CD 3.27Å; D1530-K1582 WeakPolarHBondContact OD1-CD 3.42Å; D1530-K1582 WeakPolarHBondContact OD1-CE 3.31Å; D1530-K1582 IonicContact OD1-NZ 2.69Å; D1530-K1582 PolarHBondContact OD1-NZ 3.14Å; D1530-K1582 WeakPolarHBondContact OD2-CE 3.44Å; D1530-K1582 IonicContact OD2-NZ 3.42Å; Y1578-K1582 HydrophobicContact CD1-CG 4.27Å; Y1578-K1582 HydrophobicContact CE1-CG 4.03Å; Y1578-K1582 VanDerWaalsContact CZ-CE 3.42Å; Y1578-K1582 VanDerWaalsContact O-CG 3.29Å; Y1578-K1582 WeakPolarHBondContact O-CG 3.35Å; Y1578-K1582 PolarHBondContact O-N 3.13Å; Y1578-K1582 VanDerWaalsContact O-N 3.08Å; Y1578-K1582 VanDerWaalsContact OH-CE 3.25Å; Y1578-K1582 WeakPolarHBondContact OH-CE 3.35Å; L1579-K1582 PolarHBondContact O-N 3.05Å; M1580-K1582 VanDerWaalsContact C-N 3.31Å; M1580-K1582 PolarHBondContact O-N 3.17Å; K1582-M1584 VanDerWaalsContact C-N 3.3Å; K1582-M1584 PolarHBondContact O-N 3.3Å; K1582-Q1585 WeakPolarHBondContact O-CB 3.4Å; K1582-Q1585 PolarHBondContact O-N 3.26Å; K1582-Q1585 VanDerWaalsContact O-N 3.1Å; K1582-I1586 WeakPolarHBondContact O-CG1 3.42Å; K1582-I1586 PolarHBondContact O-N 3.09Å; K1582-I1586 VanDerWaalsContact O-N 3.13Å
1583L83.1Confident79.2Confident4.2 Ų4.242.8 Ų42.82%0.02222%0.223CC..Hα-helixtrans-60.6-41.5172.7-73.1168.8000111.3L1529 I1551 L1579 M1580 Q1585 I1586 N1587 S1596 C1599 I1603L1529-L1583 HydrophobicContact CD1-CD2 3.69Å; L1529-L1583 HydrophobicContact CD1-CG 3.96Å; I1551-L1583 HydrophobicContact CD1-CD2 4.47Å; L1579-L1583 HydrophobicContact CD1-CD1 4.28Å; L1579-L1583 HydrophobicContact CD1-CG 4.41Å; L1579-L1583 HydrophobicContact CD2-CD1 3.51Å; L1579-L1583 HydrophobicContact CD2-CG 4.26Å; L1579-L1583 HydrophobicContact CG-CD1 4.1Å; L1579-L1583 WeakPolarHBondContact O-CB 3.14Å; L1579-L1583 WeakPolarHBondContact O-CG 3.43Å; L1579-L1583 PolarHBondContact O-N 3.33Å; M1580-L1583 PolarHBondContact O-N 3.38Å; L1583-Q1585 VanDerWaalsContact C-N 3.32Å; L1583-Q1585 PolarHBondContact O-N 3.38Å; L1583-I1586 CarbonylContact O-C 3.58Å; L1583-I1586 WeakPolarHBondContact O-CA 3.2Å; L1583-I1586 PolarHBondContact O-N 3.22Å; L1583-I1586 VanDerWaalsContact O-N 3.11Å; L1583-N1587 PolarHBondContact O-N 3.04Å; L1583-N1587 VanDerWaalsContact O-N 3.16Å; L1583-N1587 PolarHBondContact O-OD1 3.09Å; L1583-N1587 VanDerWaalsContact O-OD1 3.07Å; L1583-S1596 WeakPolarHBondContact O-CB 3.48Å; L1583-S1596 PolarHBondContact O-OG 3.49Å; L1583-C1599 HydrophobicContact CD1-CB 4.07Å; L1583-C1599 VanDerWaalsContact CD1-SG 3.57Å; L1583-I1603 HydrophobicContact CD1-CD1 3.66Å
1584M80.8Confident79.3Confident73.8 Ų73.846.3 Ų46.336%0.36425%0.246SC..Hα-helixtrans-64.2-35.1175.3-72.1-130.890.200113.1M1580 H1581 K1582 I1586 N1587 S1600 M1604 F1625M1580-M1584 HydrophobicContact CG-SD 4.45Å; M1580-M1584 WeakPolarHBondContact O-CB 3.37Å; M1580-M1584 VanDerWaalsContact O-CG 3.3Å; M1580-M1584 WeakPolarHBondContact O-CG 3.45Å; M1580-M1584 PolarHBondContact O-N 3.09Å; H1581-M1584 PolarHBondContact O-N 3.32Å; K1582-M1584 VanDerWaalsContact C-N 3.3Å; K1582-M1584 PolarHBondContact O-N 3.3Å; M1584-I1586 VanDerWaalsContact C-N 3.28Å; M1584-I1586 PolarHBondContact O-N 3.21Å; M1584-N1587 WeakPolarHBondContact O-CB 3.3Å; M1584-N1587 VanDerWaalsContact O-CG 3.31Å; M1584-N1587 PolarHBondContact O-N 3.08Å; M1584-N1587 PolarHBondContact O-ND2 2.68Å; M1584-N1587 PolarHBondContact SD-ND2 3.41Å; M1584-S1600 WeakPolarHBondContact CE-OG 3.47Å; M1584-S1600 PolarHBondContact SD-OG 3.07Å; M1584-S1600 VanDerWaalsContact SD-OG 3.34Å; M1584-M1604 HydrophobicContact CE-CE 3.95Å; M1584-F1625 HydrophobicContact CE-CD2 3.67Å; M1584-F1625 HydrophobicContact CE-CE2 3.23Å; M1584-F1625 HydrophobicContact CE-CZ 3.93Å
1585Q80.8Confident79.3Confident79 Ų7943.3 Ų43.337%0.36923%0.233SC..Hα-helixtrans-66.6-29.4174.3-74.1178.5-5.400112.6L1533 H1581 K1582 L1583 N1587L1533-Q1585 HydrophobicContact CD1-CB 4.13Å; H1581-Q1585 PolarHBondContact CE1-NE2 3.04Å; H1581-Q1585 WeakPolarHBondContact O-CG 3.31Å; H1581-Q1585 PolarHBondContact O-N 3.19Å; K1582-Q1585 WeakPolarHBondContact O-CB 3.4Å; K1582-Q1585 PolarHBondContact O-N 3.26Å; K1582-Q1585 VanDerWaalsContact O-N 3.1Å; L1583-Q1585 VanDerWaalsContact C-N 3.32Å; L1583-Q1585 PolarHBondContact O-N 3.38Å; Q1585-N1587 VanDerWaalsContact C-N 3.31Å; Q1585-N1587 PolarHBondContact O-N 3.42Å
1586I77.3Confident79.4Confident8 Ų842.6 Ų42.64%0.04123%0.227CC..Hα-helixtrans-84.9-7.2-179.6-67.2165.8000112.3L1529 L1533 K1582 L1583 M1584 N1588 D1589 L1592L1529-I1586 HydrophobicContact CB-CD1 3.59Å; L1529-I1586 HydrophobicContact CD1-CD1 4.24Å; L1529-I1586 HydrophobicContact CD2-CD1 3.61Å; L1529-I1586 HydrophobicContact CG-CD1 3.97Å; L1533-I1586 HydrophobicContact CD1-CD1 4.09Å; L1533-I1586 HydrophobicContact CD1-CG1 3.99Å; L1533-I1586 HydrophobicContact CG-CG1 4.14Å; K1582-I1586 WeakPolarHBondContact O-CG1 3.42Å; K1582-I1586 PolarHBondContact O-N 3.09Å; K1582-I1586 VanDerWaalsContact O-N 3.13Å; L1583-I1586 CarbonylContact O-C 3.58Å; L1583-I1586 WeakPolarHBondContact O-CA 3.2Å; L1583-I1586 PolarHBondContact O-N 3.22Å; L1583-I1586 VanDerWaalsContact O-N 3.11Å; M1584-I1586 VanDerWaalsContact C-N 3.28Å; M1584-I1586 PolarHBondContact O-N 3.21Å; I1586-N1588 PolarHBondContact O-N 3.16Å; I1586-D1589 HydrophobicContact CG2-CB 4.01Å; I1586-D1589 VanDerWaalsContact O-CB 3.27Å; I1586-D1589 WeakPolarHBondContact O-CB 3.38Å; I1586-D1589 PolarHBondContact O-N 3.33Å; I1586-L1592 HydrophobicContact CG2-CB 3.63Å; I1586-L1592 HydrophobicContact CG2-CD1 4.07Å; I1586-L1592 HydrophobicContact CG2-CG 4.43Å
1587N73.6Confident79.3Confident46.4 Ų46.445.3 Ų45.325%0.24824%0.241CC..THydrogen-bonded Turntrans-52.4-27.1179-112.9-0.4000114.1L1583 M1584 Q1585 D1589 G1593 S1596 I1597L1583-N1587 PolarHBondContact O-N 3.04Å; L1583-N1587 VanDerWaalsContact O-N 3.16Å; L1583-N1587 PolarHBondContact O-OD1 3.09Å; L1583-N1587 VanDerWaalsContact O-OD1 3.07Å; M1584-N1587 WeakPolarHBondContact O-CB 3.3Å; M1584-N1587 VanDerWaalsContact O-CG 3.31Å; M1584-N1587 PolarHBondContact O-N 3.08Å; M1584-N1587 PolarHBondContact O-ND2 2.68Å; M1584-N1587 PolarHBondContact SD-ND2 3.41Å; Q1585-N1587 VanDerWaalsContact C-N 3.31Å; Q1585-N1587 PolarHBondContact O-N 3.42Å; N1587-D1589 VanDerWaalsContact C-N 3.3Å; N1587-D1589 PolarHBondContact O-N 3.2Å; N1587-G1593 WeakPolarHBondContact O-CA 3.48Å; N1587-S1596 WeakPolarHBondContact OD1-CB 3.49Å; N1587-S1596 PolarHBondContact OD1-OG 3.28Å; N1587-S1596 VanDerWaalsContact OD1-OG 3.06Å; N1587-I1597 HydrophobicContact CB-CD1 4.44Å; N1587-I1597 HydrophobicContact CB-CG1 4.26Å; N1587-I1597 VanDerWaalsContact CG-CG1 3.4Å; N1587-I1597 WeakPolarHBondContact ND2-CG1 3.3Å; N1587-I1597 WeakPolarHBondContact OD1-CD1 3.47Å; N1587-I1597 WeakPolarHBondContact OD1-CG1 3.35Å; N1587-I1597 PolarHBondContact OD1-N 2.87Å; N1587-I1597 VanDerWaalsContact OD1-N 3.14Å
1588N71.7Confident79.2Confident148.4 Ų148.450.6 Ų50.679%0.79426%0.264SS*.THydrogen-bonded Turntrans-77.9-7.8177.7-63.8-22.3000114I1586I1586-N1588 PolarHBondContact O-N 3.16Å
1589D75Confident79.4Confident29.4 Ų29.445.3 Ų45.316%0.15724%0.244CC..  trans-78.7125.8177.7-170.2-60.3000110.2K1543 I1586 N1587 L1591 L1592 G1593K1543-D1589 WeakPolarHBondContact CE-OD2 3.47Å; K1543-D1589 IonicContact NZ-OD1 3.32Å; K1543-D1589 IonicContact NZ-OD2 3.04Å; K1543-D1589 PolarHBondContact NZ-OD2 3.28Å; I1586-D1589 HydrophobicContact CG2-CB 4.01Å; I1586-D1589 VanDerWaalsContact O-CB 3.27Å; I1586-D1589 WeakPolarHBondContact O-CB 3.38Å; I1586-D1589 PolarHBondContact O-N 3.33Å; N1587-D1589 VanDerWaalsContact C-N 3.3Å; N1587-D1589 PolarHBondContact O-N 3.2Å; D1589-L1591 VanDerWaalsContact C-N 3.28Å; D1589-L1591 PolarHBondContact O-N 3.08Å; D1589-L1591 VanDerWaalsContact O-N 3.12Å; D1589-L1591 WeakPolarHBondContact OD1-CA 3.41Å; D1589-L1591 WeakPolarHBondContact OD1-CB 3.24Å; D1589-L1591 PolarHBondContact OD1-N 3.03Å; D1589-L1591 VanDerWaalsContact OD1-N 3.08Å; D1589-L1592 HydrophobicContact CB-CB 4.3Å; D1589-L1592 PolarHBondContact O-N 3.02Å; D1589-L1592 PolarHBondContact OD1-N 3.4Å; D1589-L1592 VanDerWaalsContact OD1-N 3.15Å; D1589-G1593 VanDerWaalsContact O-CA 3.27Å; D1589-G1593 WeakPolarHBondContact O-CA 3.36Å; D1589-G1593 PolarHBondContact O-N 2.99Å
1590P72.7Confident79.2Confident118.4 Ų118.445.4 Ų45.477%0.76925%0.245SC*.THydrogen-bonded Turntrans-64.9-24.9-175.225.5-34.8000113.9
1591L73.9Confident79Confident46 Ų4648.9 Ų48.924%0.24126%0.261CS..THydrogen-bonded Turntrans-89-41.2-179-72.2165.2000111.9N1540 K1543 I1544 R1547 D1589N1540-L1591 HydrophobicContact CB-CD1 4.16Å; K1543-L1591 HydrophobicContact CB-CB 4.4Å; K1543-L1591 HydrophobicContact CB-CD1 4.27Å; K1543-L1591 HydrophobicContact CD-CD1 4.09Å; I1544-L1591 HydrophobicContact CG1-CD2 4.39Å; R1547-L1591 VanDerWaalsContact CD-O 3.23Å; R1547-L1591 WeakPolarHBondContact CD-O 3.33Å; D1589-L1591 VanDerWaalsContact C-N 3.28Å; D1589-L1591 PolarHBondContact O-N 3.08Å; D1589-L1591 VanDerWaalsContact O-N 3.12Å; D1589-L1591 WeakPolarHBondContact OD1-CA 3.41Å; D1589-L1591 WeakPolarHBondContact OD1-CB 3.24Å; D1589-L1591 PolarHBondContact OD1-N 3.03Å; D1589-L1591 VanDerWaalsContact OD1-N 3.08Å
1592L77Confident78.8Confident0.2 Ų0.247.8 Ų47.80%0.00126%0.257CS..THydrogen-bonded Turntrans-96.4-20.9-173.8-74.2150.9000113.6I1532 K1543 L1546 R1547 I1551 I1586 D1589 A1595 S1596I1532-L1592 HydrophobicContact CG2-CD1 4.45Å; K1543-L1592 HydrophobicContact CB-CD1 3.95Å; K1543-L1592 HydrophobicContact CB-CG 4.24Å; K1543-L1592 HydrophobicContact CD-CD1 4.05Å; K1543-L1592 HydrophobicContact CG-CD1 3.85Å; K1543-L1592 WeakPolarHBondContact O-CD2 3.34Å; L1546-L1592 HydrophobicContact CB-CD2 3.93Å; R1547-L1592 HydrophobicContact CB-CD2 4.25Å; I1551-L1592 HydrophobicContact CD1-CD2 3.64Å; I1586-L1592 HydrophobicContact CG2-CB 3.63Å; I1586-L1592 HydrophobicContact CG2-CD1 4.07Å; I1586-L1592 HydrophobicContact CG2-CG 4.43Å; D1589-L1592 HydrophobicContact CB-CB 4.3Å; D1589-L1592 PolarHBondContact O-N 3.02Å; D1589-L1592 PolarHBondContact OD1-N 3.4Å; D1589-L1592 VanDerWaalsContact OD1-N 3.15Å; L1592-A1595 PolarHBondContact O-N 3.08Å; L1592-S1596 VanDerWaalsContact O-CB 3.25Å; L1592-S1596 WeakPolarHBondContact O-CB 3.39Å; L1592-S1596 PolarHBondContact O-N 3.17Å; L1592-S1596 PolarHBondContact O-OG 3.17Å
1593G79Confident78.8Confident2.6 Ų2.645.9 Ų45.93%0.02725%0.248CC..Hα-helixtrans-49.8-58.4-170.400000114.7N1587 D1589 A1595 S1596 I1597N1587-G1593 WeakPolarHBondContact O-CA 3.48Å; D1589-G1593 VanDerWaalsContact O-CA 3.27Å; D1589-G1593 WeakPolarHBondContact O-CA 3.36Å; D1589-G1593 PolarHBondContact O-N 2.99Å; G1593-A1595 PolarHBondContact O-N 3.16Å; G1593-S1596 WeakPolarHBondContact CA-OG 3.39Å; G1593-S1596 PolarHBondContact O-N 3.11Å; G1593-S1596 VanDerWaalsContact O-N 3.15Å; G1593-S1596 PolarHBondContact O-OG 2.81Å; G1593-I1597 WeakPolarHBondContact O-CD1 3.32Å; G1593-I1597 VanDerWaalsContact O-CG1 3.27Å; G1593-I1597 WeakPolarHBondContact O-CG1 3.24Å; G1593-I1597 PolarHBondContact O-N 3.11Å
1594P79.7Confident78.5Confident91.6 Ų91.648.7 Ų48.760%0.59526%0.262SS*.Hα-helixtrans-59.8-45.8-175.8-6.28.2000113.3S1596 I1597 E1598P1594-S1596 VanDerWaalsContact C-N 3.33Å; P1594-S1596 PolarHBondContact O-N 3.25Å; P1594-I1597 PolarHBondContact O-N 3.05Å; P1594-E1598 PolarHBondContact O-N 3.01Å
1595A79.8Confident78.1Confident17.8 Ų17.848.2 Ų48.215%0.14727%0.265CS..Hα-helixtrans-68-36178.900000111.8R1547 I1551 L1592 G1593 C1599R1547-A1595 HydrophobicContact CG-CB 3.98Å; I1551-A1595 HydrophobicContact CB-CB 4.42Å; I1551-A1595 HydrophobicContact CD1-CB 4.39Å; I1551-A1595 HydrophobicContact CG2-CB 3.87Å; I1551-A1595 VanDerWaalsContact CG2-O 3.3Å; I1551-A1595 WeakPolarHBondContact CG2-O 3.34Å; L1592-A1595 PolarHBondContact O-N 3.08Å; G1593-A1595 PolarHBondContact O-N 3.16Å; A1595-C1599 VanDerWaalsContact O-CB 3.28Å; A1595-C1599 WeakPolarHBondContact O-CB 3.33Å; A1595-C1599 PolarHBondContact O-N 3.26Å; A1595-C1599 VanDerWaalsContact O-N 3.08Å
1596S83Confident77.5Confident0 Ų045.1 Ų45.10%025%0.251CS..Hα-helixtrans-69.3-34.7177.227.50000112.4L1583 N1587 L1592 G1593 P1594 C1599 S1600L1583-S1596 WeakPolarHBondContact O-CB 3.48Å; L1583-S1596 PolarHBondContact O-OG 3.49Å; N1587-S1596 WeakPolarHBondContact OD1-CB 3.49Å; N1587-S1596 PolarHBondContact OD1-OG 3.28Å; N1587-S1596 VanDerWaalsContact OD1-OG 3.06Å; L1592-S1596 VanDerWaalsContact O-CB 3.25Å; L1592-S1596 WeakPolarHBondContact O-CB 3.39Å; L1592-S1596 PolarHBondContact O-N 3.17Å; L1592-S1596 PolarHBondContact O-OG 3.17Å; G1593-S1596 WeakPolarHBondContact CA-OG 3.39Å; G1593-S1596 PolarHBondContact O-N 3.11Å; G1593-S1596 VanDerWaalsContact O-N 3.15Å; G1593-S1596 PolarHBondContact O-OG 2.81Å; P1594-S1596 VanDerWaalsContact C-N 3.33Å; P1594-S1596 PolarHBondContact O-N 3.25Å; S1596-C1599 PolarHBondContact O-N 2.72Å; S1596-S1600 VanDerWaalsContact O-CB 3.27Å; S1596-S1600 WeakPolarHBondContact O-CB 3.43Å; S1596-S1600 PolarHBondContact O-N 2.98Å; S1596-S1600 PolarHBondContact O-OG 3.15Å; S1596-S1600 VanDerWaalsContact O-OG 3.1Å
1597I80.8Confident77.2Confident57.8 Ų57.845.2 Ų45.230%0.29625%0.252SS..Hα-helixtrans-62.1-52.5173.9-67.4162.5000110N1587 G1593 P1594 C1599 S1600 Q1601N1587-I1597 HydrophobicContact CB-CD1 4.44Å; N1587-I1597 HydrophobicContact CB-CG1 4.26Å; N1587-I1597 VanDerWaalsContact CG-CG1 3.4Å; N1587-I1597 WeakPolarHBondContact ND2-CG1 3.3Å; N1587-I1597 WeakPolarHBondContact OD1-CD1 3.47Å; N1587-I1597 WeakPolarHBondContact OD1-CG1 3.35Å; N1587-I1597 PolarHBondContact OD1-N 2.87Å; N1587-I1597 VanDerWaalsContact OD1-N 3.14Å; G1593-I1597 WeakPolarHBondContact O-CD1 3.32Å; G1593-I1597 VanDerWaalsContact O-CG1 3.27Å; G1593-I1597 WeakPolarHBondContact O-CG1 3.24Å; G1593-I1597 PolarHBondContact O-N 3.11Å; P1594-I1597 PolarHBondContact O-N 3.05Å; I1597-C1599 VanDerWaalsContact C-N 3.32Å; I1597-C1599 PolarHBondContact O-N 3.01Å; I1597-S1600 WeakPolarHBondContact CA-OG 3.39Å; I1597-S1600 PolarHBondContact O-N 3.25Å; I1597-S1600 VanDerWaalsContact O-N 3.14Å; I1597-S1600 PolarHBondContact O-OG 2.92Å; I1597-Q1601 HydrophobicContact CG2-CG 4.37Å; I1597-Q1601 WeakPolarHBondContact O-CB 3.4Å; I1597-Q1601 VanDerWaalsContact O-CG 3.27Å; I1597-Q1601 WeakPolarHBondContact O-CG 3.31Å; I1597-Q1601 PolarHBondContact O-N 3.12Å
1598E81.1Confident76.8Confident118 Ų11845.8 Ų45.855%0.55126%0.258SS*.Hα-helixtrans-59.2-46-179.6-173-177.9176.200111.2T1555 P1594 S1600 Q1601 M1602T1555-E1598 HydrophobicContact CG2-CG 4.26Å; P1594-E1598 PolarHBondContact O-N 3.01Å; E1598-S1600 PolarHBondContact O-N 3.13Å; E1598-Q1601 PolarHBondContact O-N 3.17Å; E1598-M1602 WeakPolarHBondContact O-CB 3.33Å; E1598-M1602 WeakPolarHBondContact O-CG 3.24Å; E1598-M1602 PolarHBondContact O-N 3.05Å
1599C84Confident76.1Confident0.8 Ų0.843.4 Ų43.41%0.00525%0.254CS..Hα-helixtrans-63.8-43.5177.7-169.30000112.5I1551 V1554 T1555 L1583 A1595 S1596 I1597 Q1601 M1602 I1603I1551-C1599 HydrophobicContact CG2-CB 3.73Å; V1554-C1599 VanDerWaalsContact CG1-SG 3.59Å; T1555-C1599 VanDerWaalsContact CG2-CA 3.46Å; T1555-C1599 HydrophobicContact CG2-CB 3.43Å; T1555-C1599 VanDerWaalsContact CG2-CB 3.43Å; T1555-C1599 WeakPolarHBondContact OG1-CA 3.43Å; T1555-C1599 VanDerWaalsContact OG1-CB 3.26Å; T1555-C1599 WeakPolarHBondContact OG1-CB 3.47Å; T1555-C1599 PolarHBondContact OG1-SG 3.2Å; T1555-C1599 VanDerWaalsContact OG1-SG 3.38Å; L1583-C1599 HydrophobicContact CD1-CB 4.07Å; L1583-C1599 VanDerWaalsContact CD1-SG 3.57Å; A1595-C1599 VanDerWaalsContact O-CB 3.28Å; A1595-C1599 WeakPolarHBondContact O-CB 3.33Å; A1595-C1599 PolarHBondContact O-N 3.26Å; A1595-C1599 VanDerWaalsContact O-N 3.08Å; S1596-C1599 PolarHBondContact O-N 2.72Å; I1597-C1599 VanDerWaalsContact C-N 3.32Å; I1597-C1599 PolarHBondContact O-N 3.01Å; C1599-Q1601 VanDerWaalsContact C-N 3.35Å; C1599-M1602 WeakPolarHBondContact O-CB 3.43Å; C1599-M1602 PolarHBondContact O-N 3.03Å; C1599-I1603 WeakPolarHBondContact O-CD1 3.29Å; C1599-I1603 VanDerWaalsContact O-CG1 3.26Å; C1599-I1603 WeakPolarHBondContact O-CG1 3.38Å; C1599-I1603 PolarHBondContact O-N 3.1Å
1600S82.7Confident75.2Confident3.2 Ų3.249.9 Ų49.92%0.02228%0.283CS..Hα-helixtrans-67-37.3178.965.20000112.4M1584 S1596 I1597 E1598 I1603 M1604M1584-S1600 WeakPolarHBondContact CE-OG 3.47Å; M1584-S1600 PolarHBondContact SD-OG 3.07Å; M1584-S1600 VanDerWaalsContact SD-OG 3.34Å; S1596-S1600 VanDerWaalsContact O-CB 3.27Å; S1596-S1600 WeakPolarHBondContact O-CB 3.43Å; S1596-S1600 PolarHBondContact O-N 2.98Å; S1596-S1600 PolarHBondContact O-OG 3.15Å; S1596-S1600 VanDerWaalsContact O-OG 3.1Å; I1597-S1600 WeakPolarHBondContact CA-OG 3.39Å; I1597-S1600 PolarHBondContact O-N 3.25Å; I1597-S1600 VanDerWaalsContact O-N 3.14Å; I1597-S1600 PolarHBondContact O-OG 2.92Å; E1598-S1600 PolarHBondContact O-N 3.13Å; S1600-I1603 PolarHBondContact O-N 3.04Å; S1600-M1604 WeakPolarHBondContact O-CB 3.43Å; S1600-M1604 VanDerWaalsContact O-CG 3.28Å; S1600-M1604 WeakPolarHBondContact O-CG 3.42Å; S1600-M1604 PolarHBondContact O-N 3.08Å
1601Q80Confident74.4Confident82.2 Ų82.245.9 Ų45.938%0.38426%0.258SS..Hα-helixtrans-63.2-44.7172.6-74174.9-8.100111.2I1597 E1598 C1599 I1603 M1604 C1605I1597-Q1601 HydrophobicContact CG2-CG 4.37Å; I1597-Q1601 WeakPolarHBondContact O-CB 3.4Å; I1597-Q1601 VanDerWaalsContact O-CG 3.27Å; I1597-Q1601 WeakPolarHBondContact O-CG 3.31Å; I1597-Q1601 PolarHBondContact O-N 3.12Å; E1598-Q1601 PolarHBondContact O-N 3.17Å; C1599-Q1601 VanDerWaalsContact C-N 3.35Å; Q1601-I1603 VanDerWaalsContact C-N 3.35Å; Q1601-I1603 PolarHBondContact O-N 3.25Å; Q1601-M1604 WeakPolarHBondContact O-CB 3.38Å; Q1601-M1604 PolarHBondContact O-N 3.26Å; Q1601-C1605 PolarHBondContact O-N 3.28Å; Q1601-C1605 VanDerWaalsContact O-N 3.09Å; Q1601-C1605 PolarHBondContact O-SG 3.04Å; Q1601-C1605 VanDerWaalsContact O-SG 3.35Å
1602M78.6Confident73.4Confident36.6 Ų36.647.3 Ų47.318%0.1827%0.265CS..Hα-helixtrans-62.7-42.3176.3-88.9-40.7-64.500112.2T1555 F1558 A1559 Q1562 E1598 C1599 M1604 C1605 T1606 Y1630T1555-M1602 HydrophobicContact CG2-CB 4.08Å; T1555-M1602 HydrophobicContact CG2-CG 3.77Å; F1558-M1602 HydrophobicContact CB-CG 4.17Å; A1559-M1602 VanDerWaalsContact CA-CE 3.49Å; A1559-M1602 HydrophobicContact CB-CE 3.86Å; A1559-M1602 HydrophobicContact CB-CG 4.38Å; A1559-M1602 HydrophobicContact CB-SD 3.84Å; Q1562-M1602 HydrophobicContact CB-CE 3.81Å; Q1562-M1602 HydrophobicContact CG-CE 4.11Å; Q1562-M1602 VanDerWaalsContact OE1-CE 3.23Å; E1598-M1602 WeakPolarHBondContact O-CB 3.33Å; E1598-M1602 WeakPolarHBondContact O-CG 3.24Å; E1598-M1602 PolarHBondContact O-N 3.05Å; C1599-M1602 WeakPolarHBondContact O-CB 3.43Å; C1599-M1602 PolarHBondContact O-N 3.03Å; M1602-M1604 PolarHBondContact O-N 2.89Å; M1602-C1605 HydrophobicContact CE-CB 4.33Å; M1602-C1605 PolarHBondContact O-N 3.02Å; M1602-T1606 HydrophobicContact CE-CG2 4.05Å; M1602-T1606 WeakPolarHBondContact O-CG2 3.27Å; M1602-T1606 PolarHBondContact O-N 3.28Å; M1602-Y1630 HydrophobicContact SD-CE2 4.47Å
1603I79.8Confident72.1Confident0 Ų052.1 Ų52.10%030%0.298CS..Hα-helixtrans-65.2-43.1176-64161.6000110.7F1558 L1579 M1580 L1583 C1599 S1600 Q1601 C1605 T1606 I1607F1558-I1603 HydrophobicContact CB-CG1 4.22Å; F1558-I1603 HydrophobicContact CD1-CB 4.41Å; F1558-I1603 HydrophobicContact CD1-CG1 3.86Å; F1558-I1603 HydrophobicContact CD1-CG2 4.34Å; F1558-I1603 HydrophobicContact CD2-CD1 4.13Å; F1558-I1603 HydrophobicContact CD2-CG1 3.58Å; F1558-I1603 HydrophobicContact CE1-CB 4.49Å; F1558-I1603 HydrophobicContact CE1-CG1 4.06Å; F1558-I1603 HydrophobicContact CE1-CG2 4.08Å; F1558-I1603 HydrophobicContact CE2-CD1 4.01Å; F1558-I1603 HydrophobicContact CE2-CG1 3.79Å; F1558-I1603 HydrophobicContact CG-CB 4.49Å; F1558-I1603 HydrophobicContact CG-CG1 3.61Å; F1558-I1603 HydrophobicContact CZ-CD1 4.4Å; F1558-I1603 HydrophobicContact CZ-CG1 4.03Å; F1558-I1603 HydrophobicContact CZ-CG2 4.41Å; L1579-I1603 HydrophobicContact CD2-CD1 3.78Å; L1579-I1603 HydrophobicContact CG-CD1 4.1Å; M1580-I1603 HydrophobicContact CB-CB 4.31Å; M1580-I1603 HydrophobicContact CB-CG2 3.8Å; M1580-I1603 HydrophobicContact CG-CB 4.42Å; M1580-I1603 HydrophobicContact CG-CG2 4.28Å; M1580-I1603 HydrophobicContact SD-CG2 4.43Å; L1583-I1603 HydrophobicContact CD1-CD1 3.66Å; C1599-I1603 WeakPolarHBondContact O-CD1 3.29Å; C1599-I1603 VanDerWaalsContact O-CG1 3.26Å; C1599-I1603 WeakPolarHBondContact O-CG1 3.38Å; C1599-I1603 PolarHBondContact O-N 3.1Å; S1600-I1603 PolarHBondContact O-N 3.04Å; Q1601-I1603 VanDerWaalsContact C-N 3.35Å; Q1601-I1603 PolarHBondContact O-N 3.25Å; I1603-C1605 VanDerWaalsContact C-N 3.28Å; I1603-C1605 PolarHBondContact O-N 3.23Å; I1603-T1606 WeakPolarHBondContact O-CB 3.47Å; I1603-T1606 PolarHBondContact O-N 3.15Å; I1603-T1606 PolarHBondContact O-OG1 3.17Å; I1603-I1607 HydrophobicContact CG2-CD1 3.77Å; I1603-I1607 HydrophobicContact CG2-CG1 4.45Å; I1603-I1607 WeakPolarHBondContact O-CG1 3.25Å; I1603-I1607 PolarHBondContact O-N 2.98Å
1604M76.5Confident70.4Confident62.8 Ų62.857.2 Ų57.231%0.30933%0.329SS..Hα-helixtrans-55.6-41.4176.1-115.4-112.8-64.400111.8M1580 M1584 S1600 Q1601 M1602 T1606 I1607 L1612 Y1630M1580-M1604 HydrophobicContact CE-SD 3.66Å; M1580-M1604 VanDerWaalsContact CE-SD 3.55Å; M1580-M1604 HydrophobicContact CG-CG 4.03Å; M1580-M1604 HydrophobicContact CG-SD 4.25Å; M1580-M1604 HydrophobicContact SD-CB 4.18Å; M1580-M1604 HydrophobicContact SD-CE 4.08Å; M1580-M1604 HydrophobicContact SD-CG 3.6Å; M1580-M1604 WeakPolarHBondContact SD-CG 3.41Å; M1580-M1604 HydrophobicContact SD-SD 3.19Å; M1584-M1604 HydrophobicContact CE-CE 3.95Å; S1600-M1604 WeakPolarHBondContact O-CB 3.43Å; S1600-M1604 VanDerWaalsContact O-CG 3.28Å; S1600-M1604 WeakPolarHBondContact O-CG 3.42Å; S1600-M1604 PolarHBondContact O-N 3.08Å; Q1601-M1604 WeakPolarHBondContact O-CB 3.38Å; Q1601-M1604 PolarHBondContact O-N 3.26Å; M1602-M1604 PolarHBondContact O-N 2.89Å; M1604-T1606 PolarHBondContact O-N 3.13Å; M1604-T1606 VanDerWaalsContact O-N 3.16Å; M1604-I1607 PolarHBondContact O-N 3.02Å; M1604-L1612 HydrophobicContact CE-CD1 3.77Å; M1604-L1612 HydrophobicContact CE-CD2 4.16Å; M1604-L1612 HydrophobicContact CE-CG 4.46Å; M1604-L1612 HydrophobicContact SD-CD1 4.42Å; M1604-L1612 HydrophobicContact SD-CD2 3.9Å; M1604-Y1630 HydrophobicContact CE-CD1 4.08Å; M1604-Y1630 HydrophobicContact CE-CE1 3.95Å; M1604-Y1630 HydrophobicContact CG-CE2 4.49Å; M1604-Y1630 HydrophobicContact SD-CE2 4.36Å
1605C72.5Confident68.5Low62.6 Ų62.656.5 Ų56.542%0.42332%0.32SS..Hα-helixtrans-66-17.3176.8-69.20000114Q1562 Q1601 M1602 I1603Q1562-C1605 HydrophobicContact CG-CB 4.47Å; Q1601-C1605 PolarHBondContact O-N 3.28Å; Q1601-C1605 VanDerWaalsContact O-N 3.09Å; Q1601-C1605 PolarHBondContact O-SG 3.04Å; Q1601-C1605 VanDerWaalsContact O-SG 3.35Å; M1602-C1605 HydrophobicContact CE-CB 4.33Å; M1602-C1605 PolarHBondContact O-N 3.02Å; I1603-C1605 VanDerWaalsContact C-N 3.28Å; I1603-C1605 PolarHBondContact O-N 3.23Å
1606T69.5Low66.6Low13.4 Ų13.461.6 Ų61.68%0.08235%0.351CS..Hα-helixtrans-92-15.9178.267.80000114.3F1558 I1561 Q1562 Q1568 M1602 I1603 M1604F1558-T1606 HydrophobicContact CB-CG2 4.29Å; F1558-T1606 HydrophobicContact CD1-CG2 4.08Å; F1558-T1606 VanDerWaalsContact O-CG2 3.26Å; F1558-T1606 WeakPolarHBondContact O-CG2 3.44Å; I1561-T1606 HydrophobicContact CG2-CG2 4.44Å; Q1562-T1606 HydrophobicContact CB-CG2 3.7Å; Q1562-T1606 HydrophobicContact CG-CG2 4.15Å; Q1568-T1606 PolarHBondContact NE2-O 3.37Å; M1602-T1606 HydrophobicContact CE-CG2 4.05Å; M1602-T1606 WeakPolarHBondContact O-CG2 3.27Å; M1602-T1606 PolarHBondContact O-N 3.28Å; I1603-T1606 WeakPolarHBondContact O-CB 3.47Å; I1603-T1606 PolarHBondContact O-N 3.15Å; I1603-T1606 PolarHBondContact O-OG1 3.17Å; M1604-T1606 PolarHBondContact O-N 3.13Å; M1604-T1606 VanDerWaalsContact O-N 3.16Å
1607I69.6Low64.4Low10 Ų1069.5 Ų69.55%0.05139%0.388CS..SBendtrans-94.2123.2-173.9-65.3163.3000109.1L1573 M1580 I1603 M1604 S1609 S1611 L1612L1573-I1607 HydrophobicContact CD2-CB 4.4Å; L1573-I1607 HydrophobicContact CD2-CG1 4.42Å; L1573-I1607 HydrophobicContact CD2-CG2 4.31Å; M1580-I1607 HydrophobicContact CE-CD1 4.34Å; M1580-I1607 HydrophobicContact SD-CD1 3.73Å; M1580-I1607 VanDerWaalsContact SD-CD1 3.58Å; I1603-I1607 HydrophobicContact CG2-CD1 3.77Å; I1603-I1607 HydrophobicContact CG2-CG1 4.45Å; I1603-I1607 WeakPolarHBondContact O-CG1 3.25Å; I1603-I1607 PolarHBondContact O-N 2.98Å; M1604-I1607 PolarHBondContact O-N 3.02Å; I1607-S1609 PolarHBondContact O-N 3.09Å; I1607-S1611 WeakPolarHBondContact CG2-OG 3.33Å; I1607-L1612 HydrophobicContact CB-CD1 4.32Å; I1607-L1612 HydrophobicContact CG2-CD1 3.83Å; I1607-L1612 HydrophobicContact CG2-CD2 4.43Å; I1607-L1612 HydrophobicContact CG2-CG 4.17Å
1608P65.4Low62.2Low59.8 Ų59.872.6 Ų72.639%0.38840%0.4SS..  trans-59.9135.9176.7-12.419.8000111.4L1573 E1610 S1611L1573-P1608 HydrophobicContact CD2-CG 4.36Å; P1608-E1610 PolarHBondContact O-N 3.31Å; P1608-E1610 VanDerWaalsContact O-N 3.07Å; P1608-S1611 PolarHBondContact O-N 3.12Å; P1608-S1611 PolarHBondContact O-OG 3.18Å
1609S58.2Low59.8Low99.2 Ų99.272.6 Ų72.669%0.69441%0.413SS*.THydrogen-bonded Turntrans-53.9-30.1-177.348.30000114.1I1607 S1611 L1612I1607-S1609 PolarHBondContact O-N 3.09Å; S1609-S1611 VanDerWaalsContact C-N 3.31Å; S1609-S1611 PolarHBondContact O-N 2.99Å; S1609-L1612 PolarHBondContact O-N 2.98Å
1610E55.3Low57.2Low165 Ų16582.6 Ų82.677%0.77145%0.452SS*.THydrogen-bonded Turntrans-65.7-30.1177.9-64.4179.6173.300113.3P1608 S1613P1608-E1610 PolarHBondContact O-N 3.31Å; P1608-E1610 VanDerWaalsContact O-N 3.07Å; E1610-S1613 PolarHBondContact O-OG 3.01Å; E1610-S1613 VanDerWaalsContact O-OG 3.12Å
1611S55.3Low54.5Low34.4 Ų34.492.3 Ų92.324%0.24149%0.488CS..G310 helixtrans-81.4-20-17758.80000114.1I1607 P1608 S1609 S1613 V1614I1607-S1611 WeakPolarHBondContact CG2-OG 3.33Å; P1608-S1611 PolarHBondContact O-N 3.12Å; P1608-S1611 PolarHBondContact O-OG 3.18Å; S1609-S1611 VanDerWaalsContact C-N 3.31Å; S1609-S1611 PolarHBondContact O-N 2.99Å; S1611-S1613 VanDerWaalsContact C-N 3.27Å; S1611-S1613 PolarHBondContact O-N 3.05Å; S1611-V1614 PolarHBondContact O-N 3.03Å
1612L54.1Low52.2Low76.2 Ų76.296.3 Ų96.340%0.39951%0.506SS..G310 helixtrans-69.1-21.6178.7-87.2132.4000113.2M1580 M1604 I1607 S1609 V1614M1580-L1612 HydrophobicContact CE-CD2 4.16Å; M1604-L1612 HydrophobicContact CE-CD1 3.77Å; M1604-L1612 HydrophobicContact CE-CD2 4.16Å; M1604-L1612 HydrophobicContact CE-CG 4.46Å; M1604-L1612 HydrophobicContact SD-CD1 4.42Å; M1604-L1612 HydrophobicContact SD-CD2 3.9Å; I1607-L1612 HydrophobicContact CB-CD1 4.32Å; I1607-L1612 HydrophobicContact CG2-CD1 3.83Å; I1607-L1612 HydrophobicContact CG2-CD2 4.43Å; I1607-L1612 HydrophobicContact CG2-CG 4.17Å; S1609-L1612 PolarHBondContact O-N 2.98Å; L1612-V1614 VanDerWaalsContact C-N 3.31Å; L1612-V1614 PolarHBondContact O-N 3.07Å
1613S49.3Very low49.9Very low99.2 Ų99.2101.2 Ų101.269%0.69453%0.533SS*.G310 helixtrans-81.8-7.4-174.252.10000115.3E1610 S1611E1610-S1613 PolarHBondContact O-OG 3.01Å; E1610-S1613 VanDerWaalsContact O-OG 3.12Å; S1611-S1613 VanDerWaalsContact C-N 3.27Å; S1611-S1613 PolarHBondContact O-N 3.05Å
1614V44.2Very low47.6Very low110.4 Ų110.4107.2 Ų107.267%0.66956%0.564SS**G310 helixtrans-109.711.2-165.2-171.40000114.7S1611 L1612 P1616S1611-V1614 PolarHBondContact O-N 3.03Å; L1612-V1614 VanDerWaalsContact C-N 3.31Å; L1612-V1614 PolarHBondContact O-N 3.07Å; V1614-P1616 VanDerWaalsContact O-CD 3.28Å; V1614-P1616 WeakPolarHBondContact O-CD 3.34Å
1615L38.9Very low45.5Very low77.6 Ų77.6111 Ų11141%0.40658%0.579SS.*  trans-106.4115.9173.1-9095.6000112.7C1577 Y1578 E1617 F1618C1577-L1615 HydrophobicContact CB-CD1 3.83Å; Y1578-L1615 HydrophobicContact CD1-CD2 4.5Å; Y1578-L1615 HydrophobicContact CE1-CD2 4.01Å; L1615-E1617 VanDerWaalsContact C-N 3.33Å; L1615-E1617 PolarHBondContact O-N 3.2Å; L1615-E1617 VanDerWaalsContact O-N 3.11Å; L1615-F1618 HydrophobicContact CB-CD2 3.41Å; L1615-F1618 VanDerWaalsContact CB-CD2 3.41Å; L1615-F1618 HydrophobicContact CB-CE2 3.47Å; L1615-F1618 VanDerWaalsContact CB-CE2 3.47Å; L1615-F1618 HydrophobicContact CD2-CD2 4.46Å; L1615-F1618 HydrophobicContact CD2-CE2 3.9Å; L1615-F1618 HydrophobicContact CD2-CZ 4.49Å; L1615-F1618 HydrophobicContact CG-CE2 4.14Å; L1615-F1618 PolarHBondContact O-N 3.2Å
1616P40.1Very low43.4Very low124 Ų124115.4 Ų115.481%0.80560%0.595SS**  trans-78.120.8-171.7-3.617.5000115.2V1614 F1618V1614-P1616 VanDerWaalsContact O-CD 3.28Å; V1614-P1616 WeakPolarHBondContact O-CD 3.34Å; P1616-F1618 VanDerWaalsContact C-N 3.29Å; P1616-F1618 PolarHBondContact O-N 3.07Å; P1616-F1618 VanDerWaalsContact O-N 3.17Å
1617E36.2Very low41.6Very low165.4 Ų165.4120.4 Ų120.477%0.77363%0.626SS**THydrogen-bonded Turntrans-88.840.1178.5-71.3-176.1165.900114.5L1615L1615-E1617 VanDerWaalsContact C-N 3.33Å; L1615-E1617 PolarHBondContact O-N 3.2Å; L1615-E1617 VanDerWaalsContact O-N 3.11Å
1618F35.6Very low39.8Very low124.8 Ų124.8125.9 Ų125.955%0.54766%0.655SS.*  trans-132.969.9176.3-62.7-70.3000113.7Y1578 H1581 L1615 P1616 Y1620Y1578-F1618 HydrophobicContact CD1-CE1 4.39Å; Y1578-F1618 AromaticContact CD1-CZ 3.8Å; Y1578-F1618 HydrophobicContact CD1-CZ 3.8Å; Y1578-F1618 AromaticContact CE1-CZ 3.69Å; Y1578-F1618 HydrophobicContact CE1-CZ 3.69Å; H1581-F1618 HydrophobicContact CB-CD1 4.03Å; H1581-F1618 HydrophobicContact CB-CE1 3.73Å; H1581-F1618 AromaticContact CD2-CD1 3.52Å; H1581-F1618 AromaticContact CE1-CD1 3.93Å; H1581-F1618 AromaticContact CG-CD1 3.56Å; H1581-F1618 AromaticContact CG-CE1 3.56Å; H1581-F1618 AromaticContact ND1-CD1 3.85Å; H1581-F1618 AromaticContact ND1-CE1 3.66Å; H1581-F1618 AromaticContact NE2-CD1 3.79Å; L1615-F1618 HydrophobicContact CB-CD2 3.41Å; L1615-F1618 VanDerWaalsContact CB-CD2 3.41Å; L1615-F1618 HydrophobicContact CB-CE2 3.47Å; L1615-F1618 VanDerWaalsContact CB-CE2 3.47Å; L1615-F1618 HydrophobicContact CD2-CD2 4.46Å; L1615-F1618 HydrophobicContact CD2-CE2 3.9Å; L1615-F1618 HydrophobicContact CD2-CZ 4.49Å; L1615-F1618 HydrophobicContact CG-CE2 4.14Å; L1615-F1618 PolarHBondContact O-N 3.2Å; P1616-F1618 VanDerWaalsContact C-N 3.29Å; P1616-F1618 PolarHBondContact O-N 3.07Å; P1616-F1618 VanDerWaalsContact O-N 3.17Å; F1618-Y1620 PolarHBondContact O-N 3.14Å
1619S29.2Very low38.3Very low117 Ų117125.9 Ų125.982%0.81866%0.657SS**  trans-80.184.7168.6570000111.3
1620Y29.9Very low37.2Very low210.6 Ų210.6128.6 Ų128.683%0.82665%0.653SS**  trans-133.5123.7158.2-131.5-94.6000110.2F1618 Q1622F1618-Y1620 PolarHBondContact O-N 3.14Å; Y1620-Q1622 PolarHBondContact O-N 3.24Å
1621R27.5Very low36.3Very low208 Ų208123.8 Ų123.879%0.78564%0.642SS**  trans-4.9111.2-176.3-80.7-175.8-178.5-178.70.4115.3D1623R1621-D1623 VanDerWaalsContact C-N 3.3Å; R1621-D1623 PolarHBondContact O-N 2.94Å; R1621-D1623 VanDerWaalsContact O-N 3.16Å
1622Q31.7Very low35.4Very low165.2 Ų165.2126.7 Ų126.777%0.77265%0.654SS**G310 helixtrans-78.5-0.9175.2-102.8165.6-26.300114Y1620 I1624 F1625 M1626Y1620-Q1622 PolarHBondContact O-N 3.24Å; Q1622-I1624 VanDerWaalsContact C-N 3.29Å; Q1622-I1624 PolarHBondContact O-N 3.11Å; Q1622-I1624 VanDerWaalsContact O-N 3.13Å; Q1622-F1625 PolarHBondContact O-N 2.83Å; Q1622-M1626 WeakPolarHBondContact O-CG 3.3Å
1623D30.2Very low34.4Very low138.8 Ų138.8127.8 Ų127.874%0.74266%0.66SS**G310 helixtrans-90.20.5-165.6-63.7-26.2000116.5R1621R1621-D1623 VanDerWaalsContact C-N 3.3Å; R1621-D1623 PolarHBondContact O-N 2.94Å; R1621-D1623 VanDerWaalsContact O-N 3.16Å
1624I31.3Very low33.7Very low126.4 Ų126.4131.5 Ų131.565%0.64866%0.659SS**G310 helixtrans-104.3-10.8-177.5-59.8178.1000113.9Q1622Q1622-I1624 VanDerWaalsContact C-N 3.29Å; Q1622-I1624 PolarHBondContact O-N 3.11Å; Q1622-I1624 VanDerWaalsContact O-N 3.13Å
1625F30.7Very low33.3Very low143.4 Ų143.4132.9 Ų132.963%0.62966%0.656SS**THydrogen-bonded Turntrans-118.36.9-173.3-76.1-77.7000116.3M1584 Q1622 T1627M1584-F1625 HydrophobicContact CE-CD2 3.67Å; M1584-F1625 HydrophobicContact CE-CE2 3.23Å; M1584-F1625 HydrophobicContact CE-CZ 3.93Å; Q1622-F1625 PolarHBondContact O-N 2.83Å; F1625-T1627 PolarHBondContact O-N 3.43Å
1626M30Very low33.1Very low154.4 Ų154.4133.4 Ų133.476%0.76166%0.663SS**THydrogen-bonded Turntrans-95.813.1-179-75.1-66.4-73.800115Q1622 Y1630Q1622-M1626 WeakPolarHBondContact O-CG 3.3Å; M1626-Y1630 HydrophobicContact CE-CD2 4.18Å; M1626-Y1630 HydrophobicContact CE-CE2 4.42Å
1627T31.6Very low32.8Very low118.4 Ų118.4133.4 Ų133.473%0.72666%0.655SS**SBendtrans-111.12.7175.8450000114.5F1625F1625-T1627 PolarHBondContact O-N 3.43Å
1628N30.9Very low32.7Very low125.2 Ų125.2131.5 Ų131.567%0.6765%0.646SS**SBendtrans-122.564.2177.1-67.3-7.7000112Y1630N1628-Y1630 PolarHBondContact O-N 3.08Å
1629S35.2Very low32.7Very low59.4 Ų59.4130.9 Ų130.942%0.41565%0.649SS.*  trans-69.9136.1175.777.70000110.5A1631 D1632 L1633S1629-A1631 PolarHBondContact O-N 3.15Å; S1629-A1631 WeakPolarHBondContact OG-CB 3.03Å; S1629-A1631 PolarHBondContact OG-N 3.07Å; S1629-D1632 PolarHBondContact O-N 3.32Å; S1629-D1632 VanDerWaalsContact OG-CG 3.31Å; S1629-D1632 PolarHBondContact OG-OD2 3.03Å; S1629-D1632 VanDerWaalsContact OG-OD2 3.06Å; S1629-L1633 VanDerWaalsContact O-CB 3.28Å; S1629-L1633 WeakPolarHBondContact O-CB 3.36Å; S1629-L1633 WeakPolarHBondContact O-CG 3.34Å; S1629-L1633 PolarHBondContact O-N 3.46Å
1630Y33.4Very low32.8Very low156.4 Ų156.4133.7 Ų133.761%0.61365%0.646SS**Hα-helixtrans-56.5-17.5-179.6-119.1-94.4000113.9M1602 M1604 M1626 N1628 R1634M1602-Y1630 HydrophobicContact SD-CE2 4.47Å; M1604-Y1630 HydrophobicContact CE-CD1 4.08Å; M1604-Y1630 HydrophobicContact CE-CE1 3.95Å; M1604-Y1630 HydrophobicContact CG-CE2 4.49Å; M1604-Y1630 HydrophobicContact SD-CE2 4.36Å; M1626-Y1630 HydrophobicContact CE-CD2 4.18Å; M1626-Y1630 HydrophobicContact CE-CE2 4.42Å; N1628-Y1630 PolarHBondContact O-N 3.08Å; Y1630-R1634 PolarHBondContact O-N 3.2Å
1631A36.8Very low32.8Very low65.6 Ų65.6130.5 Ų130.554%0.54264%0.644SS.*Hα-helixtrans-77.2-33.6176.700000113.3S1629 L1633 R1634 K1635S1629-A1631 PolarHBondContact O-N 3.15Å; S1629-A1631 WeakPolarHBondContact OG-CB 3.03Å; S1629-A1631 PolarHBondContact OG-N 3.07Å; A1631-L1633 PolarHBondContact O-N 3.09Å; A1631-R1634 PolarHBondContact O-N 3.44Å; A1631-K1635 WeakPolarHBondContact O-CB 3.34Å; A1631-K1635 PolarHBondContact O-N 3.25Å
1632D36.7Very low32.8Very low94 Ų94126.3 Ų126.350%0.50364%0.641SS.*Hα-helixtrans-78.1-27.4-177.4-68.9-34.3000112.9S1629 R1634 K1635 T1636S1629-D1632 PolarHBondContact O-N 3.32Å; S1629-D1632 VanDerWaalsContact OG-CG 3.31Å; S1629-D1632 PolarHBondContact OG-OD2 3.03Å; S1629-D1632 VanDerWaalsContact OG-OD2 3.06Å; D1632-R1634 VanDerWaalsContact C-N 3.31Å; D1632-K1635 PolarHBondContact O-N 3.36Å; D1632-T1636 WeakPolarHBondContact O-CB 3.2Å; D1632-T1636 VanDerWaalsContact O-CG2 3.27Å; D1632-T1636 WeakPolarHBondContact O-CG2 3.37Å; D1632-T1636 PolarHBondContact O-N 3.01Å; D1632-T1636 PolarHBondContact O-OG1 3.03Å; D1632-T1636 VanDerWaalsContact O-OG1 3.07Å
1633L33.9Very low32.7Very low98.8 Ų98.8123.2 Ų123.252%0.51764%0.638SS.*Hα-helixtrans-72.9-28.8173-81.8169000112.9S1629 A1631 T1636 L1637S1629-L1633 VanDerWaalsContact O-CB 3.28Å; S1629-L1633 WeakPolarHBondContact O-CB 3.36Å; S1629-L1633 WeakPolarHBondContact O-CG 3.34Å; S1629-L1633 PolarHBondContact O-N 3.46Å; A1631-L1633 PolarHBondContact O-N 3.09Å; L1633-T1636 VanDerWaalsContact CA-OG1 3.31Å; L1633-T1636 WeakPolarHBondContact CA-OG1 3.36Å; L1633-T1636 PolarHBondContact O-OG1 3.25Å; L1633-T1636 VanDerWaalsContact O-OG1 3.13Å; L1633-L1637 PolarHBondContact O-N 3.31Å; L1633-L1637 VanDerWaalsContact O-N 3.15Å
1634R32.9Very low32.5Very low177 Ų177123.2 Ų123.267%0.66864%0.642SS**Hα-helixtrans-76.2-34.8175.5-130179.9-177.61712.6112.5Y1630 A1631 D1632 L1637 E1638Y1630-R1634 PolarHBondContact O-N 3.2Å; A1631-R1634 PolarHBondContact O-N 3.44Å; D1632-R1634 VanDerWaalsContact C-N 3.31Å; R1634-L1637 PolarHBondContact O-N 2.94Å; R1634-E1638 IonicContact NE-OE1 3.4Å; R1634-E1638 WeakPolarHBondContact O-CG 3.35Å; R1634-E1638 PolarHBondContact O-N 3.32Å
1635K36.4Very low32.2Very low141.2 Ų141.2122.6 Ų122.661%0.61465%0.65SS**Hα-helixtrans-74.7-34.9177.7-95.5-176.1171.9-177.20113.9A1631 D1632 L1637 E1638 D1639A1631-K1635 WeakPolarHBondContact O-CB 3.34Å; A1631-K1635 PolarHBondContact O-N 3.25Å; D1632-K1635 PolarHBondContact O-N 3.36Å; K1635-L1637 VanDerWaalsContact C-N 3.25Å; K1635-L1637 PolarHBondContact O-N 3.02Å; K1635-E1638 CarbonylContact O-C 3.25Å; K1635-E1638 PolarHBondContact O-N 3.03Å; K1635-D1639 WeakPolarHBondContact CB-OD2 3.5Å; K1635-D1639 WeakPolarHBondContact CD-OD2 3.4Å; K1635-D1639 WeakPolarHBondContact CG-OD2 3.19Å; K1635-D1639 VanDerWaalsContact O-CB 3.23Å; K1635-D1639 WeakPolarHBondContact O-CB 3.34Å; K1635-D1639 VanDerWaalsContact O-CG 3.23Å; K1635-D1639 PolarHBondContact O-N 3.33Å
1636T34.9Very low32Very low88 Ų88119.1 Ų119.154%0.5465%0.654SS.*Hα-helixtrans-72.4-19.4-179.945.90000113.6D1632 L1633 K1640D1632-T1636 WeakPolarHBondContact O-CB 3.2Å; D1632-T1636 VanDerWaalsContact O-CG2 3.27Å; D1632-T1636 WeakPolarHBondContact O-CG2 3.37Å; D1632-T1636 PolarHBondContact O-N 3.01Å; D1632-T1636 PolarHBondContact O-OG1 3.03Å; D1632-T1636 VanDerWaalsContact O-OG1 3.07Å; L1633-T1636 VanDerWaalsContact CA-OG1 3.31Å; L1633-T1636 WeakPolarHBondContact CA-OG1 3.36Å; L1633-T1636 PolarHBondContact O-OG1 3.25Å; L1633-T1636 VanDerWaalsContact O-OG1 3.13Å; T1636-K1640 VanDerWaalsContact O-CB 3.24Å; T1636-K1640 WeakPolarHBondContact O-CB 2.82Å; T1636-K1640 VanDerWaalsContact O-CG 3.26Å; T1636-K1640 WeakPolarHBondContact O-CG 3.43Å; T1636-K1640 PolarHBondContact O-N 3.49Å
1637L33.4Very low31.9Very low124 Ų124119.8 Ų119.865%0.64966%0.659SS**Hα-helixtrans-84.8-25.6174-111.7134.6000113.6L1633 R1634 K1635 K1640 N1641L1633-L1637 PolarHBondContact O-N 3.31Å; L1633-L1637 VanDerWaalsContact O-N 3.15Å; R1634-L1637 PolarHBondContact O-N 2.94Å; K1635-L1637 VanDerWaalsContact C-N 3.25Å; K1635-L1637 PolarHBondContact O-N 3.02Å; L1637-K1640 PolarHBondContact O-N 3.46Å; L1637-N1641 PolarHBondContact O-N 2.96Å; L1637-N1641 VanDerWaalsContact O-N 3.13Å
1638E35.6Very low31.6Very low124.6 Ų124.6120.2 Ų120.258%0.58266%0.661SS**Hα-helixtrans-86.2-31.9178.5-73.5177.7-17800112.9R1634 K1635 K1640 N1641 T1642R1634-E1638 IonicContact NE-OE1 3.4Å; R1634-E1638 WeakPolarHBondContact O-CG 3.35Å; R1634-E1638 PolarHBondContact O-N 3.32Å; K1635-E1638 CarbonylContact O-C 3.25Å; K1635-E1638 PolarHBondContact O-N 3.03Å; E1638-K1640 PolarHBondContact O-N 3.02Å; E1638-N1641 PolarHBondContact O-N 3.46Å; E1638-T1642 PolarHBondContact O-N 2.88Å; E1638-T1642 VanDerWaalsContact O-N 3.16Å; E1638-T1642 PolarHBondContact O-OG1 3.2Å; E1638-T1642 VanDerWaalsContact O-OG1 3.09Å
1639D34.3Very low31.5Very low112.6 Ų112.6119.5 Ų119.560%0.60267%0.667SS**Hα-helixtrans-85.9-7.1-174.9-72.1-23.2000114.2K1635 N1641 T1642 S1643K1635-D1639 WeakPolarHBondContact CB-OD2 3.5Å; K1635-D1639 WeakPolarHBondContact CD-OD2 3.4Å; K1635-D1639 WeakPolarHBondContact CG-OD2 3.19Å; K1635-D1639 VanDerWaalsContact O-CB 3.23Å; K1635-D1639 WeakPolarHBondContact O-CB 3.34Å; K1635-D1639 VanDerWaalsContact O-CG 3.23Å; K1635-D1639 PolarHBondContact O-N 3.33Å; D1639-N1641 VanDerWaalsContact C-N 3.28Å; D1639-N1641 PolarHBondContact O-N 3.14Å; D1639-T1642 CarbonylContact O-C 3.6Å; D1639-T1642 PolarHBondContact O-N 2.85Å; D1639-T1642 PolarHBondContact O-OG1 2.88Å; D1639-T1642 VanDerWaalsContact O-OG1 3.12Å; D1639-S1643 PolarHBondContact O-N 3.02Å; D1639-S1643 PolarHBondContact O-OG 3.47Å
1640K31.5Very low31Very low176.6 Ų176.6123.6 Ų123.677%0.76868%0.684SS**THydrogen-bonded Turntrans-83.7-1.2174.4-86.5-172.9177.4-179.40114.2T1636 L1637 E1638 T1642 T1644T1636-K1640 VanDerWaalsContact O-CB 3.24Å; T1636-K1640 WeakPolarHBondContact O-CB 2.82Å; T1636-K1640 VanDerWaalsContact O-CG 3.26Å; T1636-K1640 WeakPolarHBondContact O-CG 3.43Å; T1636-K1640 PolarHBondContact O-N 3.49Å; L1637-K1640 PolarHBondContact O-N 3.46Å; E1638-K1640 PolarHBondContact O-N 3.02Å; K1640-T1642 VanDerWaalsContact C-N 3.3Å; K1640-T1644 HydrophobicContact CG-CG2 4.38Å; K1640-T1644 PolarHBondContact O-OG1 3.46Å
1641N29.9Very low30.7Very low143.4 Ų143.4122.6 Ų122.677%0.76769%0.689SS**SBendtrans-102.229172.3-73.6-23.7000112.1L1637 E1638 D1639L1637-N1641 PolarHBondContact O-N 2.96Å; L1637-N1641 VanDerWaalsContact O-N 3.13Å; E1638-N1641 PolarHBondContact O-N 3.46Å; D1639-N1641 VanDerWaalsContact C-N 3.28Å; D1639-N1641 PolarHBondContact O-N 3.14Å
1642T28.5Very low30.3Very low119.8 Ų119.8127.3 Ų127.374%0.73570%0.704SS**SBendtrans-156.776.5170.1500000115E1638 D1639 K1640E1638-T1642 PolarHBondContact O-N 2.88Å; E1638-T1642 VanDerWaalsContact O-N 3.16Å; E1638-T1642 PolarHBondContact O-OG1 3.2Å; E1638-T1642 VanDerWaalsContact O-OG1 3.09Å; D1639-T1642 CarbonylContact O-C 3.6Å; D1639-T1642 PolarHBondContact O-N 2.85Å; D1639-T1642 PolarHBondContact O-OG1 2.88Å; D1639-T1642 VanDerWaalsContact O-OG1 3.12Å; K1640-T1642 VanDerWaalsContact C-N 3.3Å
1643S28Very low29.9Very low100 Ų100130.5 Ų130.570%0.69972%0.72SS**  trans15882.3172.860.20000114.9D1639 S1645D1639-S1643 PolarHBondContact O-N 3.02Å; D1639-S1643 PolarHBondContact O-OG 3.47Å; S1643-S1645 PolarHBondContact O-N 3.15Å
1644T26.2Very low29.5Very low137.2 Ų137.2133 Ų13384%0.84273%0.734SS**  trans-70.596.3135.743.30000112.3K1640K1640-T1644 HydrophobicContact CG-CG2 4.38Å; K1640-T1644 PolarHBondContact O-OG1 3.46Å
1645S26Very low29.2Very low114.6 Ų114.6129.9 Ų129.980%0.80174%0.739SS**  trans-172.2119.4150.258.10000110S1643S1643-S1645 PolarHBondContact O-N 3.15Å
1646G25.1Very low28.7Very low70 Ų70126.6 Ų126.672%0.72275%0.745SS**  trans103.5108.7153.900000114.5
1647I28.1Very low28.3Very low168 Ų168130.6 Ų130.686%0.86276%0.762SS**  trans-157.1116.3138-73.6159.4000106.8
1648T26.2Very low27.8Very low126.8 Ų126.8132.3 Ų132.378%0.77877%0.767SS**  trans-57.8124160.949.90000112.4D1650T1648-D1650 PolarHBondContact O-N 2.82Å
1649S28Very low27.4Very low112.4 Ų112.4133 Ų13379%0.78678%0.775SS**  trans-133.8108.6150.544.40000109.5
1650D24.8Very low26.9Very low144.4 Ų144.4136.1 Ų136.177%0.77279%0.786SS**  trans-80.3135.1145.9-77-32.6000111.4T1648T1648-D1650 PolarHBondContact O-N 2.82Å
1651D28Very low26.6Very low135.2 Ų135.2134.6 Ų134.672%0.72379%0.786SS**  trans122.9110.6150.7-73.5-20.8000115.1T2014D1651-T2014 WeakPolarHBondContact OD2-CG2 3.36Å; D1651-T2014 PolarHBondContact OD2-OG1 3.28Å
1652L28.7Very low26.4Very low164.2 Ų164.2132.7 Ų132.786%0.8678%0.784SS**  trans-168.7100.1149.1-77157.6000112.3
1653I27.6Very low26.2Very low161.4 Ų161.4135.2 Ų135.283%0.82879%0.792SS**  trans-140.1118.9139.7-66.9170.7000110.4
1654D24.7Very low26.1Very low151 Ų151137.8 Ų137.881%0.80780%0.798SS**  trans-97.4140.6157.4-147.2-1.6000113.5
1655S27.6Very low25.9Very low113.2 Ų113.2135.9 Ų135.979%0.79279%0.791SS**  trans115112.415965.30000115.2
1656G25.1Very low25.9Very low71.6 Ų71.6137.9 Ų137.974%0.73879%0.792SS**  trans-165.9108.9154.400000113.4
1657L26.7Very low25.8Very low171 Ų171143 Ų14390%0.89580%0.8SS**  trans87.1117.6133.7-74167.5000114.1
1658Q23.2Very low25.5Very low159.6 Ų159.6144.4 Ų144.475%0.74680%0.8SS**  trans-36.5140.2153-65.3176.4-38.800111.8
1659D26.9Very low25.4Very low141 Ų141147.7 Ų147.775%0.75481%0.806SS**  171.7130.898.5-84-27.7000110.9
1660E24.8Very low25.3Very low176 Ų176148.4 Ų148.482%0.82281%0.806SS**  trans74.1108.8138.1-66-128.514800116.6
1661N24.9Very low25.3Very low145 Ų145148.3 Ų148.378%0.77581%0.81SS**  trans-127.1122.5146.1-71.1-40.2000113.9
1662S24.4Very low25.2Very low105.2 Ų105.2146.2 Ų146.274%0.73681%0.806SS**  trans93.5115134.659.50000114.6D1664S1662-D1664 PolarHBondContact O-N 3.43Å
1663L25.4Very low25.2Very low171.8 Ų171.8144.1 Ų144.190%0.89980%0.8SS**  trans-146112.7144.1-100.7148.5000110.5S1665L1663-S1665 PolarHBondContact O-N 2.81Å; L1663-S1665 VanDerWaalsContact O-N 3.16Å
1664D24.7Very low25.2Very low153.4 Ų153.4144.8 Ų144.882%0.8280%0.797SS**  trans-46.2129.6168.5-72.7-37.4000115.7S1662S1662-D1664 PolarHBondContact O-N 3.43Å
1665S23.6Very low25.3Very low98.8 Ų98.8143.4 Ų143.469%0.69179%0.794SS**  trans-90.5113.9149.960.60000115.2L1663L1663-S1665 PolarHBondContact O-N 2.81Å; L1663-S1665 VanDerWaalsContact O-N 3.16Å
1666N25.3Very low25.4Very low155.2 Ų155.2144.4 Ų144.483%0.8380%0.795SS**  trans176.295.3146-79.1-22.9000111.6F1668N1666-F1668 PolarHBondContact O-N 3.45Å
1667M22.4Very low25.5Very low178.2 Ų178.2147.9 Ų147.988%0.87879%0.792SS**  trans-103.489.4153.9-117.9-112.2138.500110.5
1668F23.3Very low25.5Very low197.4 Ų197.4148.4 Ų148.487%0.86679%0.787SS**  trans-135.8107.5158.3-84.3-78.3000108.8N1666 T1670N1666-F1668 PolarHBondContact O-N 3.45Å; F1668-T1670 VanDerWaalsContact C-N 3.29Å; F1668-T1670 PolarHBondContact O-N 3.18Å; F1668-T1670 VanDerWaalsContact O-N 3.11Å
1669E23.9Very low25.5Very low195 Ų195146.4 Ų146.491%0.91179%0.79SS**  trans-92111.4168.1-105.2175.5166.300110.5V1671E1669-V1671 PolarHBondContact O-N 3.42Å
1670T24.8Very low25.4Very low127.2 Ų127.2147.3 Ų147.378%0.7879%0.789SS**  trans-88.8119173.440.70000109.7F1668 S1672F1668-T1670 VanDerWaalsContact C-N 3.29Å; F1668-T1670 PolarHBondContact O-N 3.18Å; F1668-T1670 VanDerWaalsContact O-N 3.11Å; T1670-S1672 VanDerWaalsContact C-N 3.25Å; T1670-S1672 PolarHBondContact O-N 3.25Å
1671V25.2Very low25.4Very low142.8 Ų142.8146.6 Ų146.687%0.86579%0.788SS**  trans-58.4105.3175.71780000109.4E1669 V1673E1669-V1671 PolarHBondContact O-N 3.42Å; V1671-V1673 PolarHBondContact O-N 3.36Å
1672S25.9Very low25.4Very low91.4 Ų91.4144.5 Ų144.564%0.63978%0.784SS**  trans-93.9122.8177.460.10000111.1T1670 K1674T1670-S1672 VanDerWaalsContact C-N 3.25Å; T1670-S1672 PolarHBondContact O-N 3.25Å; S1672-K1674 PolarHBondContact O-N 3.12Å
1673V29.3Very low25.5Very low119.8 Ų119.8146.3 Ų146.373%0.72679%0.786SS**SBendtrans-59.721.9176.3179.10000113.8V1671 T1675 V1676 Q1677V1671-V1673 PolarHBondContact O-N 3.36Å; V1673-T1675 PolarHBondContact O-N 2.92Å; V1673-V1676 HydrophobicContact CG1-CB 4.48Å; V1673-V1676 PolarHBondContact O-N 3.06Å; V1673-Q1677 HydrophobicContact CG1-CG 4.22Å; V1673-Q1677 WeakPolarHBondContact O-CB 3.24Å; V1673-Q1677 PolarHBondContact O-N 3.22Å; V1673-Q1677 VanDerWaalsContact O-N 3.13Å
1674K26.9Very low25.5Very low176.8 Ų176.8145.2 Ų145.277%0.76978%0.78SS**  trans-1067.3178.8-81-177.3178.7-179.40115.7S1672S1672-K1674 PolarHBondContact O-N 3.12Å
1675T28Very low25.5Very low121 Ų121145.6 Ų145.674%0.74278%0.782SS**  trans-110.410.3168.820.90000113.2V1673 Q1677V1673-T1675 PolarHBondContact O-N 2.92Å; T1675-Q1677 HydrophobicContact CG2-CB 4.48Å; T1675-Q1677 PolarHBondContact O-N 3.29Å
1676V28Very low25.6Very low133.2 Ų133.2145.8 Ų145.881%0.80778%0.783SS**  trans-841.6171.3-177.90000110.9V1673 K1678 C1679V1673-V1676 HydrophobicContact CG1-CB 4.48Å; V1673-V1676 PolarHBondContact O-N 3.06Å; V1676-K1678 VanDerWaalsContact C-N 3.33Å; V1676-K1678 PolarHBondContact O-N 2.99Å; V1676-C1679 WeakPolarHBondContact O-CB 2.96Å; V1676-C1679 PolarHBondContact O-N 3.47Å; V1676-C1679 VanDerWaalsContact O-N 3.15Å
1677Q27.7Very low25.7Very low145.2 Ų145.2146.9 Ų146.968%0.67978%0.784SS**G310 helixtrans-95.429.5176.6-112.7178-13.200112.8V1673 T1675 C1679 H1680V1673-Q1677 HydrophobicContact CG1-CG 4.22Å; V1673-Q1677 WeakPolarHBondContact O-CB 3.24Å; V1673-Q1677 PolarHBondContact O-N 3.22Å; V1673-Q1677 VanDerWaalsContact O-N 3.13Å; T1675-Q1677 HydrophobicContact CG2-CB 4.48Å; T1675-Q1677 PolarHBondContact O-N 3.29Å; Q1677-C1679 VanDerWaalsContact C-N 3.27Å; Q1677-C1679 PolarHBondContact O-N 3.09Å; Q1677-H1680 PolarHBondContact NE2-NE2 3.37Å; Q1677-H1680 PolarHBondContact O-CD2 3.49Å; Q1677-H1680 PolarHBondContact O-N 3.14Å
1678K26.2Very low25.9Very low182.4 Ų182.4146.3 Ų146.379%0.79378%0.782SS**THydrogen-bonded Turntrans-86.623.5163.7-84.1-179.6179.8-177.20114.3V1676 H1680V1676-K1678 VanDerWaalsContact C-N 3.33Å; V1676-K1678 PolarHBondContact O-N 2.99Å; K1678-H1680 VanDerWaalsContact C-N 3.31Å; K1678-H1680 PolarHBondContact O-N 3.39Å
1679C23.9Very low26Very low118.6 Ų118.6145.4 Ų145.480%0.80178%0.78SS**  trans-86.445.1172-660000112.2V1676 Q1677 M1681V1676-C1679 WeakPolarHBondContact O-CB 2.96Å; V1676-C1679 PolarHBondContact O-N 3.47Å; V1676-C1679 VanDerWaalsContact O-N 3.15Å; Q1677-C1679 VanDerWaalsContact C-N 3.27Å; Q1677-C1679 PolarHBondContact O-N 3.09Å; C1679-M1681 VanDerWaalsContact C-N 3.26Å; C1679-M1681 PolarHBondContact O-N 3.3Å
1680H24.8Very low26Very low159.2 Ų159.2144.4 Ų144.474%0.73778%0.778SS**  trans-90.874.1167.1-88.5-73.1000111.3Q1677 K1678 S1682Q1677-H1680 PolarHBondContact NE2-NE2 3.37Å; Q1677-H1680 PolarHBondContact O-CD2 3.49Å; Q1677-H1680 PolarHBondContact O-N 3.14Å; K1678-H1680 VanDerWaalsContact C-N 3.31Å; K1678-H1680 PolarHBondContact O-N 3.39Å; H1680-S1682 VanDerWaalsContact C-N 3.34Å; H1680-S1682 PolarHBondContact O-N 3.13Å; H1680-S1682 VanDerWaalsContact O-N 3.08Å; H1680-S1682 PolarHBondContact O-OG 3.43Å
1681M24.4Very low26.2Very low162 Ų162143.7 Ų143.780%0.79878%0.778SS**  trans-54.775.6161.8-67.9-76.3-87.900111.4C1679 N1683 L1685C1679-M1681 VanDerWaalsContact C-N 3.26Å; C1679-M1681 PolarHBondContact O-N 3.3Å; M1681-N1683 VanDerWaalsContact C-N 3.28Å; M1681-N1683 PolarHBondContact O-N 3.2Å; M1681-L1685 WeakPolarHBondContact O-CD1 3.32Å
1682S25.9Very low26.3Very low100.8 Ų100.8145.6 Ų145.671%0.70578%0.778SS**  trans-78.8102.316554.40000110.3H1680 N1684H1680-S1682 VanDerWaalsContact C-N 3.34Å; H1680-S1682 PolarHBondContact O-N 3.13Å; H1680-S1682 VanDerWaalsContact O-N 3.08Å; H1680-S1682 PolarHBondContact O-OG 3.43Å; S1682-N1684 PolarHBondContact O-N 3.01Å
1683N25.8Very low26.5Very low142 Ų142146.5 Ų146.576%0.75978%0.781SS**SBendtrans-20.472.2165-64.7-16.8000115.8M1681M1681-N1683 VanDerWaalsContact C-N 3.28Å; M1681-N1683 PolarHBondContact O-N 3.2Å
1684N25.1Very low26.4Very low148.2 Ų148.2148.2 Ų148.279%0.79378%0.783SS**  trans-139.651163.4-84.9-8.3000111.1S1682 S1686 E1687S1682-N1684 PolarHBondContact O-N 3.01Å; N1684-S1686 PolarHBondContact O-N 3.41Å; N1684-E1687 PolarHBondContact O-N 3.13Å
1685L24.8Very low26.8Very low162.2 Ų162.2146.1 Ų146.185%0.84978%0.78SS**  trans-124.644.6167.4-94158.1000110.4M1681 E1687M1681-L1685 WeakPolarHBondContact O-CD1 3.32Å; L1685-E1687 VanDerWaalsContact C-N 3.35Å; L1685-E1687 PolarHBondContact O-N 3.21Å
1686S25.6Very low27.1Very low103.6 Ų103.6146.6 Ų146.672%0.72478%0.779SS**  trans-93.477.6165.949.30000110.6N1684N1684-S1686 PolarHBondContact O-N 3.41Å
1687E26.8Very low27.6Very low178.6 Ų178.6144.4 Ų144.484%0.83577%0.766SS**  trans171.759.8173.1-72.3-177.9171.500114.4N1684 L1685N1684-E1687 PolarHBondContact O-N 3.13Å; L1685-E1687 VanDerWaalsContact C-N 3.35Å; L1685-E1687 PolarHBondContact O-N 3.21Å
1688I27.8Very low28.2Very low164.8 Ų164.8143.5 Ų143.585%0.84577%0.765SS**  trans-13987.7148-62.2175.4000108.2M1690I1688-M1690 VanDerWaalsContact C-N 3.35Å; I1688-M1690 PolarHBondContact O-N 2.81Å; I1688-M1690 VanDerWaalsContact O-N 3.12Å
1689Q24.3Very low28.8Very low177.6 Ų177.6144 Ų14483%0.8376%0.762SS**  trans-71.8127.9175.8-74.6174.4-26.900111.3
1690M23.8Very low30Very low175.6 Ų175.6141.1 Ų141.187%0.86574%0.744SS**  trans74.698.4147.2-65.8-76.1-86.300114.6I1688I1688-M1690 VanDerWaalsContact C-N 3.35Å; I1688-M1690 PolarHBondContact O-N 2.81Å; I1688-M1690 VanDerWaalsContact O-N 3.12Å
1691S29.5Very low30.9Very low111.2 Ų111.2138.4 Ų138.478%0.77873%0.734SS**  trans-166.7110.914852.80000111.3
1692Q27.7Very low32.2Very low184.4 Ų184.4133.7 Ų133.786%0.86272%0.717SS**  trans-37.7130.9157.5-68.9-174.1-22.600113.7M1694Q1692-M1694 PolarHBondContact O-N 2.92Å; Q1692-M1694 VanDerWaalsContact O-N 3.15Å
1693P30.2Very low33.6Very low108.6 Ų108.6134.3 Ų134.371%0.70571%0.709SS**  trans-95.6116-171.135.4-28.1000112.6T1697P1693-T1697 PolarHBondContact O-OG1 3.43Å
1694M27.2Very low35.1Very low155.2 Ų155.2132.2 Ų132.277%0.76570%0.698SS**  trans-90.170.4165.6-63.6-64.4-87.300113.7Q1692Q1692-M1694 PolarHBondContact O-N 2.92Å; Q1692-M1694 VanDerWaalsContact O-N 3.15Å
1695D35.1Very low36.8Very low133.4 Ų133.4129.4 Ų129.471%0.71368%0.678SS**SBendtrans-156.723.8150.3-73.4-22.2000114.4T1697 R1699D1695-T1697 PolarHBondContact O-N 3.32Å; D1695-T1697 PolarHBondContact O-OG1 3.04Å; D1695-R1699 PolarHBondContact O-N 3.29Å
1696D34.9Very low38.5Very low132 Ų132123.2 Ų123.271%0.70665%0.651SS**  trans-49.60.6176-71.8-26.1000116.9N1698 R1699 S1700D1696-N1698 PolarHBondContact O-N 3.17Å; D1696-R1699 PolarHBondContact O-N 3.29Å; D1696-S1700 WeakPolarHBondContact O-CB 3.18Å; D1696-S1700 PolarHBondContact O-N 3.33Å; D1696-S1700 VanDerWaalsContact O-N 3.08Å; D1696-S1700 PolarHBondContact O-OG 3.2Å
1697T38Very low40.4Very low87.4 Ų87.4124.7 Ų124.754%0.53664%0.644SS.*Hα-helixtrans-80.7-20.6178.645.40000113.7P1693 D1695 R1699 S1700 L1701P1693-T1697 PolarHBondContact O-OG1 3.43Å; D1695-T1697 PolarHBondContact O-N 3.32Å; D1695-T1697 PolarHBondContact O-OG1 3.04Å; T1697-R1699 VanDerWaalsContact C-N 3.29Å; T1697-R1699 PolarHBondContact O-N 3.02Å; T1697-S1700 WeakPolarHBondContact CA-OG 3.35Å; T1697-S1700 PolarHBondContact O-N 2.9Å; T1697-S1700 PolarHBondContact O-OG 3.06Å; T1697-L1701 WeakPolarHBondContact O-CB 3.43Å; T1697-L1701 WeakPolarHBondContact O-CD1 3.27Å; T1697-L1701 WeakPolarHBondContact O-CG 3.37Å; T1697-L1701 PolarHBondContact O-N 2.91Å
1698N39.6Very low42.3Very low126.2 Ų126.2119.8 Ų119.868%0.67562%0.624SS**Hα-helixtrans-71-23.2-179.4-76.7-21000114D1696 S1702D1696-N1698 PolarHBondContact O-N 3.17Å; N1698-S1702 PolarHBondContact O-N 3.04Å; N1698-S1702 PolarHBondContact O-OG 3.25Å
1699R39.9Very low44Very low191.8 Ų191.8113.9 Ų113.972%0.72459%0.593SS**Hα-helixtrans-78.7-39.8178.8-96.6-179.2175.1-179.7-1.1113.3D1695 D1696 T1697 L1701 S1702 Q1703D1695-R1699 PolarHBondContact O-N 3.29Å; D1696-R1699 PolarHBondContact O-N 3.29Å; T1697-R1699 VanDerWaalsContact C-N 3.29Å; T1697-R1699 PolarHBondContact O-N 3.02Å; R1699-L1701 VanDerWaalsContact C-N 3.33Å; R1699-L1701 PolarHBondContact O-N 2.86Å; R1699-S1702 PolarHBondContact O-N 3.21Å; R1699-S1702 PolarHBondContact O-OG 3.06Å; R1699-Q1703 WeakPolarHBondContact O-CG 3.34Å; R1699-Q1703 PolarHBondContact O-N 3.26Å; R1699-Q1703 VanDerWaalsContact O-N 3.08Å
1700S48.2Very low46.1Very low58.8 Ų58.8110.1 Ų110.141%0.41158%0.576SS.*Hα-helixtrans-69.3-36.1179.355.80000112.3D1696 T1697 S1702 Q1703 N1704D1696-S1700 WeakPolarHBondContact O-CB 3.18Å; D1696-S1700 PolarHBondContact O-N 3.33Å; D1696-S1700 VanDerWaalsContact O-N 3.08Å; D1696-S1700 PolarHBondContact O-OG 3.2Å; T1697-S1700 WeakPolarHBondContact CA-OG 3.35Å; T1697-S1700 PolarHBondContact O-N 2.9Å; T1697-S1700 PolarHBondContact O-OG 3.06Å; S1700-S1702 PolarHBondContact O-N 2.65Å; S1700-Q1703 PolarHBondContact O-N 3.22Å; S1700-N1704 WeakPolarHBondContact O-CB 3.28Å; S1700-N1704 VanDerWaalsContact O-CG 3.28Å; S1700-N1704 PolarHBondContact O-N 3.25Å; S1700-N1704 VanDerWaalsContact O-N 3.09Å; S1700-N1704 PolarHBondContact O-ND2 3.1Å
1701L44.4Very low48.4Very low101.2 Ų101.2107.5 Ų107.553%0.5356%0.56SS.*Hα-helixtrans-61.2-45.9174.9-95143.2000111.9A1034 T1697 R1699 Q1703 N1704 F1705A1034-L1701 HydrophobicContact CB-CD2 4.47Å; T1697-L1701 WeakPolarHBondContact O-CB 3.43Å; T1697-L1701 WeakPolarHBondContact O-CD1 3.27Å; T1697-L1701 WeakPolarHBondContact O-CG 3.37Å; T1697-L1701 PolarHBondContact O-N 2.91Å; R1699-L1701 VanDerWaalsContact C-N 3.33Å; R1699-L1701 PolarHBondContact O-N 2.86Å; L1701-Q1703 VanDerWaalsContact C-N 3.33Å; L1701-Q1703 PolarHBondContact O-N 3.17Å; L1701-N1704 PolarHBondContact O-N 3.13Å; L1701-F1705 VanDerWaalsContact C-CD2 3.45Å; L1701-F1705 HydrophobicContact CB-CD2 4.2Å; L1701-F1705 HydrophobicContact CB-CE2 3.97Å; L1701-F1705 HydrophobicContact CD2-CD2 4.45Å; L1701-F1705 HydrophobicContact CD2-CE2 3.58Å; L1701-F1705 HydrophobicContact CD2-CZ 4.11Å; L1701-F1705 HydrophobicContact CG-CE2 4.4Å; L1701-F1705 VanDerWaalsContact O-CB 3.3Å; L1701-F1705 WeakPolarHBondContact O-CB 3.35Å; L1701-F1705 WeakPolarHBondContact O-CD2 3.29Å; L1701-F1705 WeakPolarHBondContact O-CG 3.17Å; L1701-F1705 PolarHBondContact O-N 2.93Å
1702S51.8Low50.2Low64.2 Ų64.2105.4 Ų105.445%0.44954%0.537SS..Hα-helixtrans-64.6-35.7-179.269.70000113.6N1698 R1699 S1700 F1705 A1706N1698-S1702 PolarHBondContact O-N 3.04Å; N1698-S1702 PolarHBondContact O-OG 3.25Å; R1699-S1702 PolarHBondContact O-N 3.21Å; R1699-S1702 PolarHBondContact O-OG 3.06Å; S1700-S1702 PolarHBondContact O-N 2.65Å; S1702-F1705 PolarHBondContact O-N 3.48Å; S1702-A1706 WeakPolarHBondContact O-CB 3.33Å; S1702-A1706 PolarHBondContact O-N 3.07Å; S1702-A1706 VanDerWaalsContact O-N 3.09Å
1703Q54.1Low52.2Low112.4 Ų112.499.3 Ų99.353%0.52551%0.508SS..Hα-helixtrans-73-39.8177.3-76.2-176.8-15.100112.3R1699 S1700 L1701 F1705 A1706 K1707R1699-Q1703 WeakPolarHBondContact O-CG 3.34Å; R1699-Q1703 PolarHBondContact O-N 3.26Å; R1699-Q1703 VanDerWaalsContact O-N 3.08Å; S1700-Q1703 PolarHBondContact O-N 3.22Å; L1701-Q1703 VanDerWaalsContact C-N 3.33Å; L1701-Q1703 PolarHBondContact O-N 3.17Å; Q1703-F1705 VanDerWaalsContact C-N 3.33Å; Q1703-A1706 PolarHBondContact O-N 3.04Å; Q1703-K1707 WeakPolarHBondContact O-CB 3.34Å; Q1703-K1707 WeakPolarHBondContact O-CG 3.39Å; Q1703-K1707 PolarHBondContact O-N 3.02Å
1704N57.6Low54.2Low99.8 Ų99.897.9 Ų97.953%0.53450%0.495SS..Hα-helixtrans-67-37.8175.6-73.2-16.3000111.3S1700 L1701 K1707 N1708S1700-N1704 WeakPolarHBondContact O-CB 3.28Å; S1700-N1704 VanDerWaalsContact O-CG 3.28Å; S1700-N1704 PolarHBondContact O-N 3.25Å; S1700-N1704 VanDerWaalsContact O-N 3.09Å; S1700-N1704 PolarHBondContact O-ND2 3.1Å; L1701-N1704 PolarHBondContact O-N 3.13Å; N1704-K1707 PolarHBondContact O-N 3.14Å; N1704-N1708 WeakPolarHBondContact O-CB 3.29Å; N1704-N1708 VanDerWaalsContact O-CG 3.28Å; N1704-N1708 PolarHBondContact O-N 3.14Å
1705F61Low56.4Low88.4 Ų88.494.1 Ų94.139%0.38848%0.478SS..Hα-helixtrans-61.8-46.8173.2-154.7-92.8000112.1Q1031 V1145 L1701 S1702 Q1703 K1707 N1708 I1709Q1031-F1705 HydrophobicContact CB-CE2 4.36Å; V1145-F1705 HydrophobicContact CG1-CD1 3.72Å; V1145-F1705 HydrophobicContact CG1-CE1 3.79Å; L1701-F1705 VanDerWaalsContact C-CD2 3.45Å; L1701-F1705 HydrophobicContact CB-CD2 4.2Å; L1701-F1705 HydrophobicContact CB-CE2 3.97Å; L1701-F1705 HydrophobicContact CD2-CD2 4.45Å; L1701-F1705 HydrophobicContact CD2-CE2 3.58Å; L1701-F1705 HydrophobicContact CD2-CZ 4.11Å; L1701-F1705 HydrophobicContact CG-CE2 4.4Å; L1701-F1705 VanDerWaalsContact O-CB 3.3Å; L1701-F1705 WeakPolarHBondContact O-CB 3.35Å; L1701-F1705 WeakPolarHBondContact O-CD2 3.29Å; L1701-F1705 WeakPolarHBondContact O-CG 3.17Å; L1701-F1705 PolarHBondContact O-N 2.93Å; S1702-F1705 PolarHBondContact O-N 3.48Å; Q1703-F1705 VanDerWaalsContact C-N 3.33Å; F1705-K1707 VanDerWaalsContact C-N 3.34Å; F1705-K1707 PolarHBondContact O-N 3.48Å; F1705-N1708 PolarHBondContact O-N 3.14Å; F1705-I1709 HydrophobicContact CD1-CD1 3.69Å; F1705-I1709 HydrophobicContact CD1-CG1 4.21Å; F1705-I1709 HydrophobicContact CE1-CD1 3.38Å; F1705-I1709 HydrophobicContact CE1-CG1 4.41Å; F1705-I1709 HydrophobicContact CE2-CD1 4.24Å; F1705-I1709 HydrophobicContact CG-CD1 4.31Å; F1705-I1709 HydrophobicContact CZ-CD1 3.63Å; F1705-I1709 VanDerWaalsContact CZ-CD1 3.49Å; F1705-I1709 WeakPolarHBondContact O-CG1 3.26Å; F1705-I1709 PolarHBondContact O-N 3.01Å; F1705-I1709 VanDerWaalsContact O-N 3.09Å
1706A61.7Low58Low32 Ų3289.8 Ų89.826%0.26445%0.454SS..Hα-helixtrans-61.1-44.7176.800000112.4V1145 S1702 Q1703 N1708 I1709 E1710V1145-A1706 HydrophobicContact CB-CB 4.04Å; V1145-A1706 HydrophobicContact CG1-CB 4.03Å; S1702-A1706 WeakPolarHBondContact O-CB 3.33Å; S1702-A1706 PolarHBondContact O-N 3.07Å; S1702-A1706 VanDerWaalsContact O-N 3.09Å; Q1703-A1706 PolarHBondContact O-N 3.04Å; A1706-N1708 VanDerWaalsContact C-N 3.31Å; A1706-N1708 PolarHBondContact O-N 3.22Å; A1706-I1709 PolarHBondContact O-N 3.01Å; A1706-E1710 VanDerWaalsContact O-CB 3.25Å; A1706-E1710 WeakPolarHBondContact O-CB 3.41Å; A1706-E1710 WeakPolarHBondContact O-CG 3.32Å; A1706-E1710 PolarHBondContact O-N 2.92Å
1707K64.8Low59.7Low134.6 Ų134.685.3 Ų85.359%0.58543%0.429SS*.Hα-helixtrans-63.3-37.7176.8-76.2179.8179178.20112.8Q1703 N1704 F1705 E1710 K1711Q1703-K1707 WeakPolarHBondContact O-CB 3.34Å; Q1703-K1707 WeakPolarHBondContact O-CG 3.39Å; Q1703-K1707 PolarHBondContact O-N 3.02Å; N1704-K1707 PolarHBondContact O-N 3.14Å; F1705-K1707 VanDerWaalsContact C-N 3.34Å; F1705-K1707 PolarHBondContact O-N 3.48Å; K1707-E1710 PolarHBondContact O-N 2.88Å; K1707-K1711 VanDerWaalsContact O-CB 3.3Å; K1707-K1711 WeakPolarHBondContact O-CB 3.35Å; K1707-K1711 PolarHBondContact O-N 3.27Å
1708N66.6Low61.2Low76.4 Ų76.487.6 Ų87.641%0.40943%0.432SS..Hα-helixtrans-67.6-41.2177.1-1150.2000111.7N1704 F1705 A1706 E1710 K1711 Q1712N1704-N1708 WeakPolarHBondContact O-CB 3.29Å; N1704-N1708 VanDerWaalsContact O-CG 3.28Å; N1704-N1708 PolarHBondContact O-N 3.14Å; F1705-N1708 PolarHBondContact O-N 3.14Å; A1706-N1708 VanDerWaalsContact C-N 3.31Å; A1706-N1708 PolarHBondContact O-N 3.22Å; N1708-E1710 PolarHBondContact O-N 2.94Å; N1708-K1711 WeakPolarHBondContact O-CB 3.26Å; N1708-K1711 PolarHBondContact O-N 3.11Å; N1708-Q1712 WeakPolarHBondContact O-CB 3.42Å; N1708-Q1712 WeakPolarHBondContact O-CG 3.23Å; N1708-Q1712 PolarHBondContact O-N 3.24Å
1709I64.3Low62.7Low39.8 Ų39.885.6 Ų85.620%0.20442%0.418CS..Hα-helixtrans-63.3-44.5175-69.2168.7000110.9W871 L1026 L1143 V1145 F1705 A1706 K1711 Q1712 F1713W871-I1709 HydrophobicContact CD2-CD1 4.13Å; W871-I1709 HydrophobicContact CE3-CG2 4.13Å; W871-I1709 HydrophobicContact CH2-CG2 4.36Å; W871-I1709 HydrophobicContact CZ2-CD1 3.95Å; W871-I1709 HydrophobicContact CZ2-CG1 4.4Å; W871-I1709 HydrophobicContact CZ3-CG2 4.04Å; L1026-I1709 HydrophobicContact CD2-CG2 4.28Å; L1143-I1709 HydrophobicContact CD2-CG2 3.62Å; V1145-I1709 HydrophobicContact CG1-CD1 3.7Å; V1145-I1709 HydrophobicContact CG2-CB 4.13Å; V1145-I1709 HydrophobicContact CG2-CD1 4.05Å; V1145-I1709 HydrophobicContact CG2-CG2 3.74Å; F1705-I1709 HydrophobicContact CD1-CD1 3.69Å; F1705-I1709 HydrophobicContact CD1-CG1 4.21Å; F1705-I1709 HydrophobicContact CE1-CD1 3.38Å; F1705-I1709 HydrophobicContact CE1-CG1 4.41Å; F1705-I1709 HydrophobicContact CE2-CD1 4.24Å; F1705-I1709 HydrophobicContact CG-CD1 4.31Å; F1705-I1709 HydrophobicContact CZ-CD1 3.63Å; F1705-I1709 VanDerWaalsContact CZ-CD1 3.49Å; F1705-I1709 WeakPolarHBondContact O-CG1 3.26Å; F1705-I1709 PolarHBondContact O-N 3.01Å; F1705-I1709 VanDerWaalsContact O-N 3.09Å; A1706-I1709 PolarHBondContact O-N 3.01Å; I1709-K1711 VanDerWaalsContact C-N 3.33Å; I1709-K1711 PolarHBondContact O-N 3.14Å; I1709-Q1712 PolarHBondContact O-N 3.15Å; I1709-F1713 HydrophobicContact CG2-CD2 4.16Å; I1709-F1713 VanDerWaalsContact O-CB 3.32Å; I1709-F1713 WeakPolarHBondContact O-CB 3.4Å; I1709-F1713 PolarHBondContact O-N 3.09Å
1710E68.1Low64.2Low98.6 Ų98.678.3 Ų78.346%0.46139%0.393SS..Hα-helixtrans-61.7-41176.9-134.9179.418000111.8Q1255 A1706 K1707 N1708 Q1712 F1713 N1714Q1255-E1710 PolarHBondContact NE2-OE1 3.04Å; A1706-E1710 VanDerWaalsContact O-CB 3.25Å; A1706-E1710 WeakPolarHBondContact O-CB 3.41Å; A1706-E1710 WeakPolarHBondContact O-CG 3.32Å; A1706-E1710 PolarHBondContact O-N 2.92Å; K1707-E1710 PolarHBondContact O-N 2.88Å; N1708-E1710 PolarHBondContact O-N 2.94Å; E1710-Q1712 PolarHBondContact O-N 3.4Å; E1710-F1713 PolarHBondContact O-N 3.23Å; E1710-N1714 VanDerWaalsContact O-CB 3.29Å; E1710-N1714 WeakPolarHBondContact O-CB 3.36Å; E1710-N1714 PolarHBondContact O-N 3.05Å; E1710-N1714 PolarHBondContact O-ND2 3.07Å; E1710-N1714 VanDerWaalsContact O-ND2 3.09Å
1711K71Confident65.2Low121.2 Ų121.279.6 Ų79.653%0.52739%0.393SS..Hα-helixtrans-64-42.8175.7-169.3-179179.3-171.70111.8E1045 K1707 N1708 I1709 F1713 N1714 N1715E1045-K1711 IonicContact OE1-NZ 3.5Å; E1045-K1711 IonicContact OE2-NZ 2.62Å; E1045-K1711 PolarHBondContact OE2-NZ 2.75Å; K1707-K1711 VanDerWaalsContact O-CB 3.3Å; K1707-K1711 WeakPolarHBondContact O-CB 3.35Å; K1707-K1711 PolarHBondContact O-N 3.27Å; N1708-K1711 WeakPolarHBondContact O-CB 3.26Å; N1708-K1711 PolarHBondContact O-N 3.11Å; I1709-K1711 VanDerWaalsContact C-N 3.33Å; I1709-K1711 PolarHBondContact O-N 3.14Å; K1711-F1713 VanDerWaalsContact C-N 3.33Å; K1711-F1713 PolarHBondContact O-N 3.05Å; K1711-N1714 PolarHBondContact O-N 3.24Å; K1711-N1715 WeakPolarHBondContact O-CB 3.39Å; K1711-N1715 VanDerWaalsContact O-CG 3.28Å; K1711-N1715 PolarHBondContact O-N 3.16Å; K1711-N1715 VanDerWaalsContact O-N 3.1Å
1712Q67.1Low66.5Low67.2 Ų67.280.5 Ų80.531%0.31440%0.398SS..Hα-helixtrans-66.1-40.2175.9-74.7-171.3-10.500112.1L1026 L1052 N1708 I1709 E1710 N1714 N1715 M1716L1026-Q1712 HydrophobicContact CD1-CB 4.46Å; L1052-Q1712 HydrophobicContact CD1-CB 4.12Å; L1052-Q1712 HydrophobicContact CD1-CG 4.16Å; N1708-Q1712 WeakPolarHBondContact O-CB 3.42Å; N1708-Q1712 WeakPolarHBondContact O-CG 3.23Å; N1708-Q1712 PolarHBondContact O-N 3.24Å; I1709-Q1712 PolarHBondContact O-N 3.15Å; E1710-Q1712 PolarHBondContact O-N 3.4Å; Q1712-N1714 VanDerWaalsContact C-N 3.35Å; Q1712-N1715 PolarHBondContact O-N 3.05Å; Q1712-M1716 WeakPolarHBondContact O-CB 3.37Å; Q1712-M1716 PolarHBondContact O-N 3.23Å; Q1712-M1716 VanDerWaalsContact O-N 3.13Å
1713F70.9Confident67.3Low56.6 Ų56.681.8 Ų81.825%0.24840%0.396CS..Hα-helixtrans-62.9-45.3176-159.5-103.9000111.7L1023 L1026 L1138 V1141 I1709 E1710 K1711 N1715 M1716 I1717L1023-F1713 HydrophobicContact CD2-CD2 3.86Å; L1023-F1713 HydrophobicContact CD2-CE2 3.51Å; L1023-F1713 VanDerWaalsContact CD2-CE2 3.48Å; L1023-F1713 HydrophobicContact CD2-CZ 4.42Å; L1026-F1713 VanDerWaalsContact CD1-CA 3.42Å; L1026-F1713 HydrophobicContact CD1-CB 3.81Å; L1026-F1713 HydrophobicContact CD1-CD2 3.95Å; L1026-F1713 HydrophobicContact CD1-CG 4.4Å; L1138-F1713 HydrophobicContact CD1-CE2 3.87Å; L1138-F1713 HydrophobicContact CD1-CZ 4Å; L1138-F1713 HydrophobicContact CG-CE2 4.28Å; L1138-F1713 HydrophobicContact CG-CZ 4.15Å; V1141-F1713 HydrophobicContact CB-CZ 4.27Å; V1141-F1713 HydrophobicContact CG1-CZ 4.49Å; I1709-F1713 HydrophobicContact CG2-CD2 4.16Å; I1709-F1713 VanDerWaalsContact O-CB 3.32Å; I1709-F1713 WeakPolarHBondContact O-CB 3.4Å; I1709-F1713 PolarHBondContact O-N 3.09Å; E1710-F1713 PolarHBondContact O-N 3.23Å; K1711-F1713 VanDerWaalsContact C-N 3.33Å; K1711-F1713 PolarHBondContact O-N 3.05Å; F1713-N1715 VanDerWaalsContact C-N 3.33Å; F1713-N1715 PolarHBondContact O-N 3.18Å; F1713-M1716 HydrophobicContact CD2-CE 3.62Å; F1713-M1716 HydrophobicContact CE2-CE 3.74Å; F1713-M1716 WeakPolarHBondContact O-CB 3.34Å; F1713-M1716 PolarHBondContact O-N 3.19Å; F1713-M1716 VanDerWaalsContact O-N 3.16Å; F1713-I1717 HydrophobicContact CD1-CD1 3.84Å; F1713-I1717 HydrophobicContact CD1-CG1 4.22Å; F1713-I1717 HydrophobicContact CE1-CD1 3.62Å; F1713-I1717 VanDerWaalsContact CE1-CD1 3.49Å; F1713-I1717 HydrophobicContact CE1-CG1 4.37Å; F1713-I1717 HydrophobicContact CE2-CD1 4.37Å; F1713-I1717 HydrophobicContact CG-CD1 4.45Å; F1713-I1717 HydrophobicContact CZ-CD1 3.82Å; F1713-I1717 HydrophobicContact CZ-CG1 4.4Å; F1713-I1717 WeakPolarHBondContact O-CG1 3.43Å; F1713-I1717 PolarHBondContact O-N 3.04Å
1714N72.8Confident67.9Low78.6 Ų78.678.5 Ų78.542%0.4238%0.382SS..Hα-helixtrans-65-35.5176.6-74.1-32.1000112.7E1710 K1711 Q1712 I1717 K1718E1710-N1714 VanDerWaalsContact O-CB 3.29Å; E1710-N1714 WeakPolarHBondContact O-CB 3.36Å; E1710-N1714 PolarHBondContact O-N 3.05Å; E1710-N1714 PolarHBondContact O-ND2 3.07Å; E1710-N1714 VanDerWaalsContact O-ND2 3.09Å; K1711-N1714 PolarHBondContact O-N 3.24Å; Q1712-N1714 VanDerWaalsContact C-N 3.35Å; N1714-I1717 PolarHBondContact O-N 3.27Å; N1714-K1718 WeakPolarHBondContact O-CB 3.4Å; N1714-K1718 WeakPolarHBondContact O-CG 3.39Å; N1714-K1718 PolarHBondContact O-N 3.02Å; N1714-K1718 VanDerWaalsContact O-N 3.15Å
1715N72.5Confident68.1Low75.6 Ų75.676 Ų7640%0.40437%0.373SS..Hα-helixtrans-67.2-40.5173.6-75-8.8000111.7K1711 Q1712 F1713 I1717 K1718 E1719K1711-N1715 WeakPolarHBondContact O-CB 3.39Å; K1711-N1715 VanDerWaalsContact O-CG 3.28Å; K1711-N1715 PolarHBondContact O-N 3.16Å; K1711-N1715 VanDerWaalsContact O-N 3.1Å; Q1712-N1715 PolarHBondContact O-N 3.05Å; F1713-N1715 VanDerWaalsContact C-N 3.33Å; F1713-N1715 PolarHBondContact O-N 3.18Å; N1715-I1717 VanDerWaalsContact C-N 3.35Å; N1715-I1717 PolarHBondContact O-N 3.04Å; N1715-K1718 PolarHBondContact O-N 3.2Å; N1715-E1719 PolarHBondContact O-N 3.3Å
1716M68Low68.3Low43.2 Ų43.275.8 Ų75.821%0.21338%0.379CS..Hα-helixtrans-62.2-43.1174.7-163.3-174.7-21.300111.6L1022 L1026 V1056 L1138 Q1712 F1713 K1718 E1719 I1720L1022-M1716 HydrophobicContact CB-CE 4.46Å; L1026-M1716 HydrophobicContact CB-SD 3.97Å; L1026-M1716 HydrophobicContact CD1-CB 4.35Å; L1026-M1716 HydrophobicContact CD1-CE 4.01Å; L1026-M1716 HydrophobicContact CD1-SD 3.94Å; L1026-M1716 HydrophobicContact CG-SD 4.45Å; V1056-M1716 HydrophobicContact CG2-CG 3.78Å; V1056-M1716 HydrophobicContact CG2-SD 4.19Å; L1138-M1716 HydrophobicContact CD2-CE 4.4Å; Q1712-M1716 WeakPolarHBondContact O-CB 3.37Å; Q1712-M1716 PolarHBondContact O-N 3.23Å; Q1712-M1716 VanDerWaalsContact O-N 3.13Å; F1713-M1716 HydrophobicContact CD2-CE 3.62Å; F1713-M1716 HydrophobicContact CE2-CE 3.74Å; F1713-M1716 WeakPolarHBondContact O-CB 3.34Å; F1713-M1716 PolarHBondContact O-N 3.19Å; F1713-M1716 VanDerWaalsContact O-N 3.16Å; M1716-K1718 VanDerWaalsContact C-N 3.33Å; M1716-K1718 PolarHBondContact O-N 3.01Å; M1716-E1719 PolarHBondContact O-N 3.12Å; M1716-I1720 HydrophobicContact CE-CD1 4.35Å; M1716-I1720 HydrophobicContact CG-CD1 3.83Å; M1716-I1720 HydrophobicContact CG-CG1 4.27Å; M1716-I1720 WeakPolarHBondContact O-CB 3.28Å; M1716-I1720 WeakPolarHBondContact O-CD1 3.2Å; M1716-I1720 WeakPolarHBondContact O-CG1 3.42Å; M1716-I1720 PolarHBondContact O-N 3Å; M1716-I1720 HydrophobicContact SD-CD1 4.28Å
1717I70.2Confident68.4Low37 Ų3776 Ų7619%0.1938%0.378CS..Hα-helixtrans-59.3-46.6175.7-68.7168.5000110.5L1138 K1139 F1713 N1714 N1715 E1719 I1720 E1721L1138-I1717 HydrophobicContact CD2-CG1 3.79Å; L1138-I1717 HydrophobicContact CG-CD1 4.46Å; L1138-I1717 HydrophobicContact CG-CG1 4.06Å; K1139-I1717 HydrophobicContact CG-CG2 4.12Å; F1713-I1717 HydrophobicContact CD1-CD1 3.84Å; F1713-I1717 HydrophobicContact CD1-CG1 4.22Å; F1713-I1717 HydrophobicContact CE1-CD1 3.62Å; F1713-I1717 VanDerWaalsContact CE1-CD1 3.49Å; F1713-I1717 HydrophobicContact CE1-CG1 4.37Å; F1713-I1717 HydrophobicContact CE2-CD1 4.37Å; F1713-I1717 HydrophobicContact CG-CD1 4.45Å; F1713-I1717 HydrophobicContact CZ-CD1 3.82Å; F1713-I1717 HydrophobicContact CZ-CG1 4.4Å; F1713-I1717 WeakPolarHBondContact O-CG1 3.43Å; F1713-I1717 PolarHBondContact O-N 3.04Å; N1714-I1717 PolarHBondContact O-N 3.27Å; N1715-I1717 VanDerWaalsContact C-N 3.35Å; N1715-I1717 PolarHBondContact O-N 3.04Å; I1717-E1719 VanDerWaalsContact C-N 3.31Å; I1717-E1719 PolarHBondContact O-N 3.11Å; I1717-I1720 PolarHBondContact O-N 3.18Å; I1717-I1720 VanDerWaalsContact O-N 3.12Å; I1717-E1721 HydrophobicContact CG2-CG 4.38Å; I1717-E1721 WeakPolarHBondContact O-CB 3.42Å; I1717-E1721 VanDerWaalsContact O-CG 3.31Å; I1717-E1721 WeakPolarHBondContact O-CG 3.32Å; I1717-E1721 PolarHBondContact O-N 3.17Å
1718K70.5Confident68.2Low135.8 Ų135.871.7 Ų71.759%0.5936%0.361SS*.Hα-helixtrans-61.6-39.7178.4-75177.7179.9-179.70112.9N1714 N1715 M1716 I1720 E1721 L1722N1714-K1718 WeakPolarHBondContact O-CB 3.4Å; N1714-K1718 WeakPolarHBondContact O-CG 3.39Å; N1714-K1718 PolarHBondContact O-N 3.02Å; N1714-K1718 VanDerWaalsContact O-N 3.15Å; N1715-K1718 PolarHBondContact O-N 3.2Å; M1716-K1718 VanDerWaalsContact C-N 3.33Å; M1716-K1718 PolarHBondContact O-N 3.01Å; K1718-I1720 VanDerWaalsContact C-N 3.33Å; K1718-E1721 PolarHBondContact O-N 3.1Å; K1718-L1722 VanDerWaalsContact O-CB 3.3Å; K1718-L1722 WeakPolarHBondContact O-CB 3.34Å; K1718-L1722 PolarHBondContact O-N 3.13Å
1719E72Confident67.9Low83.8 Ų83.873.1 Ų73.139%0.39237%0.365SS..Hα-helixtrans-68.3-39.9177.8-150.3137-171.600111.6N1715 M1716 I1717 E1721 L1722 Q1723N1715-E1719 PolarHBondContact O-N 3.3Å; M1716-E1719 PolarHBondContact O-N 3.12Å; I1717-E1719 VanDerWaalsContact C-N 3.31Å; I1717-E1719 PolarHBondContact O-N 3.11Å; E1719-E1721 VanDerWaalsContact C-N 3.34Å; E1719-E1721 PolarHBondContact O-N 3.27Å; E1719-L1722 PolarHBondContact O-N 3.2Å; E1719-Q1723 HydrophobicContact CG-CG 4.41Å; E1719-Q1723 WeakPolarHBondContact O-CB 3.31Å; E1719-Q1723 VanDerWaalsContact O-CG 3.26Å; E1719-Q1723 WeakPolarHBondContact O-CG 3.28Å; E1719-Q1723 PolarHBondContact O-N 3.11Å; E1719-Q1723 WeakPolarHBondContact OE1-CG 3.5Å; E1719-Q1723 PolarHBondContact OE1-NE2 3.05Å
1720I69.6Low67.8Low39.6 Ų39.677.7 Ų77.720%0.20338%0.384CS..Hα-helixtrans-63.5-45.2174.4-68.6167.5000110.5L1022 V1056 L1060 I1135 L1138 M1716 I1717 K1718 L1722 Q1723 L1724L1022-I1720 HydrophobicContact CD1-CD1 3.9Å; L1022-I1720 HydrophobicContact CD2-CD1 3.94Å; L1022-I1720 HydrophobicContact CG-CD1 4.41Å; V1056-I1720 HydrophobicContact CG1-CD1 4.26Å; V1056-I1720 HydrophobicContact CG1-CG1 3.55Å; L1060-I1720 HydrophobicContact CD1-CG1 4.26Å; L1060-I1720 HydrophobicContact CD2-CG2 4.45Å; I1135-I1720 HydrophobicContact CG1-CG2 4.13Å; L1138-I1720 HydrophobicContact CD2-CD1 3.81Å; M1716-I1720 HydrophobicContact CE-CD1 4.35Å; M1716-I1720 HydrophobicContact CG-CD1 3.83Å; M1716-I1720 HydrophobicContact CG-CG1 4.27Å; M1716-I1720 WeakPolarHBondContact O-CB 3.28Å; M1716-I1720 WeakPolarHBondContact O-CD1 3.2Å; M1716-I1720 WeakPolarHBondContact O-CG1 3.42Å; M1716-I1720 PolarHBondContact O-N 3Å; M1716-I1720 HydrophobicContact SD-CD1 4.28Å; I1717-I1720 PolarHBondContact O-N 3.18Å; I1717-I1720 VanDerWaalsContact O-N 3.12Å; K1718-I1720 VanDerWaalsContact C-N 3.33Å; I1720-L1722 VanDerWaalsContact C-N 3.32Å; I1720-L1722 PolarHBondContact O-N 3.15Å; I1720-Q1723 PolarHBondContact O-N 3.02Å; I1720-L1724 HydrophobicContact CG2-CD1 3.47Å; I1720-L1724 VanDerWaalsContact CG2-CD1 3.45Å; I1720-L1724 HydrophobicContact CG2-CG 4.07Å; I1720-L1724 WeakPolarHBondContact O-CA 3.35Å; I1720-L1724 VanDerWaalsContact O-CB 3.27Å; I1720-L1724 WeakPolarHBondContact O-CB 3.37Å; I1720-L1724 WeakPolarHBondContact O-CG 3.43Å; I1720-L1724 PolarHBondContact O-N 3.17Å
1721E69.9Low67.6Low84.8 Ų84.876.3 Ų76.340%0.39638%0.377SS..Hα-helixtrans-59.4-42.1176-76.5-178.6152.200112I1135 K1139 I1717 K1718 E1719 Q1723 L1724 S1725I1135-E1721 HydrophobicContact CD1-CG 4.19Å; I1135-E1721 HydrophobicContact CG1-CG 4.41Å; I1135-E1721 HydrophobicContact CG2-CG 3.69Å; I1135-E1721 WeakPolarHBondContact CG2-OE1 3.38Å; K1139-E1721 WeakPolarHBondContact CE-OE1 3.27Å; K1139-E1721 IonicContact NZ-OE1 3.29Å; K1139-E1721 PolarHBondContact NZ-OE1 3.16Å; I1717-E1721 HydrophobicContact CG2-CG 4.38Å; I1717-E1721 WeakPolarHBondContact O-CB 3.42Å; I1717-E1721 VanDerWaalsContact O-CG 3.31Å; I1717-E1721 WeakPolarHBondContact O-CG 3.32Å; I1717-E1721 PolarHBondContact O-N 3.17Å; K1718-E1721 PolarHBondContact O-N 3.1Å; E1719-E1721 VanDerWaalsContact C-N 3.34Å; E1719-E1721 PolarHBondContact O-N 3.27Å; E1721-Q1723 VanDerWaalsContact C-N 3.35Å; E1721-Q1723 PolarHBondContact O-N 2.87Å; E1721-L1724 PolarHBondContact O-N 3.21Å; E1721-S1725 VanDerWaalsContact O-CB 3.27Å; E1721-S1725 WeakPolarHBondContact O-CB 3.33Å; E1721-S1725 PolarHBondContact O-N 3.33Å; E1721-S1725 PolarHBondContact O-OG 3.4Å
1722L72.1Confident67.2Low121 Ų12173.4 Ų73.463%0.63436%0.363SS*.Hα-helixtrans-65.6-42.6179.1-164.999.3000111.6K1718 E1719 I1720 S1725 T1726K1718-L1722 VanDerWaalsContact O-CB 3.3Å; K1718-L1722 WeakPolarHBondContact O-CB 3.34Å; K1718-L1722 PolarHBondContact O-N 3.13Å; E1719-L1722 PolarHBondContact O-N 3.2Å; I1720-L1722 VanDerWaalsContact C-N 3.32Å; I1720-L1722 PolarHBondContact O-N 3.15Å; L1722-S1725 WeakPolarHBondContact CA-OG 3.37Å; L1722-S1725 PolarHBondContact O-OG 3.26Å; L1722-S1725 VanDerWaalsContact O-OG 3.05Å; L1722-T1726 WeakPolarHBondContact O-CG2 3.27Å; L1722-T1726 PolarHBondContact O-N 2.82Å
1723Q68.1Low67Low90.4 Ų90.473.8 Ų73.842%0.42237%0.367SS..Hα-helixtrans-69.9-44.4178-67.9-139-2.800112.1L1060 E1719 I1720 E1721 S1725 T1726 S1727L1060-Q1723 HydrophobicContact CD1-CB 4.15Å; E1719-Q1723 HydrophobicContact CG-CG 4.41Å; E1719-Q1723 WeakPolarHBondContact O-CB 3.31Å; E1719-Q1723 VanDerWaalsContact O-CG 3.26Å; E1719-Q1723 WeakPolarHBondContact O-CG 3.28Å; E1719-Q1723 PolarHBondContact O-N 3.11Å; E1719-Q1723 WeakPolarHBondContact OE1-CG 3.5Å; E1719-Q1723 PolarHBondContact OE1-NE2 3.05Å; I1720-Q1723 PolarHBondContact O-N 3.02Å; E1721-Q1723 VanDerWaalsContact C-N 3.35Å; E1721-Q1723 PolarHBondContact O-N 2.87Å; Q1723-S1725 VanDerWaalsContact C-N 3.33Å; Q1723-S1725 PolarHBondContact O-N 3.06Å; Q1723-T1726 PolarHBondContact O-N 3.01Å; Q1723-T1726 PolarHBondContact O-OG1 3.3Å; Q1723-T1726 VanDerWaalsContact O-OG1 3.11Å; Q1723-S1727 PolarHBondContact O-N 3.05Å; Q1723-S1727 VanDerWaalsContact O-N 3.15Å
1724L66.5Low66.7Low43.4 Ų43.473.7 Ų73.723%0.22737%0.374CS..Hα-helixtrans-70.9-30.5-178.8-88.4149.5000112.5L1060 F1064 Q1131 I1135 I1720 E1721 T1726 S1727 I1728L1060-L1724 HydrophobicContact CD1-CD2 4.47Å; L1060-L1724 HydrophobicContact CD1-CG 4.37Å; L1060-L1724 HydrophobicContact CD2-CD1 4.25Å; L1060-L1724 HydrophobicContact CD2-CD2 4.29Å; L1060-L1724 HydrophobicContact CD2-CG 4.44Å; F1064-L1724 HydrophobicContact CD2-CD2 4.36Å; F1064-L1724 HydrophobicContact CE2-CD2 4.47Å; Q1131-L1724 HydrophobicContact CB-CD1 4.19Å; Q1131-L1724 HydrophobicContact CB-CD2 4.49Å; Q1131-L1724 HydrophobicContact CG-CD1 4.42Å; Q1131-L1724 HydrophobicContact CG-CD2 4.08Å; I1135-L1724 HydrophobicContact CD1-CB 4.2Å; I1135-L1724 HydrophobicContact CD1-CD1 4.03Å; I1135-L1724 HydrophobicContact CG1-CD1 4.19Å; I1720-L1724 HydrophobicContact CG2-CD1 3.47Å; I1720-L1724 VanDerWaalsContact CG2-CD1 3.45Å; I1720-L1724 HydrophobicContact CG2-CG 4.07Å; I1720-L1724 WeakPolarHBondContact O-CA 3.35Å; I1720-L1724 VanDerWaalsContact O-CB 3.27Å; I1720-L1724 WeakPolarHBondContact O-CB 3.37Å; I1720-L1724 WeakPolarHBondContact O-CG 3.43Å; I1720-L1724 PolarHBondContact O-N 3.17Å; E1721-L1724 PolarHBondContact O-N 3.21Å; L1724-T1726 VanDerWaalsContact C-N 3.27Å; L1724-T1726 PolarHBondContact O-N 3.25Å; L1724-T1726 VanDerWaalsContact O-N 3.14Å; L1724-S1727 VanDerWaalsContact CA-OG 3.28Å; L1724-S1727 WeakPolarHBondContact CA-OG 3.15Å; L1724-S1727 CarbonylContact O-C 3.45Å; L1724-S1727 WeakPolarHBondContact O-CA 3.38Å; L1724-S1727 PolarHBondContact O-N 3.43Å; L1724-S1727 PolarHBondContact O-OG 3.29Å; L1724-I1728 HydrophobicContact CB-CD1 4.33Å; L1724-I1728 HydrophobicContact CB-CG1 4.41Å; L1724-I1728 HydrophobicContact CD2-CD1 4.08Å; L1724-I1728 HydrophobicContact CG-CD1 4.01Å; L1724-I1728 VanDerWaalsContact O-CB 3.32Å; L1724-I1728 WeakPolarHBondContact O-CB 3.33Å; L1724-I1728 WeakPolarHBondContact O-CD1 3.47Å; L1724-I1728 VanDerWaalsContact O-CG1 3.27Å; L1724-I1728 WeakPolarHBondContact O-CG1 3.3Å; L1724-I1728 PolarHBondContact O-N 3.3Å; L1724-I1728 VanDerWaalsContact O-N 3.1Å
1725S62.3Low66.3Low47.4 Ų47.471.3 Ų71.333%0.33136%0.361SS..Hα-helixtrans-53.9-41.917862.60000112.6E1721 L1722 Q1723 S1727 I1728 H1729E1721-S1725 VanDerWaalsContact O-CB 3.27Å; E1721-S1725 WeakPolarHBondContact O-CB 3.33Å; E1721-S1725 PolarHBondContact O-N 3.33Å; E1721-S1725 PolarHBondContact O-OG 3.4Å; L1722-S1725 WeakPolarHBondContact CA-OG 3.37Å; L1722-S1725 PolarHBondContact O-OG 3.26Å; L1722-S1725 VanDerWaalsContact O-OG 3.05Å; Q1723-S1725 VanDerWaalsContact C-N 3.33Å; Q1723-S1725 PolarHBondContact O-N 3.06Å; S1725-S1727 VanDerWaalsContact C-N 3.33Å; S1725-S1727 PolarHBondContact O-N 2.94Å; S1725-I1728 PolarHBondContact O-N 3.19Å; S1725-H1729 WeakPolarHBondContact O-CB 3.31Å; S1725-H1729 PolarHBondContact O-CD2 3.23Å; S1725-H1729 PolarHBondContact O-N 3.24Å; S1725-H1729 VanDerWaalsContact O-N 3.08Å
1726T65.1Low65.8Low84.4 Ų84.468.8 Ų68.852%0.51835%0.347SS..Hα-helixtrans-68.6-31.8177.963.10000113.6L1722 Q1723 L1724 K1730L1722-T1726 WeakPolarHBondContact O-CG2 3.27Å; L1722-T1726 PolarHBondContact O-N 2.82Å; Q1723-T1726 PolarHBondContact O-N 3.01Å; Q1723-T1726 PolarHBondContact O-OG1 3.3Å; Q1723-T1726 VanDerWaalsContact O-OG1 3.11Å; L1724-T1726 VanDerWaalsContact C-N 3.27Å; L1724-T1726 PolarHBondContact O-N 3.25Å; L1724-T1726 VanDerWaalsContact O-N 3.14Å; T1726-K1730 WeakPolarHBondContact O-CG 3.31Å; T1726-K1730 PolarHBondContact O-N 3.12Å; T1726-K1730 VanDerWaalsContact O-N 3.15Å
1727S63.5Low65.8Low37 Ų3775.1 Ų75.126%0.25937%0.369SS..Hα-helixtrans-80.3-37.8178.6-29.20000111.9Q1723 L1724 S1725 H1729 K1730 E1731Q1723-S1727 PolarHBondContact O-N 3.05Å; Q1723-S1727 VanDerWaalsContact O-N 3.15Å; L1724-S1727 VanDerWaalsContact CA-OG 3.28Å; L1724-S1727 WeakPolarHBondContact CA-OG 3.15Å; L1724-S1727 CarbonylContact O-C 3.45Å; L1724-S1727 WeakPolarHBondContact O-CA 3.38Å; L1724-S1727 PolarHBondContact O-N 3.43Å; L1724-S1727 PolarHBondContact O-OG 3.29Å; S1725-S1727 VanDerWaalsContact C-N 3.33Å; S1725-S1727 PolarHBondContact O-N 2.94Å; S1727-H1729 VanDerWaalsContact C-N 3.28Å; S1727-H1729 PolarHBondContact O-N 3.27Å; S1727-K1730 CarbonylContact O-C 3.58Å; S1727-K1730 WeakPolarHBondContact O-CA 3.33Å; S1727-K1730 WeakPolarHBondContact O-CB 3.43Å; S1727-K1730 PolarHBondContact O-N 3.09Å; S1727-E1731 PolarHBondContact O-N 3.1Å
1728I60.7Low65.6Low43.2 Ų43.275.3 Ų75.322%0.22237%0.37CS..Hα-helixtrans-58.3-42.1173.9-69.4167.6000110Q1131 I1135 L1724 S1725 K1730 E1731 Y1732Q1131-I1728 HydrophobicContact CB-CD1 4.47Å; Q1131-I1728 HydrophobicContact CB-CG1 3.81Å; Q1131-I1728 VanDerWaalsContact OE1-N 3.13Å; I1135-I1728 HydrophobicContact CD1-CD1 3.97Å; L1724-I1728 HydrophobicContact CB-CD1 4.33Å; L1724-I1728 HydrophobicContact CB-CG1 4.41Å; L1724-I1728 HydrophobicContact CD2-CD1 4.08Å; L1724-I1728 HydrophobicContact CG-CD1 4.01Å; L1724-I1728 VanDerWaalsContact O-CB 3.32Å; L1724-I1728 WeakPolarHBondContact O-CB 3.33Å; L1724-I1728 WeakPolarHBondContact O-CD1 3.47Å; L1724-I1728 VanDerWaalsContact O-CG1 3.27Å; L1724-I1728 WeakPolarHBondContact O-CG1 3.3Å; L1724-I1728 PolarHBondContact O-N 3.3Å; L1724-I1728 VanDerWaalsContact O-N 3.1Å; S1725-I1728 PolarHBondContact O-N 3.19Å; I1728-K1730 VanDerWaalsContact C-N 3.32Å; I1728-K1730 PolarHBondContact O-N 3Å; I1728-E1731 WeakPolarHBondContact O-CB 3.42Å; I1728-E1731 PolarHBondContact O-N 3.21Å; I1728-Y1732 HydrophobicContact CB-CE2 4.46Å; I1728-Y1732 HydrophobicContact CG2-CD2 3.58Å; I1728-Y1732 VanDerWaalsContact CG2-CD2 3.46Å; I1728-Y1732 HydrophobicContact CG2-CE1 4.41Å; I1728-Y1732 HydrophobicContact CG2-CE2 3.2Å; I1728-Y1732 VanDerWaalsContact CG2-CZ 3.49Å; I1728-Y1732 WeakPolarHBondContact O-CB 3.4Å; I1728-Y1732 VanDerWaalsContact O-CD2 3.24Å; I1728-Y1732 WeakPolarHBondContact O-CD2 3.29Å; I1728-Y1732 PolarHBondContact O-N 3.37Å
1729H61.2Low65.4Low107 Ų10769 Ų6950%0.49534%0.343SS..Hα-helixtrans-60.3-37.4174.5-76.1-57.1000113.4S1725 S1727 E1731 Y1732 D1733S1725-H1729 WeakPolarHBondContact O-CB 3.31Å; S1725-H1729 PolarHBondContact O-CD2 3.23Å; S1725-H1729 PolarHBondContact O-N 3.24Å; S1725-H1729 VanDerWaalsContact O-N 3.08Å; S1727-H1729 VanDerWaalsContact C-N 3.28Å; S1727-H1729 PolarHBondContact O-N 3.27Å; H1729-E1731 PolarHBondContact O-N 2.8Å; H1729-Y1732 PolarHBondContact O-N 3.22Å; H1729-D1733 WeakPolarHBondContact O-CB 3.26Å; H1729-D1733 PolarHBondContact O-N 3.28Å
1730K62.7Low65.1Low135.4 Ų135.471 Ų7159%0.58935%0.352SS*.Hα-helixtrans-70.2-35.2176.4-68.3178.1-179175.80113T1726 S1727 I1728 Y1732 D1733 S1734T1726-K1730 WeakPolarHBondContact O-CG 3.31Å; T1726-K1730 PolarHBondContact O-N 3.12Å; T1726-K1730 VanDerWaalsContact O-N 3.15Å; S1727-K1730 CarbonylContact O-C 3.58Å; S1727-K1730 WeakPolarHBondContact O-CA 3.33Å; S1727-K1730 WeakPolarHBondContact O-CB 3.43Å; S1727-K1730 PolarHBondContact O-N 3.09Å; I1728-K1730 VanDerWaalsContact C-N 3.32Å; I1728-K1730 PolarHBondContact O-N 3Å; K1730-Y1732 VanDerWaalsContact C-N 3.32Å; K1730-D1733 WeakPolarHBondContact O-CB 3.35Å; K1730-D1733 PolarHBondContact O-N 3.21Å; K1730-S1734 WeakPolarHBondContact O-CB 3.41Å; K1730-S1734 PolarHBondContact O-N 2.79Å; K1730-S1734 PolarHBondContact O-OG 3.07Å
1731E63.9Low64.9Low70.4 Ų70.472.1 Ų72.133%0.32936%0.356SS..Hα-helixtrans-65.2-43173.4-73.6-172.8167.200110.6F1128 Q1131 S1727 I1728 H1729 D1733 S1734 L1735F1128-E1731 WeakPolarHBondContact O-CB 3.38Å; F1128-E1731 WeakPolarHBondContact O-CG 3.45Å; F1128-E1731 VanDerWaalsContact O-OE2 3.13Å; Q1131-E1731 VanDerWaalsContact CD-OE1 3.22Å; Q1131-E1731 VanDerWaalsContact CG-OE1 3.28Å; Q1131-E1731 WeakPolarHBondContact CG-OE1 3.37Å; Q1131-E1731 PolarHBondContact N-OE1 2.84Å; Q1131-E1731 PolarHBondContact N-OE2 2.67Å; Q1131-E1731 PolarHBondContact NE2-OE1 3.45Å; Q1131-E1731 VanDerWaalsContact NE2-OE1 3.14Å; S1727-E1731 PolarHBondContact O-N 3.1Å; I1728-E1731 WeakPolarHBondContact O-CB 3.42Å; I1728-E1731 PolarHBondContact O-N 3.21Å; H1729-E1731 PolarHBondContact O-N 2.8Å; E1731-D1733 VanDerWaalsContact C-N 3.34Å; E1731-D1733 PolarHBondContact O-N 2.8Å; E1731-S1734 WeakPolarHBondContact O-CB 3.35Å; E1731-S1734 PolarHBondContact O-N 3.09Å; E1731-S1734 VanDerWaalsContact O-N 3.13Å; E1731-S1734 PolarHBondContact O-OG 2.96Å; E1731-L1735 WeakPolarHBondContact O-CG 3.4Å; E1731-L1735 PolarHBondContact O-N 3.04Å
1732Y61.7Low64.9Low59.8 Ų59.868.1 Ų68.124%0.23534%0.338CS..Hα-helixtrans-63.2-39.1174.8-74.4-55.2000113E1132 I1728 H1729 K1730 S1734 L1735 I1736 V1760 F1795E1132-Y1732 PolarHBondContact OE2-OH 3.43Å; I1728-Y1732 HydrophobicContact CB-CE2 4.46Å; I1728-Y1732 HydrophobicContact CG2-CD2 3.58Å; I1728-Y1732 VanDerWaalsContact CG2-CD2 3.46Å; I1728-Y1732 HydrophobicContact CG2-CE1 4.41Å; I1728-Y1732 HydrophobicContact CG2-CE2 3.2Å; I1728-Y1732 VanDerWaalsContact CG2-CZ 3.49Å; I1728-Y1732 WeakPolarHBondContact O-CB 3.4Å; I1728-Y1732 VanDerWaalsContact O-CD2 3.24Å; I1728-Y1732 WeakPolarHBondContact O-CD2 3.29Å; I1728-Y1732 PolarHBondContact O-N 3.37Å; H1729-Y1732 PolarHBondContact O-N 3.22Å; K1730-Y1732 VanDerWaalsContact C-N 3.32Å; Y1732-S1734 VanDerWaalsContact C-N 3.33Å; Y1732-S1734 PolarHBondContact O-N 3.12Å; Y1732-L1735 HydrophobicContact CD1-CD1 3.6Å; Y1732-L1735 VanDerWaalsContact CD1-CD1 3.47Å; Y1732-L1735 HydrophobicContact CE1-CD1 3.97Å; Y1732-L1735 WeakPolarHBondContact O-CA 3.43Å; Y1732-L1735 VanDerWaalsContact O-CB 3.32Å; Y1732-L1735 WeakPolarHBondContact O-CB 3.35Å; Y1732-L1735 PolarHBondContact O-N 3.16Å; Y1732-L1735 VanDerWaalsContact O-N 3.1Å; Y1732-I1736 VanDerWaalsContact O-CG1 3.25Å; Y1732-I1736 WeakPolarHBondContact O-CG1 3.26Å; Y1732-I1736 PolarHBondContact O-N 3.16Å; Y1732-I1736 VanDerWaalsContact O-N 3.07Å; Y1732-V1760 HydrophobicContact CD1-CB 4.45Å; Y1732-V1760 HydrophobicContact CD1-CG1 4.04Å; Y1732-V1760 HydrophobicContact CD1-CG2 4Å; Y1732-V1760 HydrophobicContact CD2-CG1 3.98Å; Y1732-V1760 HydrophobicContact CD2-CG2 3.89Å; Y1732-V1760 HydrophobicContact CE1-CG1 4.46Å; Y1732-V1760 HydrophobicContact CE1-CG2 4.01Å; Y1732-V1760 HydrophobicContact CE2-CG1 4.37Å; Y1732-V1760 HydrophobicContact CE2-CG2 3.84Å; Y1732-V1760 HydrophobicContact CG-CB 4.4Å; Y1732-V1760 HydrophobicContact CG-CG1 3.61Å; Y1732-V1760 VanDerWaalsContact CG-CG1 3.43Å; Y1732-V1760 HydrophobicContact CG-CG2 4Å; Y1732-F1795 HydrophobicContact CD1-CD1 4.14Å; Y1732-F1795 AromaticContact CD1-CD2 3.66Å; Y1732-F1795 HydrophobicContact CD1-CD2 3.93Å; Y1732-F1795 AromaticContact CD1-CE1 3.73Å; Y1732-F1795 HydrophobicContact CD1-CE1 3.73Å; Y1732-F1795 AromaticContact CD1-CE2 3.28Å; Y1732-F1795 HydrophobicContact CD1-CE2 3.28Å; Y1732-F1795 HydrophobicContact CD1-CG 4.12Å; Y1732-F1795 AromaticContact CD1-CZ 3.59Å; Y1732-F1795 HydrophobicContact CD1-CZ 3.59Å; Y1732-F1795 HydrophobicContact CE1-CD1 4.2Å; Y1732-F1795 AromaticContact CE1-CD2 3.77Å; Y1732-F1795 HydrophobicContact CE1-CD2 3.77Å; Y1732-F1795 HydrophobicContact CE1-CE1 4.24Å; Y1732-F1795 AromaticContact CE1-CE2 3.6Å; Y1732-F1795 HydrophobicContact CE1-CE2 3.6Å; Y1732-F1795 AromaticContact CE1-CG 3.98Å; Y1732-F1795 HydrophobicContact CE1-CG 3.98Å; Y1732-F1795 HydrophobicContact CE1-CZ 4.12Å; Y1732-F1795 AromaticContact CG-CE2 3.83Å; Y1732-F1795 HydrophobicContact CG-CE2 3.83Å; Y1732-F1795 HydrophobicContact CG-CZ 4.01Å
1733D62.4Low64.6Low74.8 Ų74.863.8 Ų63.840%0.431%0.313SS..Hα-helixtrans-59.3-33.9174.5-78.7-18.4000112.6H1729 K1730 E1731 I1736 R1737H1729-D1733 WeakPolarHBondContact O-CB 3.26Å; H1729-D1733 PolarHBondContact O-N 3.28Å; K1730-D1733 WeakPolarHBondContact O-CB 3.35Å; K1730-D1733 PolarHBondContact O-N 3.21Å; E1731-D1733 VanDerWaalsContact C-N 3.34Å; E1731-D1733 PolarHBondContact O-N 2.8Å; D1733-I1736 HydrophobicContact CB-CD1 4.48Å; D1733-I1736 WeakPolarHBondContact O-CB 3.36Å; D1733-I1736 PolarHBondContact O-N 3.12Å; D1733-R1737 WeakPolarHBondContact O-CG 3.22Å; D1733-R1737 PolarHBondContact O-N 3.31Å
1734S65.4Low64.6Low55.4 Ų55.461.7 Ų61.739%0.38731%0.305SS..Hα-helixtrans-73.3-36.417728.60000112.3K1730 E1731 Y1732 I1736 R1737 L1738K1730-S1734 WeakPolarHBondContact O-CB 3.41Å; K1730-S1734 PolarHBondContact O-N 2.79Å; K1730-S1734 PolarHBondContact O-OG 3.07Å; E1731-S1734 WeakPolarHBondContact O-CB 3.35Å; E1731-S1734 PolarHBondContact O-N 3.09Å; E1731-S1734 VanDerWaalsContact O-N 3.13Å; E1731-S1734 PolarHBondContact O-OG 2.96Å; Y1732-S1734 VanDerWaalsContact C-N 3.33Å; Y1732-S1734 PolarHBondContact O-N 3.12Å; S1734-I1736 VanDerWaalsContact C-N 3.28Å; S1734-I1736 PolarHBondContact O-N 3.21Å; S1734-R1737 PolarHBondContact O-N 2.96Å; S1734-L1738 WeakPolarHBondContact O-CB 3.18Å; S1734-L1738 PolarHBondContact O-N 3.25Å
1735L63.9Low64.6Low27.4 Ų27.459.8 Ų59.814%0.14330%0.295CS..Hα-helixtrans-65.4-33.2173.3-81.5165.8000112.8F1125 F1128 E1731 Y1732 R1737 L1738 V1739 L1764 F1795F1125-L1735 HydrophobicContact CD1-CD1 4.08Å; F1125-L1735 HydrophobicContact CD1-CD2 3.54Å; F1125-L1735 HydrophobicContact CD1-CG 4.42Å; F1125-L1735 HydrophobicContact CE1-CD1 4.14Å; F1125-L1735 HydrophobicContact CE1-CD2 3.64Å; F1125-L1735 HydrophobicContact CE1-CG 4.48Å; F1125-L1735 HydrophobicContact CG-CD2 4.28Å; F1125-L1735 HydrophobicContact CZ-CD2 4.46Å; F1128-L1735 HydrophobicContact CB-CD1 3.73Å; F1128-L1735 VanDerWaalsContact CB-CD1 3.45Å; F1128-L1735 HydrophobicContact CB-CD2 3.62Å; F1128-L1735 VanDerWaalsContact CB-CD2 3.44Å; F1128-L1735 HydrophobicContact CB-CG 3.45Å; F1128-L1735 HydrophobicContact CD1-CG 4.41Å; F1128-L1735 HydrophobicContact CD2-CD2 3.55Å; F1128-L1735 HydrophobicContact CD2-CG 3.71Å; F1128-L1735 HydrophobicContact CE2-CD2 4.11Å; F1128-L1735 HydrophobicContact CG-CD1 4.25Å; F1128-L1735 HydrophobicContact CG-CD2 3.86Å; F1128-L1735 HydrophobicContact CG-CG 3.91Å; E1731-L1735 WeakPolarHBondContact O-CG 3.4Å; E1731-L1735 PolarHBondContact O-N 3.04Å; Y1732-L1735 HydrophobicContact CD1-CD1 3.6Å; Y1732-L1735 VanDerWaalsContact CD1-CD1 3.47Å; Y1732-L1735 HydrophobicContact CE1-CD1 3.97Å; Y1732-L1735 WeakPolarHBondContact O-CA 3.43Å; Y1732-L1735 VanDerWaalsContact O-CB 3.32Å; Y1732-L1735 WeakPolarHBondContact O-CB 3.35Å; Y1732-L1735 PolarHBondContact O-N 3.16Å; Y1732-L1735 VanDerWaalsContact O-N 3.1Å; L1735-R1737 VanDerWaalsContact C-N 3.3Å; L1735-R1737 PolarHBondContact O-N 3.2Å; L1735-R1737 VanDerWaalsContact O-N 3.12Å; L1735-L1738 HydrophobicContact CD2-CD1 4.33Å; L1735-L1738 WeakPolarHBondContact O-CA 3.33Å; L1735-L1738 WeakPolarHBondContact O-CB 3.44Å; L1735-L1738 PolarHBondContact O-N 3.18Å; L1735-L1738 VanDerWaalsContact O-N 3.14Å; L1735-V1739 PolarHBondContact O-N 3.42Å; L1735-V1739 VanDerWaalsContact O-N 3.11Å; L1735-L1764 HydrophobicContact CD2-CD2 4.43Å; L1735-F1795 HydrophobicContact CB-CE1 3.96Å; L1735-F1795 HydrophobicContact CB-CZ 3.97Å; L1735-F1795 HydrophobicContact CD1-CE1 3.87Å; L1735-F1795 HydrophobicContact CD1-CZ 3.8Å; L1735-F1795 HydrophobicContact CD2-CE1 4.38Å; L1735-F1795 HydrophobicContact CG-CE1 4.32Å; L1735-F1795 HydrophobicContact CG-CZ 4.33Å
1736I63.3Low64.7Low23.6 Ų23.658.9 Ų58.912%0.12129%0.286CS..Hα-helixtrans-60-35.8178-64.2170.6000111.3Y1732 D1733 S1734 L1738 V1739 Q1740 F1761 L1764 F1795 L1796 N1799 I1801Y1732-I1736 VanDerWaalsContact O-CG1 3.25Å; Y1732-I1736 WeakPolarHBondContact O-CG1 3.26Å; Y1732-I1736 PolarHBondContact O-N 3.16Å; Y1732-I1736 VanDerWaalsContact O-N 3.07Å; D1733-I1736 HydrophobicContact CB-CD1 4.48Å; D1733-I1736 WeakPolarHBondContact O-CB 3.36Å; D1733-I1736 PolarHBondContact O-N 3.12Å; S1734-I1736 VanDerWaalsContact C-N 3.28Å; S1734-I1736 PolarHBondContact O-N 3.21Å; I1736-L1738 PolarHBondContact O-N 3.21Å; I1736-L1738 VanDerWaalsContact O-N 3.11Å; I1736-V1739 HydrophobicContact CG2-CG2 4.14Å; I1736-V1739 WeakPolarHBondContact O-CB 3.24Å; I1736-V1739 WeakPolarHBondContact O-CG2 3.32Å; I1736-V1739 PolarHBondContact O-N 3.22Å; I1736-V1739 VanDerWaalsContact O-N 3.14Å; I1736-Q1740 PolarHBondContact O-N 3.26Å; I1736-F1761 HydrophobicContact CB-CE1 4.26Å; I1736-F1761 HydrophobicContact CD1-CD1 4.06Å; I1736-F1761 HydrophobicContact CD1-CE1 4.01Å; I1736-F1761 HydrophobicContact CG1-CD1 4.25Å; I1736-F1761 HydrophobicContact CG1-CE1 3.71Å; I1736-F1761 VanDerWaalsContact CG1-CE1 3.49Å; I1736-F1761 HydrophobicContact CG2-CE1 4.01Å; I1736-L1764 HydrophobicContact CD1-CD1 3.46Å; I1736-L1764 VanDerWaalsContact CD1-CD1 3.46Å; I1736-L1764 HydrophobicContact CD1-CD2 3.28Å; I1736-L1764 HydrophobicContact CG1-CD1 4.42Å; I1736-F1795 HydrophobicContact CB-CE1 4.17Å; I1736-F1795 HydrophobicContact CD1-CE1 4.22Å; I1736-F1795 HydrophobicContact CD1-CE2 4.49Å; I1736-F1795 HydrophobicContact CD1-CZ 4.43Å; I1736-F1795 HydrophobicContact CG1-CE2 4.47Å; I1736-F1795 HydrophobicContact CG1-CZ 4.02Å; I1736-F1795 HydrophobicContact CG2-CD1 4.26Å; I1736-F1795 HydrophobicContact CG2-CE1 3.71Å; I1736-F1795 HydrophobicContact CG2-CZ 4.4Å; I1736-L1796 HydrophobicContact CD1-CD2 3.89Å; I1736-L1796 HydrophobicContact CG1-CD2 4.26Å; I1736-L1796 HydrophobicContact CG2-CD2 3.78Å; I1736-N1799 HydrophobicContact CG2-CB 4.22Å; I1736-N1799 WeakPolarHBondContact CG2-ND2 3.38Å; I1736-I1801 HydrophobicContact CG2-CD1 4.21Å
1737R66.3Low64.7Low176.2 Ų176.261.5 Ų61.567%0.66529%0.293SS*.Hα-helixtrans-64.5-22175.9-65.9-177.9-166.3166.74.4112.8D1733 S1734 L1735 Q1740 H1741 F1795D1733-R1737 WeakPolarHBondContact O-CG 3.22Å; D1733-R1737 PolarHBondContact O-N 3.31Å; S1734-R1737 PolarHBondContact O-N 2.96Å; L1735-R1737 VanDerWaalsContact C-N 3.3Å; L1735-R1737 PolarHBondContact O-N 3.2Å; L1735-R1737 VanDerWaalsContact O-N 3.12Å; R1737-Q1740 PolarHBondContact O-N 3.4Å; R1737-H1741 VanDerWaalsContact O-CB 3.29Å; R1737-H1741 WeakPolarHBondContact O-CB 3.44Å; R1737-H1741 PolarHBondContact O-N 3.38Å; R1737-F1795 HydrophobicContact CG-CZ 4.28Å
1738L66.8Low64.7Low40.4 Ų40.463.1 Ų63.121%0.21230%0.298CS..Hα-helixtrans-87.8-9.7178.7-101.3143.7000112.6A1106 L1124 F1128 S1734 L1735 I1736 Q1740 H1741 A1742 L1757 F1761A1106-L1738 HydrophobicContact CB-CD2 4.39Å; L1124-L1738 HydrophobicContact CD1-CD1 4.36Å; L1124-L1738 HydrophobicContact CD2-CD1 3.51Å; L1124-L1738 VanDerWaalsContact CD2-CD1 3.44Å; L1124-L1738 HydrophobicContact CD2-CD2 3.95Å; L1124-L1738 HydrophobicContact CD2-CG 4.32Å; L1124-L1738 HydrophobicContact CG-CD1 3.88Å; F1128-L1738 HydrophobicContact CD2-CD1 4.02Å; F1128-L1738 HydrophobicContact CE2-CD1 3.84Å; S1734-L1738 WeakPolarHBondContact O-CB 3.18Å; S1734-L1738 PolarHBondContact O-N 3.25Å; L1735-L1738 HydrophobicContact CD2-CD1 4.33Å; L1735-L1738 WeakPolarHBondContact O-CA 3.33Å; L1735-L1738 WeakPolarHBondContact O-CB 3.44Å; L1735-L1738 PolarHBondContact O-N 3.18Å; L1735-L1738 VanDerWaalsContact O-N 3.14Å; I1736-L1738 PolarHBondContact O-N 3.21Å; I1736-L1738 VanDerWaalsContact O-N 3.11Å; L1738-Q1740 PolarHBondContact O-N 3.04Å; L1738-Q1740 VanDerWaalsContact O-N 3.1Å; L1738-H1741 WeakPolarHBondContact O-CA 3.01Å; L1738-H1741 WeakPolarHBondContact O-CB 3.33Å; L1738-H1741 PolarHBondContact O-N 3.09Å; L1738-A1742 PolarHBondContact O-N 3.29Å; L1738-A1742 VanDerWaalsContact O-N 3.13Å; L1738-L1757 HydrophobicContact CD1-CD1 3.82Å; L1738-L1757 HydrophobicContact CD2-CD1 4.08Å; L1738-L1757 HydrophobicContact CD2-CD2 3.76Å; L1738-L1757 HydrophobicContact CD2-CG 3.67Å; L1738-L1757 HydrophobicContact CG-CD1 4.14Å; L1738-F1761 HydrophobicContact CD2-CD1 4.44Å; L1738-F1761 HydrophobicContact CD2-CE1 3.8Å; L1738-F1761 VanDerWaalsContact CD2-CE1 3.49Å; L1738-F1761 HydrophobicContact CD2-CE2 4.48Å; L1738-F1761 HydrophobicContact CD2-CZ 3.91Å; L1738-F1761 HydrophobicContact CG-CZ 4.41Å
1739V65.7Low64.8Low4 Ų463.8 Ų63.82%0.02432%0.316CS..Hα-helixtrans-56.3-38.4175.9170.50000112.1L1735 I1736 H1741 A1742 Y1743 F1761 N1799 I1801 L1804L1735-V1739 PolarHBondContact O-N 3.42Å; L1735-V1739 VanDerWaalsContact O-N 3.11Å; I1736-V1739 HydrophobicContact CG2-CG2 4.14Å; I1736-V1739 WeakPolarHBondContact O-CB 3.24Å; I1736-V1739 WeakPolarHBondContact O-CG2 3.32Å; I1736-V1739 PolarHBondContact O-N 3.22Å; I1736-V1739 VanDerWaalsContact O-N 3.14Å; V1739-H1741 PolarHBondContact O-N 3.34Å; V1739-H1741 VanDerWaalsContact O-N 3.13Å; V1739-A1742 VanDerWaalsContact O-CB 3.3Å; V1739-A1742 WeakPolarHBondContact O-CB 3.4Å; V1739-A1742 PolarHBondContact O-N 3.24Å; V1739-A1742 VanDerWaalsContact O-N 3.08Å; V1739-Y1743 HydrophobicContact CG1-CE2 4.06Å; V1739-Y1743 VanDerWaalsContact O-CD2 3.27Å; V1739-Y1743 WeakPolarHBondContact O-CD2 3.32Å; V1739-Y1743 PolarHBondContact O-N 3.15Å; V1739-F1761 HydrophobicContact CB-CZ 4.39Å; V1739-F1761 HydrophobicContact CG2-CE1 4.06Å; V1739-F1761 HydrophobicContact CG2-CE2 3.98Å; V1739-F1761 HydrophobicContact CG2-CZ 3.57Å; V1739-N1799 WeakPolarHBondContact CG1-O 3.33Å; V1739-N1799 HydrophobicContact CG2-CB 4.43Å; V1739-I1801 HydrophobicContact CB-CG1 4.46Å; V1739-I1801 HydrophobicContact CG1-CG1 4Å; V1739-I1801 HydrophobicContact CG2-CD1 4.13Å; V1739-I1801 HydrophobicContact CG2-CG1 4Å; V1739-L1804 HydrophobicContact CG1-CB 4.35Å; V1739-L1804 HydrophobicContact CG1-CD1 3.89Å; V1739-L1804 HydrophobicContact CG1-CD2 4.21Å
1740Q66.4Low65.1Low125.6 Ų125.662.3 Ų62.359%0.58731%0.308SS*.Hα-helixtrans-59.2-35.4177.5-67.8-179-10.200112.5I1736 R1737 L1738 A1742 Y1743 D1744I1736-Q1740 PolarHBondContact O-N 3.26Å; R1737-Q1740 PolarHBondContact O-N 3.4Å; L1738-Q1740 PolarHBondContact O-N 3.04Å; L1738-Q1740 VanDerWaalsContact O-N 3.1Å; Q1740-A1742 PolarHBondContact O-N 3.37Å; Q1740-Y1743 WeakPolarHBondContact O-CB 3.44Å; Q1740-Y1743 PolarHBondContact O-N 3.09Å; Q1740-D1744 PolarHBondContact O-N 3.1Å
1741H66.2Low65.4Low62.4 Ų62.460 Ų6029%0.28930%0.299SS..Hα-helixtrans-81.1-19.1176.1-101.4-77.4000113.2L1121 R1737 L1738 V1739 Y1743 D1744 L1745L1121-H1741 HydrophobicContact CD1-CB 4.26Å; R1737-H1741 VanDerWaalsContact O-CB 3.29Å; R1737-H1741 WeakPolarHBondContact O-CB 3.44Å; R1737-H1741 PolarHBondContact O-N 3.38Å; L1738-H1741 WeakPolarHBondContact O-CA 3.01Å; L1738-H1741 WeakPolarHBondContact O-CB 3.33Å; L1738-H1741 PolarHBondContact O-N 3.09Å; V1739-H1741 PolarHBondContact O-N 3.34Å; V1739-H1741 VanDerWaalsContact O-N 3.13Å; H1741-Y1743 VanDerWaalsContact C-N 3.32Å; H1741-Y1743 PolarHBondContact O-N 3.06Å; H1741-D1744 IonicContact ND1-OD2 2.89Å; H1741-D1744 VanDerWaalsContact O-CB 3.25Å; H1741-D1744 WeakPolarHBondContact O-CB 3.39Å; H1741-D1744 PolarHBondContact O-N 3.21Å; H1741-D1744 VanDerWaalsContact O-N 3.09Å; H1741-L1745 VanDerWaalsContact CE1-CD1 3.49Å; H1741-L1745 WeakPolarHBondContact CE1-CD1 3.41Å; H1741-L1745 WeakPolarHBondContact O-CG 3.45Å; H1741-L1745 PolarHBondContact O-N 3.13Å
1742A68.3Low65.6Low1.2 Ų1.260.8 Ų60.81%0.0131%0.313CS..Hα-helixtrans-64.3-32.4179.400000112.5L1738 V1739 Q1740 D1744 L1745 I1746 F1754 L1757 F1761 L1804L1738-A1742 PolarHBondContact O-N 3.29Å; L1738-A1742 VanDerWaalsContact O-N 3.13Å; V1739-A1742 VanDerWaalsContact O-CB 3.3Å; V1739-A1742 WeakPolarHBondContact O-CB 3.4Å; V1739-A1742 PolarHBondContact O-N 3.24Å; V1739-A1742 VanDerWaalsContact O-N 3.08Å; Q1740-A1742 PolarHBondContact O-N 3.37Å; A1742-D1744 VanDerWaalsContact C-N 3.28Å; A1742-D1744 PolarHBondContact O-N 3.02Å; A1742-L1745 HydrophobicContact CB-CD1 4.26Å; A1742-L1745 VanDerWaalsContact O-CB 3.26Å; A1742-L1745 WeakPolarHBondContact O-CB 3.38Å; A1742-L1745 PolarHBondContact O-N 3.35Å; A1742-L1745 VanDerWaalsContact O-N 3.12Å; A1742-I1746 WeakPolarHBondContact O-CG1 3.48Å; A1742-I1746 PolarHBondContact O-N 3.27Å; A1742-F1754 HydrophobicContact CB-CE2 4.23Å; A1742-F1754 VanDerWaalsContact O-CD2 3.31Å; A1742-F1754 WeakPolarHBondContact O-CD2 3.32Å; A1742-F1754 WeakPolarHBondContact O-CE2 3.42Å; A1742-L1757 HydrophobicContact CB-CD1 4.03Å; A1742-L1757 HydrophobicContact CB-CD2 3.59Å; A1742-L1757 HydrophobicContact CB-CG 4.46Å; A1742-F1761 HydrophobicContact CB-CE2 4.27Å; A1742-L1804 HydrophobicContact CB-CD1 3.93Å; A1742-L1804 VanDerWaalsContact CB-CD1 3.41Å; A1742-L1804 HydrophobicContact CB-CD2 4.14Å
1743Y67.1Low66Low30 Ų3061.5 Ų61.512%0.11832%0.318CS..THydrogen-bonded Turntrans-64.1-38.1174.2-135.8-93.4000112V1739 Q1740 H1741 L1745 I1746 E1747 G1800 D1803 L1804 R1807 N1811V1739-Y1743 HydrophobicContact CG1-CE2 4.06Å; V1739-Y1743 VanDerWaalsContact O-CD2 3.27Å; V1739-Y1743 WeakPolarHBondContact O-CD2 3.32Å; V1739-Y1743 PolarHBondContact O-N 3.15Å; Q1740-Y1743 WeakPolarHBondContact O-CB 3.44Å; Q1740-Y1743 PolarHBondContact O-N 3.09Å; H1741-Y1743 VanDerWaalsContact C-N 3.32Å; H1741-Y1743 PolarHBondContact O-N 3.06Å; Y1743-L1745 VanDerWaalsContact C-N 3.28Å; Y1743-L1745 PolarHBondContact O-N 2.99Å; Y1743-L1745 VanDerWaalsContact O-N 3.08Å; Y1743-I1746 HydrophobicContact CD2-CD1 3.96Å; Y1743-I1746 HydrophobicContact CE2-CD1 4.03Å; Y1743-I1746 PolarHBondContact O-N 2.96Å; Y1743-I1746 VanDerWaalsContact O-N 3.15Å; Y1743-E1747 HydrophobicContact CD1-CG 4.34Å; Y1743-E1747 HydrophobicContact CE1-CG 3.95Å; Y1743-E1747 PolarHBondContact O-N 3.09Å; Y1743-G1800 PolarHBondContact OH-O 3.15Å; Y1743-D1803 VanDerWaalsContact OH-CB 3.31Å; Y1743-D1803 WeakPolarHBondContact OH-CB 3.34Å; Y1743-D1803 PolarHBondContact OH-OD2 3.2Å; Y1743-L1804 HydrophobicContact CD1-CD1 4.02Å; Y1743-L1804 HydrophobicContact CD2-CD1 4.28Å; Y1743-L1804 HydrophobicContact CE1-CB 4.29Å; Y1743-L1804 HydrophobicContact CE1-CD1 4.1Å; Y1743-L1804 HydrophobicContact CE2-CB 4.36Å; Y1743-L1804 HydrophobicContact CE2-CD1 4.41Å; Y1743-L1804 HydrophobicContact CG-CD1 4.28Å; Y1743-L1804 PolarHBondContact OH-N 3.22Å; Y1743-R1807 VanDerWaalsContact CD1-NH1 3.3Å; Y1743-R1807 HydrophobicContact CD2-CB 3.69Å; Y1743-R1807 HydrophobicContact CE1-CB 4.4Å; Y1743-R1807 VanDerWaalsContact CE1-CZ 3.42Å; Y1743-R1807 HydrophobicContact CE2-CB 3.39Å; Y1743-R1807 VanDerWaalsContact CE2-CB 3.46Å; Y1743-R1807 HydrophobicContact CE2-CG 4.42Å; Y1743-R1807 WeakPolarHBondContact CE2-O 3.46Å; Y1743-R1807 HydrophobicContact CG-CB 4.32Å; Y1743-R1807 VanDerWaalsContact CG-NH1 3.3Å; Y1743-R1807 PolarHBondContact OH-O 2.98Å; Y1743-N1811 PolarHBondContact OH-ND2 3.04Å
1744D67.7Low66.5Low46.8 Ų46.858.1 Ų58.125%0.2530%0.3SS..Hα-helixtrans-60.6-29.1178.5-59.6-37.6000111.5K1117 L1121 Q1740 H1741 A1742 I1746 E1747 L1748K1117-D1744 VanDerWaalsContact CE-CB 3.45Å; K1117-D1744 WeakPolarHBondContact CE-OD2 3.13Å; K1117-D1744 IonicContact NZ-OD1 2.7Å; K1117-D1744 PolarHBondContact NZ-OD1 3.08Å; K1117-D1744 IonicContact NZ-OD2 3.25Å; K1117-D1744 PolarHBondContact NZ-OD2 3.11Å; L1121-D1744 HydrophobicContact CD2-CB 4.41Å; Q1740-D1744 PolarHBondContact O-N 3.1Å; H1741-D1744 IonicContact ND1-OD2 2.89Å; H1741-D1744 VanDerWaalsContact O-CB 3.25Å; H1741-D1744 WeakPolarHBondContact O-CB 3.39Å; H1741-D1744 PolarHBondContact O-N 3.21Å; H1741-D1744 VanDerWaalsContact O-N 3.09Å; A1742-D1744 VanDerWaalsContact C-N 3.28Å; A1742-D1744 PolarHBondContact O-N 3.02Å; D1744-I1746 VanDerWaalsContact C-N 3.34Å; D1744-I1746 PolarHBondContact O-N 3.16Å; D1744-E1747 PolarHBondContact O-N 2.96Å; D1744-L1748 HydrophobicContact CB-CD1 4.34Å; D1744-L1748 VanDerWaalsContact O-CB 3.29Å; D1744-L1748 WeakPolarHBondContact O-CB 3.24Å; D1744-L1748 VanDerWaalsContact O-CD1 3.23Å; D1744-L1748 WeakPolarHBondContact O-CD1 3.38Å; D1744-L1748 VanDerWaalsContact O-CG 3.22Å; D1744-L1748 WeakPolarHBondContact O-CG 3.4Å; D1744-L1748 PolarHBondContact O-N 3.08Å
1745L66.6Low66.9Low3.4 Ų3.456.9 Ų56.92%0.01829%0.29CS..Hα-helixtrans-65.6-34.3175.8-70.3172.1000113.5L1121 F1125 H1741 A1742 Y1743 L1748 G1749 F1750 Q1753 F1754 L1757L1121-L1745 HydrophobicContact CD2-CD2 3.41Å; L1121-L1745 VanDerWaalsContact CD2-CD2 3.46Å; L1121-L1745 HydrophobicContact CD2-CG 3.74Å; L1121-L1745 HydrophobicContact CG-CD2 3.89Å; L1121-L1745 HydrophobicContact CG-CG 4.47Å; F1125-L1745 HydrophobicContact CD2-CD1 4.25Å; F1125-L1745 HydrophobicContact CD2-CD2 4.23Å; F1125-L1745 HydrophobicContact CE1-CD1 4.46Å; F1125-L1745 HydrophobicContact CE2-CD1 3.49Å; F1125-L1745 VanDerWaalsContact CE2-CD1 3.46Å; F1125-L1745 HydrophobicContact CE2-CD2 3.94Å; F1125-L1745 HydrophobicContact CE2-CG 3.98Å; F1125-L1745 HydrophobicContact CZ-CD1 3.67Å; F1125-L1745 HydrophobicContact CZ-CG 4.41Å; H1741-L1745 VanDerWaalsContact CE1-CD1 3.49Å; H1741-L1745 WeakPolarHBondContact CE1-CD1 3.41Å; H1741-L1745 WeakPolarHBondContact O-CG 3.45Å; H1741-L1745 PolarHBondContact O-N 3.13Å; A1742-L1745 HydrophobicContact CB-CD1 4.26Å; A1742-L1745 VanDerWaalsContact O-CB 3.26Å; A1742-L1745 WeakPolarHBondContact O-CB 3.38Å; A1742-L1745 PolarHBondContact O-N 3.35Å; A1742-L1745 VanDerWaalsContact O-N 3.12Å; Y1743-L1745 VanDerWaalsContact C-N 3.28Å; Y1743-L1745 PolarHBondContact O-N 2.99Å; Y1743-L1745 VanDerWaalsContact O-N 3.08Å; L1745-L1748 PolarHBondContact O-N 3.34Å; L1745-G1749 PolarHBondContact O-N 3.37Å; L1745-G1749 VanDerWaalsContact O-N 3.13Å; L1745-F1750 HydrophobicContact CB-CB 4.42Å; L1745-F1750 HydrophobicContact CD2-CB 4.11Å; L1745-F1750 HydrophobicContact CD2-CD2 4.2Å; L1745-F1750 HydrophobicContact CD2-CG 4.5Å; L1745-F1750 PolarHBondContact O-N 3.1Å; L1745-F1750 VanDerWaalsContact O-N 3.15Å; L1745-Q1753 HydrophobicContact CD1-CB 4.25Å; L1745-Q1753 HydrophobicContact CD2-CB 4.34Å; L1745-F1754 HydrophobicContact CB-CB 4.36Å; L1745-F1754 HydrophobicContact CB-CD2 4.27Å; L1745-F1754 HydrophobicContact CD1-CB 4.34Å; L1745-F1754 HydrophobicContact CD1-CD2 4.34Å; L1745-L1757 HydrophobicContact CD1-CD1 4.04Å; L1745-L1757 HydrophobicContact CD1-CD2 4.16Å
1746I64.2Low67.2Low27.8 Ų27.860.8 Ų60.814%0.14331%0.306CS..Hα-helixtrans-69.4-47178.3-59.7173000109.4A1742 Y1743 D1744 L1748 G1749 F1754 L1804 C1808 T1814A1742-I1746 WeakPolarHBondContact O-CG1 3.48Å; A1742-I1746 PolarHBondContact O-N 3.27Å; Y1743-I1746 HydrophobicContact CD2-CD1 3.96Å; Y1743-I1746 HydrophobicContact CE2-CD1 4.03Å; Y1743-I1746 PolarHBondContact O-N 2.96Å; Y1743-I1746 VanDerWaalsContact O-N 3.15Å; D1744-I1746 VanDerWaalsContact C-N 3.34Å; D1744-I1746 PolarHBondContact O-N 3.16Å; I1746-L1748 VanDerWaalsContact C-N 3.35Å; I1746-L1748 PolarHBondContact O-N 3.31Å; I1746-L1748 VanDerWaalsContact O-N 3.11Å; I1746-G1749 PolarHBondContact O-N 3.23Å; I1746-F1754 HydrophobicContact CD1-CD1 3.77Å; I1746-F1754 HydrophobicContact CD1-CD2 4.34Å; I1746-F1754 HydrophobicContact CD1-CE1 3.75Å; I1746-F1754 HydrophobicContact CD1-CE2 3.89Å; I1746-F1754 HydrophobicContact CD1-CG 4.24Å; I1746-F1754 HydrophobicContact CD1-CZ 3.55Å; I1746-F1754 VanDerWaalsContact CD1-CZ 3.47Å; I1746-F1754 HydrophobicContact CG1-CB 4.22Å; I1746-F1754 HydrophobicContact CG1-CD1 3.84Å; I1746-F1754 VanDerWaalsContact CG1-CD1 3.48Å; I1746-F1754 HydrophobicContact CG1-CD2 3.92Å; I1746-F1754 HydrophobicContact CG1-CE1 3.92Å; I1746-F1754 HydrophobicContact CG1-CE2 3.85Å; I1746-F1754 VanDerWaalsContact CG1-CE2 3.49Å; I1746-F1754 HydrophobicContact CG1-CG 4Å; I1746-F1754 HydrophobicContact CG1-CZ 3.88Å; I1746-L1804 HydrophobicContact CD1-CD1 3.93Å; I1746-L1804 HydrophobicContact CD1-CG 4.34Å; I1746-C1808 VanDerWaalsContact CD1-SG 3.57Å; I1746-T1814 HydrophobicContact CG2-CG2 4.21Å
1747E64.6Low67.7Low139.2 Ų139.260.3 Ų60.365%0.6530%0.304SS*.Hα-helixtrans-62.5-29.3178.3-71.5-170.4169.900112.4Y1743 D1744 G1749Y1743-E1747 HydrophobicContact CD1-CG 4.34Å; Y1743-E1747 HydrophobicContact CE1-CG 3.95Å; Y1743-E1747 PolarHBondContact O-N 3.09Å; D1744-E1747 PolarHBondContact O-N 2.96Å; E1747-G1749 VanDerWaalsContact C-N 3.34Å
1748L63.3Low68.1Low70.8 Ų70.852 Ų5237%0.37127%0.272SS..THydrogen-bonded Turntrans-94.6-3-176.5-63.2172.4000114.2V1114 K1117 L1118 D1744 L1745 I1746 F1750V1114-L1748 HydrophobicContact CG1-CD1 4.31Å; V1114-L1748 HydrophobicContact CG1-CD2 3.41Å; V1114-L1748 VanDerWaalsContact CG1-CD2 3.47Å; V1114-L1748 HydrophobicContact CG1-CG 4.37Å; K1117-L1748 HydrophobicContact CD-CD1 4.18Å; K1117-L1748 HydrophobicContact CG-CD1 4.22Å; L1118-L1748 HydrophobicContact CD1-CB 4.14Å; L1118-L1748 HydrophobicContact CD2-CB 3.18Å; L1118-L1748 HydrophobicContact CD2-CD1 3.65Å; L1118-L1748 HydrophobicContact CD2-CG 3.98Å; L1118-L1748 HydrophobicContact CG-CB 3.85Å; L1118-L1748 HydrophobicContact CG-CD1 3.89Å; L1118-L1748 HydrophobicContact CG-CG 4.34Å; D1744-L1748 HydrophobicContact CB-CD1 4.34Å; D1744-L1748 VanDerWaalsContact O-CB 3.29Å; D1744-L1748 WeakPolarHBondContact O-CB 3.24Å; D1744-L1748 VanDerWaalsContact O-CD1 3.23Å; D1744-L1748 WeakPolarHBondContact O-CD1 3.38Å; D1744-L1748 VanDerWaalsContact O-CG 3.22Å; D1744-L1748 WeakPolarHBondContact O-CG 3.4Å; D1744-L1748 PolarHBondContact O-N 3.08Å; L1745-L1748 PolarHBondContact O-N 3.34Å; I1746-L1748 VanDerWaalsContact C-N 3.35Å; I1746-L1748 PolarHBondContact O-N 3.31Å; I1746-L1748 VanDerWaalsContact O-N 3.11Å; L1748-F1750 HydrophobicContact CB-CD2 3.9Å; L1748-F1750 HydrophobicContact CB-CE2 3.81Å; L1748-F1750 HydrophobicContact CD1-CD2 4.42Å; L1748-F1750 HydrophobicContact CD1-CE2 4.32Å; L1748-F1750 PolarHBondContact O-N 2.96Å
1749G62.6Low68.4Low58 Ų5855.1 Ų55.160%0.59829%0.286SS*.THydrogen-bonded Turntrans85.117.1170.900000116.6L1745 I1746 E1747 E1751L1745-G1749 PolarHBondContact O-N 3.37Å; L1745-G1749 VanDerWaalsContact O-N 3.13Å; I1746-G1749 PolarHBondContact O-N 3.23Å; E1747-G1749 VanDerWaalsContact C-N 3.34Å; G1749-E1751 PolarHBondContact O-N 3.21Å; G1749-E1751 VanDerWaalsContact O-N 3.12Å
1750F67.4Low68.6Low76.6 Ų76.656.6 Ų56.634%0.33629%0.294SS..  trans-93.263.6178.7-70.7-71.4000112.8L1118 L1745 L1748 S1752 Q1753 F1754L1118-F1750 HydrophobicContact CB-CE2 4.37Å; L1118-F1750 HydrophobicContact CD1-CE2 4.32Å; L1118-F1750 HydrophobicContact CD2-CD2 3.54Å; L1118-F1750 HydrophobicContact CD2-CE2 3.4Å; L1118-F1750 VanDerWaalsContact CD2-CE2 3.45Å; L1118-F1750 HydrophobicContact CG-CE2 4.26Å; L1745-F1750 HydrophobicContact CB-CB 4.42Å; L1745-F1750 HydrophobicContact CD2-CB 4.11Å; L1745-F1750 HydrophobicContact CD2-CD2 4.2Å; L1745-F1750 HydrophobicContact CD2-CG 4.5Å; L1745-F1750 PolarHBondContact O-N 3.1Å; L1745-F1750 VanDerWaalsContact O-N 3.15Å; L1748-F1750 HydrophobicContact CB-CD2 3.9Å; L1748-F1750 HydrophobicContact CB-CE2 3.81Å; L1748-F1750 HydrophobicContact CD1-CD2 4.42Å; L1748-F1750 HydrophobicContact CD1-CE2 4.32Å; L1748-F1750 PolarHBondContact O-N 2.96Å; F1750-S1752 VanDerWaalsContact C-N 3.3Å; F1750-S1752 PolarHBondContact O-N 3.24Å; F1750-Q1753 HydrophobicContact CB-CB 4.36Å; F1750-Q1753 PolarHBondContact O-N 2.97Å; F1750-F1754 PolarHBondContact O-N 3.35Å; F1750-F1754 VanDerWaalsContact O-N 3.14Å
1751E68.6Low69.1Low86.2 Ų86.250.7 Ų50.740%0.40327%0.267SS..Hα-helixtrans-56.8-38.6-175.4-65.4-164.1146.700113.9G1749 Q1753 F1754 V1755 S1815 I1818G1749-E1751 PolarHBondContact O-N 3.21Å; G1749-E1751 VanDerWaalsContact O-N 3.12Å; E1751-Q1753 PolarHBondContact O-N 3.28Å; E1751-F1754 PolarHBondContact O-N 3.23Å; E1751-V1755 WeakPolarHBondContact O-CB 3.3Å; E1751-V1755 VanDerWaalsContact O-CG2 3.26Å; E1751-V1755 WeakPolarHBondContact O-CG2 3.4Å; E1751-V1755 PolarHBondContact O-N 3.2Å; E1751-S1815 VanDerWaalsContact OE1-CB 3.29Å; E1751-S1815 WeakPolarHBondContact OE1-CB 3.35Å; E1751-S1815 PolarHBondContact OE1-N 2.54Å; E1751-S1815 PolarHBondContact OE1-OG 3.29Å; E1751-S1815 VanDerWaalsContact OE1-OG 3.08Å; E1751-S1815 PolarHBondContact OE2-OG 3.5Å; E1751-I1818 HydrophobicContact CB-CD1 4.22Å; E1751-I1818 HydrophobicContact CG-CD1 4.13Å
1752S69.2Low69.4Low86.6 Ų86.648.2 Ų48.261%0.60626%0.256SS*.Hα-helixtrans-66.6-38.4-176.662.70000113.3F1750 K1756F1750-S1752 VanDerWaalsContact C-N 3.3Å; F1750-S1752 PolarHBondContact O-N 3.24Å; S1752-K1756 WeakPolarHBondContact O-CG 3.37Å; S1752-K1756 PolarHBondContact O-N 3.05Å; S1752-K1756 VanDerWaalsContact O-N 3.16Å
1753Q69.8Low69.5Low75.6 Ų75.650.8 Ų50.835%0.35327%0.274SS..Hα-helixtrans-72-38.6175.7-66.7-177.9-300110.6L1745 F1750 E1751 K1756 L1757L1745-Q1753 HydrophobicContact CD1-CB 4.25Å; L1745-Q1753 HydrophobicContact CD2-CB 4.34Å; F1750-Q1753 HydrophobicContact CB-CB 4.36Å; F1750-Q1753 PolarHBondContact O-N 2.97Å; E1751-Q1753 PolarHBondContact O-N 3.28Å; Q1753-K1756 PolarHBondContact O-N 3.22Å; Q1753-L1757 WeakPolarHBondContact O-CB 3.22Å; Q1753-L1757 PolarHBondContact O-N 3.16Å
1754F73.8Confident69.6Low2.2 Ų2.251.2 Ų51.21%0.0128%0.278CS..Hα-helixtrans-65.3-42.3176.9-171-105.7000112.6A1742 L1745 I1746 F1750 E1751 K1756 L1757 L1758 L1804 C1808 I1818A1742-F1754 HydrophobicContact CB-CE2 4.23Å; A1742-F1754 VanDerWaalsContact O-CD2 3.31Å; A1742-F1754 WeakPolarHBondContact O-CD2 3.32Å; A1742-F1754 WeakPolarHBondContact O-CE2 3.42Å; L1745-F1754 HydrophobicContact CB-CB 4.36Å; L1745-F1754 HydrophobicContact CB-CD2 4.27Å; L1745-F1754 HydrophobicContact CD1-CB 4.34Å; L1745-F1754 HydrophobicContact CD1-CD2 4.34Å; I1746-F1754 HydrophobicContact CD1-CD1 3.77Å; I1746-F1754 HydrophobicContact CD1-CD2 4.34Å; I1746-F1754 HydrophobicContact CD1-CE1 3.75Å; I1746-F1754 HydrophobicContact CD1-CE2 3.89Å; I1746-F1754 HydrophobicContact CD1-CG 4.24Å; I1746-F1754 HydrophobicContact CD1-CZ 3.55Å; I1746-F1754 VanDerWaalsContact CD1-CZ 3.47Å; I1746-F1754 HydrophobicContact CG1-CB 4.22Å; I1746-F1754 HydrophobicContact CG1-CD1 3.84Å; I1746-F1754 VanDerWaalsContact CG1-CD1 3.48Å; I1746-F1754 HydrophobicContact CG1-CD2 3.92Å; I1746-F1754 HydrophobicContact CG1-CE1 3.92Å; I1746-F1754 HydrophobicContact CG1-CE2 3.85Å; I1746-F1754 VanDerWaalsContact CG1-CE2 3.49Å; I1746-F1754 HydrophobicContact CG1-CG 4Å; I1746-F1754 HydrophobicContact CG1-CZ 3.88Å; F1750-F1754 PolarHBondContact O-N 3.35Å; F1750-F1754 VanDerWaalsContact O-N 3.14Å; E1751-F1754 PolarHBondContact O-N 3.23Å; F1754-K1756 VanDerWaalsContact C-N 3.33Å; F1754-K1756 PolarHBondContact O-N 3.33Å; F1754-L1757 HydrophobicContact CD2-CD2 4.34Å; F1754-L1757 HydrophobicContact CE2-CD2 4.21Å; F1754-L1757 WeakPolarHBondContact O-CB 3.31Å; F1754-L1757 PolarHBondContact O-N 3.25Å; F1754-L1757 VanDerWaalsContact O-N 3.14Å; F1754-L1758 HydrophobicContact CD1-CD1 3.89Å; F1754-L1758 HydrophobicContact CD1-CG 4.21Å; F1754-L1758 HydrophobicContact CE1-CD1 3.44Å; F1754-L1758 VanDerWaalsContact CE1-CD1 3.45Å; F1754-L1758 HydrophobicContact CE1-CD2 4.24Å; F1754-L1758 HydrophobicContact CE1-CG 3.78Å; F1754-L1758 HydrophobicContact CE2-CG 4.38Å; F1754-L1758 HydrophobicContact CZ-CD1 4.12Å; F1754-L1758 HydrophobicContact CZ-CD2 4.08Å; F1754-L1758 HydrophobicContact CZ-CG 4.02Å; F1754-L1758 PolarHBondContact O-N 3.06Å; F1754-L1804 HydrophobicContact CE2-CD1 4.16Å; F1754-L1804 HydrophobicContact CE2-CD2 4.38Å; F1754-L1804 HydrophobicContact CE2-CG 4.46Å; F1754-L1804 HydrophobicContact CZ-CD1 4.26Å; F1754-L1804 HydrophobicContact CZ-CD2 4.01Å; F1754-L1804 HydrophobicContact CZ-CG 4.3Å; F1754-C1808 VanDerWaalsContact CE1-SG 3.59Å; F1754-C1808 VanDerWaalsContact CZ-SG 3.53Å; F1754-C1808 WeakPolarHBondContact CZ-SG 3.34Å; F1754-I1818 HydrophobicContact CD1-CD1 3.97Å; F1754-I1818 HydrophobicContact CD1-CG1 4.21Å; F1754-I1818 HydrophobicContact CD1-CG2 4.07Å; F1754-I1818 HydrophobicContact CE1-CG2 3.72Å
1755V72.8Confident69.7Low30 Ų3049.3 Ų49.318%0.18227%0.268CS..Hα-helixtrans-58.4-45.3173.6165.80000110.8E1751 L1757 L1758 Q1759 I1818 M1821E1751-V1755 WeakPolarHBondContact O-CB 3.3Å; E1751-V1755 VanDerWaalsContact O-CG2 3.26Å; E1751-V1755 WeakPolarHBondContact O-CG2 3.4Å; E1751-V1755 PolarHBondContact O-N 3.2Å; V1755-L1757 VanDerWaalsContact C-N 3.29Å; V1755-L1757 PolarHBondContact O-N 2.98Å; V1755-L1758 WeakPolarHBondContact O-CB 3.43Å; V1755-L1758 PolarHBondContact O-N 3.29Å; V1755-Q1759 WeakPolarHBondContact O-CG 3.4Å; V1755-Q1759 PolarHBondContact O-N 3.15Å; V1755-I1818 HydrophobicContact CG2-CD1 4.22Å; V1755-I1818 HydrophobicContact CG2-CG1 3.73Å; V1755-M1821 HydrophobicContact CB-SD 4.48Å; V1755-M1821 HydrophobicContact CG1-CE 4.4Å; V1755-M1821 HydrophobicContact CG1-SD 3.8Å; V1755-M1821 HydrophobicContact CG2-SD 4.44Å
1756K70.9Confident69.8Low109.8 Ų109.853.7 Ų53.748%0.47729%0.287SS..Hα-helixtrans-61.3-41.5175.3-73.6-178175.8-166.80112.1E1132 S1752 Q1753 F1754 L1758 Q1759 V1760E1132-K1756 IonicContact OE1-NZ 2.92Å; E1132-K1756 PolarHBondContact OE1-NZ 3.26Å; E1132-K1756 VanDerWaalsContact OE1-NZ 3.09Å; S1752-K1756 WeakPolarHBondContact O-CG 3.37Å; S1752-K1756 PolarHBondContact O-N 3.05Å; S1752-K1756 VanDerWaalsContact O-N 3.16Å; Q1753-K1756 PolarHBondContact O-N 3.22Å; F1754-K1756 VanDerWaalsContact C-N 3.33Å; F1754-K1756 PolarHBondContact O-N 3.33Å; K1756-L1758 VanDerWaalsContact C-N 3.32Å; K1756-L1758 PolarHBondContact O-N 3.07Å; K1756-Q1759 WeakPolarHBondContact O-CB 3.36Å; K1756-Q1759 PolarHBondContact O-N 3.27Å; K1756-Q1759 VanDerWaalsContact O-N 3.1Å; K1756-V1760 WeakPolarHBondContact O-CG2 3.38Å; K1756-V1760 PolarHBondContact O-N 2.96Å
1757L72.3Confident69.4Low14 Ų1454.2 Ų54.27%0.07330%0.296CS..Hα-helixtrans-63.4-41.4177-170.5110.7000111.6F1125 L1738 A1742 L1745 Q1753 F1754 V1755 Q1759 V1760 F1761F1125-L1757 HydrophobicContact CD1-CD1 4.43Å; F1125-L1757 HydrophobicContact CE1-CD1 3.85Å; F1125-L1757 VanDerWaalsContact CE1-CD1 3.45Å; F1125-L1757 HydrophobicContact CZ-CD1 4.02Å; F1125-L1757 HydrophobicContact CZ-CD2 4.48Å; L1738-L1757 HydrophobicContact CD1-CD1 3.82Å; L1738-L1757 HydrophobicContact CD2-CD1 4.08Å; L1738-L1757 HydrophobicContact CD2-CD2 3.76Å; L1738-L1757 HydrophobicContact CD2-CG 3.67Å; L1738-L1757 HydrophobicContact CG-CD1 4.14Å; A1742-L1757 HydrophobicContact CB-CD1 4.03Å; A1742-L1757 HydrophobicContact CB-CD2 3.59Å; A1742-L1757 HydrophobicContact CB-CG 4.46Å; L1745-L1757 HydrophobicContact CD1-CD1 4.04Å; L1745-L1757 HydrophobicContact CD1-CD2 4.16Å; Q1753-L1757 WeakPolarHBondContact O-CB 3.22Å; Q1753-L1757 PolarHBondContact O-N 3.16Å; F1754-L1757 HydrophobicContact CD2-CD2 4.34Å; F1754-L1757 HydrophobicContact CE2-CD2 4.21Å; F1754-L1757 WeakPolarHBondContact O-CB 3.31Å; F1754-L1757 PolarHBondContact O-N 3.25Å; F1754-L1757 VanDerWaalsContact O-N 3.14Å; V1755-L1757 VanDerWaalsContact C-N 3.29Å; V1755-L1757 PolarHBondContact O-N 2.98Å; L1757-Q1759 VanDerWaalsContact C-N 3.33Å; L1757-Q1759 PolarHBondContact O-N 3.2Å; L1757-V1760 WeakPolarHBondContact O-CB 3.27Å; L1757-V1760 PolarHBondContact O-N 3.02Å; L1757-V1760 VanDerWaalsContact O-N 3.12Å; L1757-F1761 HydrophobicContact CD1-CE1 4.37Å; L1757-F1761 HydrophobicContact CD1-CE2 4.31Å; L1757-F1761 HydrophobicContact CD1-CZ 4.11Å; L1757-F1761 HydrophobicContact CD2-CD2 3.86Å; L1757-F1761 HydrophobicContact CD2-CE1 4.39Å; L1757-F1761 HydrophobicContact CD2-CE2 3.37Å; L1757-F1761 HydrophobicContact CD2-CG 4.48Å; L1757-F1761 HydrophobicContact CD2-CZ 3.69Å; L1757-F1761 VanDerWaalsContact CD2-CZ 3.45Å; L1757-F1761 HydrophobicContact CG-CD2 4.26Å; L1757-F1761 HydrophobicContact CG-CE1 4.3Å; L1757-F1761 HydrophobicContact CG-CE2 3.81Å; L1757-F1761 VanDerWaalsContact CG-CE2 3.45Å; L1757-F1761 HydrophobicContact CG-CZ 3.72Å; L1757-F1761 VanDerWaalsContact CG-CZ 3.44Å; L1757-F1761 WeakPolarHBondContact O-CD2 3.38Å; L1757-F1761 VanDerWaalsContact O-CG 3.31Å; L1757-F1761 WeakPolarHBondContact O-CG 3.43Å; L1757-F1761 PolarHBondContact O-N 3.15Å
1758L74.6Confident68.7Low0.6 Ų0.652.9 Ų52.90%0.00330%0.3CS..Hα-helixtrans-63.6-37.9171.7-72.9179.5000112.3F1754 V1755 K1756 V1760 F1761 T1762 L1804 I1818 M1821 L1825F1754-L1758 HydrophobicContact CD1-CD1 3.89Å; F1754-L1758 HydrophobicContact CD1-CG 4.21Å; F1754-L1758 HydrophobicContact CE1-CD1 3.44Å; F1754-L1758 VanDerWaalsContact CE1-CD1 3.45Å; F1754-L1758 HydrophobicContact CE1-CD2 4.24Å; F1754-L1758 HydrophobicContact CE1-CG 3.78Å; F1754-L1758 HydrophobicContact CE2-CG 4.38Å; F1754-L1758 HydrophobicContact CZ-CD1 4.12Å; F1754-L1758 HydrophobicContact CZ-CD2 4.08Å; F1754-L1758 HydrophobicContact CZ-CG 4.02Å; F1754-L1758 PolarHBondContact O-N 3.06Å; V1755-L1758 WeakPolarHBondContact O-CB 3.43Å; V1755-L1758 PolarHBondContact O-N 3.29Å; K1756-L1758 VanDerWaalsContact C-N 3.32Å; K1756-L1758 PolarHBondContact O-N 3.07Å; L1758-V1760 VanDerWaalsContact C-N 3.3Å; L1758-V1760 PolarHBondContact O-N 3.3Å; L1758-F1761 HydrophobicContact CD2-CD2 4.36Å; L1758-F1761 PolarHBondContact O-N 3.16Å; L1758-T1762 VanDerWaalsContact O-CB 3.25Å; L1758-T1762 WeakPolarHBondContact O-CB 3.36Å; L1758-T1762 WeakPolarHBondContact O-CG2 3.32Å; L1758-T1762 PolarHBondContact O-N 3.15Å; L1758-T1762 PolarHBondContact O-OG1 3.14Å; L1758-L1804 HydrophobicContact CD2-CD2 4.08Å; L1758-I1818 HydrophobicContact CD1-CG2 4.06Å; L1758-M1821 HydrophobicContact CB-CB 4.44Å; L1758-M1821 HydrophobicContact CB-CE 3.69Å; L1758-M1821 HydrophobicContact CD1-CB 4.11Å; L1758-L1825 HydrophobicContact CD2-CD1 4.02Å; L1758-L1825 HydrophobicContact CD2-CD2 4.1Å
1759Q73.6Confident67.5Low107.2 Ų107.255.5 Ų55.550%0.50131%0.311SS..Hα-helixtrans-61.2-41.6174-73.2176.9-13.600110.9V1755 K1756 L1757 T1762 S1763 M1821V1755-Q1759 WeakPolarHBondContact O-CG 3.4Å; V1755-Q1759 PolarHBondContact O-N 3.15Å; K1756-Q1759 WeakPolarHBondContact O-CB 3.36Å; K1756-Q1759 PolarHBondContact O-N 3.27Å; K1756-Q1759 VanDerWaalsContact O-N 3.1Å; L1757-Q1759 VanDerWaalsContact C-N 3.33Å; L1757-Q1759 PolarHBondContact O-N 3.2Å; Q1759-T1762 VanDerWaalsContact CA-OG1 3.31Å; Q1759-T1762 WeakPolarHBondContact CA-OG1 3.43Å; Q1759-T1762 PolarHBondContact O-N 3.05Å; Q1759-T1762 PolarHBondContact O-OG1 3.2Å; Q1759-S1763 WeakPolarHBondContact O-CB 3.47Å; Q1759-S1763 PolarHBondContact O-N 3.27Å; Q1759-S1763 PolarHBondContact O-OG 2.95Å; Q1759-M1821 HydrophobicContact CB-CE 4.13Å; Q1759-M1821 HydrophobicContact CG-CE 3.29Å; Q1759-M1821 HydrophobicContact CG-SD 4.35Å; Q1759-M1821 VanDerWaalsContact N-CE 3.31Å
1760V71.3Confident66Low33.8 Ų33.860.3 Ų60.321%0.20532%0.32CS..Hα-helixtrans-64.6-46.9176.2172.90000111.1Y1732 K1756 L1757 L1758 T1762 S1763 L1764Y1732-V1760 HydrophobicContact CD1-CB 4.45Å; Y1732-V1760 HydrophobicContact CD1-CG1 4.04Å; Y1732-V1760 HydrophobicContact CD1-CG2 4Å; Y1732-V1760 HydrophobicContact CD2-CG1 3.98Å; Y1732-V1760 HydrophobicContact CD2-CG2 3.89Å; Y1732-V1760 HydrophobicContact CE1-CG1 4.46Å; Y1732-V1760 HydrophobicContact CE1-CG2 4.01Å; Y1732-V1760 HydrophobicContact CE2-CG1 4.37Å; Y1732-V1760 HydrophobicContact CE2-CG2 3.84Å; Y1732-V1760 HydrophobicContact CG-CB 4.4Å; Y1732-V1760 HydrophobicContact CG-CG1 3.61Å; Y1732-V1760 VanDerWaalsContact CG-CG1 3.43Å; Y1732-V1760 HydrophobicContact CG-CG2 4Å; K1756-V1760 WeakPolarHBondContact O-CG2 3.38Å; K1756-V1760 PolarHBondContact O-N 2.96Å; L1757-V1760 WeakPolarHBondContact O-CB 3.27Å; L1757-V1760 PolarHBondContact O-N 3.02Å; L1757-V1760 VanDerWaalsContact O-N 3.12Å; L1758-V1760 VanDerWaalsContact C-N 3.3Å; L1758-V1760 PolarHBondContact O-N 3.3Å; V1760-T1762 VanDerWaalsContact C-N 3.31Å; V1760-T1762 PolarHBondContact O-N 3.21Å; V1760-S1763 WeakPolarHBondContact CA-OG 3.35Å; V1760-S1763 PolarHBondContact O-N 3.38Å; V1760-S1763 VanDerWaalsContact O-N 3.09Å; V1760-S1763 PolarHBondContact O-OG 3.24Å; V1760-L1764 HydrophobicContact CG1-CD1 3.8Å; V1760-L1764 HydrophobicContact CG1-CG 4.5Å; V1760-L1764 VanDerWaalsContact O-CB 3.3Å; V1760-L1764 WeakPolarHBondContact O-CB 3.41Å; V1760-L1764 WeakPolarHBondContact O-CG 3.26Å; V1760-L1764 PolarHBondContact O-N 3Å
1761F75Confident64.3Low3 Ų365.3 Ų65.31%0.01334%0.344CS..Hα-helixtrans-62.4-37.6175.9-65.2-33.2000112.5I1736 L1738 V1739 A1742 L1757 L1758 L1764 S1765 L1796 I1801 L1804 L1825I1736-F1761 HydrophobicContact CB-CE1 4.26Å; I1736-F1761 HydrophobicContact CD1-CD1 4.06Å; I1736-F1761 HydrophobicContact CD1-CE1 4.01Å; I1736-F1761 HydrophobicContact CG1-CD1 4.25Å; I1736-F1761 HydrophobicContact CG1-CE1 3.71Å; I1736-F1761 VanDerWaalsContact CG1-CE1 3.49Å; I1736-F1761 HydrophobicContact CG2-CE1 4.01Å; L1738-F1761 HydrophobicContact CD2-CD1 4.44Å; L1738-F1761 HydrophobicContact CD2-CE1 3.8Å; L1738-F1761 VanDerWaalsContact CD2-CE1 3.49Å; L1738-F1761 HydrophobicContact CD2-CE2 4.48Å; L1738-F1761 HydrophobicContact CD2-CZ 3.91Å; L1738-F1761 HydrophobicContact CG-CZ 4.41Å; V1739-F1761 HydrophobicContact CB-CZ 4.39Å; V1739-F1761 HydrophobicContact CG2-CE1 4.06Å; V1739-F1761 HydrophobicContact CG2-CE2 3.98Å; V1739-F1761 HydrophobicContact CG2-CZ 3.57Å; A1742-F1761 HydrophobicContact CB-CE2 4.27Å; L1757-F1761 HydrophobicContact CD1-CE1 4.37Å; L1757-F1761 HydrophobicContact CD1-CE2 4.31Å; L1757-F1761 HydrophobicContact CD1-CZ 4.11Å; L1757-F1761 HydrophobicContact CD2-CD2 3.86Å; L1757-F1761 HydrophobicContact CD2-CE1 4.39Å; L1757-F1761 HydrophobicContact CD2-CE2 3.37Å; L1757-F1761 HydrophobicContact CD2-CG 4.48Å; L1757-F1761 HydrophobicContact CD2-CZ 3.69Å; L1757-F1761 VanDerWaalsContact CD2-CZ 3.45Å; L1757-F1761 HydrophobicContact CG-CD2 4.26Å; L1757-F1761 HydrophobicContact CG-CE1 4.3Å; L1757-F1761 HydrophobicContact CG-CE2 3.81Å; L1757-F1761 VanDerWaalsContact CG-CE2 3.45Å; L1757-F1761 HydrophobicContact CG-CZ 3.72Å; L1757-F1761 VanDerWaalsContact CG-CZ 3.44Å; L1757-F1761 WeakPolarHBondContact O-CD2 3.38Å; L1757-F1761 VanDerWaalsContact O-CG 3.31Å; L1757-F1761 WeakPolarHBondContact O-CG 3.43Å; L1757-F1761 PolarHBondContact O-N 3.15Å; L1758-F1761 HydrophobicContact CD2-CD2 4.36Å; L1758-F1761 PolarHBondContact O-N 3.16Å; F1761-L1764 HydrophobicContact CD1-CD1 4.17Å; F1761-L1764 PolarHBondContact O-N 3.3Å; F1761-S1765 WeakPolarHBondContact O-CB 3.38Å; F1761-S1765 PolarHBondContact O-N 3.22Å; F1761-S1765 PolarHBondContact O-OG 3.17Å; F1761-L1796 HydrophobicContact CD1-CD2 4.48Å; F1761-I1801 HydrophobicContact CD1-CD1 4.07Å; F1761-I1801 HydrophobicContact CD2-CD1 4.46Å; F1761-I1801 HydrophobicContact CE1-CD1 4.12Å; F1761-I1801 HydrophobicContact CE2-CD1 4.48Å; F1761-I1801 HydrophobicContact CG-CD1 4.4Å; F1761-I1801 HydrophobicContact CZ-CD1 4.44Å; F1761-L1804 HydrophobicContact CD2-CD2 4.43Å; F1761-L1804 HydrophobicContact CE2-CD2 4.03Å; F1761-L1825 VanDerWaalsContact C-CD1 3.47Å; F1761-L1825 HydrophobicContact CB-CD1 3.61Å; F1761-L1825 HydrophobicContact CB-CD2 3.88Å; F1761-L1825 HydrophobicContact CB-CG 4.42Å; F1761-L1825 HydrophobicContact CD2-CD1 4.22Å; F1761-L1825 HydrophobicContact CD2-CD2 4.29Å; F1761-L1825 HydrophobicContact CG-CD1 4.29Å; F1761-L1825 HydrophobicContact CG-CD2 4.42Å; F1761-L1825 WeakPolarHBondContact O-CD1 3.48Å
1762T74.3Confident62.4Low9.8 Ų9.866.1 Ų66.16%0.0636%0.36CS..Hα-helixtrans-66.6-41.6176.1-17.70000111.1L1758 Q1759 V1760 S1765 K1766 L1825L1758-T1762 VanDerWaalsContact O-CB 3.25Å; L1758-T1762 WeakPolarHBondContact O-CB 3.36Å; L1758-T1762 WeakPolarHBondContact O-CG2 3.32Å; L1758-T1762 PolarHBondContact O-N 3.15Å; L1758-T1762 PolarHBondContact O-OG1 3.14Å; Q1759-T1762 VanDerWaalsContact CA-OG1 3.31Å; Q1759-T1762 WeakPolarHBondContact CA-OG1 3.43Å; Q1759-T1762 PolarHBondContact O-N 3.05Å; Q1759-T1762 PolarHBondContact O-OG1 3.2Å; V1760-T1762 VanDerWaalsContact C-N 3.31Å; V1760-T1762 PolarHBondContact O-N 3.21Å; T1762-S1765 WeakPolarHBondContact CA-OG 3.39Å; T1762-S1765 PolarHBondContact O-N 3.11Å; T1762-S1765 PolarHBondContact O-OG 2.95Å; T1762-K1766 HydrophobicContact CG2-CD 4.3Å; T1762-K1766 WeakPolarHBondContact O-CB 3.42Å; T1762-K1766 VanDerWaalsContact O-CG 3.28Å; T1762-K1766 WeakPolarHBondContact O-CG 3.38Å; T1762-K1766 PolarHBondContact O-N 3.12Å; T1762-K1766 VanDerWaalsContact O-N 3.13Å; T1762-L1825 HydrophobicContact CG2-CB 3.73Å; T1762-L1825 HydrophobicContact CG2-CD1 4.11Å; T1762-L1825 HydrophobicContact CG2-CG 4.12Å
1763S70Confident60.5Low54.4 Ų54.467.9 Ų67.938%0.3837%0.367SS..Hα-helixtrans-66.6-40.4176.469.60000112.4Q1759 V1760 S1765 K1766 A1767Q1759-S1763 WeakPolarHBondContact O-CB 3.47Å; Q1759-S1763 PolarHBondContact O-N 3.27Å; Q1759-S1763 PolarHBondContact O-OG 2.95Å; V1760-S1763 WeakPolarHBondContact CA-OG 3.35Å; V1760-S1763 PolarHBondContact O-N 3.38Å; V1760-S1763 VanDerWaalsContact O-N 3.09Å; V1760-S1763 PolarHBondContact O-OG 3.24Å; S1763-S1765 VanDerWaalsContact C-N 3.32Å; S1763-S1765 PolarHBondContact O-N 3.1Å; S1763-K1766 PolarHBondContact O-N 3.26Å; S1763-K1766 VanDerWaalsContact O-N 3.11Å; S1763-A1767 PolarHBondContact O-N 2.93Å
1764L69Low58.7Low39.6 Ų39.669.7 Ų69.721%0.20739%0.385CS..Hα-helixtrans-64.4-39.4175.9-137.6102.3000111.8L1735 I1736 V1760 F1761 K1766 A1767 I1792 L1796L1735-L1764 HydrophobicContact CD2-CD2 4.43Å; I1736-L1764 HydrophobicContact CD1-CD1 3.46Å; I1736-L1764 VanDerWaalsContact CD1-CD1 3.46Å; I1736-L1764 HydrophobicContact CD1-CD2 3.28Å; I1736-L1764 HydrophobicContact CG1-CD1 4.42Å; V1760-L1764 HydrophobicContact CG1-CD1 3.8Å; V1760-L1764 HydrophobicContact CG1-CG 4.5Å; V1760-L1764 VanDerWaalsContact O-CB 3.3Å; V1760-L1764 WeakPolarHBondContact O-CB 3.41Å; V1760-L1764 WeakPolarHBondContact O-CG 3.26Å; V1760-L1764 PolarHBondContact O-N 3Å; F1761-L1764 HydrophobicContact CD1-CD1 4.17Å; F1761-L1764 PolarHBondContact O-N 3.3Å; L1764-K1766 VanDerWaalsContact C-N 3.29Å; L1764-K1766 PolarHBondContact O-N 3.04Å; L1764-A1767 WeakPolarHBondContact O-CB 3.26Å; L1764-A1767 PolarHBondContact O-N 2.85Å; L1764-I1792 HydrophobicContact CD1-CG2 4.48Å; L1764-I1792 HydrophobicContact CD2-CG2 4.38Å; L1764-I1792 HydrophobicContact CG-CG2 4.08Å; L1764-L1796 HydrophobicContact CD2-CD1 4.27Å; L1764-L1796 HydrophobicContact CD2-CD2 3.79Å; L1764-L1796 HydrophobicContact CD2-CG 4.41Å; L1764-L1796 HydrophobicContact CG-CD1 4.43Å
1765S70.4Confident56.6Low6.6 Ų6.677.4 Ų77.45%0.04643%0.425CS..Hα-helixtrans-69.3-2417670.90000113.5F1761 T1762 S1763 H1793 N1828F1761-S1765 WeakPolarHBondContact O-CB 3.38Å; F1761-S1765 PolarHBondContact O-N 3.22Å; F1761-S1765 PolarHBondContact O-OG 3.17Å; T1762-S1765 WeakPolarHBondContact CA-OG 3.39Å; T1762-S1765 PolarHBondContact O-N 3.11Å; T1762-S1765 PolarHBondContact O-OG 2.95Å; S1763-S1765 VanDerWaalsContact C-N 3.32Å; S1763-S1765 PolarHBondContact O-N 3.1Å; S1765-H1793 PolarHBondContact O-NE2 3.03Å; S1765-N1828 VanDerWaalsContact OG-CB 3.25Å; S1765-N1828 WeakPolarHBondContact OG-CB 3.39Å
1766K67.6Low54.6Low95 Ų9584.9 Ų84.941%0.41346%0.458SS..Hα-helixtrans-86.5-5.4178.2-73.7174.8-176.1174.60112.5T1762 S1763 L1764 P1768 E1824 N1828T1762-K1766 HydrophobicContact CG2-CD 4.3Å; T1762-K1766 WeakPolarHBondContact O-CB 3.42Å; T1762-K1766 VanDerWaalsContact O-CG 3.28Å; T1762-K1766 WeakPolarHBondContact O-CG 3.38Å; T1762-K1766 PolarHBondContact O-N 3.12Å; T1762-K1766 VanDerWaalsContact O-N 3.13Å; S1763-K1766 PolarHBondContact O-N 3.26Å; S1763-K1766 VanDerWaalsContact O-N 3.11Å; L1764-K1766 VanDerWaalsContact C-N 3.29Å; L1764-K1766 PolarHBondContact O-N 3.04Å; K1766-P1768 VanDerWaalsContact O-CD 3.28Å; K1766-P1768 WeakPolarHBondContact O-CD 3.34Å; K1766-E1824 WeakPolarHBondContact CE-OE1 3.08Å; K1766-E1824 IonicContact NZ-OE1 3.31Å; K1766-E1824 PolarHBondContact NZ-OE1 3.04Å; K1766-N1828 VanDerWaalsContact CE-ND2 3.3Å; K1766-N1828 WeakPolarHBondContact CE-ND2 3.46Å
1767A56.4Low52.6Low40 Ų4088 Ų8833%0.33148%0.477SS..  trans-58.4126.4-176.300000111.7S1763 L1764 M1769 Q1789 I1792S1763-A1767 PolarHBondContact O-N 2.93Å; L1764-A1767 WeakPolarHBondContact O-CB 3.26Å; L1764-A1767 PolarHBondContact O-N 2.85Å; A1767-M1769 PolarHBondContact O-N 3.12Å; A1767-Q1789 HydrophobicContact CB-CG 4.24Å; A1767-Q1789 VanDerWaalsContact O-CG 3.26Å; A1767-Q1789 WeakPolarHBondContact O-CG 3.32Å; A1767-Q1789 PolarHBondContact O-NE2 3.23Å; A1767-I1792 HydrophobicContact CB-CD1 4.4Å
1768P48.5Very low50.5Low111.6 Ų111.695.7 Ų95.773%0.72551%0.51SS*.  trans-71.9125.117427.9-30.2000109.8K1766 M1770K1766-P1768 VanDerWaalsContact O-CD 3.28Å; K1766-P1768 WeakPolarHBondContact O-CD 3.34Å; P1768-M1770 PolarHBondContact O-N 3.35Å
1769M38.5Very low48.4Very low124.8 Ų124.8107 Ų10762%0.61555%0.553SS**  trans-49.4115.9170.7-125.1-176.8118.900110.7A1767 E1771 T1787 G1788 Q1789 F2040A1767-M1769 PolarHBondContact O-N 3.12Å; M1769-E1771 HydrophobicContact CE-CG 3.59Å; M1769-E1771 VanDerWaalsContact CE-OE1 3.3Å; M1769-E1771 WeakPolarHBondContact CE-OE1 3.37Å; M1769-E1771 HydrophobicContact CG-CG 4.44Å; M1769-E1771 PolarHBondContact O-N 3.06Å; M1769-T1787 HydrophobicContact CE-CG2 4.48Å; M1769-G1788 WeakPolarHBondContact SD-CA 3.32Å; M1769-Q1789 HydrophobicContact CB-CG 4.47Å; M1769-F2040 HydrophobicContact SD-CE2 4.26Å
1770M32.2Very low46.3Very low158.6 Ų158.6107 Ų10778%0.78156%0.564SS**  trans-70.9106.3168.7-92.6-105.3-165.600109.8P1768 S1772 K1778P1768-M1770 PolarHBondContact O-N 3.35Å; M1770-S1772 PolarHBondContact O-N 3.15Å; M1770-S1772 VanDerWaalsContact O-N 3.09Å; M1770-K1778 HydrophobicContact CE-CG 4.09Å
1771E30.5Very low44.4Very low181 Ų181112.8 Ų112.885%0.84659%0.593SS**  trans-71.788.2179.1-73.9178.4154.500112.1M1769M1769-E1771 HydrophobicContact CE-CG 3.59Å; M1769-E1771 VanDerWaalsContact CE-OE1 3.3Å; M1769-E1771 WeakPolarHBondContact CE-OE1 3.37Å; M1769-E1771 HydrophobicContact CG-CG 4.44Å; M1769-E1771 PolarHBondContact O-N 3.06Å
1772S30.4Very low42.4Very low103.8 Ų103.8119.1 Ų119.173%0.72663%0.627SS**  trans-159.469.3167.6580000114M1770M1770-S1772 PolarHBondContact O-N 3.15Å; M1770-S1772 VanDerWaalsContact O-N 3.09Å
1773V29.5Very low40.5Very low124.2 Ų124.2121.5 Ų121.575%0.75365%0.653SS**  trans-127.9128.8153.3-176.10000109.2M1777V1773-M1777 HydrophobicContact CG1-CB 4.44Å
1774P30.7Very low38.8Very low113.8 Ų113.8125.4 Ų125.474%0.73967%0.669SS**  trans-66.4143.6-174.7-1730.2000113.8E1776 M1777P1774-E1776 PolarHBondContact O-N 3.12Å; P1774-E1776 VanDerWaalsContact O-N 3.13Å; P1774-M1777 PolarHBondContact O-N 2.93Å
1775L30.6Very low37.5Very low163 Ų163128.5 Ų128.585%0.85369%0.694SS**SBendtrans-49.767.1177.3-82.3126.5000115.6M1777L1775-M1777 PolarHBondContact O-N 3.35Å
1776E29.6Very low36.1Very low187.8 Ų187.8131.9 Ų131.988%0.87871%0.712SS**  trans-137.950169.5-76.1-173.7178.200113.2P1774P1774-E1776 PolarHBondContact O-N 3.12Å; P1774-E1776 VanDerWaalsContact O-N 3.13Å
1777M29.2Very low35.2Very low175 Ų175131.5 Ų131.586%0.86272%0.717SS**  trans-136.590.8160.6-123.4148-179.900111.3V1773 P1774 L1775 W1779V1773-M1777 HydrophobicContact CG1-CB 4.44Å; P1774-M1777 PolarHBondContact O-N 2.93Å; L1775-M1777 PolarHBondContact O-N 3.35Å; M1777-W1779 VanDerWaalsContact C-N 3.34Å; M1777-W1779 PolarHBondContact O-N 3.16Å; M1777-W1779 VanDerWaalsContact O-N 3.16Å
1778K29.4Very low35Very low176 Ų176130.6 Ų130.677%0.76571%0.713SS**  trans-63.697.5176.6-96171.8177.91720111M1770 S1780M1770-K1778 HydrophobicContact CE-CG 4.09Å; K1778-S1780 PolarHBondContact O-N 3.34Å; K1778-S1780 VanDerWaalsContact O-N 3.1Å
1779W29.1Very low35.4Very low238.8 Ų238.8127.4 Ų127.491%0.90569%0.688SS**  trans-92.495160.7-66.839.6000112.6M1777M1777-W1779 VanDerWaalsContact C-N 3.34Å; M1777-W1779 PolarHBondContact O-N 3.16Å; M1777-W1779 VanDerWaalsContact O-N 3.16Å
1780S29.6Very low36.5Very low106 Ų106124.5 Ų124.574%0.74168%0.675SS**  trans-108.994.5169.441.60000111.3K1778 D1782K1778-S1780 PolarHBondContact O-N 3.34Å; K1778-S1780 VanDerWaalsContact O-N 3.1Å; S1780-D1782 PolarHBondContact O-N 3.25Å
1781L32.3Very low38.1Very low155.6 Ų155.6120 Ų12082%0.81566%0.659SS**THydrogen-bonded Turntrans-91.878.3176-15569.8000112.1G1783L1781-G1783 VanDerWaalsContact C-N 3.29Å; L1781-G1783 PolarHBondContact O-N 2.89Å
1782D32.7Very low39.9Very low135.8 Ų135.8113.7 Ų113.773%0.72663%0.631SS**THydrogen-bonded Turntrans-106.239.9172.2-67.7-21.1000116S1780S1780-D1782 PolarHBondContact O-N 3.25Å
1783G35.3Very low42Very low59.8 Ų59.8109 Ų10962%0.61660%0.597SS**THydrogen-bonded Turntrans-125.519.8166.700000116.7L1781 S1785L1781-G1783 VanDerWaalsContact C-N 3.29Å; L1781-G1783 PolarHBondContact O-N 2.89Å; G1783-S1785 PolarHBondContact O-N 3.16Å
1784L33.6Very low44.1Very low136.8 Ų136.8109.1 Ų109.172%0.71659%0.585SS**SBendtrans-105.217.2-175.8-111.498000115.5N1786 T1787 G1788L1784-N1786 PolarHBondContact O-N 3.08Å; L1784-N1786 VanDerWaalsContact O-N 3.16Å; L1784-T1787 HydrophobicContact CD1-CG2 3.96Å; L1784-T1787 HydrophobicContact CG-CG2 4.14Å; L1784-T1787 PolarHBondContact O-N 3.25Å; L1784-T1787 VanDerWaalsContact O-N 3.13Å; L1784-T1787 PolarHBondContact O-OG1 3.06Å; L1784-G1788 WeakPolarHBondContact O-CA 3.4Å; L1784-G1788 PolarHBondContact O-N 3.16Å
1785S40.7Very low46Very low104.8 Ų104.8106.5 Ų106.573%0.73356%0.562SS**THydrogen-bonded Turntrans-78.65.5-179.558.40000113.9G1783G1783-S1785 PolarHBondContact O-N 3.16Å
1786N42.4Very low48Very low76.8 Ų76.898.9 Ų98.941%0.41152%0.522SS..  trans-120.816.4179.3-84.4-12.9000113.6L1784 G1788 N1790L1784-N1786 PolarHBondContact O-N 3.08Å; L1784-N1786 VanDerWaalsContact O-N 3.16Å; N1786-G1788 VanDerWaalsContact C-N 3.29Å; N1786-G1788 PolarHBondContact O-N 3.37Å; N1786-N1790 VanDerWaalsContact O-CB 3.26Å; N1786-N1790 WeakPolarHBondContact O-CB 3.19Å; N1786-N1790 PolarHBondContact O-N 3.43Å; N1786-N1790 VanDerWaalsContact O-N 3.11Å; N1786-N1790 PolarHBondContact O-ND2 3.16Å
1787T47.4Very low50.2Low86.6 Ų86.690.4 Ų90.453%0.53148%0.484SS..Hα-helixtrans-50.6-24.7175.953.20000113.9M1769 L1784 Q1789 N1790 S1791M1769-T1787 HydrophobicContact CE-CG2 4.48Å; L1784-T1787 HydrophobicContact CD1-CG2 3.96Å; L1784-T1787 HydrophobicContact CG-CG2 4.14Å; L1784-T1787 PolarHBondContact O-N 3.25Å; L1784-T1787 VanDerWaalsContact O-N 3.13Å; L1784-T1787 PolarHBondContact O-OG1 3.06Å; T1787-Q1789 PolarHBondContact O-N 3.33Å; T1787-N1790 PolarHBondContact O-N 3.1Å; T1787-N1790 PolarHBondContact OG1-ND2 2.97Å; T1787-S1791 WeakPolarHBondContact O-CB 3.42Å; T1787-S1791 PolarHBondContact O-N 3.1Å; T1787-S1791 VanDerWaalsContact O-N 3.09Å; T1787-S1791 PolarHBondContact O-OG 3.38Å
1788G52.5Low52.2Low22.8 Ų22.885 Ų8524%0.23546%0.463CS..Hα-helixtrans-64.8-44.5-179.500000114.8M1769 L1784 N1786 N1790 S1791 I1792M1769-G1788 WeakPolarHBondContact SD-CA 3.32Å; L1784-G1788 WeakPolarHBondContact O-CA 3.4Å; L1784-G1788 PolarHBondContact O-N 3.16Å; N1786-G1788 VanDerWaalsContact C-N 3.29Å; N1786-G1788 PolarHBondContact O-N 3.37Å; G1788-N1790 VanDerWaalsContact C-N 3.27Å; G1788-N1790 PolarHBondContact O-N 2.88Å; G1788-S1791 WeakPolarHBondContact CA-OG 3.25Å; G1788-S1791 PolarHBondContact O-N 3.27Å; G1788-S1791 PolarHBondContact O-OG 3.25Å; G1788-I1792 VanDerWaalsContact O-CG1 3.22Å; G1788-I1792 WeakPolarHBondContact O-CG1 3.38Å; G1788-I1792 PolarHBondContact O-N 2.94Å; G1788-I1792 VanDerWaalsContact O-N 3.09Å
1789Q56.2Low54.2Low43.6 Ų43.678.2 Ų78.220%0.20444%0.435CS..Hα-helixtrans-65.4-39.8177.6-74.1-176.6-8.800112A1767 M1769 T1787 S1791 I1792 H1793A1767-Q1789 HydrophobicContact CB-CG 4.24Å; A1767-Q1789 VanDerWaalsContact O-CG 3.26Å; A1767-Q1789 WeakPolarHBondContact O-CG 3.32Å; A1767-Q1789 PolarHBondContact O-NE2 3.23Å; M1769-Q1789 HydrophobicContact CB-CG 4.47Å; T1787-Q1789 PolarHBondContact O-N 3.33Å; Q1789-S1791 VanDerWaalsContact C-N 3.29Å; Q1789-S1791 PolarHBondContact O-N 3.01Å; Q1789-I1792 PolarHBondContact O-N 3.01Å; Q1789-H1793 WeakPolarHBondContact O-CB 3.34Å; Q1789-H1793 PolarHBondContact O-CD2 3.31Å; Q1789-H1793 VanDerWaalsContact O-CD2 3.25Å; Q1789-H1793 VanDerWaalsContact O-CG 3.25Å; Q1789-H1793 PolarHBondContact O-N 3.14Å
1790N62.6Low56.5Low63 Ų6367.8 Ų67.834%0.33740%0.403SS..Hα-helixtrans-65.5-32.7176.7-74.6-20.4000112.2N1786 T1787 G1788 Y1794 N1834N1786-N1790 VanDerWaalsContact O-CB 3.26Å; N1786-N1790 WeakPolarHBondContact O-CB 3.19Å; N1786-N1790 PolarHBondContact O-N 3.43Å; N1786-N1790 VanDerWaalsContact O-N 3.11Å; N1786-N1790 PolarHBondContact O-ND2 3.16Å; T1787-N1790 PolarHBondContact O-N 3.1Å; T1787-N1790 PolarHBondContact OG1-ND2 2.97Å; G1788-N1790 VanDerWaalsContact C-N 3.27Å; G1788-N1790 PolarHBondContact O-N 2.88Å; N1790-Y1794 VanDerWaalsContact O-CB 3.25Å; N1790-Y1794 WeakPolarHBondContact O-CB 3.34Å; N1790-Y1794 PolarHBondContact O-N 3.11Å; N1790-N1834 PolarHBondContact OD1-ND2 3.12Å
1791S64.8Low59Low64.6 Ų64.662.8 Ų62.845%0.45237%0.367SS..Hα-helixtrans-70.6-39.6176.367.80000112.3T1787 G1788 Q1789 Y1794 F1795T1787-S1791 WeakPolarHBondContact O-CB 3.42Å; T1787-S1791 PolarHBondContact O-N 3.1Å; T1787-S1791 VanDerWaalsContact O-N 3.09Å; T1787-S1791 PolarHBondContact O-OG 3.38Å; G1788-S1791 WeakPolarHBondContact CA-OG 3.25Å; G1788-S1791 PolarHBondContact O-N 3.27Å; G1788-S1791 PolarHBondContact O-OG 3.25Å; Q1789-S1791 VanDerWaalsContact C-N 3.29Å; Q1789-S1791 PolarHBondContact O-N 3.01Å; S1791-Y1794 PolarHBondContact O-N 3.21Å; S1791-F1795 VanDerWaalsContact O-CB 3.28Å; S1791-F1795 WeakPolarHBondContact O-CB 3.27Å; S1791-F1795 PolarHBondContact O-N 3.16Å
1792I68.8Low61.4Low48.8 Ų48.855.5 Ų55.525%0.2533%0.329SS..Hα-helixtrans-65.1-47.4173.7-64.6168000109.8L1764 A1767 G1788 Q1789 Y1794 F1795 L1796L1764-I1792 HydrophobicContact CD1-CG2 4.48Å; L1764-I1792 HydrophobicContact CD2-CG2 4.38Å; L1764-I1792 HydrophobicContact CG-CG2 4.08Å; A1767-I1792 HydrophobicContact CB-CD1 4.4Å; G1788-I1792 VanDerWaalsContact O-CG1 3.22Å; G1788-I1792 WeakPolarHBondContact O-CG1 3.38Å; G1788-I1792 PolarHBondContact O-N 2.94Å; G1788-I1792 VanDerWaalsContact O-N 3.09Å; Q1789-I1792 PolarHBondContact O-N 3.01Å; I1792-Y1794 VanDerWaalsContact C-N 3.29Å; I1792-Y1794 PolarHBondContact O-N 3.17Å; I1792-F1795 WeakPolarHBondContact O-CB 3.32Å; I1792-F1795 PolarHBondContact O-N 3.23Å; I1792-F1795 VanDerWaalsContact O-N 3.15Å; I1792-L1796 HydrophobicContact CG2-CD1 3.84Å; I1792-L1796 HydrophobicContact CG2-CG 4.2Å; I1792-L1796 WeakPolarHBondContact O-CB 3.23Å; I1792-L1796 VanDerWaalsContact O-CG 3.27Å; I1792-L1796 WeakPolarHBondContact O-CG 3.25Å; I1792-L1796 PolarHBondContact O-N 3.22Å
1793H74.5Confident63.7Low4.8 Ų4.850.5 Ų50.52%0.02230%0.302CS..Hα-helixtrans-60.7-40.8177.5-68.2-171.6000111.3S1765 Q1789 F1795 L1796 C1797 N1828 L1829 V1837S1765-H1793 PolarHBondContact O-NE2 3.03Å; Q1789-H1793 WeakPolarHBondContact O-CB 3.34Å; Q1789-H1793 PolarHBondContact O-CD2 3.31Å; Q1789-H1793 VanDerWaalsContact O-CD2 3.25Å; Q1789-H1793 VanDerWaalsContact O-CG 3.25Å; Q1789-H1793 PolarHBondContact O-N 3.14Å; H1793-F1795 PolarHBondContact O-N 2.78Å; H1793-L1796 PolarHBondContact O-N 3.34Å; H1793-C1797 VanDerWaalsContact O-CB 3.3Å; H1793-C1797 WeakPolarHBondContact O-CB 3.27Å; H1793-C1797 PolarHBondContact O-N 3.25Å; H1793-C1797 PolarHBondContact O-SG 3.14Å; H1793-N1828 PolarHBondContact CE1-O 3.09Å; H1793-L1829 HydrophobicContact CB-CD2 4.39Å; H1793-L1829 PolarHBondContact CE1-O 3.4Å; H1793-L1829 PolarHBondContact ND1-O 3.08Å; H1793-V1837 HydrophobicContact CB-CG2 4.3Å
1794Y73.5Confident65.9Low127.4 Ų127.447.7 Ų47.750%0.527%0.273SS..Hα-helixtrans-61.1-47.9174.2-178.5-90.2000111.6N1790 S1791 I1792 L1796 C1797 S1798 Y1836N1790-Y1794 VanDerWaalsContact O-CB 3.25Å; N1790-Y1794 WeakPolarHBondContact O-CB 3.34Å; N1790-Y1794 PolarHBondContact O-N 3.11Å; S1791-Y1794 PolarHBondContact O-N 3.21Å; I1792-Y1794 VanDerWaalsContact C-N 3.29Å; I1792-Y1794 PolarHBondContact O-N 3.17Å; Y1794-L1796 VanDerWaalsContact C-N 3.34Å; Y1794-L1796 PolarHBondContact O-N 3.11Å; Y1794-C1797 PolarHBondContact O-N 3.18Å; Y1794-S1798 VanDerWaalsContact O-CB 3.3Å; Y1794-S1798 WeakPolarHBondContact O-CB 3.35Å; Y1794-S1798 PolarHBondContact O-N 3.21Å; Y1794-S1798 PolarHBondContact O-OG 3.01Å; Y1794-Y1836 AromaticContact CD2-CD1 3.59Å; Y1794-Y1836 HydrophobicContact CD2-CD1 3.59Å; Y1794-Y1836 VanDerWaalsContact CD2-CD1 3.49Å; Y1794-Y1836 AromaticContact CD2-CD2 3.97Å; Y1794-Y1836 HydrophobicContact CD2-CD2 4.11Å; Y1794-Y1836 AromaticContact CD2-CE1 3.34Å; Y1794-Y1836 HydrophobicContact CD2-CE1 3.34Å; Y1794-Y1836 AromaticContact CD2-CE2 3.86Å; Y1794-Y1836 HydrophobicContact CD2-CE2 3.92Å; Y1794-Y1836 AromaticContact CD2-CG 3.87Å; Y1794-Y1836 HydrophobicContact CD2-CG 3.96Å; Y1794-Y1836 AromaticContact CD2-CZ 3.53Å; Y1794-Y1836 VanDerWaalsContact CD2-CZ 3.47Å; Y1794-Y1836 AromaticContact CE2-CD1 3.94Å; Y1794-Y1836 HydrophobicContact CE2-CD1 4.07Å; Y1794-Y1836 AromaticContact CE2-CD2 3.87Å; Y1794-Y1836 HydrophobicContact CE2-CD2 3.99Å; Y1794-Y1836 AromaticContact CE2-CE1 3.67Å; Y1794-Y1836 HydrophobicContact CE2-CE1 3.67Å; Y1794-Y1836 AromaticContact CE2-CE2 3.48Å; Y1794-Y1836 HydrophobicContact CE2-CE2 3.48Å; Y1794-Y1836 VanDerWaalsContact CE2-CE2 3.4Å; Y1794-Y1836 HydrophobicContact CE2-CG 4.17Å; Y1794-Y1836 AromaticContact CE2-CZ 3.29Å; Y1794-Y1836 WeakPolarHBondContact CE2-OH 3.41Å; Y1794-Y1836 HydrophobicContact CG-CD1 4.37Å; Y1794-Y1836 AromaticContact CG-CE1 3.98Å; Y1794-Y1836 HydrophobicContact CG-CE1 4.11Å; Y1794-Y1836 AromaticContact CZ-CZ 3.91Å
1795F70.8Confident68.3Low58.2 Ų58.241.2 Ų41.226%0.25524%0.239SC..Hα-helixtrans-60.6-45.4178178.6-102.7000112Y1732 L1735 I1736 R1737 S1791 I1792 H1793 C1797 S1798 N1799Y1732-F1795 HydrophobicContact CD1-CD1 4.14Å; Y1732-F1795 AromaticContact CD1-CD2 3.66Å; Y1732-F1795 HydrophobicContact CD1-CD2 3.93Å; Y1732-F1795 AromaticContact CD1-CE1 3.73Å; Y1732-F1795 HydrophobicContact CD1-CE1 3.73Å; Y1732-F1795 AromaticContact CD1-CE2 3.28Å; Y1732-F1795 HydrophobicContact CD1-CE2 3.28Å; Y1732-F1795 HydrophobicContact CD1-CG 4.12Å; Y1732-F1795 AromaticContact CD1-CZ 3.59Å; Y1732-F1795 HydrophobicContact CD1-CZ 3.59Å; Y1732-F1795 HydrophobicContact CE1-CD1 4.2Å; Y1732-F1795 AromaticContact CE1-CD2 3.77Å; Y1732-F1795 HydrophobicContact CE1-CD2 3.77Å; Y1732-F1795 HydrophobicContact CE1-CE1 4.24Å; Y1732-F1795 AromaticContact CE1-CE2 3.6Å; Y1732-F1795 HydrophobicContact CE1-CE2 3.6Å; Y1732-F1795 AromaticContact CE1-CG 3.98Å; Y1732-F1795 HydrophobicContact CE1-CG 3.98Å; Y1732-F1795 HydrophobicContact CE1-CZ 4.12Å; Y1732-F1795 AromaticContact CG-CE2 3.83Å; Y1732-F1795 HydrophobicContact CG-CE2 3.83Å; Y1732-F1795 HydrophobicContact CG-CZ 4.01Å; L1735-F1795 HydrophobicContact CB-CE1 3.96Å; L1735-F1795 HydrophobicContact CB-CZ 3.97Å; L1735-F1795 HydrophobicContact CD1-CE1 3.87Å; L1735-F1795 HydrophobicContact CD1-CZ 3.8Å; L1735-F1795 HydrophobicContact CD2-CE1 4.38Å; L1735-F1795 HydrophobicContact CG-CE1 4.32Å; L1735-F1795 HydrophobicContact CG-CZ 4.33Å; I1736-F1795 HydrophobicContact CB-CE1 4.17Å; I1736-F1795 HydrophobicContact CD1-CE1 4.22Å; I1736-F1795 HydrophobicContact CD1-CE2 4.49Å; I1736-F1795 HydrophobicContact CD1-CZ 4.43Å; I1736-F1795 HydrophobicContact CG1-CE2 4.47Å; I1736-F1795 HydrophobicContact CG1-CZ 4.02Å; I1736-F1795 HydrophobicContact CG2-CD1 4.26Å; I1736-F1795 HydrophobicContact CG2-CE1 3.71Å; I1736-F1795 HydrophobicContact CG2-CZ 4.4Å; R1737-F1795 HydrophobicContact CG-CZ 4.28Å; S1791-F1795 VanDerWaalsContact O-CB 3.28Å; S1791-F1795 WeakPolarHBondContact O-CB 3.27Å; S1791-F1795 PolarHBondContact O-N 3.16Å; I1792-F1795 WeakPolarHBondContact O-CB 3.32Å; I1792-F1795 PolarHBondContact O-N 3.23Å; I1792-F1795 VanDerWaalsContact O-N 3.15Å; H1793-F1795 PolarHBondContact O-N 2.78Å; F1795-C1797 PolarHBondContact O-N 3.19Å; F1795-S1798 WeakPolarHBondContact CA-OG 3.41Å; F1795-S1798 PolarHBondContact O-N 3.25Å; F1795-S1798 PolarHBondContact O-OG 3.13Å; F1795-N1799 WeakPolarHBondContact CD2-ND2 3.42Å; F1795-N1799 VanDerWaalsContact CE1-ND2 3.31Å; F1795-N1799 WeakPolarHBondContact CE1-ND2 3.3Å; F1795-N1799 WeakPolarHBondContact CE2-ND2 3.39Å; F1795-N1799 VanDerWaalsContact CZ-ND2 3.25Å; F1795-N1799 WeakPolarHBondContact CZ-ND2 3.41Å; F1795-N1799 VanDerWaalsContact O-CG 3.28Å; F1795-N1799 PolarHBondContact O-N 3.31Å; F1795-N1799 VanDerWaalsContact O-N 3.14Å; F1795-N1799 PolarHBondContact O-ND2 3.14Å
1796L73.2Confident70.4Confident3.2 Ų3.236.2 Ų36.22%0.01721%0.205CC..Hα-helixtrans-62.7-44.9177.6-70176.5000111.6I1736 F1761 L1764 I1792 H1793 Y1794 S1798 N1799 I1801 L1829I1736-L1796 HydrophobicContact CD1-CD2 3.89Å; I1736-L1796 HydrophobicContact CG1-CD2 4.26Å; I1736-L1796 HydrophobicContact CG2-CD2 3.78Å; F1761-L1796 HydrophobicContact CD1-CD2 4.48Å; L1764-L1796 HydrophobicContact CD2-CD1 4.27Å; L1764-L1796 HydrophobicContact CD2-CD2 3.79Å; L1764-L1796 HydrophobicContact CD2-CG 4.41Å; L1764-L1796 HydrophobicContact CG-CD1 4.43Å; I1792-L1796 HydrophobicContact CG2-CD1 3.84Å; I1792-L1796 HydrophobicContact CG2-CG 4.2Å; I1792-L1796 WeakPolarHBondContact O-CB 3.23Å; I1792-L1796 VanDerWaalsContact O-CG 3.27Å; I1792-L1796 WeakPolarHBondContact O-CG 3.25Å; I1792-L1796 PolarHBondContact O-N 3.22Å; H1793-L1796 PolarHBondContact O-N 3.34Å; Y1794-L1796 VanDerWaalsContact C-N 3.34Å; Y1794-L1796 PolarHBondContact O-N 3.11Å; L1796-S1798 PolarHBondContact O-N 2.9Å; L1796-N1799 PolarHBondContact O-N 3.15Å; L1796-I1801 HydrophobicContact CB-CB 4.46Å; L1796-I1801 HydrophobicContact CB-CD1 3.49Å; L1796-I1801 VanDerWaalsContact CB-CD1 3.46Å; L1796-I1801 HydrophobicContact CB-CG1 4.42Å; L1796-I1801 HydrophobicContact CD1-CD1 4.38Å; L1796-I1801 HydrophobicContact CD2-CD1 3.24Å; L1796-I1801 HydrophobicContact CG-CD1 3.84Å; L1796-I1801 WeakPolarHBondContact O-CB 3.29Å; L1796-I1801 WeakPolarHBondContact O-CG1 3.27Å; L1796-I1801 PolarHBondContact O-N 3.35Å; L1796-L1829 HydrophobicContact CB-CD2 4.41Å; L1796-L1829 HydrophobicContact CD1-CD2 4.04Å
1797C74.7Confident72.2Confident10.2 Ų10.236.7 Ų36.77%0.06920%0.201CC..Hα-helixtrans-68.9-37.7178.8-66.90000112.5H1793 Y1794 F1795 N1799 G1800 C1802 Y1836H1793-C1797 VanDerWaalsContact O-CB 3.3Å; H1793-C1797 WeakPolarHBondContact O-CB 3.27Å; H1793-C1797 PolarHBondContact O-N 3.25Å; H1793-C1797 PolarHBondContact O-SG 3.14Å; Y1794-C1797 PolarHBondContact O-N 3.18Å; F1795-C1797 PolarHBondContact O-N 3.19Å; C1797-N1799 VanDerWaalsContact C-N 3.26Å; C1797-N1799 PolarHBondContact O-N 3.06Å; C1797-G1800 PolarHBondContact O-N 3.06Å; C1797-G1800 VanDerWaalsContact O-N 3.11Å; C1797-C1802 PolarHBondContact SG-SG 3.02Å; C1797-Y1836 HydrophobicContact CB-CD1 4.41Å; C1797-Y1836 HydrophobicContact CB-CE1 3.91Å
1798S71.4Confident73.9Confident60.4 Ų60.432.6 Ų32.642%0.42218%0.176SC..Hα-helixtrans-64.7-27.2176.867.90000112.8Y1794 F1795 L1796 G1800Y1794-S1798 VanDerWaalsContact O-CB 3.3Å; Y1794-S1798 WeakPolarHBondContact O-CB 3.35Å; Y1794-S1798 PolarHBondContact O-N 3.21Å; Y1794-S1798 PolarHBondContact O-OG 3.01Å; F1795-S1798 WeakPolarHBondContact CA-OG 3.41Å; F1795-S1798 PolarHBondContact O-N 3.25Å; F1795-S1798 PolarHBondContact O-OG 3.13Å; L1796-S1798 PolarHBondContact O-N 2.9Å; S1798-G1800 VanDerWaalsContact C-N 3.29Å; S1798-G1800 PolarHBondContact O-N 3.31Å
1799N72.6Confident75.3Confident34.4 Ų34.431.6 Ų31.618%0.18416%0.164CC..THydrogen-bonded Turntrans-876.3176.2-69.2-48.7000113.9I1736 V1739 F1795 L1796 C1797I1736-N1799 HydrophobicContact CG2-CB 4.22Å; I1736-N1799 WeakPolarHBondContact CG2-ND2 3.38Å; V1739-N1799 WeakPolarHBondContact CG1-O 3.33Å; V1739-N1799 HydrophobicContact CG2-CB 4.43Å; F1795-N1799 WeakPolarHBondContact CD2-ND2 3.42Å; F1795-N1799 VanDerWaalsContact CE1-ND2 3.31Å; F1795-N1799 WeakPolarHBondContact CE1-ND2 3.3Å; F1795-N1799 WeakPolarHBondContact CE2-ND2 3.39Å; F1795-N1799 VanDerWaalsContact CZ-ND2 3.25Å; F1795-N1799 WeakPolarHBondContact CZ-ND2 3.41Å; F1795-N1799 VanDerWaalsContact O-CG 3.28Å; F1795-N1799 PolarHBondContact O-N 3.31Å; F1795-N1799 VanDerWaalsContact O-N 3.14Å; F1795-N1799 PolarHBondContact O-ND2 3.14Å; L1796-N1799 PolarHBondContact O-N 3.15Å; C1797-N1799 VanDerWaalsContact C-N 3.26Å; C1797-N1799 PolarHBondContact O-N 3.06Å
1800G76Confident76.6Confident21 Ų2130.6 Ų30.622%0.21616%0.16CC..THydrogen-bonded Turntrans9017.3172.500000115.6Y1743 C1797 S1798 C1802 D1803 L1804Y1743-G1800 PolarHBondContact OH-O 3.15Å; C1797-G1800 PolarHBondContact O-N 3.06Å; C1797-G1800 VanDerWaalsContact O-N 3.11Å; S1798-G1800 VanDerWaalsContact C-N 3.29Å; S1798-G1800 PolarHBondContact O-N 3.31Å; G1800-C1802 VanDerWaalsContact C-N 3.29Å; G1800-C1802 PolarHBondContact O-N 3.17Å; G1800-D1803 WeakPolarHBondContact O-CB 3.4Å; G1800-D1803 PolarHBondContact O-N 3.11Å; G1800-D1803 VanDerWaalsContact O-N 3.1Å; G1800-L1804 PolarHBondContact O-N 3.09Å; G1800-L1804 VanDerWaalsContact O-N 3.13Å
1801I82.3Confident77.3Confident0.6 Ų0.630.1 Ų30.10%0.00316%0.157CC..Hα-helixtrans-62.6-32.8178.4-74.8169000112.6I1736 V1739 F1761 L1796 D1803 L1804 I1805 L1825 L1829I1736-I1801 HydrophobicContact CG2-CD1 4.21Å; V1739-I1801 HydrophobicContact CB-CG1 4.46Å; V1739-I1801 HydrophobicContact CG1-CG1 4Å; V1739-I1801 HydrophobicContact CG2-CD1 4.13Å; V1739-I1801 HydrophobicContact CG2-CG1 4Å; F1761-I1801 HydrophobicContact CD1-CD1 4.07Å; F1761-I1801 HydrophobicContact CD2-CD1 4.46Å; F1761-I1801 HydrophobicContact CE1-CD1 4.12Å; F1761-I1801 HydrophobicContact CE2-CD1 4.48Å; F1761-I1801 HydrophobicContact CG-CD1 4.4Å; F1761-I1801 HydrophobicContact CZ-CD1 4.44Å; L1796-I1801 HydrophobicContact CB-CB 4.46Å; L1796-I1801 HydrophobicContact CB-CD1 3.49Å; L1796-I1801 VanDerWaalsContact CB-CD1 3.46Å; L1796-I1801 HydrophobicContact CB-CG1 4.42Å; L1796-I1801 HydrophobicContact CD1-CD1 4.38Å; L1796-I1801 HydrophobicContact CD2-CD1 3.24Å; L1796-I1801 HydrophobicContact CG-CD1 3.84Å; L1796-I1801 WeakPolarHBondContact O-CB 3.29Å; L1796-I1801 WeakPolarHBondContact O-CG1 3.27Å; L1796-I1801 PolarHBondContact O-N 3.35Å; I1801-D1803 VanDerWaalsContact C-N 3.31Å; I1801-D1803 PolarHBondContact O-N 3.1Å; I1801-L1804 WeakPolarHBondContact O-CB 3.39Å; I1801-L1804 PolarHBondContact O-N 3.19Å; I1801-I1805 HydrophobicContact CG2-CD1 3.89Å; I1801-I1805 HydrophobicContact CG2-CG1 4.29Å; I1801-I1805 VanDerWaalsContact O-CG1 3.27Å; I1801-I1805 WeakPolarHBondContact O-CG1 3.34Å; I1801-I1805 PolarHBondContact O-N 3.03Å; I1801-L1825 HydrophobicContact CG2-CD2 3.88Å; I1801-L1829 HydrophobicContact CG2-CD1 3.86Å
1802C82.2Confident77.4Confident1.4 Ų1.432.3 Ų32.31%0.00917%0.17CC..Hα-helixtrans-62-37.8174.6-64.10000112.4C1797 G1800 I1805 I1806 C1840 F1841 I1844C1797-C1802 PolarHBondContact SG-SG 3.02Å; G1800-C1802 VanDerWaalsContact C-N 3.29Å; G1800-C1802 PolarHBondContact O-N 3.17Å; C1802-I1805 PolarHBondContact O-N 3.34Å; C1802-I1806 WeakPolarHBondContact O-CD1 3.46Å; C1802-I1806 VanDerWaalsContact O-CG1 3.28Å; C1802-I1806 WeakPolarHBondContact O-CG1 3.39Å; C1802-I1806 PolarHBondContact O-N 2.97Å; C1802-I1806 VanDerWaalsContact O-N 3.12Å; C1802-C1840 HydrophobicContact CB-CB 4.43Å; C1802-F1841 HydrophobicContact CB-CD1 4.43Å; C1802-F1841 HydrophobicContact CB-CE1 4.23Å; C1802-F1841 HydrophobicContact CB-CZ 4.31Å; C1802-I1844 HydrophobicContact CB-CD1 3.54Å; C1802-I1844 VanDerWaalsContact CB-CD1 3.45Å
1803D82.7Confident77.5Confident31 Ų3136.8 Ų36.817%0.16620%0.195CC..Hα-helixtrans-69.3-40.6176.7-175.538.4000110.5Y1743 G1800 I1801 I1805 I1806 R1807 I1844 H1851Y1743-D1803 VanDerWaalsContact OH-CB 3.31Å; Y1743-D1803 WeakPolarHBondContact OH-CB 3.34Å; Y1743-D1803 PolarHBondContact OH-OD2 3.2Å; G1800-D1803 WeakPolarHBondContact O-CB 3.4Å; G1800-D1803 PolarHBondContact O-N 3.11Å; G1800-D1803 VanDerWaalsContact O-N 3.1Å; I1801-D1803 VanDerWaalsContact C-N 3.31Å; I1801-D1803 PolarHBondContact O-N 3.1Å; D1803-I1805 VanDerWaalsContact C-N 3.34Å; D1803-I1805 PolarHBondContact O-N 3.17Å; D1803-I1806 PolarHBondContact O-N 2.99Å; D1803-R1807 WeakPolarHBondContact O-CB 3.31Å; D1803-R1807 VanDerWaalsContact O-CG 3.3Å; D1803-R1807 WeakPolarHBondContact O-CG 3.39Å; D1803-R1807 PolarHBondContact O-N 3.01Å; D1803-R1807 VanDerWaalsContact O-N 3.07Å; D1803-R1807 IonicContact OD1-CZ 3.57Å; D1803-R1807 IonicContact OD1-NE 3.63Å; D1803-R1807 PolarHBondContact OD1-NE 3.1Å; D1803-R1807 IonicContact OD1-NH2 3.14Å; D1803-R1807 PolarHBondContact OD1-NH2 3.48Å; D1803-R1807 IonicContact OD2-CZ 3.64Å; D1803-R1807 VanDerWaalsContact OD2-CZ 3.27Å; D1803-R1807 IonicContact OD2-NE 3.51Å; D1803-R1807 PolarHBondContact OD2-NE 3.43Å; D1803-R1807 IonicContact OD2-NH2 3.37Å; D1803-R1807 PolarHBondContact OD2-NH2 3.04Å; D1803-I1844 HydrophobicContact CB-CD1 4.19Å; D1803-H1851 IonicContact OD1-CE1 2.97Å; D1803-H1851 IonicContact OD1-NE2 2.59Å
1804L81.2Confident77.4Confident1.6 Ų1.637.6 Ų37.61%0.00820%0.2CC..Hα-helixtrans-58.5-46.5173.2-176.5100.2000112.1V1739 A1742 Y1743 I1746 F1754 L1758 F1761 G1800 I1801 I1806 R1807 C1808V1739-L1804 HydrophobicContact CG1-CB 4.35Å; V1739-L1804 HydrophobicContact CG1-CD1 3.89Å; V1739-L1804 HydrophobicContact CG1-CD2 4.21Å; A1742-L1804 HydrophobicContact CB-CD1 3.93Å; A1742-L1804 VanDerWaalsContact CB-CD1 3.41Å; A1742-L1804 HydrophobicContact CB-CD2 4.14Å; Y1743-L1804 HydrophobicContact CD1-CD1 4.02Å; Y1743-L1804 HydrophobicContact CD2-CD1 4.28Å; Y1743-L1804 HydrophobicContact CE1-CB 4.29Å; Y1743-L1804 HydrophobicContact CE1-CD1 4.1Å; Y1743-L1804 HydrophobicContact CE2-CB 4.36Å; Y1743-L1804 HydrophobicContact CE2-CD1 4.41Å; Y1743-L1804 HydrophobicContact CG-CD1 4.28Å; Y1743-L1804 PolarHBondContact OH-N 3.22Å; I1746-L1804 HydrophobicContact CD1-CD1 3.93Å; I1746-L1804 HydrophobicContact CD1-CG 4.34Å; F1754-L1804 HydrophobicContact CE2-CD1 4.16Å; F1754-L1804 HydrophobicContact CE2-CD2 4.38Å; F1754-L1804 HydrophobicContact CE2-CG 4.46Å; F1754-L1804 HydrophobicContact CZ-CD1 4.26Å; F1754-L1804 HydrophobicContact CZ-CD2 4.01Å; F1754-L1804 HydrophobicContact CZ-CG 4.3Å; L1758-L1804 HydrophobicContact CD2-CD2 4.08Å; F1761-L1804 HydrophobicContact CD2-CD2 4.43Å; F1761-L1804 HydrophobicContact CE2-CD2 4.03Å; G1800-L1804 PolarHBondContact O-N 3.09Å; G1800-L1804 VanDerWaalsContact O-N 3.13Å; I1801-L1804 WeakPolarHBondContact O-CB 3.39Å; I1801-L1804 PolarHBondContact O-N 3.19Å; L1804-I1806 VanDerWaalsContact C-N 3.33Å; L1804-I1806 PolarHBondContact O-N 3.2Å; L1804-R1807 PolarHBondContact O-N 3.13Å; L1804-C1808 WeakPolarHBondContact O-CB 3.44Å; L1804-C1808 PolarHBondContact O-N 3.18Å; L1804-C1808 VanDerWaalsContact O-N 3.09Å; L1804-C1808 PolarHBondContact O-SG 3.21Å
1805I84.4Confident77.5Confident0.8 Ų0.832.8 Ų32.80%0.00419%0.185CC..Hα-helixtrans-60.3-46.4178.2-69164.3000110.9I1801 C1802 D1803 R1807 C1808 I1809 L1825 A1826 L1829 F1841I1801-I1805 HydrophobicContact CG2-CD1 3.89Å; I1801-I1805 HydrophobicContact CG2-CG1 4.29Å; I1801-I1805 VanDerWaalsContact O-CG1 3.27Å; I1801-I1805 WeakPolarHBondContact O-CG1 3.34Å; I1801-I1805 PolarHBondContact O-N 3.03Å; C1802-I1805 PolarHBondContact O-N 3.34Å; D1803-I1805 VanDerWaalsContact C-N 3.34Å; D1803-I1805 PolarHBondContact O-N 3.17Å; I1805-R1807 PolarHBondContact O-N 3.44Å; I1805-C1808 WeakPolarHBondContact O-CB 3.17Å; I1805-C1808 PolarHBondContact O-N 3.29Å; I1805-I1809 HydrophobicContact CG2-CD1 3.95Å; I1805-I1809 WeakPolarHBondContact O-CG1 3.31Å; I1805-I1809 PolarHBondContact O-N 3.07Å; I1805-I1809 VanDerWaalsContact O-N 3.09Å; I1805-L1825 HydrophobicContact CD1-CB 4.43Å; I1805-L1825 HydrophobicContact CD1-CD2 3.72Å; I1805-L1825 VanDerWaalsContact CD1-CD2 3.42Å; I1805-L1825 HydrophobicContact CD1-CG 3.92Å; I1805-L1825 HydrophobicContact CG1-CD2 3.92Å; I1805-L1825 HydrophobicContact CG1-CG 4.41Å; I1805-A1826 HydrophobicContact CD1-CB 4.16Å; I1805-A1826 HydrophobicContact CG2-CB 3.89Å; I1805-L1829 HydrophobicContact CD1-CD1 3.77Å; I1805-F1841 HydrophobicContact CB-CE1 4.49Å; I1805-F1841 HydrophobicContact CD1-CE1 4.44Å; I1805-F1841 HydrophobicContact CD1-CZ 4.09Å; I1805-F1841 HydrophobicContact CG2-CE1 4.23Å; I1805-F1841 HydrophobicContact CG2-CZ 4.37Å
1806I83.9Confident77.9Confident0 Ų033.7 Ų33.70%019%0.19CC..Hα-helixtrans-61.7-47.1-179.8-70.7165.1000109.9C1802 D1803 L1804 C1808 I1809 E1810 F1841 I1844 L1845 H1851 F1854C1802-I1806 WeakPolarHBondContact O-CD1 3.46Å; C1802-I1806 VanDerWaalsContact O-CG1 3.28Å; C1802-I1806 WeakPolarHBondContact O-CG1 3.39Å; C1802-I1806 PolarHBondContact O-N 2.97Å; C1802-I1806 VanDerWaalsContact O-N 3.12Å; D1803-I1806 PolarHBondContact O-N 2.99Å; L1804-I1806 VanDerWaalsContact C-N 3.33Å; L1804-I1806 PolarHBondContact O-N 3.2Å; I1806-C1808 VanDerWaalsContact C-N 3.29Å; I1806-C1808 PolarHBondContact O-N 3.24Å; I1806-I1809 WeakPolarHBondContact O-CA 3.31Å; I1806-I1809 WeakPolarHBondContact O-CB 3.34Å; I1806-I1809 PolarHBondContact O-N 3.31Å; I1806-E1810 VanDerWaalsContact CG2-CD 3.49Å; I1806-E1810 HydrophobicContact CG2-CG 4.24Å; I1806-E1810 VanDerWaalsContact CG2-OE1 3.31Å; I1806-E1810 WeakPolarHBondContact CG2-OE1 3.39Å; I1806-E1810 WeakPolarHBondContact O-CB 3.38Å; I1806-E1810 VanDerWaalsContact O-CG 3.29Å; I1806-E1810 WeakPolarHBondContact O-CG 3.34Å; I1806-E1810 PolarHBondContact O-N 3.35Å; I1806-F1841 HydrophobicContact CD1-CD1 3.93Å; I1806-F1841 HydrophobicContact CD1-CE1 4.34Å; I1806-F1841 HydrophobicContact CG1-CD1 4.15Å; I1806-F1841 HydrophobicContact CG1-CE1 4.15Å; I1806-I1844 HydrophobicContact CD1-CB 3.73Å; I1806-I1844 HydrophobicContact CD1-CD1 4.3Å; I1806-I1844 HydrophobicContact CD1-CG2 3.38Å; I1806-I1844 VanDerWaalsContact CD1-CG2 3.43Å; I1806-L1845 HydrophobicContact CD1-CD2 3.84Å; I1806-L1845 HydrophobicContact CD1-CG 3.91Å; I1806-L1845 HydrophobicContact CG1-CD2 4.11Å; I1806-L1845 HydrophobicContact CG1-CG 4.46Å; I1806-L1845 HydrophobicContact CG2-CD2 4.1Å; I1806-H1851 HydrophobicContact CG2-CB 4.28Å; I1806-H1851 VanDerWaalsContact CG2-ND1 3.34Å; I1806-H1851 WeakPolarHBondContact CG2-ND1 3.28Å; I1806-F1854 HydrophobicContact CG2-CB 4.32Å; I1806-F1854 HydrophobicContact CG2-CD2 4.21Å; I1806-F1854 HydrophobicContact CG2-CG 4.43Å
1807R81.2Confident78.2Confident86.2 Ų86.237.3 Ų37.333%0.32521%0.212SC..Hα-helixtrans-63.2-31.8177.3-67.5-171.5-145.4177.43.2113.7Y1743 D1803 L1804 I1805 I1809 E1810 N1811Y1743-R1807 VanDerWaalsContact CD1-NH1 3.3Å; Y1743-R1807 HydrophobicContact CD2-CB 3.69Å; Y1743-R1807 HydrophobicContact CE1-CB 4.4Å; Y1743-R1807 VanDerWaalsContact CE1-CZ 3.42Å; Y1743-R1807 HydrophobicContact CE2-CB 3.39Å; Y1743-R1807 VanDerWaalsContact CE2-CB 3.46Å; Y1743-R1807 HydrophobicContact CE2-CG 4.42Å; Y1743-R1807 WeakPolarHBondContact CE2-O 3.46Å; Y1743-R1807 HydrophobicContact CG-CB 4.32Å; Y1743-R1807 VanDerWaalsContact CG-NH1 3.3Å; Y1743-R1807 PolarHBondContact OH-O 2.98Å; D1803-R1807 WeakPolarHBondContact O-CB 3.31Å; D1803-R1807 VanDerWaalsContact O-CG 3.3Å; D1803-R1807 WeakPolarHBondContact O-CG 3.39Å; D1803-R1807 PolarHBondContact O-N 3.01Å; D1803-R1807 VanDerWaalsContact O-N 3.07Å; D1803-R1807 IonicContact OD1-CZ 3.57Å; D1803-R1807 IonicContact OD1-NE 3.63Å; D1803-R1807 PolarHBondContact OD1-NE 3.1Å; D1803-R1807 IonicContact OD1-NH2 3.14Å; D1803-R1807 PolarHBondContact OD1-NH2 3.48Å; D1803-R1807 IonicContact OD2-CZ 3.64Å; D1803-R1807 VanDerWaalsContact OD2-CZ 3.27Å; D1803-R1807 IonicContact OD2-NE 3.51Å; D1803-R1807 PolarHBondContact OD2-NE 3.43Å; D1803-R1807 IonicContact OD2-NH2 3.37Å; D1803-R1807 PolarHBondContact OD2-NH2 3.04Å; L1804-R1807 PolarHBondContact O-N 3.13Å; I1805-R1807 PolarHBondContact O-N 3.44Å; R1807-I1809 VanDerWaalsContact C-N 3.28Å; R1807-I1809 PolarHBondContact O-N 3.21Å; R1807-E1810 WeakPolarHBondContact CA-OE2 3.43Å; R1807-E1810 PolarHBondContact O-N 3.41Å; R1807-N1811 PolarHBondContact O-N 3.12Å; R1807-N1811 VanDerWaalsContact O-N 3.13Å; R1807-N1811 PolarHBondContact O-ND2 3.07Å
1808C81.7Confident78.4Confident1.2 Ų1.237.1 Ų37.11%0.00821%0.211CC..Hα-helixtrans-67.5-30.5172.5-67.10000112.7I1746 F1754 L1804 I1805 I1806 T1814 I1818 A1822I1746-C1808 VanDerWaalsContact CD1-SG 3.57Å; F1754-C1808 VanDerWaalsContact CE1-SG 3.59Å; F1754-C1808 VanDerWaalsContact CZ-SG 3.53Å; F1754-C1808 WeakPolarHBondContact CZ-SG 3.34Å; L1804-C1808 WeakPolarHBondContact O-CB 3.44Å; L1804-C1808 PolarHBondContact O-N 3.18Å; L1804-C1808 VanDerWaalsContact O-N 3.09Å; L1804-C1808 PolarHBondContact O-SG 3.21Å; I1805-C1808 WeakPolarHBondContact O-CB 3.17Å; I1805-C1808 PolarHBondContact O-N 3.29Å; I1806-C1808 VanDerWaalsContact C-N 3.29Å; I1806-C1808 PolarHBondContact O-N 3.24Å; C1808-T1814 WeakPolarHBondContact O-CG2 3.37Å; C1808-T1814 PolarHBondContact O-OG1 3.38Å; C1808-I1818 HydrophobicContact CB-CG2 4.4Å; C1808-A1822 HydrophobicContact CB-CB 3.77Å
1809I83Confident79Confident0.2 Ų0.234.2 Ų34.20%0.00119%0.191CC..Hα-helixtrans-82.8-34178.7-70.2168000111.2I1805 I1806 R1807 F1819 A1822 N1823 F1854 S1857 M1858 F1910I1805-I1809 HydrophobicContact CG2-CD1 3.95Å; I1805-I1809 WeakPolarHBondContact O-CG1 3.31Å; I1805-I1809 PolarHBondContact O-N 3.07Å; I1805-I1809 VanDerWaalsContact O-N 3.09Å; I1806-I1809 WeakPolarHBondContact O-CA 3.31Å; I1806-I1809 WeakPolarHBondContact O-CB 3.34Å; I1806-I1809 PolarHBondContact O-N 3.31Å; R1807-I1809 VanDerWaalsContact C-N 3.28Å; R1807-I1809 PolarHBondContact O-N 3.21Å; I1809-F1819 HydrophobicContact CB-CE2 4.36Å; I1809-F1819 HydrophobicContact CG1-CD2 4.27Å; I1809-F1819 HydrophobicContact CG1-CE2 4.11Å; I1809-F1819 HydrophobicContact CG2-CE2 3.98Å; I1809-A1822 HydrophobicContact CG1-CB 4.49Å; I1809-N1823 WeakPolarHBondContact CD1-OD1 3.07Å; I1809-F1854 HydrophobicContact CB-CD2 3.92Å; I1809-F1854 HydrophobicContact CB-CE2 4.14Å; I1809-F1854 HydrophobicContact CD1-CD2 4.43Å; I1809-F1854 HydrophobicContact CD1-CE2 3.89Å; I1809-F1854 HydrophobicContact CG2-CD2 3.39Å; I1809-F1854 VanDerWaalsContact CG2-CD2 3.42Å; I1809-F1854 HydrophobicContact CG2-CE2 3.59Å; I1809-F1854 HydrophobicContact CG2-CG 4.38Å; I1809-S1857 VanDerWaalsContact O-CB 3.24Å; I1809-S1857 WeakPolarHBondContact O-CB 3.33Å; I1809-S1857 PolarHBondContact O-OG 3.15Å; I1809-M1858 HydrophobicContact CG2-CG 4.25Å; I1809-M1858 HydrophobicContact CG2-SD 4.25Å; I1809-F1910 HydrophobicContact CD1-CD1 4.44Å; I1809-F1910 HydrophobicContact CD1-CE1 4.1Å
1810E83.3Confident79.5Confident23.8 Ų23.833.6 Ų33.611%0.11119%0.188CC..Hα-helixtrans-65-45.1178.2-77.8171.2169.300113.6I1806 R1807 P1812 H1851 D1853 F1854I1806-E1810 VanDerWaalsContact CG2-CD 3.49Å; I1806-E1810 HydrophobicContact CG2-CG 4.24Å; I1806-E1810 VanDerWaalsContact CG2-OE1 3.31Å; I1806-E1810 WeakPolarHBondContact CG2-OE1 3.39Å; I1806-E1810 WeakPolarHBondContact O-CB 3.38Å; I1806-E1810 VanDerWaalsContact O-CG 3.29Å; I1806-E1810 WeakPolarHBondContact O-CG 3.34Å; I1806-E1810 PolarHBondContact O-N 3.35Å; R1807-E1810 WeakPolarHBondContact CA-OE2 3.43Å; R1807-E1810 PolarHBondContact O-N 3.41Å; E1810-P1812 VanDerWaalsContact O-CD 3.24Å; E1810-P1812 WeakPolarHBondContact O-CD 3.33Å; E1810-P1812 VanDerWaalsContact O-N 3.12Å; E1810-H1851 VanDerWaalsContact CD-ND1 3.32Å; E1810-H1851 VanDerWaalsContact OE1-CA 3.27Å; E1810-H1851 WeakPolarHBondContact OE1-CA 3.38Å; E1810-H1851 VanDerWaalsContact OE1-CB 3.3Å; E1810-H1851 WeakPolarHBondContact OE1-CB 3.44Å; E1810-H1851 IonicContact OE1-CE1 3.1Å; E1810-H1851 IonicContact OE1-CG 2.95Å; E1810-H1851 VanDerWaalsContact OE1-CG 3.24Å; E1810-H1851 IonicContact OE1-ND1 3.31Å; E1810-H1851 PolarHBondContact OE1-ND1 2.98Å; E1810-H1851 IonicContact OE2-CE1 3.51Å; E1810-H1851 IonicContact OE2-ND1 3.26Å; E1810-H1851 PolarHBondContact OE2-ND1 2.99Å; E1810-D1853 HydrophobicContact CB-CB 4.15Å; E1810-D1853 HydrophobicContact CG-CB 4.13Å; E1810-F1854 HydrophobicContact CG-CB 3.72Å; E1810-F1854 VanDerWaalsContact CG-N 3.31Å
1811N77.3Confident79.8Confident51.8 Ų51.833.7 Ų33.728%0.27718%0.183SC..  trans-70115.4-170.5-143.5-17.9000110.9Y1743 R1807 N1813 T1814Y1743-N1811 PolarHBondContact OH-ND2 3.04Å; R1807-N1811 PolarHBondContact O-N 3.12Å; R1807-N1811 VanDerWaalsContact O-N 3.13Å; R1807-N1811 PolarHBondContact O-ND2 3.07Å; N1811-N1813 PolarHBondContact O-N 2.99Å; N1811-N1813 WeakPolarHBondContact OD1-CB 3.22Å; N1811-N1813 PolarHBondContact OD1-N 3.16Å; N1811-T1814 HydrophobicContact CB-CG2 3.84Å; N1811-T1814 WeakPolarHBondContact CB-OG1 3.38Å; N1811-T1814 VanDerWaalsContact O-CB 3.26Å; N1811-T1814 WeakPolarHBondContact O-CB 3.31Å; N1811-T1814 WeakPolarHBondContact O-CG2 3.25Å; N1811-T1814 PolarHBondContact O-N 3.26Å; N1811-T1814 VanDerWaalsContact O-N 3.16Å; N1811-T1814 PolarHBondContact O-OG1 3.19Å
1812P67.8Low79.9Confident111.6 Ų111.633.7 Ų33.773%0.72518%0.183SC*.THydrogen-bonded Turntrans-68.8-19.3-17728.8-36000113.1E1810 T1814E1810-P1812 VanDerWaalsContact O-CD 3.24Å; E1810-P1812 WeakPolarHBondContact O-CD 3.33Å; E1810-P1812 VanDerWaalsContact O-N 3.12Å; P1812-T1814 VanDerWaalsContact C-N 3.3Å; P1812-T1814 PolarHBondContact O-N 3.04Å
1813N69.7Low80.1Confident143.6 Ų143.633.6 Ų33.677%0.76818%0.182SC*.THydrogen-bonded Turntrans-84.1-2.6179.8-62.8-21.1000113.2N1811 S1815N1811-N1813 PolarHBondContact O-N 2.99Å; N1811-N1813 WeakPolarHBondContact OD1-CB 3.22Å; N1811-N1813 PolarHBondContact OD1-N 3.16Å; N1813-S1815 PolarHBondContact O-N 3.12Å
1814T73.2Confident80.2Confident20.8 Ų20.834.8 Ų34.813%0.12819%0.187CC..SBendtrans-68.3132.1-178.913.10000111.2I1746 C1808 N1811 P1812 I1818I1746-T1814 HydrophobicContact CG2-CG2 4.21Å; C1808-T1814 WeakPolarHBondContact O-CG2 3.37Å; C1808-T1814 PolarHBondContact O-OG1 3.38Å; N1811-T1814 HydrophobicContact CB-CG2 3.84Å; N1811-T1814 WeakPolarHBondContact CB-OG1 3.38Å; N1811-T1814 VanDerWaalsContact O-CB 3.26Å; N1811-T1814 WeakPolarHBondContact O-CB 3.31Å; N1811-T1814 WeakPolarHBondContact O-CG2 3.25Å; N1811-T1814 PolarHBondContact O-N 3.26Å; N1811-T1814 VanDerWaalsContact O-N 3.16Å; N1811-T1814 PolarHBondContact O-OG1 3.19Å; P1812-T1814 VanDerWaalsContact C-N 3.3Å; P1812-T1814 PolarHBondContact O-N 3.04Å; T1814-I1818 HydrophobicContact CG2-CB 3.51Å; T1814-I1818 VanDerWaalsContact CG2-CB 3.47Å; T1814-I1818 HydrophobicContact CG2-CD1 4.38Å; T1814-I1818 HydrophobicContact CG2-CG2 4Å
1815S76Confident80.3Confident27.6 Ų27.634.8 Ų34.819%0.19319%0.187CC..  trans-59.2146.917453.70000111.8E1751 N1813 T1817 I1818 F1819E1751-S1815 VanDerWaalsContact OE1-CB 3.29Å; E1751-S1815 WeakPolarHBondContact OE1-CB 3.35Å; E1751-S1815 PolarHBondContact OE1-N 2.54Å; E1751-S1815 PolarHBondContact OE1-OG 3.29Å; E1751-S1815 VanDerWaalsContact OE1-OG 3.08Å; E1751-S1815 PolarHBondContact OE2-OG 3.5Å; N1813-S1815 PolarHBondContact O-N 3.12Å; S1815-T1817 PolarHBondContact O-N 3.19Å; S1815-T1817 VanDerWaalsContact O-N 3.11Å; S1815-T1817 PolarHBondContact OG-OG1 3.23Å; S1815-I1818 WeakPolarHBondContact O-CB 3.45Å; S1815-I1818 PolarHBondContact O-N 2.93Å; S1815-I1818 VanDerWaalsContact O-N 3.11Å; S1815-I1818 VanDerWaalsContact OG-CD1 3.27Å; S1815-I1818 WeakPolarHBondContact OG-CD1 3.33Å; S1815-I1818 WeakPolarHBondContact OG-CG1 3.26Å; S1815-F1819 PolarHBondContact O-N 3.35Å; S1815-F1819 VanDerWaalsContact O-N 3.1Å
1816E77.8Confident80.4Confident75.4 Ų75.434.8 Ų34.835%0.35219%0.187SC..Hα-helixtrans-59.1-29.2-176-170.7127-163.900112.3F1819 V1820 R1861 K1900 S1903E1816-F1819 PolarHBondContact O-N 3.23Å; E1816-V1820 WeakPolarHBondContact O-CB 3.36Å; E1816-V1820 VanDerWaalsContact O-CG2 3.28Å; E1816-V1820 WeakPolarHBondContact O-CG2 3.39Å; E1816-V1820 PolarHBondContact O-N 3.28Å; E1816-R1861 VanDerWaalsContact CD-NH1 3.27Å; E1816-R1861 IonicContact OE1-CZ 3.45Å; E1816-R1861 IonicContact OE1-NH1 3.08Å; E1816-R1861 PolarHBondContact OE1-NH1 3.04Å; E1816-R1861 IonicContact OE1-NH2 3.54Å; E1816-R1861 IonicContact OE2-CZ 3.1Å; E1816-R1861 IonicContact OE2-NH1 3.63Å; E1816-R1861 PolarHBondContact OE2-NH1 3.32Å; E1816-R1861 IonicContact OE2-NH2 3.83Å; E1816-R1861 PolarHBondContact OE2-NH2 2.87Å; E1816-K1900 WeakPolarHBondContact OE1-CA 3.3Å; E1816-S1903 WeakPolarHBondContact OE1-CB 3.42Å; E1816-S1903 PolarHBondContact OE1-OG 2.67Å
1817T79.3Confident80.4Confident80 Ų8036 Ų3649%0.49119%0.193SC..Hα-helixtrans-65-46.8174.151.20000112.2S1815 F1819 V1820 M1821S1815-T1817 PolarHBondContact O-N 3.19Å; S1815-T1817 VanDerWaalsContact O-N 3.11Å; S1815-T1817 PolarHBondContact OG-OG1 3.23Å; T1817-F1819 VanDerWaalsContact C-N 3.32Å; T1817-F1819 PolarHBondContact O-N 3.15Å; T1817-V1820 PolarHBondContact O-N 3.06Å; T1817-M1821 VanDerWaalsContact O-CB 3.3Å; T1817-M1821 WeakPolarHBondContact O-CB 3.34Å; T1817-M1821 VanDerWaalsContact O-CG 3.29Å; T1817-M1821 WeakPolarHBondContact O-CG 3.32Å; T1817-M1821 PolarHBondContact O-N 3.15Å
1818I80.5Confident80.4Confident5.8 Ų5.832.7 Ų32.73%0.0318%0.182CC..Hα-helixtrans-62.5-42.9176.6-68.1171.6000110E1751 F1754 V1755 L1758 C1808 T1814 S1815 V1820 M1821 A1822E1751-I1818 HydrophobicContact CB-CD1 4.22Å; E1751-I1818 HydrophobicContact CG-CD1 4.13Å; F1754-I1818 HydrophobicContact CD1-CD1 3.97Å; F1754-I1818 HydrophobicContact CD1-CG1 4.21Å; F1754-I1818 HydrophobicContact CD1-CG2 4.07Å; F1754-I1818 HydrophobicContact CE1-CG2 3.72Å; V1755-I1818 HydrophobicContact CG2-CD1 4.22Å; V1755-I1818 HydrophobicContact CG2-CG1 3.73Å; L1758-I1818 HydrophobicContact CD1-CG2 4.06Å; C1808-I1818 HydrophobicContact CB-CG2 4.4Å; T1814-I1818 HydrophobicContact CG2-CB 3.51Å; T1814-I1818 VanDerWaalsContact CG2-CB 3.47Å; T1814-I1818 HydrophobicContact CG2-CD1 4.38Å; T1814-I1818 HydrophobicContact CG2-CG2 4Å; S1815-I1818 WeakPolarHBondContact O-CB 3.45Å; S1815-I1818 PolarHBondContact O-N 2.93Å; S1815-I1818 VanDerWaalsContact O-N 3.11Å; S1815-I1818 VanDerWaalsContact OG-CD1 3.27Å; S1815-I1818 WeakPolarHBondContact OG-CD1 3.33Å; S1815-I1818 WeakPolarHBondContact OG-CG1 3.26Å; I1818-V1820 PolarHBondContact O-N 2.9Å; I1818-M1821 PolarHBondContact O-N 2.99Å; I1818-A1822 VanDerWaalsContact O-CB 3.26Å; I1818-A1822 WeakPolarHBondContact O-CB 3.37Å; I1818-A1822 PolarHBondContact O-N 3.26Å
1819F83.8Confident80.4Confident0.4 Ų0.432.6 Ų32.60%0.00218%0.181CC..Hα-helixtrans-60.3-48177178.9-90.5000112.4I1809 S1815 E1816 T1817 M1821 A1822 N1823 M1858 R1861 S1907I1809-F1819 HydrophobicContact CB-CE2 4.36Å; I1809-F1819 HydrophobicContact CG1-CD2 4.27Å; I1809-F1819 HydrophobicContact CG1-CE2 4.11Å; I1809-F1819 HydrophobicContact CG2-CE2 3.98Å; S1815-F1819 PolarHBondContact O-N 3.35Å; S1815-F1819 VanDerWaalsContact O-N 3.1Å; E1816-F1819 PolarHBondContact O-N 3.23Å; T1817-F1819 VanDerWaalsContact C-N 3.32Å; T1817-F1819 PolarHBondContact O-N 3.15Å; F1819-M1821 VanDerWaalsContact C-N 3.33Å; F1819-M1821 PolarHBondContact O-N 3.13Å; F1819-A1822 PolarHBondContact O-N 2.96Å; F1819-N1823 WeakPolarHBondContact CD1-ND2 3.32Å; F1819-N1823 VanDerWaalsContact CE1-ND2 3.31Å; F1819-N1823 WeakPolarHBondContact CE1-ND2 3.34Å; F1819-N1823 WeakPolarHBondContact CE2-ND2 3.34Å; F1819-N1823 VanDerWaalsContact CZ-ND2 3.3Å; F1819-N1823 WeakPolarHBondContact CZ-ND2 3.31Å; F1819-N1823 PolarHBondContact O-N 3.28Å; F1819-N1823 VanDerWaalsContact O-N 3.11Å; F1819-N1823 PolarHBondContact O-ND2 3.05Å; F1819-M1858 HydrophobicContact CZ-SD 4.22Å; F1819-R1861 VanDerWaalsContact CD1-CZ 3.47Å; F1819-R1861 VanDerWaalsContact CD1-NH1 3.32Å; F1819-R1861 VanDerWaalsContact CD2-CZ 3.42Å; F1819-R1861 VanDerWaalsContact CD2-NH2 3.26Å; F1819-R1861 VanDerWaalsContact CE1-CZ 3.42Å; F1819-R1861 VanDerWaalsContact CE1-NH1 3.26Å; F1819-R1861 VanDerWaalsContact CE2-CZ 3.47Å; F1819-R1861 VanDerWaalsContact CE2-NE 3.28Å; F1819-R1861 VanDerWaalsContact CG-CZ 3.43Å; F1819-R1861 VanDerWaalsContact CG-NH2 3.35Å; F1819-R1861 VanDerWaalsContact CZ-CD 3.46Å; F1819-R1861 VanDerWaalsContact CZ-CZ 3.44Å; F1819-R1861 VanDerWaalsContact CZ-NE 3.27Å; F1819-S1907 WeakPolarHBondContact CE1-OG 3.23Å; F1819-S1907 VanDerWaalsContact CZ-OG 3.31Å; F1819-S1907 WeakPolarHBondContact CZ-OG 3.42Å
1820V82.8Confident80.3Confident20.6 Ų20.632.7 Ų32.713%0.12518%0.182CC..Hα-helixtrans-60.2-46.1177.81630000110.5E1816 T1817 I1818 N1823 E1824 V1902 I1906E1816-V1820 WeakPolarHBondContact O-CB 3.36Å; E1816-V1820 VanDerWaalsContact O-CG2 3.28Å; E1816-V1820 WeakPolarHBondContact O-CG2 3.39Å; E1816-V1820 PolarHBondContact O-N 3.28Å; T1817-V1820 PolarHBondContact O-N 3.06Å; I1818-V1820 PolarHBondContact O-N 2.9Å; V1820-N1823 PolarHBondContact O-N 3.19Å; V1820-E1824 WeakPolarHBondContact O-CB 3.38Å; V1820-E1824 PolarHBondContact O-N 3.2Å; V1820-V1902 HydrophobicContact CG1-CG1 4.13Å; V1820-V1902 HydrophobicContact CG2-CG1 4.22Å; V1820-I1906 HydrophobicContact CB-CD1 4.39Å; V1820-I1906 HydrophobicContact CG1-CD1 3.65Å; V1820-I1906 HydrophobicContact CG2-CD1 4.29Å; V1820-I1906 WeakPolarHBondContact O-CD1 3.36Å
1821M81.3Confident79.7Confident23.8 Ų23.836.4 Ų36.412%0.11720%0.198CC..Hα-helixtrans-67-39179.5-76.2-170.972.600113.7V1755 L1758 Q1759 T1817 I1818 F1819 E1824 L1825V1755-M1821 HydrophobicContact CB-SD 4.48Å; V1755-M1821 HydrophobicContact CG1-CE 4.4Å; V1755-M1821 HydrophobicContact CG1-SD 3.8Å; V1755-M1821 HydrophobicContact CG2-SD 4.44Å; L1758-M1821 HydrophobicContact CB-CB 4.44Å; L1758-M1821 HydrophobicContact CB-CE 3.69Å; L1758-M1821 HydrophobicContact CD1-CB 4.11Å; Q1759-M1821 HydrophobicContact CB-CE 4.13Å; Q1759-M1821 HydrophobicContact CG-CE 3.29Å; Q1759-M1821 HydrophobicContact CG-SD 4.35Å; Q1759-M1821 VanDerWaalsContact N-CE 3.31Å; T1817-M1821 VanDerWaalsContact O-CB 3.3Å; T1817-M1821 WeakPolarHBondContact O-CB 3.34Å; T1817-M1821 VanDerWaalsContact O-CG 3.29Å; T1817-M1821 WeakPolarHBondContact O-CG 3.32Å; T1817-M1821 PolarHBondContact O-N 3.15Å; I1818-M1821 PolarHBondContact O-N 2.99Å; F1819-M1821 VanDerWaalsContact C-N 3.33Å; F1819-M1821 PolarHBondContact O-N 3.13Å; M1821-E1824 PolarHBondContact O-N 3.1Å; M1821-L1825 VanDerWaalsContact O-CB 3.31Å; M1821-L1825 WeakPolarHBondContact O-CB 3.39Å; M1821-L1825 PolarHBondContact O-N 3.24Å
1822A85.1Confident79.2Confident0 Ų038.4 Ų38.40%021%0.205CC..Hα-helixtrans-63.1-43.5176.300000111.1C1808 I1809 I1818 F1819 L1825 A1826C1808-A1822 HydrophobicContact CB-CB 3.77Å; I1809-A1822 HydrophobicContact CG1-CB 4.49Å; I1818-A1822 VanDerWaalsContact O-CB 3.26Å; I1818-A1822 WeakPolarHBondContact O-CB 3.37Å; I1818-A1822 PolarHBondContact O-N 3.26Å; F1819-A1822 PolarHBondContact O-N 2.96Å; A1822-L1825 PolarHBondContact O-N 3.18Å; A1822-A1826 WeakPolarHBondContact O-CB 3.42Å; A1822-A1826 PolarHBondContact O-N 3.18Å
1823N85.6Confident79Confident0 Ų033.4 Ų33.40%017%0.173CC..Hα-helixtrans-67.7-38173.9-75.6-78.1000112.3I1809 F1819 V1820 L1825 A1826 I1827 I1906 F1910I1809-N1823 WeakPolarHBondContact CD1-OD1 3.07Å; F1819-N1823 WeakPolarHBondContact CD1-ND2 3.32Å; F1819-N1823 VanDerWaalsContact CE1-ND2 3.31Å; F1819-N1823 WeakPolarHBondContact CE1-ND2 3.34Å; F1819-N1823 WeakPolarHBondContact CE2-ND2 3.34Å; F1819-N1823 VanDerWaalsContact CZ-ND2 3.3Å; F1819-N1823 WeakPolarHBondContact CZ-ND2 3.31Å; F1819-N1823 PolarHBondContact O-N 3.28Å; F1819-N1823 VanDerWaalsContact O-N 3.11Å; F1819-N1823 PolarHBondContact O-ND2 3.05Å; V1820-N1823 PolarHBondContact O-N 3.19Å; N1823-L1825 VanDerWaalsContact C-N 3.34Å; N1823-L1825 PolarHBondContact O-N 3.11Å; N1823-A1826 WeakPolarHBondContact O-CB 3.39Å; N1823-A1826 PolarHBondContact O-N 3.06Å; N1823-I1827 WeakPolarHBondContact O-CB 3.45Å; N1823-I1827 WeakPolarHBondContact O-CD1 3.35Å; N1823-I1827 VanDerWaalsContact O-CG1 3.26Å; N1823-I1827 WeakPolarHBondContact O-CG1 3.41Å; N1823-I1827 PolarHBondContact O-N 3.04Å; N1823-I1906 HydrophobicContact CB-CB 4.41Å; N1823-I1906 HydrophobicContact CB-CD1 4.25Å; N1823-I1906 HydrophobicContact CB-CG1 3.91Å; N1823-I1906 HydrophobicContact CB-CG2 3.37Å; N1823-F1910 VanDerWaalsContact OD1-CD1 3.25Å; N1823-F1910 WeakPolarHBondContact OD1-CD1 3.39Å
1824E84.5Confident79.2Confident56.6 Ų56.627.7 Ų27.726%0.26414%0.142SC..Hα-helixtrans-61.8-43.7175.3-164.9-166.8154.400111.3K1766 V1820 M1821 A1826 I1827 N1828 I1906K1766-E1824 WeakPolarHBondContact CE-OE1 3.08Å; K1766-E1824 IonicContact NZ-OE1 3.31Å; K1766-E1824 PolarHBondContact NZ-OE1 3.04Å; V1820-E1824 WeakPolarHBondContact O-CB 3.38Å; V1820-E1824 PolarHBondContact O-N 3.2Å; M1821-E1824 PolarHBondContact O-N 3.1Å; E1824-A1826 VanDerWaalsContact C-N 3.32Å; E1824-A1826 PolarHBondContact O-N 3.1Å; E1824-I1827 PolarHBondContact O-N 3.16Å; E1824-N1828 WeakPolarHBondContact O-CB 3.24Å; E1824-N1828 VanDerWaalsContact O-CG 3.3Å; E1824-N1828 PolarHBondContact O-N 3.08Å; E1824-N1828 PolarHBondContact O-ND2 3.09Å; E1824-I1906 HydrophobicContact CB-CD1 3.95Å
1825L83.9Confident79.5Confident1.2 Ų1.233.5 Ų33.51%0.00617%0.166CC..Hα-helixtrans-59.3-44.7173.8-175.797.1000110.9L1758 F1761 T1762 I1801 I1805 M1821 A1822 N1823 I1827 N1828 L1829L1758-L1825 HydrophobicContact CD2-CD1 4.02Å; L1758-L1825 HydrophobicContact CD2-CD2 4.1Å; F1761-L1825 VanDerWaalsContact C-CD1 3.47Å; F1761-L1825 HydrophobicContact CB-CD1 3.61Å; F1761-L1825 HydrophobicContact CB-CD2 3.88Å; F1761-L1825 HydrophobicContact CB-CG 4.42Å; F1761-L1825 HydrophobicContact CD2-CD1 4.22Å; F1761-L1825 HydrophobicContact CD2-CD2 4.29Å; F1761-L1825 HydrophobicContact CG-CD1 4.29Å; F1761-L1825 HydrophobicContact CG-CD2 4.42Å; F1761-L1825 WeakPolarHBondContact O-CD1 3.48Å; T1762-L1825 HydrophobicContact CG2-CB 3.73Å; T1762-L1825 HydrophobicContact CG2-CD1 4.11Å; T1762-L1825 HydrophobicContact CG2-CG 4.12Å; I1801-L1825 HydrophobicContact CG2-CD2 3.88Å; I1805-L1825 HydrophobicContact CD1-CB 4.43Å; I1805-L1825 HydrophobicContact CD1-CD2 3.72Å; I1805-L1825 VanDerWaalsContact CD1-CD2 3.42Å; I1805-L1825 HydrophobicContact CD1-CG 3.92Å; I1805-L1825 HydrophobicContact CG1-CD2 3.92Å; I1805-L1825 HydrophobicContact CG1-CG 4.41Å; M1821-L1825 VanDerWaalsContact O-CB 3.31Å; M1821-L1825 WeakPolarHBondContact O-CB 3.39Å; M1821-L1825 PolarHBondContact O-N 3.24Å; A1822-L1825 PolarHBondContact O-N 3.18Å; N1823-L1825 VanDerWaalsContact C-N 3.34Å; N1823-L1825 PolarHBondContact O-N 3.11Å; L1825-I1827 PolarHBondContact O-N 3.4Å; L1825-N1828 PolarHBondContact O-N 3.16Å; L1825-L1829 HydrophobicContact CD1-CD1 4.44Å; L1825-L1829 HydrophobicContact CD1-CG 4.48Å; L1825-L1829 HydrophobicContact CD2-CD1 3.57Å; L1825-L1829 HydrophobicContact CD2-CG 4.1Å; L1825-L1829 HydrophobicContact CG-CD1 4.24Å; L1825-L1829 WeakPolarHBondContact O-CG 3.38Å; L1825-L1829 PolarHBondContact O-N 3.04Å
1826A85.9Confident79.7Confident0 Ų035.9 Ų35.90%017%0.171CC..Hα-helixtrans-60.9-45176.700000112.4I1805 A1822 N1823 E1824 N1828 L1829 L1830 F1841 F1910I1805-A1826 HydrophobicContact CD1-CB 4.16Å; I1805-A1826 HydrophobicContact CG2-CB 3.89Å; A1822-A1826 WeakPolarHBondContact O-CB 3.42Å; A1822-A1826 PolarHBondContact O-N 3.18Å; N1823-A1826 WeakPolarHBondContact O-CB 3.39Å; N1823-A1826 PolarHBondContact O-N 3.06Å; E1824-A1826 VanDerWaalsContact C-N 3.32Å; E1824-A1826 PolarHBondContact O-N 3.1Å; A1826-N1828 VanDerWaalsContact C-N 3.32Å; A1826-N1828 PolarHBondContact O-N 3.19Å; A1826-L1829 PolarHBondContact O-N 3.34Å; A1826-L1830 WeakPolarHBondContact O-CB 3.42Å; A1826-L1830 VanDerWaalsContact O-CG 3.31Å; A1826-L1830 WeakPolarHBondContact O-CG 3.32Å; A1826-L1830 PolarHBondContact O-N 3.12Å; A1826-F1841 HydrophobicContact CB-CZ 4.12Å; A1826-F1910 HydrophobicContact CB-CD2 3.59Å; A1826-F1910 HydrophobicContact CB-CE2 3.43Å; A1826-F1910 VanDerWaalsContact CB-CE2 3.46Å; A1826-F1910 HydrophobicContact CB-CG 4.35Å; A1826-F1910 HydrophobicContact CB-CZ 4.1Å
1827I84.3Confident79.9Confident25.6 Ų25.632.3 Ų32.313%0.13115%0.154CC..Hα-helixtrans-61-41176.1-69.8160.7000110.8N1823 E1824 L1825 L1830 K1831 I1906 Q1909 F1910 T1913N1823-I1827 WeakPolarHBondContact O-CB 3.45Å; N1823-I1827 WeakPolarHBondContact O-CD1 3.35Å; N1823-I1827 VanDerWaalsContact O-CG1 3.26Å; N1823-I1827 WeakPolarHBondContact O-CG1 3.41Å; N1823-I1827 PolarHBondContact O-N 3.04Å; E1824-I1827 PolarHBondContact O-N 3.16Å; L1825-I1827 PolarHBondContact O-N 3.4Å; I1827-L1830 CarbonylContact O-C 3.56Å; I1827-L1830 PolarHBondContact O-N 3.16Å; I1827-K1831 PolarHBondContact O-N 3.02Å; I1827-K1831 VanDerWaalsContact O-N 3.08Å; I1827-I1906 HydrophobicContact CD1-CD1 4.32Å; I1827-I1906 HydrophobicContact CD1-CG1 3.46Å; I1827-I1906 VanDerWaalsContact CD1-CG1 3.46Å; I1827-I1906 HydrophobicContact CD1-CG2 4Å; I1827-Q1909 HydrophobicContact CD1-CB 3.92Å; I1827-Q1909 HydrophobicContact CD1-CG 3.74Å; I1827-Q1909 HydrophobicContact CG1-CG 4.22Å; I1827-Q1909 HydrophobicContact CG2-CG 4.33Å; I1827-F1910 HydrophobicContact CD1-CB 4.29Å; I1827-F1910 HydrophobicContact CG1-CB 4.01Å; I1827-T1913 HydrophobicContact CG2-CG2 4.41Å
1828N82Confident80.1Confident16 Ų1628.8 Ų28.89%0.08613%0.132CC..Hα-helixtrans-67.8-40.8178.3-71-45.5000112.2S1765 K1766 H1793 E1824 L1825 A1826 L1830 K1831S1765-N1828 VanDerWaalsContact OG-CB 3.25Å; S1765-N1828 WeakPolarHBondContact OG-CB 3.39Å; K1766-N1828 VanDerWaalsContact CE-ND2 3.3Å; K1766-N1828 WeakPolarHBondContact CE-ND2 3.46Å; H1793-N1828 PolarHBondContact CE1-O 3.09Å; E1824-N1828 WeakPolarHBondContact O-CB 3.24Å; E1824-N1828 VanDerWaalsContact O-CG 3.3Å; E1824-N1828 PolarHBondContact O-N 3.08Å; E1824-N1828 PolarHBondContact O-ND2 3.09Å; L1825-N1828 PolarHBondContact O-N 3.16Å; A1826-N1828 VanDerWaalsContact C-N 3.32Å; A1826-N1828 PolarHBondContact O-N 3.19Å; N1828-L1830 VanDerWaalsContact C-N 3.28Å; N1828-L1830 PolarHBondContact O-N 3.07Å; N1828-K1831 VanDerWaalsContact O-CB 3.28Å; N1828-K1831 WeakPolarHBondContact O-CB 3.38Å; N1828-K1831 PolarHBondContact O-N 3.11Å; N1828-K1831 WeakPolarHBondContact OD1-CE 3.49Å; N1828-K1831 PolarHBondContact OD1-NZ 3.27Å
1829L81.9Confident80.3Confident0.4 Ų0.430.9 Ų30.90%0.00214%0.142CC..Hα-helixtrans-65.2-33.6174.7-69.8173.8000112.6H1793 L1796 I1801 I1805 L1825 A1826 K1831 V1837H1793-L1829 HydrophobicContact CB-CD2 4.39Å; H1793-L1829 PolarHBondContact CE1-O 3.4Å; H1793-L1829 PolarHBondContact ND1-O 3.08Å; L1796-L1829 HydrophobicContact CB-CD2 4.41Å; L1796-L1829 HydrophobicContact CD1-CD2 4.04Å; I1801-L1829 HydrophobicContact CG2-CD1 3.86Å; I1805-L1829 HydrophobicContact CD1-CD1 3.77Å; L1825-L1829 HydrophobicContact CD1-CD1 4.44Å; L1825-L1829 HydrophobicContact CD1-CG 4.48Å; L1825-L1829 HydrophobicContact CD2-CD1 3.57Å; L1825-L1829 HydrophobicContact CD2-CG 4.1Å; L1825-L1829 HydrophobicContact CG-CD1 4.24Å; L1825-L1829 WeakPolarHBondContact O-CG 3.38Å; L1825-L1829 PolarHBondContact O-N 3.04Å; A1826-L1829 PolarHBondContact O-N 3.34Å; L1829-K1831 VanDerWaalsContact C-N 3.32Å; L1829-V1837 HydrophobicContact CB-CG1 4.1Å
1830L80.1Confident80.3Confident2 Ų231.8 Ų31.81%0.0115%0.148CC..THydrogen-bonded Turntrans-86.5-3.7178-69.6168.7000113.7A1826 I1827 N1828 H1832 S1833 V1837 Q1838 F1841 F1910 L1914A1826-L1830 WeakPolarHBondContact O-CB 3.42Å; A1826-L1830 VanDerWaalsContact O-CG 3.31Å; A1826-L1830 WeakPolarHBondContact O-CG 3.32Å; A1826-L1830 PolarHBondContact O-N 3.12Å; I1827-L1830 CarbonylContact O-C 3.56Å; I1827-L1830 PolarHBondContact O-N 3.16Å; N1828-L1830 VanDerWaalsContact C-N 3.28Å; N1828-L1830 PolarHBondContact O-N 3.07Å; L1830-H1832 PolarHBondContact O-N 3.24Å; L1830-S1833 WeakPolarHBondContact O-CA 3.4Å; L1830-S1833 PolarHBondContact O-N 3.15Å; L1830-V1837 HydrophobicContact CD2-CB 4.11Å; L1830-V1837 HydrophobicContact CD2-CG1 3.69Å; L1830-V1837 HydrophobicContact CG-CG1 4.15Å; L1830-Q1838 HydrophobicContact CD2-CB 4.49Å; L1830-Q1838 HydrophobicContact CD2-CG 3.62Å; L1830-F1841 HydrophobicContact CD1-CD2 4.36Å; L1830-F1841 HydrophobicContact CD1-CE2 4.11Å; L1830-F1841 HydrophobicContact CD2-CD2 4.18Å; L1830-F1841 HydrophobicContact CD2-CE2 4.32Å; L1830-F1841 HydrophobicContact CG-CD2 4.45Å; L1830-F1841 HydrophobicContact CG-CE2 4.16Å; L1830-F1910 HydrophobicContact CD1-CD2 3.89Å; L1830-F1910 HydrophobicContact CD1-CE2 3.65Å; L1830-L1914 HydrophobicContact CD1-CB 4.18Å; L1830-L1914 HydrophobicContact CD1-CD1 4.23Å; L1830-L1914 HydrophobicContact CD1-CD2 3.57Å; L1830-L1914 HydrophobicContact CD1-CG 3.79Å; L1830-L1914 HydrophobicContact CD2-CD2 4.39Å
1831K71.8Confident80.5Confident101.6 Ų101.630.8 Ų30.844%0.44214%0.142SC..THydrogen-bonded Turntrans-57.9133.2179.7-149.1173.5-179.7174.40110.6I1827 N1828 L1829 S1833 D2036I1827-K1831 PolarHBondContact O-N 3.02Å; I1827-K1831 VanDerWaalsContact O-N 3.08Å; N1828-K1831 VanDerWaalsContact O-CB 3.28Å; N1828-K1831 WeakPolarHBondContact O-CB 3.38Å; N1828-K1831 PolarHBondContact O-N 3.11Å; N1828-K1831 WeakPolarHBondContact OD1-CE 3.49Å; N1828-K1831 PolarHBondContact OD1-NZ 3.27Å; L1829-K1831 VanDerWaalsContact C-N 3.32Å; K1831-S1833 VanDerWaalsContact C-N 3.31Å; K1831-S1833 PolarHBondContact O-N 3.03Å; K1831-D2036 IonicContact NZ-OD1 3.09Å; K1831-D2036 PolarHBondContact NZ-OD1 2.89Å
1832H65.5Low80.7Confident94.2 Ų94.232.3 Ų32.344%0.43615%0.147SC..THydrogen-bonded Turntrans64.513.6-173.4-49.4-53.6000115.5L1830 N1834 R1917L1830-H1832 PolarHBondContact O-N 3.24Å; H1832-N1834 VanDerWaalsContact C-N 3.31Å; H1832-N1834 PolarHBondContact O-N 3.07Å; H1832-R1917 PolarHBondContact O-NH1 3.08Å
1833S64.1Low80.7Confident6.8 Ų6.837 Ų375%0.04817%0.171CC..  trans53.255.4178.3-14.30000112.6L1830 K1831 K1835 H1916 R1917L1830-S1833 WeakPolarHBondContact O-CA 3.4Å; L1830-S1833 PolarHBondContact O-N 3.15Å; K1831-S1833 VanDerWaalsContact C-N 3.31Å; K1831-S1833 PolarHBondContact O-N 3.03Å; S1833-K1835 PolarHBondContact O-N 3.26Å; S1833-K1835 VanDerWaalsContact O-N 3.07Å; S1833-H1916 VanDerWaalsContact OG-CB 3.3Å; S1833-H1916 WeakPolarHBondContact OG-CB 3.33Å; S1833-H1916 PolarHBondContact OG-CD2 3.2Å; S1833-H1916 VanDerWaalsContact OG-CG 3.29Å; S1833-H1916 PolarHBondContact OG-ND1 3.05Å; S1833-R1917 WeakPolarHBondContact OG-CD 3.42Å; S1833-R1917 WeakPolarHBondContact OG-CG 3.41Å; S1833-R1917 PolarHBondContact OG-NE 3.27Å; S1833-R1917 VanDerWaalsContact OG-NE 3.08Å; S1833-R1917 PolarHBondContact OG-NH1 3.16Å
1834N74.1Confident80.6Confident23.4 Ų23.437.9 Ų37.913%0.12518%0.176CC..  trans-65.7105.9174.2-172.4-18.2000109.3N1790 H1832 Y1836 V1837 Q1838N1790-N1834 PolarHBondContact OD1-ND2 3.12Å; H1832-N1834 VanDerWaalsContact C-N 3.31Å; H1832-N1834 PolarHBondContact O-N 3.07Å; N1834-Y1836 PolarHBondContact O-N 3.09Å; N1834-Y1836 VanDerWaalsContact O-N 3.15Å; N1834-Y1836 WeakPolarHBondContact OD1-CB 3.28Å; N1834-Y1836 PolarHBondContact OD1-N 3.2Å; N1834-Y1836 VanDerWaalsContact OD1-N 3.11Å; N1834-V1837 HydrophobicContact CB-CB 4.3Å; N1834-V1837 HydrophobicContact CB-CG2 3.83Å; N1834-V1837 PolarHBondContact O-N 2.96Å; N1834-V1837 VanDerWaalsContact O-N 3.11Å; N1834-Q1838 PolarHBondContact O-N 3.21Å; N1834-Q1838 VanDerWaalsContact O-N 3.12Å
1835K79.3Confident80.5Confident141.8 Ų141.835.4 Ų35.462%0.61716%0.164SC*.Hα-helixtrans-56.1-33.4-178.2-134.4-178.5178.6-174.60112.1S1833 Q1838 E1839S1833-K1835 PolarHBondContact O-N 3.26Å; S1833-K1835 VanDerWaalsContact O-N 3.07Å; K1835-Q1838 PolarHBondContact O-N 3.21Å; K1835-E1839 WeakPolarHBondContact CE-OE1 3.47Å; K1835-E1839 HydrophobicContact CG-CG 4.27Å; K1835-E1839 IonicContact NZ-OE1 2.66Å; K1835-E1839 PolarHBondContact NZ-OE1 2.99Å; K1835-E1839 VanDerWaalsContact NZ-OE1 3.13Å; K1835-E1839 WeakPolarHBondContact O-CB 3.36Å; K1835-E1839 VanDerWaalsContact O-CG 3.28Å; K1835-E1839 WeakPolarHBondContact O-CG 3.38Å; K1835-E1839 PolarHBondContact O-N 3.18Å
1836Y79.9Confident80.5Confident78.6 Ų78.637 Ų3731%0.30818%0.175SC..Hα-helixtrans-63.3-46.3177.4179.9-100.5000111.7Y1794 C1797 N1834 Q1838 E1839 C1840Y1794-Y1836 AromaticContact CD2-CD1 3.59Å; Y1794-Y1836 HydrophobicContact CD2-CD1 3.59Å; Y1794-Y1836 VanDerWaalsContact CD2-CD1 3.49Å; Y1794-Y1836 AromaticContact CD2-CD2 3.97Å; Y1794-Y1836 HydrophobicContact CD2-CD2 4.11Å; Y1794-Y1836 AromaticContact CD2-CE1 3.34Å; Y1794-Y1836 HydrophobicContact CD2-CE1 3.34Å; Y1794-Y1836 AromaticContact CD2-CE2 3.86Å; Y1794-Y1836 HydrophobicContact CD2-CE2 3.92Å; Y1794-Y1836 AromaticContact CD2-CG 3.87Å; Y1794-Y1836 HydrophobicContact CD2-CG 3.96Å; Y1794-Y1836 AromaticContact CD2-CZ 3.53Å; Y1794-Y1836 VanDerWaalsContact CD2-CZ 3.47Å; Y1794-Y1836 AromaticContact CE2-CD1 3.94Å; Y1794-Y1836 HydrophobicContact CE2-CD1 4.07Å; Y1794-Y1836 AromaticContact CE2-CD2 3.87Å; Y1794-Y1836 HydrophobicContact CE2-CD2 3.99Å; Y1794-Y1836 AromaticContact CE2-CE1 3.67Å; Y1794-Y1836 HydrophobicContact CE2-CE1 3.67Å; Y1794-Y1836 AromaticContact CE2-CE2 3.48Å; Y1794-Y1836 HydrophobicContact CE2-CE2 3.48Å; Y1794-Y1836 VanDerWaalsContact CE2-CE2 3.4Å; Y1794-Y1836 HydrophobicContact CE2-CG 4.17Å; Y1794-Y1836 AromaticContact CE2-CZ 3.29Å; Y1794-Y1836 WeakPolarHBondContact CE2-OH 3.41Å; Y1794-Y1836 HydrophobicContact CG-CD1 4.37Å; Y1794-Y1836 AromaticContact CG-CE1 3.98Å; Y1794-Y1836 HydrophobicContact CG-CE1 4.11Å; Y1794-Y1836 AromaticContact CZ-CZ 3.91Å; C1797-Y1836 HydrophobicContact CB-CD1 4.41Å; C1797-Y1836 HydrophobicContact CB-CE1 3.91Å; N1834-Y1836 PolarHBondContact O-N 3.09Å; N1834-Y1836 VanDerWaalsContact O-N 3.15Å; N1834-Y1836 WeakPolarHBondContact OD1-CB 3.28Å; N1834-Y1836 PolarHBondContact OD1-N 3.2Å; N1834-Y1836 VanDerWaalsContact OD1-N 3.11Å; Y1836-Q1838 VanDerWaalsContact C-N 3.34Å; Y1836-Q1838 PolarHBondContact O-N 3.26Å; Y1836-E1839 PolarHBondContact O-N 3.17Å; Y1836-C1840 VanDerWaalsContact CE1-SG 3.57Å; Y1836-C1840 PolarHBondContact O-N 3.05Å; Y1836-C1840 PolarHBondContact O-SG 3.07Å; Y1836-C1840 VanDerWaalsContact O-SG 3.32Å
1837V82.2Confident80.2Confident0 Ų040.9 Ų40.90%019%0.192CC..Hα-helixtrans-63.7-42.3178.6-177.40000110.7H1793 L1829 L1830 N1834 E1839 C1840 F1841H1793-V1837 HydrophobicContact CB-CG2 4.3Å; L1829-V1837 HydrophobicContact CB-CG1 4.1Å; L1830-V1837 HydrophobicContact CD2-CB 4.11Å; L1830-V1837 HydrophobicContact CD2-CG1 3.69Å; L1830-V1837 HydrophobicContact CG-CG1 4.15Å; N1834-V1837 HydrophobicContact CB-CB 4.3Å; N1834-V1837 HydrophobicContact CB-CG2 3.83Å; N1834-V1837 PolarHBondContact O-N 2.96Å; N1834-V1837 VanDerWaalsContact O-N 3.11Å; V1837-E1839 VanDerWaalsContact C-N 3.34Å; V1837-E1839 PolarHBondContact O-N 3.17Å; V1837-C1840 WeakPolarHBondContact O-CB 3.36Å; V1837-C1840 PolarHBondContact O-N 3.21Å; V1837-F1841 HydrophobicContact CG1-CD2 3.92Å; V1837-F1841 HydrophobicContact CG1-CE2 3.73Å; V1837-F1841 VanDerWaalsContact O-CD2 3.28Å; V1837-F1841 WeakPolarHBondContact O-CD2 3.35Å; V1837-F1841 PolarHBondContact O-N 3.29Å
1838Q84.6Confident79.5Confident5.2 Ų5.243.7 Ų43.72%0.02421%0.212CC..Hα-helixtrans-60.4-44.5174.3-71.6178.1-17.700112.1L1830 N1834 K1835 Y1836 C1840 F1841 Y1842 T1913 L1914 H1916 N1919 L1922L1830-Q1838 HydrophobicContact CD2-CB 4.49Å; L1830-Q1838 HydrophobicContact CD2-CG 3.62Å; N1834-Q1838 PolarHBondContact O-N 3.21Å; N1834-Q1838 VanDerWaalsContact O-N 3.12Å; K1835-Q1838 PolarHBondContact O-N 3.21Å; Y1836-Q1838 VanDerWaalsContact C-N 3.34Å; Y1836-Q1838 PolarHBondContact O-N 3.26Å; Q1838-C1840 VanDerWaalsContact C-N 3.34Å; Q1838-C1840 PolarHBondContact O-N 3.22Å; Q1838-F1841 PolarHBondContact O-N 3.09Å; Q1838-Y1842 WeakPolarHBondContact O-CB 3.31Å; Q1838-Y1842 PolarHBondContact O-N 3.22Å; Q1838-T1913 PolarHBondContact NE2-O 3.32Å; Q1838-L1914 PolarHBondContact NE2-O 3.23Å; Q1838-H1916 PolarHBondContact NE2-O 3.08Å; Q1838-N1919 PolarHBondContact OE1-ND2 3.44Å; Q1838-L1922 HydrophobicContact CB-CD1 3.89Å; Q1838-L1922 HydrophobicContact CG-CD1 4.34Å
1839E83.9Confident78.8Confident51.2 Ų51.250.6 Ų50.624%0.23924%0.241CC..Hα-helixtrans-65.1-36175.2-69.9-71.8163.900111.7K1835 Y1836 V1837 Y1842 I1843 R1921K1835-E1839 WeakPolarHBondContact CE-OE1 3.47Å; K1835-E1839 HydrophobicContact CG-CG 4.27Å; K1835-E1839 IonicContact NZ-OE1 2.66Å; K1835-E1839 PolarHBondContact NZ-OE1 2.99Å; K1835-E1839 VanDerWaalsContact NZ-OE1 3.13Å; K1835-E1839 WeakPolarHBondContact O-CB 3.36Å; K1835-E1839 VanDerWaalsContact O-CG 3.28Å; K1835-E1839 WeakPolarHBondContact O-CG 3.38Å; K1835-E1839 PolarHBondContact O-N 3.18Å; Y1836-E1839 PolarHBondContact O-N 3.17Å; V1837-E1839 VanDerWaalsContact C-N 3.34Å; V1837-E1839 PolarHBondContact O-N 3.17Å; E1839-Y1842 PolarHBondContact O-N 3.04Å; E1839-I1843 WeakPolarHBondContact O-CB 3.33Å; E1839-I1843 WeakPolarHBondContact O-CD1 3.38Å; E1839-I1843 WeakPolarHBondContact O-CG1 3.39Å; E1839-I1843 PolarHBondContact O-N 3.21Å; E1839-R1921 IonicContact OE1-NH1 3.45Å; E1839-R1921 IonicContact OE2-NH1 3.05Å; E1839-R1921 PolarHBondContact OE2-NH1 3.34Å; E1839-R1921 VanDerWaalsContact OE2-NH1 3.1Å
1840C84.4Confident78.3Confident19.2 Ų19.256.1 Ų56.113%0.1327%0.267CS..Hα-helixtrans-60.8-48.3172.4-70.30000111.8C1802 Y1836 V1837 Q1838 Y1842 I1843 I1844C1802-C1840 HydrophobicContact CB-CB 4.43Å; Y1836-C1840 VanDerWaalsContact CE1-SG 3.57Å; Y1836-C1840 PolarHBondContact O-N 3.05Å; Y1836-C1840 PolarHBondContact O-SG 3.07Å; Y1836-C1840 VanDerWaalsContact O-SG 3.32Å; V1837-C1840 WeakPolarHBondContact O-CB 3.36Å; V1837-C1840 PolarHBondContact O-N 3.21Å; Q1838-C1840 VanDerWaalsContact C-N 3.34Å; Q1838-C1840 PolarHBondContact O-N 3.22Å; C1840-Y1842 VanDerWaalsContact C-N 3.31Å; C1840-Y1842 PolarHBondContact O-N 3.21Å; C1840-I1843 PolarHBondContact O-N 3.11Å; C1840-I1844 WeakPolarHBondContact O-CD1 3.24Å; C1840-I1844 VanDerWaalsContact O-CG1 3.25Å; C1840-I1844 WeakPolarHBondContact O-CG1 3.32Å; C1840-I1844 PolarHBondContact O-N 3.4Å; C1840-I1844 VanDerWaalsContact O-N 3.09Å
1841F86.4Confident78.2Confident0 Ų056.4 Ų56.40%027%0.268CS..Hα-helixtrans-59.5-42.6174.2-82.7-71.2000111.6C1802 I1805 I1806 A1826 L1830 V1837 Q1838 I1844 L1845 F1910 L1914C1802-F1841 HydrophobicContact CB-CD1 4.43Å; C1802-F1841 HydrophobicContact CB-CE1 4.23Å; C1802-F1841 HydrophobicContact CB-CZ 4.31Å; I1805-F1841 HydrophobicContact CB-CE1 4.49Å; I1805-F1841 HydrophobicContact CD1-CE1 4.44Å; I1805-F1841 HydrophobicContact CD1-CZ 4.09Å; I1805-F1841 HydrophobicContact CG2-CE1 4.23Å; I1805-F1841 HydrophobicContact CG2-CZ 4.37Å; I1806-F1841 HydrophobicContact CD1-CD1 3.93Å; I1806-F1841 HydrophobicContact CD1-CE1 4.34Å; I1806-F1841 HydrophobicContact CG1-CD1 4.15Å; I1806-F1841 HydrophobicContact CG1-CE1 4.15Å; A1826-F1841 HydrophobicContact CB-CZ 4.12Å; L1830-F1841 HydrophobicContact CD1-CD2 4.36Å; L1830-F1841 HydrophobicContact CD1-CE2 4.11Å; L1830-F1841 HydrophobicContact CD2-CD2 4.18Å; L1830-F1841 HydrophobicContact CD2-CE2 4.32Å; L1830-F1841 HydrophobicContact CG-CD2 4.45Å; L1830-F1841 HydrophobicContact CG-CE2 4.16Å; V1837-F1841 HydrophobicContact CG1-CD2 3.92Å; V1837-F1841 HydrophobicContact CG1-CE2 3.73Å; V1837-F1841 VanDerWaalsContact O-CD2 3.28Å; V1837-F1841 WeakPolarHBondContact O-CD2 3.35Å; V1837-F1841 PolarHBondContact O-N 3.29Å; Q1838-F1841 PolarHBondContact O-N 3.09Å; F1841-I1844 PolarHBondContact O-N 2.87Å; F1841-L1845 VanDerWaalsContact O-CB 3.29Å; F1841-L1845 WeakPolarHBondContact O-CB 3.41Å; F1841-L1845 VanDerWaalsContact O-CG 3.29Å; F1841-L1845 WeakPolarHBondContact O-CG 3.42Å; F1841-L1845 PolarHBondContact O-N 3.21Å; F1841-F1910 HydrophobicContact CD1-CZ 4.38Å; F1841-F1910 HydrophobicContact CE1-CE2 4.36Å; F1841-F1910 AromaticContact CE1-CZ 3.93Å; F1841-F1910 HydrophobicContact CE1-CZ 4.03Å; F1841-F1910 HydrophobicContact CE2-CE2 4.42Å; F1841-F1910 HydrophobicContact CZ-CE2 4.21Å; F1841-F1910 HydrophobicContact CZ-CZ 4.34Å; F1841-L1914 HydrophobicContact CB-CD1 4.06Å; F1841-L1914 HydrophobicContact CB-CD2 3.91Å; F1841-L1914 HydrophobicContact CD1-CD2 4.49Å; F1841-L1914 HydrophobicContact CD2-CD1 4.25Å; F1841-L1914 HydrophobicContact CD2-CD2 3.91Å; F1841-L1914 HydrophobicContact CE2-CD2 4.5Å; F1841-L1914 HydrophobicContact CG-CD1 4.26Å; F1841-L1914 HydrophobicContact CG-CD2 3.88Å
1842Y85.9Confident78.6Confident53.6 Ų53.653.3 Ų53.321%0.2126%0.255CS..Hα-helixtrans-61.8-48.7177.1178.1-100.9000112.3Q1838 E1839 C1840 I1844 L1845 S1846 R1921 L1922 L1925Q1838-Y1842 WeakPolarHBondContact O-CB 3.31Å; Q1838-Y1842 PolarHBondContact O-N 3.22Å; E1839-Y1842 PolarHBondContact O-N 3.04Å; C1840-Y1842 VanDerWaalsContact C-N 3.31Å; C1840-Y1842 PolarHBondContact O-N 3.21Å; Y1842-I1844 VanDerWaalsContact C-N 3.27Å; Y1842-I1844 PolarHBondContact O-N 3.27Å; Y1842-L1845 PolarHBondContact O-N 3.26Å; Y1842-S1846 WeakPolarHBondContact CE1-OG 3.26Å; Y1842-S1846 WeakPolarHBondContact CE2-OG 3.48Å; Y1842-S1846 WeakPolarHBondContact O-CB 3.37Å; Y1842-S1846 PolarHBondContact O-N 3.22Å; Y1842-S1846 PolarHBondContact O-OG 3.2Å; Y1842-R1921 HydrophobicContact CD2-CB 3.89Å; Y1842-R1921 HydrophobicContact CE1-CB 4.38Å; Y1842-R1921 HydrophobicContact CE2-CB 3.58Å; Y1842-R1921 VanDerWaalsContact CE2-CB 3.48Å; Y1842-R1921 HydrophobicContact CE2-CG 4.46Å; Y1842-R1921 HydrophobicContact CG-CB 4.44Å; Y1842-R1921 PolarHBondContact OH-NE 2.91Å; Y1842-R1921 PolarHBondContact OH-NH2 3.45Å; Y1842-L1922 HydrophobicContact CD2-CD2 4Å; Y1842-L1922 HydrophobicContact CD2-CG 4.27Å; Y1842-L1922 HydrophobicContact CG-CD2 4.41Å; Y1842-L1922 HydrophobicContact CG-CG 4.49Å; Y1842-L1925 HydrophobicContact CD2-CD1 3.91Å; Y1842-L1925 HydrophobicContact CD2-CD2 4.12Å; Y1842-L1925 HydrophobicContact CE2-CB 4.45Å; Y1842-L1925 HydrophobicContact CE2-CD1 3.86Å; Y1842-L1925 HydrophobicContact CE2-CD2 4.39Å
1843I84.3Confident79.4Confident98.6 Ų98.653.6 Ų53.651%0.50626%0.26SS..Hα-helixtrans-61.1-38.7-179.6-70.5164.1000110.8E1839 C1840 S1846 K1847E1839-I1843 WeakPolarHBondContact O-CB 3.33Å; E1839-I1843 WeakPolarHBondContact O-CD1 3.38Å; E1839-I1843 WeakPolarHBondContact O-CG1 3.39Å; E1839-I1843 PolarHBondContact O-N 3.21Å; C1840-I1843 PolarHBondContact O-N 3.11Å; I1843-S1846 PolarHBondContact O-OG 3.07Å; I1843-K1847 WeakPolarHBondContact O-CG 3.34Å
1844I83Confident80.5Confident19.8 Ų19.853.3 Ų53.310%0.10226%0.258CS..Hα-helixtrans-72.5-55.7178.9-60.6162.3000110.1C1802 D1803 I1806 C1840 F1841 Y1842 S1846 K1847 H1851C1802-I1844 HydrophobicContact CB-CD1 3.54Å; C1802-I1844 VanDerWaalsContact CB-CD1 3.45Å; D1803-I1844 HydrophobicContact CB-CD1 4.19Å; I1806-I1844 HydrophobicContact CD1-CB 3.73Å; I1806-I1844 HydrophobicContact CD1-CD1 4.3Å; I1806-I1844 HydrophobicContact CD1-CG2 3.38Å; I1806-I1844 VanDerWaalsContact CD1-CG2 3.43Å; C1840-I1844 WeakPolarHBondContact O-CD1 3.24Å; C1840-I1844 VanDerWaalsContact O-CG1 3.25Å; C1840-I1844 WeakPolarHBondContact O-CG1 3.32Å; C1840-I1844 PolarHBondContact O-N 3.4Å; C1840-I1844 VanDerWaalsContact O-N 3.09Å; F1841-I1844 PolarHBondContact O-N 2.87Å; Y1842-I1844 VanDerWaalsContact C-N 3.27Å; Y1842-I1844 PolarHBondContact O-N 3.27Å; I1844-S1846 PolarHBondContact O-N 3.25Å; I1844-S1846 VanDerWaalsContact O-N 3.15Å; I1844-K1847 WeakPolarHBondContact O-CB 3.34Å; I1844-K1847 WeakPolarHBondContact O-CG 3.28Å; I1844-K1847 PolarHBondContact O-N 3.31Å; I1844-K1847 VanDerWaalsContact O-N 3.08Å; I1844-H1851 VanDerWaalsContact CG2-NE2 3.29Å; I1844-H1851 WeakPolarHBondContact CG2-NE2 3.37Å; I1844-H1851 PolarHBondContact O-CD2 3.14Å
1845L83.7Confident81.1Confident4.8 Ų4.852.2 Ų52.23%0.02525%0.252CS..Hα-helixtrans-63.8-23.2-177.5-67.5173.3000113.8I1806 F1841 Y1842 K1847 H1851 F1854 F1855 L1925I1806-L1845 HydrophobicContact CD1-CD2 3.84Å; I1806-L1845 HydrophobicContact CD1-CG 3.91Å; I1806-L1845 HydrophobicContact CG1-CD2 4.11Å; I1806-L1845 HydrophobicContact CG1-CG 4.46Å; I1806-L1845 HydrophobicContact CG2-CD2 4.1Å; F1841-L1845 VanDerWaalsContact O-CB 3.29Å; F1841-L1845 WeakPolarHBondContact O-CB 3.41Å; F1841-L1845 VanDerWaalsContact O-CG 3.29Å; F1841-L1845 WeakPolarHBondContact O-CG 3.42Å; F1841-L1845 PolarHBondContact O-N 3.21Å; Y1842-L1845 PolarHBondContact O-N 3.26Å; L1845-K1847 VanDerWaalsContact C-N 3.33Å; L1845-H1851 HydrophobicContact CD2-CB 4.27Å; L1845-F1854 HydrophobicContact CD1-CD1 4.42Å; L1845-F1854 HydrophobicContact CD1-CE1 4.04Å; L1845-F1854 HydrophobicContact CD1-CZ 4.35Å; L1845-F1854 HydrophobicContact CD2-CB 4.26Å; L1845-F1854 HydrophobicContact CD2-CD1 3.53Å; L1845-F1854 VanDerWaalsContact CD2-CD1 3.49Å; L1845-F1854 HydrophobicContact CD2-CD2 4.21Å; L1845-F1854 HydrophobicContact CD2-CE1 3.88Å; L1845-F1854 HydrophobicContact CD2-CE2 4.45Å; L1845-F1854 HydrophobicContact CD2-CG 3.73Å; L1845-F1854 HydrophobicContact CD2-CZ 4.35Å; L1845-F1855 HydrophobicContact CB-CE2 4.48Å; L1845-F1855 HydrophobicContact CB-CZ 4.33Å; L1845-F1855 HydrophobicContact CD1-CZ 4.47Å; L1845-F1855 HydrophobicContact CD2-CE2 4.41Å; L1845-F1855 HydrophobicContact CD2-CZ 4.44Å; L1845-L1925 HydrophobicContact CB-CD1 4.31Å; L1845-L1925 HydrophobicContact CB-CD2 4.05Å; L1845-L1925 HydrophobicContact CD1-CD2 4.34Å
1846S82.6Confident81.4Confident34.6 Ų34.646.5 Ų46.524%0.24223%0.23CC..THydrogen-bonded Turntrans-80.4-9.7176.2117.60000114Y1842 I1843 I1844 N1931Y1842-S1846 WeakPolarHBondContact CE1-OG 3.26Å; Y1842-S1846 WeakPolarHBondContact CE2-OG 3.48Å; Y1842-S1846 WeakPolarHBondContact O-CB 3.37Å; Y1842-S1846 PolarHBondContact O-N 3.22Å; Y1842-S1846 PolarHBondContact O-OG 3.2Å; I1843-S1846 PolarHBondContact O-OG 3.07Å; I1844-S1846 PolarHBondContact O-N 3.25Å; I1844-S1846 VanDerWaalsContact O-N 3.15Å; S1846-N1931 PolarHBondContact O-ND2 3.27Å
1847K79.8Confident81.7Confident82 Ų8243.5 Ų43.536%0.35722%0.22SC..SBendtrans-64.2130.7179.1-70.4180-171.1169.60110.4I1843 I1844 L1845 K1849 Q1850I1843-K1847 WeakPolarHBondContact O-CG 3.34Å; I1844-K1847 WeakPolarHBondContact O-CB 3.34Å; I1844-K1847 WeakPolarHBondContact O-CG 3.28Å; I1844-K1847 PolarHBondContact O-N 3.31Å; I1844-K1847 VanDerWaalsContact O-N 3.08Å; L1845-K1847 VanDerWaalsContact C-N 3.33Å; K1847-K1849 PolarHBondContact O-N 3.06Å; K1847-Q1850 HydrophobicContact CB-CB 4.38Å; K1847-Q1850 HydrophobicContact CB-CG 4.45Å; K1847-Q1850 VanDerWaalsContact CD-OE1 3.29Å
1848P69.8Low81.8Confident83.4 Ų83.443.5 Ų43.554%0.54222%0.22SC..THydrogen-bonded Turntrans-64.7131.3-17326.2-34.4000111.8Q1850 N1931P1848-Q1850 PolarHBondContact O-N 3.34Å; P1848-Q1850 VanDerWaalsContact O-N 3.13Å; P1848-N1931 HydrophobicContact CB-CB 4.02Å
1849K67.1Low81.9Confident161.4 Ų161.445.4 Ų45.470%0.70223%0.229SC*.THydrogen-bonded Turntrans62.31.8173.1-53.9-179.7178.1-178.60117.1K1847K1847-K1849 PolarHBondContact O-N 3.06Å
1850Q70.6Confident82Confident116.2 Ų116.248 Ų4854%0.54324%0.241SC..THydrogen-bonded Turntrans-86.2-37.4-177.2-71.7-172.7-21.500112.7K1847 P1848K1847-Q1850 HydrophobicContact CB-CB 4.38Å; K1847-Q1850 HydrophobicContact CB-CG 4.45Å; K1847-Q1850 VanDerWaalsContact CD-OE1 3.29Å; P1848-Q1850 PolarHBondContact O-N 3.34Å; P1848-Q1850 VanDerWaalsContact O-N 3.13Å
1851H78.3Confident82Confident9 Ų949.4 Ų49.44%0.04224%0.243CC..SBendtrans-122.333-167.3-57.8-66.9000113.1D1803 I1806 E1810 I1844 L1845 D1853 F1854 F1855D1803-H1851 IonicContact OD1-CE1 2.97Å; D1803-H1851 IonicContact OD1-NE2 2.59Å; I1806-H1851 HydrophobicContact CG2-CB 4.28Å; I1806-H1851 VanDerWaalsContact CG2-ND1 3.34Å; I1806-H1851 WeakPolarHBondContact CG2-ND1 3.28Å; E1810-H1851 VanDerWaalsContact CD-ND1 3.32Å; E1810-H1851 VanDerWaalsContact OE1-CA 3.27Å; E1810-H1851 WeakPolarHBondContact OE1-CA 3.38Å; E1810-H1851 VanDerWaalsContact OE1-CB 3.3Å; E1810-H1851 WeakPolarHBondContact OE1-CB 3.44Å; E1810-H1851 IonicContact OE1-CE1 3.1Å; E1810-H1851 IonicContact OE1-CG 2.95Å; E1810-H1851 VanDerWaalsContact OE1-CG 3.24Å; E1810-H1851 IonicContact OE1-ND1 3.31Å; E1810-H1851 PolarHBondContact OE1-ND1 2.98Å; E1810-H1851 IonicContact OE2-CE1 3.51Å; E1810-H1851 IonicContact OE2-ND1 3.26Å; E1810-H1851 PolarHBondContact OE2-ND1 2.99Å; I1844-H1851 VanDerWaalsContact CG2-NE2 3.29Å; I1844-H1851 WeakPolarHBondContact CG2-NE2 3.37Å; I1844-H1851 PolarHBondContact O-CD2 3.14Å; L1845-H1851 HydrophobicContact CD2-CB 4.27Å; H1851-D1853 VanDerWaalsContact C-N 3.31Å; H1851-D1853 PolarHBondContact O-N 2.9Å; H1851-F1854 HydrophobicContact CB-CB 4.49Å; H1851-F1854 WeakPolarHBondContact O-CB 3.4Å; H1851-F1854 PolarHBondContact O-N 3.19Å; H1851-F1855 VanDerWaalsContact O-CD2 3.32Å; H1851-F1855 WeakPolarHBondContact O-CD2 3.31Å
1852E80.6Confident81.9Confident36 Ų3649.4 Ų49.417%0.16824%0.243CC..Hα-helixtrans-67-34.5176-171.9166.1169.300111.3F1854 F1855 S1856 N1932 V1933 T1934 F1936E1852-F1854 VanDerWaalsContact C-N 3.27Å; E1852-F1854 PolarHBondContact O-N 3.11Å; E1852-F1855 PolarHBondContact O-N 3.15Å; E1852-S1856 PolarHBondContact O-N 3.11Å; E1852-S1856 VanDerWaalsContact O-N 3.08Å; E1852-N1932 HydrophobicContact CB-CB 4.47Å; E1852-N1932 HydrophobicContact CG-CB 4.22Å; E1852-V1933 PolarHBondContact OE2-N 3.21Å; E1852-V1933 VanDerWaalsContact OE2-N 3.13Å; E1852-T1934 WeakPolarHBondContact OE1-CB 3.22Å; E1852-T1934 PolarHBondContact OE1-N 3.15Å; E1852-T1934 PolarHBondContact OE1-OG1 3.18Å; E1852-F1936 HydrophobicContact CG-CE2 4.01Å
1853D83.4Confident81.9Confident100 Ų10050.3 Ų50.354%0.53525%0.249SC..Hα-helixtrans-64.1-26.3178.1-67.3-35.6000113E1810 H1851 S1856 S1857E1810-D1853 HydrophobicContact CB-CB 4.15Å; E1810-D1853 HydrophobicContact CG-CB 4.13Å; H1851-D1853 VanDerWaalsContact C-N 3.31Å; H1851-D1853 PolarHBondContact O-N 2.9Å; D1853-S1856 WeakPolarHBondContact CA-OG 3.45Å; D1853-S1856 PolarHBondContact O-N 3.21Å; D1853-S1856 PolarHBondContact O-OG 3.43Å; D1853-S1856 VanDerWaalsContact O-OG 3.06Å; D1853-S1857 VanDerWaalsContact O-CB 3.25Å; D1853-S1857 WeakPolarHBondContact O-CB 3.42Å; D1853-S1857 PolarHBondContact O-N 3.03Å
1854F87.1Confident81.9Confident0.8 Ų0.849.6 Ų49.60%0.00425%0.247CC..Hα-helixtrans-63.4-49.6175.9169.1-92000110.1I1806 I1809 E1810 L1845 H1851 E1852 S1856 S1857 M1858 F1910I1806-F1854 HydrophobicContact CG2-CB 4.32Å; I1806-F1854 HydrophobicContact CG2-CD2 4.21Å; I1806-F1854 HydrophobicContact CG2-CG 4.43Å; I1809-F1854 HydrophobicContact CB-CD2 3.92Å; I1809-F1854 HydrophobicContact CB-CE2 4.14Å; I1809-F1854 HydrophobicContact CD1-CD2 4.43Å; I1809-F1854 HydrophobicContact CD1-CE2 3.89Å; I1809-F1854 HydrophobicContact CG2-CD2 3.39Å; I1809-F1854 VanDerWaalsContact CG2-CD2 3.42Å; I1809-F1854 HydrophobicContact CG2-CE2 3.59Å; I1809-F1854 HydrophobicContact CG2-CG 4.38Å; E1810-F1854 HydrophobicContact CG-CB 3.72Å; E1810-F1854 VanDerWaalsContact CG-N 3.31Å; L1845-F1854 HydrophobicContact CD1-CD1 4.42Å; L1845-F1854 HydrophobicContact CD1-CE1 4.04Å; L1845-F1854 HydrophobicContact CD1-CZ 4.35Å; L1845-F1854 HydrophobicContact CD2-CB 4.26Å; L1845-F1854 HydrophobicContact CD2-CD1 3.53Å; L1845-F1854 VanDerWaalsContact CD2-CD1 3.49Å; L1845-F1854 HydrophobicContact CD2-CD2 4.21Å; L1845-F1854 HydrophobicContact CD2-CE1 3.88Å; L1845-F1854 HydrophobicContact CD2-CE2 4.45Å; L1845-F1854 HydrophobicContact CD2-CG 3.73Å; L1845-F1854 HydrophobicContact CD2-CZ 4.35Å; H1851-F1854 HydrophobicContact CB-CB 4.49Å; H1851-F1854 WeakPolarHBondContact O-CB 3.4Å; H1851-F1854 PolarHBondContact O-N 3.19Å; E1852-F1854 VanDerWaalsContact C-N 3.27Å; E1852-F1854 PolarHBondContact O-N 3.11Å; F1854-S1856 VanDerWaalsContact C-N 3.34Å; F1854-S1857 PolarHBondContact O-N 3.16Å; F1854-M1858 HydrophobicContact CE1-CG 4.36Å; F1854-M1858 HydrophobicContact CE2-CG 4.42Å; F1854-M1858 HydrophobicContact CZ-CG 4.23Å; F1854-M1858 VanDerWaalsContact O-CG 3.3Å; F1854-M1858 WeakPolarHBondContact O-CG 3.45Å; F1854-M1858 PolarHBondContact O-N 3.27Å; F1854-M1858 VanDerWaalsContact O-N 3.08Å; F1854-F1910 AromaticContact CE2-CE1 3.99Å; F1854-F1910 HydrophobicContact CE2-CE1 4.06Å; F1854-F1910 AromaticContact CZ-CE1 3.87Å; F1854-F1910 HydrophobicContact CZ-CE1 3.87Å
1855F86.5Confident81.8Confident0.2 Ų0.249.2 Ų49.20%0.00125%0.247CC..Hα-helixtrans-68.2-38.4179.1-64.8-79.9000111.1L1845 H1851 E1852 M1858 F1859 L1925 Q1929 N1932 F1936 L1938L1845-F1855 HydrophobicContact CB-CE2 4.48Å; L1845-F1855 HydrophobicContact CB-CZ 4.33Å; L1845-F1855 HydrophobicContact CD1-CZ 4.47Å; L1845-F1855 HydrophobicContact CD2-CE2 4.41Å; L1845-F1855 HydrophobicContact CD2-CZ 4.44Å; H1851-F1855 VanDerWaalsContact O-CD2 3.32Å; H1851-F1855 WeakPolarHBondContact O-CD2 3.31Å; E1852-F1855 PolarHBondContact O-N 3.15Å; F1855-M1858 PolarHBondContact O-N 3.19Å; F1855-F1859 WeakPolarHBondContact O-CB 3.4Å; F1855-F1859 PolarHBondContact O-N 3.13Å; F1855-L1925 HydrophobicContact CE1-CD2 3.78Å; F1855-L1925 HydrophobicContact CE1-CG 4.41Å; F1855-L1925 HydrophobicContact CZ-CD1 4.43Å; F1855-L1925 HydrophobicContact CZ-CD2 3.94Å; F1855-L1925 VanDerWaalsContact CZ-CD2 3.48Å; F1855-L1925 HydrophobicContact CZ-CG 4.04Å; F1855-Q1929 HydrophobicContact CD1-CG 4.02Å; F1855-Q1929 HydrophobicContact CD2-CG 4Å; F1855-Q1929 HydrophobicContact CE1-CG 3.82Å; F1855-Q1929 HydrophobicContact CE2-CG 3.8Å; F1855-Q1929 HydrophobicContact CG-CG 4.11Å; F1855-Q1929 HydrophobicContact CZ-CG 3.71Å; F1855-N1932 WeakPolarHBondContact CD2-ND2 3.48Å; F1855-F1936 HydrophobicContact CB-CB 4.05Å; F1855-F1936 HydrophobicContact CB-CD2 3.62Å; F1855-F1936 HydrophobicContact CB-CE2 4.42Å; F1855-F1936 HydrophobicContact CB-CG 4.12Å; F1855-L1938 HydrophobicContact CD1-CD1 4.1Å
1856S85.7Confident81.7Confident21.8 Ų21.851.7 Ų51.715%0.15226%0.256CS..Hα-helixtrans-60.8-46.9174.3171.30000111.9E1852 D1853 F1854 M1858 F1859 Q1860E1852-S1856 PolarHBondContact O-N 3.11Å; E1852-S1856 VanDerWaalsContact O-N 3.08Å; D1853-S1856 WeakPolarHBondContact CA-OG 3.45Å; D1853-S1856 PolarHBondContact O-N 3.21Å; D1853-S1856 PolarHBondContact O-OG 3.43Å; D1853-S1856 VanDerWaalsContact O-OG 3.06Å; F1854-S1856 VanDerWaalsContact C-N 3.34Å; S1856-M1858 PolarHBondContact O-N 3.06Å; S1856-F1859 PolarHBondContact O-N 3.11Å; S1856-Q1860 VanDerWaalsContact O-CB 3.28Å; S1856-Q1860 WeakPolarHBondContact O-CB 3.31Å; S1856-Q1860 VanDerWaalsContact O-CG 3.23Å; S1856-Q1860 WeakPolarHBondContact O-CG 3.31Å; S1856-Q1860 PolarHBondContact O-N 3.27Å; S1856-Q1860 PolarHBondContact OG-NE2 2.97Å; S1856-Q1860 VanDerWaalsContact OG-NE2 3.14Å
1857S85Confident81.6Confident14.8 Ų14.851.8 Ų51.810%0.10326%0.257CS..Hα-helixtrans-61-46.7177.9178.20000111.9I1809 D1853 F1854 Q1860 R1861I1809-S1857 VanDerWaalsContact O-CB 3.24Å; I1809-S1857 WeakPolarHBondContact O-CB 3.33Å; I1809-S1857 PolarHBondContact O-OG 3.15Å; D1853-S1857 VanDerWaalsContact O-CB 3.25Å; D1853-S1857 WeakPolarHBondContact O-CB 3.42Å; D1853-S1857 PolarHBondContact O-N 3.03Å; F1854-S1857 PolarHBondContact O-N 3.16Å; S1857-Q1860 PolarHBondContact O-N 2.99Å; S1857-R1861 VanDerWaalsContact O-CG 3.31Å; S1857-R1861 WeakPolarHBondContact O-CG 3.31Å; S1857-R1861 PolarHBondContact O-N 3.01Å; S1857-R1861 VanDerWaalsContact O-N 3.11Å
1858M85.2Confident81.4Confident0 Ų051.1 Ų51.10%026%0.255CS..Hα-helixtrans-64.9-44.9176.8-69-68.7-76.200111.8I1809 F1819 F1854 F1855 S1856 R1861 F1862 F1910 L1911 L1938I1809-M1858 HydrophobicContact CG2-CG 4.25Å; I1809-M1858 HydrophobicContact CG2-SD 4.25Å; F1819-M1858 HydrophobicContact CZ-SD 4.22Å; F1854-M1858 HydrophobicContact CE1-CG 4.36Å; F1854-M1858 HydrophobicContact CE2-CG 4.42Å; F1854-M1858 HydrophobicContact CZ-CG 4.23Å; F1854-M1858 VanDerWaalsContact O-CG 3.3Å; F1854-M1858 WeakPolarHBondContact O-CG 3.45Å; F1854-M1858 PolarHBondContact O-N 3.27Å; F1854-M1858 VanDerWaalsContact O-N 3.08Å; F1855-M1858 PolarHBondContact O-N 3.19Å; S1856-M1858 PolarHBondContact O-N 3.06Å; M1858-R1861 PolarHBondContact O-N 3.28Å; M1858-F1862 HydrophobicContact CB-CE2 4.47Å; M1858-F1862 HydrophobicContact CE-CE2 4.26Å; M1858-F1862 HydrophobicContact CE-CZ 4.13Å; M1858-F1862 WeakPolarHBondContact O-CD2 3.33Å; M1858-F1862 WeakPolarHBondContact O-CG 3.37Å; M1858-F1862 PolarHBondContact O-N 3.19Å; M1858-F1862 VanDerWaalsContact O-N 3.1Å; M1858-F1910 HydrophobicContact CE-CD1 4.41Å; M1858-L1911 HydrophobicContact CE-CD1 3.87Å; M1858-L1911 HydrophobicContact CE-CD2 3.94Å; M1858-L1911 HydrophobicContact CE-CG 3.72Å; M1858-L1938 HydrophobicContact CB-CD1 4.46Å; M1858-L1938 HydrophobicContact CB-CD2 4.15Å
1859F87.5Confident81.5Confident47 Ų4747.7 Ų47.721%0.20623%0.232CC..Hα-helixtrans-60.1-49176.7-177.9-83.5000111.2F1855 S1856 R1861 F1862 H1863 F1936 L1938 E1941F1855-F1859 WeakPolarHBondContact O-CB 3.4Å; F1855-F1859 PolarHBondContact O-N 3.13Å; S1856-F1859 PolarHBondContact O-N 3.11Å; F1859-R1861 VanDerWaalsContact C-N 3.3Å; F1859-R1861 PolarHBondContact O-N 3.19Å; F1859-F1862 PolarHBondContact O-N 3.09Å; F1859-H1863 HydrophobicContact CD1-CB 4.36Å; F1859-H1863 HydrophobicContact CE1-CB 4.18Å; F1859-H1863 VanDerWaalsContact O-CB 3.29Å; F1859-H1863 WeakPolarHBondContact O-CB 3.33Å; F1859-H1863 PolarHBondContact O-N 3.14Å; F1859-F1936 HydrophobicContact CB-CB 4.34Å; F1859-F1936 HydrophobicContact CB-CD1 3.88Å; F1859-F1936 HydrophobicContact CB-CG 4.36Å; F1859-F1936 HydrophobicContact CD1-CD1 4.16Å; F1859-F1936 HydrophobicContact CD2-CB 4.13Å; F1859-F1936 AromaticContact CD2-CD1 3.97Å; F1859-F1936 HydrophobicContact CD2-CD1 3.97Å; F1859-F1936 HydrophobicContact CD2-CG 4.47Å; F1859-F1936 HydrophobicContact CG-CB 4.43Å; F1859-F1936 AromaticContact CG-CD1 3.74Å; F1859-F1936 HydrophobicContact CG-CD1 3.74Å; F1859-F1936 HydrophobicContact CG-CE1 4.49Å; F1859-F1936 HydrophobicContact CG-CG 4.47Å; F1859-L1938 HydrophobicContact CB-CD2 3.96Å; F1859-L1938 HydrophobicContact CD2-CD2 4.42Å; F1859-E1941 HydrophobicContact CD2-CG 3.56Å; F1859-E1941 VanDerWaalsContact CD2-CG 3.48Å; F1859-E1941 HydrophobicContact CE1-CG 4.4Å; F1859-E1941 HydrophobicContact CE2-CB 4.46Å; F1859-E1941 HydrophobicContact CE2-CG 3.14Å; F1859-E1941 HydrophobicContact CG-CG 4.32Å; F1859-E1941 HydrophobicContact CZ-CG 3.6Å; F1859-E1941 VanDerWaalsContact CZ-OE1 3.25Å; F1859-E1941 WeakPolarHBondContact CZ-OE1 3.36Å
1860Q85.9Confident81.9Confident105.2 Ų105.241.3 Ų41.349%0.49221%0.205SC..Hα-helixtrans-60-38.4178.9-75176.321.300112.1S1856 S1857 H1863 N1864S1856-Q1860 VanDerWaalsContact O-CB 3.28Å; S1856-Q1860 WeakPolarHBondContact O-CB 3.31Å; S1856-Q1860 VanDerWaalsContact O-CG 3.23Å; S1856-Q1860 WeakPolarHBondContact O-CG 3.31Å; S1856-Q1860 PolarHBondContact O-N 3.27Å; S1856-Q1860 PolarHBondContact OG-NE2 2.97Å; S1856-Q1860 VanDerWaalsContact OG-NE2 3.14Å; S1857-Q1860 PolarHBondContact O-N 2.99Å; Q1860-H1863 PolarHBondContact O-N 3.03Å; Q1860-N1864 VanDerWaalsContact O-CB 3.22Å; Q1860-N1864 WeakPolarHBondContact O-CB 3.26Å; Q1860-N1864 PolarHBondContact O-N 3.19Å; Q1860-N1864 PolarHBondContact O-ND2 3.27Å; Q1860-N1864 VanDerWaalsContact O-ND2 3.11Å; Q1860-N1864 PolarHBondContact O-OD1 2.88Å
1861R83.4Confident82.1Confident47.2 Ų47.239.7 Ų39.718%0.17820%0.2CC..Hα-helixtrans-65-45.1177-74.2174.2-178.1-96.72.8112.1E1816 F1819 S1857 M1858 F1859 N1864 A1865 S1903E1816-R1861 VanDerWaalsContact CD-NH1 3.27Å; E1816-R1861 IonicContact OE1-CZ 3.45Å; E1816-R1861 IonicContact OE1-NH1 3.08Å; E1816-R1861 PolarHBondContact OE1-NH1 3.04Å; E1816-R1861 IonicContact OE1-NH2 3.54Å; E1816-R1861 IonicContact OE2-CZ 3.1Å; E1816-R1861 IonicContact OE2-NH1 3.63Å; E1816-R1861 PolarHBondContact OE2-NH1 3.32Å; E1816-R1861 IonicContact OE2-NH2 3.83Å; E1816-R1861 PolarHBondContact OE2-NH2 2.87Å; F1819-R1861 VanDerWaalsContact CD1-CZ 3.47Å; F1819-R1861 VanDerWaalsContact CD1-NH1 3.32Å; F1819-R1861 VanDerWaalsContact CD2-CZ 3.42Å; F1819-R1861 VanDerWaalsContact CD2-NH2 3.26Å; F1819-R1861 VanDerWaalsContact CE1-CZ 3.42Å; F1819-R1861 VanDerWaalsContact CE1-NH1 3.26Å; F1819-R1861 VanDerWaalsContact CE2-CZ 3.47Å; F1819-R1861 VanDerWaalsContact CE2-NE 3.28Å; F1819-R1861 VanDerWaalsContact CG-CZ 3.43Å; F1819-R1861 VanDerWaalsContact CG-NH2 3.35Å; F1819-R1861 VanDerWaalsContact CZ-CD 3.46Å; F1819-R1861 VanDerWaalsContact CZ-CZ 3.44Å; F1819-R1861 VanDerWaalsContact CZ-NE 3.27Å; S1857-R1861 VanDerWaalsContact O-CG 3.31Å; S1857-R1861 WeakPolarHBondContact O-CG 3.31Å; S1857-R1861 PolarHBondContact O-N 3.01Å; S1857-R1861 VanDerWaalsContact O-N 3.11Å; M1858-R1861 PolarHBondContact O-N 3.28Å; F1859-R1861 VanDerWaalsContact C-N 3.3Å; F1859-R1861 PolarHBondContact O-N 3.19Å; R1861-N1864 PolarHBondContact O-N 2.92Å; R1861-A1865 PolarHBondContact O-N 3.16Å; R1861-A1865 VanDerWaalsContact O-N 3.11Å; R1861-S1903 PolarHBondContact NH1-OG 3.35Å
1862F85.1Confident81.5Confident0.4 Ų0.440.9 Ų40.90%0.00221%0.207CC..Hα-helixtrans-66.5-42174.7-61.7-44.2000112M1858 F1859 N1864 A1865 Y1866 V1904 L1908 L1911 L1938 E1941 I1942 L1945M1858-F1862 HydrophobicContact CB-CE2 4.47Å; M1858-F1862 HydrophobicContact CE-CE2 4.26Å; M1858-F1862 HydrophobicContact CE-CZ 4.13Å; M1858-F1862 WeakPolarHBondContact O-CD2 3.33Å; M1858-F1862 WeakPolarHBondContact O-CG 3.37Å; M1858-F1862 PolarHBondContact O-N 3.19Å; M1858-F1862 VanDerWaalsContact O-N 3.1Å; F1859-F1862 PolarHBondContact O-N 3.09Å; F1862-N1864 VanDerWaalsContact C-N 3.34Å; F1862-N1864 PolarHBondContact O-N 3.27Å; F1862-A1865 WeakPolarHBondContact O-CB 3.22Å; F1862-A1865 PolarHBondContact O-N 2.99Å; F1862-Y1866 VanDerWaalsContact O-CB 3.29Å; F1862-Y1866 WeakPolarHBondContact O-CB 3.39Å; F1862-Y1866 PolarHBondContact O-N 3.27Å; F1862-V1904 HydrophobicContact CD1-CG1 4.1Å; F1862-V1904 HydrophobicContact CE1-CG1 4.19Å; F1862-L1908 HydrophobicContact CE1-CD2 3.89Å; F1862-L1908 HydrophobicContact CE1-CG 3.84Å; F1862-L1908 HydrophobicContact CZ-CD2 4.07Å; F1862-L1908 HydrophobicContact CZ-CG 4.32Å; F1862-L1911 HydrophobicContact CE2-CD1 3.66Å; F1862-L1911 HydrophobicContact CZ-CD1 3.75Å; F1862-L1938 HydrophobicContact CD2-CD2 4.25Å; F1862-L1938 HydrophobicContact CE2-CD2 4.4Å; F1862-E1941 HydrophobicContact CB-CB 4.25Å; F1862-I1942 HydrophobicContact CD2-CG1 4.32Å; F1862-I1942 HydrophobicContact CE2-CD1 4.26Å; F1862-I1942 HydrophobicContact CE2-CG1 4.32Å; F1862-I1942 HydrophobicContact CG-CG1 4.49Å; F1862-I1942 HydrophobicContact CZ-CD1 4.44Å; F1862-L1945 HydrophobicContact CB-CD1 4.45Å; F1862-L1945 HydrophobicContact CD1-CD1 4.46Å
1863H86.1Confident80.8Confident73.2 Ų73.240.3 Ų40.334%0.33921%0.206SC..Hα-helixtrans-64.9-38.3178.7-168.573.6000112.3F1859 Q1860 Y1866 S1867 E1941F1859-H1863 HydrophobicContact CD1-CB 4.36Å; F1859-H1863 HydrophobicContact CE1-CB 4.18Å; F1859-H1863 VanDerWaalsContact O-CB 3.29Å; F1859-H1863 WeakPolarHBondContact O-CB 3.33Å; F1859-H1863 PolarHBondContact O-N 3.14Å; Q1860-H1863 PolarHBondContact O-N 3.03Å; H1863-Y1866 PolarHBondContact O-N 3.12Å; H1863-S1867 VanDerWaalsContact O-CB 3.27Å; H1863-S1867 WeakPolarHBondContact O-CB 3.35Å; H1863-S1867 PolarHBondContact O-N 3.17Å; H1863-S1867 PolarHBondContact O-OG 3.23Å; H1863-E1941 WeakPolarHBondContact CA-OE2 3.38Å; H1863-E1941 IonicContact CG-OE2 3.09Å; H1863-E1941 IonicContact ND1-OE1 3.16Å; H1863-E1941 PolarHBondContact ND1-OE1 3.19Å; H1863-E1941 IonicContact ND1-OE2 3.49Å; H1863-E1941 PolarHBondContact ND1-OE2 3.01Å; H1863-E1941 VanDerWaalsContact ND1-OE2 3.16Å
1864N83.4Confident80Confident84.2 Ų84.242 Ų4245%0.4521%0.208SC..Hα-helixtrans-64.7-41.5174.7-75.8-26.9000111.6Q1860 R1861 F1862 S1867 Q1868Q1860-N1864 VanDerWaalsContact O-CB 3.22Å; Q1860-N1864 WeakPolarHBondContact O-CB 3.26Å; Q1860-N1864 PolarHBondContact O-N 3.19Å; Q1860-N1864 PolarHBondContact O-ND2 3.27Å; Q1860-N1864 VanDerWaalsContact O-ND2 3.11Å; Q1860-N1864 PolarHBondContact O-OD1 2.88Å; R1861-N1864 PolarHBondContact O-N 2.92Å; F1862-N1864 VanDerWaalsContact C-N 3.34Å; F1862-N1864 PolarHBondContact O-N 3.27Å; N1864-S1867 WeakPolarHBondContact CA-OG 3.41Å; N1864-S1867 PolarHBondContact O-OG 3.16Å; N1864-S1867 VanDerWaalsContact O-OG 3.09Å; N1864-Q1868 WeakPolarHBondContact O-CB 3.37Å; N1864-Q1868 VanDerWaalsContact O-CG 3.25Å; N1864-Q1868 WeakPolarHBondContact O-CG 3.3Å; N1864-Q1868 PolarHBondContact O-N 3.2Å; N1864-Q1868 VanDerWaalsContact O-N 3.08Å; N1864-Q1868 PolarHBondContact O-NE2 3.1Å
1865A80.4Confident78.6Confident11.8 Ų11.846.1 Ų46.110%0.09823%0.23CC..Hα-helixtrans-64.8-4717400000111.1R1861 F1862 S1867 Q1868 M1869 V1904 L1945R1861-A1865 PolarHBondContact O-N 3.16Å; R1861-A1865 VanDerWaalsContact O-N 3.11Å; F1862-A1865 WeakPolarHBondContact O-CB 3.22Å; F1862-A1865 PolarHBondContact O-N 2.99Å; A1865-S1867 VanDerWaalsContact C-N 3.34Å; A1865-S1867 PolarHBondContact O-N 3.04Å; A1865-Q1868 PolarHBondContact O-N 3.33Å; A1865-M1869 WeakPolarHBondContact O-CB 3.44Å; A1865-M1869 VanDerWaalsContact O-CG 3.25Å; A1865-M1869 WeakPolarHBondContact O-CG 3.41Å; A1865-M1869 PolarHBondContact O-N 3.3Å; A1865-M1869 VanDerWaalsContact O-N 3.11Å; A1865-V1904 HydrophobicContact CB-CG1 4.47Å; A1865-V1904 HydrophobicContact CB-CG2 3.8Å; A1865-L1945 HydrophobicContact CB-CD1 3.94Å
1866Y82.3Confident76.7Confident56.6 Ų56.657.1 Ų57.122%0.22227%0.272CS..Hα-helixtrans-56.9-48.9175.7166.4-96.8000112.4F1862 H1863 Q1868 M1869 D1870 S1944 N1948F1862-Y1866 VanDerWaalsContact O-CB 3.29Å; F1862-Y1866 WeakPolarHBondContact O-CB 3.39Å; F1862-Y1866 PolarHBondContact O-N 3.27Å; H1863-Y1866 PolarHBondContact O-N 3.12Å; Y1866-Q1868 PolarHBondContact O-N 2.99Å; Y1866-M1869 CarbonylContact O-C 3.58Å; Y1866-M1869 WeakPolarHBondContact O-CB 3.44Å; Y1866-M1869 PolarHBondContact O-N 3.27Å; Y1866-M1869 VanDerWaalsContact O-N 3.14Å; Y1866-D1870 HydrophobicContact CE1-CB 4.42Å; Y1866-D1870 WeakPolarHBondContact O-CB 3.41Å; Y1866-D1870 PolarHBondContact O-N 3.2Å; Y1866-S1944 WeakPolarHBondContact CE2-O 3.17Å; Y1866-N1948 HydrophobicContact CD2-CB 4.2Å; Y1866-N1948 VanDerWaalsContact CD2-ND2 3.33Å; Y1866-N1948 WeakPolarHBondContact CD2-ND2 3.36Å; Y1866-N1948 HydrophobicContact CE2-CB 4.21Å; Y1866-N1948 VanDerWaalsContact CE2-CG 3.44Å; Y1866-N1948 WeakPolarHBondContact CE2-ND2 3.31Å; Y1866-N1948 PolarHBondContact O-ND2 2.86Å
1867S80.1Confident74.7Confident36.8 Ų36.864 Ų6426%0.25730%0.3SS..Hα-helixtrans-66.7-40.2-177.698.30000112.4H1863 N1864 A1865 M1869 D1870 N1871H1863-S1867 VanDerWaalsContact O-CB 3.27Å; H1863-S1867 WeakPolarHBondContact O-CB 3.35Å; H1863-S1867 PolarHBondContact O-N 3.17Å; H1863-S1867 PolarHBondContact O-OG 3.23Å; N1864-S1867 WeakPolarHBondContact CA-OG 3.41Å; N1864-S1867 PolarHBondContact O-OG 3.16Å; N1864-S1867 VanDerWaalsContact O-OG 3.09Å; A1865-S1867 VanDerWaalsContact C-N 3.34Å; A1865-S1867 PolarHBondContact O-N 3.04Å; S1867-M1869 VanDerWaalsContact C-N 3.29Å; S1867-M1869 PolarHBondContact O-N 3.11Å; S1867-D1870 PolarHBondContact O-N 3.14Å; S1867-N1871 WeakPolarHBondContact O-CB 3.37Å; S1867-N1871 VanDerWaalsContact O-CG 3.22Å; S1867-N1871 PolarHBondContact O-N 3.12Å; S1867-N1871 PolarHBondContact O-ND2 3.21Å
1868Q76Confident72.6Confident67 Ų6766.6 Ų66.631%0.31331%0.309SS..Hα-helixtrans-58.6-44.2172.5-75169.72000111N1864 A1865 Y1866 N1871 L1872 K1900N1864-Q1868 WeakPolarHBondContact O-CB 3.37Å; N1864-Q1868 VanDerWaalsContact O-CG 3.25Å; N1864-Q1868 WeakPolarHBondContact O-CG 3.3Å; N1864-Q1868 PolarHBondContact O-N 3.2Å; N1864-Q1868 VanDerWaalsContact O-N 3.08Å; N1864-Q1868 PolarHBondContact O-NE2 3.1Å; A1865-Q1868 PolarHBondContact O-N 3.33Å; Y1866-Q1868 PolarHBondContact O-N 2.99Å; Q1868-N1871 PolarHBondContact O-N 3.12Å; Q1868-L1872 WeakPolarHBondContact O-CG 3.37Å; Q1868-L1872 PolarHBondContact O-N 3.14Å; Q1868-L1872 VanDerWaalsContact O-N 3.14Å; Q1868-K1900 VanDerWaalsContact NE2-NZ 3.2Å
1869M71.3Confident70.4Confident13 Ų1370.1 Ų70.16%0.06433%0.333CS..Hα-helixtrans-70.2-39.1178.1-67.7-174.885.200113.2A1865 Y1866 S1867 N1871 L1872 T1873 I1897 L1945 N1948 L1949 I1952A1865-M1869 WeakPolarHBondContact O-CB 3.44Å; A1865-M1869 VanDerWaalsContact O-CG 3.25Å; A1865-M1869 WeakPolarHBondContact O-CG 3.41Å; A1865-M1869 PolarHBondContact O-N 3.3Å; A1865-M1869 VanDerWaalsContact O-N 3.11Å; Y1866-M1869 CarbonylContact O-C 3.58Å; Y1866-M1869 WeakPolarHBondContact O-CB 3.44Å; Y1866-M1869 PolarHBondContact O-N 3.27Å; Y1866-M1869 VanDerWaalsContact O-N 3.14Å; S1867-M1869 VanDerWaalsContact C-N 3.29Å; S1867-M1869 PolarHBondContact O-N 3.11Å; M1869-N1871 VanDerWaalsContact C-N 3.32Å; M1869-N1871 PolarHBondContact O-N 3.21Å; M1869-L1872 WeakPolarHBondContact O-CB 3.26Å; M1869-L1872 PolarHBondContact O-N 3.15Å; M1869-L1872 VanDerWaalsContact O-N 3.14Å; M1869-T1873 WeakPolarHBondContact O-CG2 3.45Å; M1869-T1873 PolarHBondContact O-N 3.16Å; M1869-I1897 HydrophobicContact CG-CD1 4.5Å; M1869-L1945 HydrophobicContact SD-CD1 3.84Å; M1869-N1948 VanDerWaalsContact C-ND2 3.33Å; M1869-N1948 HydrophobicContact CB-CB 4.37Å; M1869-N1948 VanDerWaalsContact CB-ND2 3.31Å; M1869-N1948 WeakPolarHBondContact CB-ND2 3.4Å; M1869-N1948 HydrophobicContact CE-CB 4.23Å; M1869-L1949 VanDerWaalsContact CE-CA 3.46Å; M1869-L1949 HydrophobicContact CE-CB 4.12Å; M1869-L1949 HydrophobicContact CE-CD1 4.31Å; M1869-L1949 HydrophobicContact CE-CD2 3.19Å; M1869-L1949 VanDerWaalsContact CE-CD2 3.47Å; M1869-L1949 HydrophobicContact CE-CG 3.51Å; M1869-L1949 VanDerWaalsContact CE-CG 3.45Å; M1869-L1949 HydrophobicContact SD-CD1 4.18Å; M1869-L1949 HydrophobicContact SD-CD2 3.72Å; M1869-L1949 WeakPolarHBondContact SD-CD2 3.46Å; M1869-L1949 HydrophobicContact SD-CG 3.72Å; M1869-L1949 WeakPolarHBondContact SD-CG 3.33Å; M1869-I1952 HydrophobicContact CB-CD1 4.33Å; M1869-I1952 HydrophobicContact CE-CD1 3.58Å; M1869-I1952 VanDerWaalsContact CE-CD1 3.47Å
1870D76.2Confident68.3Low25.2 Ų25.277.1 Ų77.114%0.13536%0.364CS..Hα-helixtrans-62.8-41.9176.7-170.140.4000110.6Y1866 S1867 L1872 T1873 K1874 N1948Y1866-D1870 HydrophobicContact CE1-CB 4.42Å; Y1866-D1870 WeakPolarHBondContact O-CB 3.41Å; Y1866-D1870 PolarHBondContact O-N 3.2Å; S1867-D1870 PolarHBondContact O-N 3.14Å; D1870-L1872 VanDerWaalsContact C-N 3.3Å; D1870-L1872 PolarHBondContact O-N 3.21Å; D1870-T1873 WeakPolarHBondContact O-CA 3.23Å; D1870-T1873 PolarHBondContact O-N 3.24Å; D1870-T1873 PolarHBondContact O-OG1 3.16Å; D1870-T1873 PolarHBondContact OD1-OG1 3.22Å; D1870-K1874 WeakPolarHBondContact O-CB 3.36Å; D1870-K1874 WeakPolarHBondContact O-CG 3.3Å; D1870-K1874 PolarHBondContact O-N 3.25Å; D1870-K1874 VanDerWaalsContact OD1-CE 3.26Å; D1870-K1874 WeakPolarHBondContact OD1-CE 3.17Å; D1870-K1874 IonicContact OD1-NZ 3.9Å; D1870-K1874 WeakPolarHBondContact OD2-CE 3.32Å; D1870-K1874 IonicContact OD2-NZ 3.26Å; D1870-K1874 PolarHBondContact OD2-NZ 3.16Å; D1870-N1948 VanDerWaalsContact CA-ND2 3.31Å; D1870-N1948 WeakPolarHBondContact CA-ND2 3.33Å; D1870-N1948 WeakPolarHBondContact CB-ND2 3.33Å; D1870-N1948 PolarHBondContact N-ND2 2.87Å; D1870-N1948 PolarHBondContact OD1-ND2 3.5Å
1871N74.5Confident66.2Low84 Ų8480.3 Ų80.345%0.44938%0.379SS..Hα-helixtrans-58.7-40.8173.1-70.7-25.9000111.9S1867 Q1868 M1869 T1873 K1874 N1875S1867-N1871 WeakPolarHBondContact O-CB 3.37Å; S1867-N1871 VanDerWaalsContact O-CG 3.22Å; S1867-N1871 PolarHBondContact O-N 3.12Å; S1867-N1871 PolarHBondContact O-ND2 3.21Å; Q1868-N1871 PolarHBondContact O-N 3.12Å; M1869-N1871 VanDerWaalsContact C-N 3.32Å; M1869-N1871 PolarHBondContact O-N 3.21Å; N1871-T1873 VanDerWaalsContact C-N 3.33Å; N1871-T1873 PolarHBondContact O-N 3.17Å; N1871-K1874 PolarHBondContact O-N 2.93Å; N1871-N1875 VanDerWaalsContact O-CB 3.25Å; N1871-N1875 WeakPolarHBondContact O-CB 3.35Å; N1871-N1875 VanDerWaalsContact O-CG 3.23Å; N1871-N1875 PolarHBondContact O-N 3.18Å; N1871-N1875 VanDerWaalsContact O-N 3.09Å; N1871-N1875 PolarHBondContact O-ND2 3.05Å
1872L65.6Low64Low34.6 Ų34.684 Ų8418%0.18140%0.398CS..Hα-helixtrans-62.9-39.8172.6-66.5172.2000111.9Q1868 M1869 D1870 K1874 F1878 F1893 L1896Q1868-L1872 WeakPolarHBondContact O-CG 3.37Å; Q1868-L1872 PolarHBondContact O-N 3.14Å; Q1868-L1872 VanDerWaalsContact O-N 3.14Å; M1869-L1872 WeakPolarHBondContact O-CB 3.26Å; M1869-L1872 PolarHBondContact O-N 3.15Å; M1869-L1872 VanDerWaalsContact O-N 3.14Å; D1870-L1872 VanDerWaalsContact C-N 3.3Å; D1870-L1872 PolarHBondContact O-N 3.21Å; L1872-K1874 VanDerWaalsContact C-N 3.32Å; L1872-K1874 PolarHBondContact O-N 3.34Å; L1872-F1878 HydrophobicContact CB-CE2 4.2Å; L1872-F1878 WeakPolarHBondContact O-CD2 3.16Å; L1872-F1878 VanDerWaalsContact O-CE2 3.27Å; L1872-F1878 WeakPolarHBondContact O-CE2 3.43Å; L1872-F1893 HydrophobicContact CD1-CD1 4.29Å; L1872-F1893 HydrophobicContact CD1-CE1 3.83Å; L1872-F1893 HydrophobicContact CD1-CE2 4.14Å; L1872-F1893 HydrophobicContact CD1-CZ 3.76Å; L1872-L1896 HydrophobicContact CD1-CD1 3.73Å; L1872-L1896 HydrophobicContact CD1-CD2 4.02Å; L1872-L1896 HydrophobicContact CD1-CG 4.43Å; L1872-L1896 HydrophobicContact CD2-CD1 4.35Å; L1872-L1896 HydrophobicContact CD2-CD2 4.24Å
1873T66.6Low61.7Low23 Ų2387 Ų8714%0.14141%0.411CS..Hα-helixtrans-71.1-29.8178.568.10000114.4M1869 D1870 N1871 N1948 I1952 R1955M1869-T1873 WeakPolarHBondContact O-CG2 3.45Å; M1869-T1873 PolarHBondContact O-N 3.16Å; D1870-T1873 WeakPolarHBondContact O-CA 3.23Å; D1870-T1873 PolarHBondContact O-N 3.24Å; D1870-T1873 PolarHBondContact O-OG1 3.16Å; D1870-T1873 PolarHBondContact OD1-OG1 3.22Å; N1871-T1873 VanDerWaalsContact C-N 3.33Å; N1871-T1873 PolarHBondContact O-N 3.17Å; T1873-N1948 WeakPolarHBondContact CG2-OD1 3.35Å; T1873-I1952 HydrophobicContact CG2-CD1 3.83Å; T1873-I1952 HydrophobicContact CG2-CG1 3.48Å; T1873-I1952 VanDerWaalsContact CG2-CG1 3.45Å; T1873-R1955 PolarHBondContact O-NH1 3.12Å; T1873-R1955 VanDerWaalsContact O-NH1 3.08Å
1874K66.8Low59.5Low134.2 Ų134.288.1 Ų88.158%0.58342%0.423SS*.Hα-helixtrans-82.7-34.3-179.8-76.8172.8174.7165.20112.7D1870 N1871 L1872 R1876D1870-K1874 WeakPolarHBondContact O-CB 3.36Å; D1870-K1874 WeakPolarHBondContact O-CG 3.3Å; D1870-K1874 PolarHBondContact O-N 3.25Å; D1870-K1874 VanDerWaalsContact OD1-CE 3.26Å; D1870-K1874 WeakPolarHBondContact OD1-CE 3.17Å; D1870-K1874 IonicContact OD1-NZ 3.9Å; D1870-K1874 WeakPolarHBondContact OD2-CE 3.32Å; D1870-K1874 IonicContact OD2-NZ 3.26Å; D1870-K1874 PolarHBondContact OD2-NZ 3.16Å; N1871-K1874 PolarHBondContact O-N 2.93Å; L1872-K1874 VanDerWaalsContact C-N 3.32Å; L1872-K1874 PolarHBondContact O-N 3.34Å; K1874-R1876 PolarHBondContact O-N 3.34Å; K1874-R1876 VanDerWaalsContact O-N 3.08Å
1875N57Low57.5Low87.6 Ų87.691.2 Ų91.247%0.46843%0.432SS..SBendtrans-63.9105.5175.5-76.4-14.8000109.2N1871 F1877N1871-N1875 VanDerWaalsContact O-CB 3.25Å; N1871-N1875 WeakPolarHBondContact O-CB 3.35Å; N1871-N1875 VanDerWaalsContact O-CG 3.23Å; N1871-N1875 PolarHBondContact O-N 3.18Å; N1871-N1875 VanDerWaalsContact O-N 3.09Å; N1871-N1875 PolarHBondContact O-ND2 3.05Å; N1875-F1877 HydrophobicContact CB-CD2 4.22Å; N1875-F1877 PolarHBondContact O-N 3.1Å
1876R47.6Very low55.6Low231.6 Ų231.694 Ų9487%0.87445%0.449SS*.THydrogen-bonded Turntrans-63.513.6-178.8-72.7-176.9179.3166-0.7114.9K1874 F1878 S1879K1874-R1876 PolarHBondContact O-N 3.34Å; K1874-R1876 VanDerWaalsContact O-N 3.08Å; R1876-F1878 CarbonylContact O-C 3.37Å; R1876-F1878 PolarHBondContact O-N 3.16Å; R1876-F1878 VanDerWaalsContact O-N 3.12Å; R1876-S1879 PolarHBondContact O-N 3.3Å; R1876-S1879 PolarHBondContact O-OG 3.3Å
1877F42.1Very low53.7Low167.4 Ų167.495.9 Ų95.973%0.73447%0.466SS*.THydrogen-bonded Turntrans-61.3-11.8174.4-82.7-78.7000113.3N1875 S1879N1875-F1877 HydrophobicContact CB-CD2 4.22Å; N1875-F1877 PolarHBondContact O-N 3.1Å; F1877-S1879 VanDerWaalsContact C-N 3.3Å; F1877-S1879 PolarHBondContact O-N 3.09Å; F1877-S1879 VanDerWaalsContact O-N 3.14Å
1878F42.2Very low51.9Low68.8 Ų68.898.8 Ų98.830%0.30248%0.479SS..  trans-81.648.8169.9-61.3-67.1000113.2L1872 R1876 K1880 F1883 Y1889 F1893L1872-F1878 HydrophobicContact CB-CE2 4.2Å; L1872-F1878 WeakPolarHBondContact O-CD2 3.16Å; L1872-F1878 VanDerWaalsContact O-CE2 3.27Å; L1872-F1878 WeakPolarHBondContact O-CE2 3.43Å; R1876-F1878 CarbonylContact O-C 3.37Å; R1876-F1878 PolarHBondContact O-N 3.16Å; R1876-F1878 VanDerWaalsContact O-N 3.12Å; F1878-K1880 PolarHBondContact O-N 2.97Å; F1878-F1883 HydrophobicContact CB-CE2 4Å; F1878-F1883 HydrophobicContact CB-CZ 3.73Å; F1878-F1883 HydrophobicContact CD1-CE1 4.26Å; F1878-F1883 HydrophobicContact CD1-CE2 4.49Å; F1878-F1883 AromaticContact CD1-CZ 3.92Å; F1878-F1883 HydrophobicContact CD1-CZ 3.92Å; F1878-F1883 AromaticContact CG-CZ 3.96Å; F1878-F1883 HydrophobicContact CG-CZ 4.21Å; F1878-Y1889 AromaticContact CD1-CD2 3.84Å; F1878-Y1889 HydrophobicContact CD1-CD2 3.84Å; F1878-Y1889 AromaticContact CD1-CE1 3.97Å; F1878-Y1889 HydrophobicContact CD1-CE1 3.97Å; F1878-Y1889 AromaticContact CD1-CE2 3.63Å; F1878-Y1889 HydrophobicContact CD1-CE2 3.63Å; F1878-Y1889 VanDerWaalsContact CD1-CE2 3.41Å; F1878-Y1889 HydrophobicContact CE1-CD1 4.32Å; F1878-Y1889 AromaticContact CE1-CD2 3.42Å; F1878-Y1889 HydrophobicContact CE1-CD2 3.42Å; F1878-Y1889 VanDerWaalsContact CE1-CD2 3.46Å; F1878-Y1889 AromaticContact CE1-CE1 3.65Å; F1878-Y1889 HydrophobicContact CE1-CE1 4.05Å; F1878-Y1889 AromaticContact CE1-CE2 3.41Å; F1878-Y1889 HydrophobicContact CE1-CE2 3.41Å; F1878-Y1889 VanDerWaalsContact CE1-CE2 3.49Å; F1878-Y1889 HydrophobicContact CE1-CG 4.48Å; F1878-Y1889 AromaticContact CE1-CZ 3.73Å; F1878-Y1889 WeakPolarHBondContact CE1-OH 3.29Å; F1878-Y1889 HydrophobicContact CG-CE2 4.25Å; F1878-Y1889 HydrophobicContact CZ-CD2 4.41Å; F1878-Y1889 AromaticContact CZ-CE2 3.82Å; F1878-Y1889 HydrophobicContact CZ-CE2 4Å; F1878-Y1889 WeakPolarHBondContact CZ-OH 3.21Å; F1878-F1893 AromaticContact CZ-CE2 3.96Å; F1878-F1893 HydrophobicContact CZ-CE2 4.12Å
1879S38.8Very low50.3Low72.4 Ų72.497.9 Ų97.951%0.50647%0.473SS..  trans-74.3136.4168.6-22.70000109.9R1876 F1877 E1881 E1882R1876-S1879 PolarHBondContact O-N 3.3Å; R1876-S1879 PolarHBondContact O-OG 3.3Å; F1877-S1879 VanDerWaalsContact C-N 3.3Å; F1877-S1879 PolarHBondContact O-N 3.09Å; F1877-S1879 VanDerWaalsContact O-N 3.14Å; S1879-E1881 PolarHBondContact O-N 2.99Å; S1879-E1882 PolarHBondContact O-N 3.11Å
1880K42.9Very low49.1Very low195 Ų195101.1 Ų101.185%0.84849%0.49SS*.THydrogen-bonded Turntrans-37.9-23.2-176.6-79.6-179.3173-179.10117.2F1878F1878-K1880 PolarHBondContact O-N 2.97Å
1881E41.8Very low47.6Very low172 Ų172104.6 Ų104.680%0.80451%0.509SS*.THydrogen-bonded Turntrans-85.5-23.7-170.5-67.9-179.7162.300114.4S1879 T1884S1879-E1881 PolarHBondContact O-N 2.99Å; E1881-T1884 PolarHBondContact O-OG1 3.2Å; E1881-T1884 VanDerWaalsContact O-OG1 3.08Å
1882E36.1Very low46Very low126.2 Ų126.2104.3 Ų104.359%0.5951%0.512SS*.G310 helixtrans-91.8-10.1-178.7-67.5-167.2156.200114.4S1879 T1884 K1885S1879-E1882 PolarHBondContact O-N 3.11Å; E1882-T1884 PolarHBondContact O-N 3.15Å; E1882-T1884 VanDerWaalsContact O-N 3.07Å; E1882-K1885 PolarHBondContact O-N 3.18Å; E1882-K1885 VanDerWaalsContact O-N 3.1Å
1883F36.7Very low45.1Very low62.4 Ų62.4103.6 Ų103.627%0.27451%0.508SS..G310 helixtrans-60.3-15.7177.8-87.5-80.2000114.1F1878 K1885 Y1889 L1956 A1959F1878-F1883 HydrophobicContact CB-CE2 4Å; F1878-F1883 HydrophobicContact CB-CZ 3.73Å; F1878-F1883 HydrophobicContact CD1-CE1 4.26Å; F1878-F1883 HydrophobicContact CD1-CE2 4.49Å; F1878-F1883 AromaticContact CD1-CZ 3.92Å; F1878-F1883 HydrophobicContact CD1-CZ 3.92Å; F1878-F1883 AromaticContact CG-CZ 3.96Å; F1878-F1883 HydrophobicContact CG-CZ 4.21Å; F1883-K1885 VanDerWaalsContact C-N 3.34Å; F1883-Y1889 WeakPolarHBondContact CA-OH 3.38Å; F1883-Y1889 HydrophobicContact CD1-CD2 4.39Å; F1883-Y1889 HydrophobicContact CD1-CE1 4.44Å; F1883-Y1889 HydrophobicContact CD1-CE2 4.18Å; F1883-Y1889 HydrophobicContact CE1-CD2 4.41Å; F1883-Y1889 HydrophobicContact CE1-CE1 4.33Å; F1883-Y1889 AromaticContact CE1-CE2 3.86Å; F1883-Y1889 HydrophobicContact CE1-CE2 3.86Å; F1883-Y1889 PolarHBondContact N-OH 2.91Å; F1883-L1956 HydrophobicContact CD1-CD2 4.08Å; F1883-L1956 HydrophobicContact CE1-CD2 3.97Å; F1883-L1956 HydrophobicContact CE1-CG 4.44Å; F1883-A1959 HydrophobicContact CD1-CB 3.91Å; F1883-A1959 HydrophobicContact CE1-CB 3.67Å; F1883-A1959 HydrophobicContact CE2-CB 4.06Å; F1883-A1959 HydrophobicContact CG-CB 4.4Å; F1883-A1959 HydrophobicContact CZ-CB 3.61Å
1884T41Very low44.2Very low97.2 Ų97.2106.8 Ų106.860%0.59652%0.524SS*.G310 helixtrans-83.3-13.7-179.857.10000114E1881 E1882 T1886E1881-T1884 PolarHBondContact O-OG1 3.2Å; E1881-T1884 VanDerWaalsContact O-OG1 3.08Å; E1882-T1884 PolarHBondContact O-N 3.15Å; E1882-T1884 VanDerWaalsContact O-N 3.07Å; T1884-T1886 PolarHBondContact O-N 3.14Å
1885K40.7Very low43.2Very low147.6 Ų147.6104.2 Ų104.264%0.64252%0.523SS*.  trans-108.862.5179.7-67.7-178.6-177.2173.70111.7E1882 F1883 T1887 N1888E1882-K1885 PolarHBondContact O-N 3.18Å; E1882-K1885 VanDerWaalsContact O-N 3.1Å; F1883-K1885 VanDerWaalsContact C-N 3.34Å; K1885-T1887 PolarHBondContact O-N 3.26Å; K1885-N1888 PolarHBondContact O-N 3.19Å; K1885-N1888 VanDerWaalsContact O-N 3.16Å
1886T42.2Very low42.6Very low71 Ų71103.9 Ų103.944%0.43652%0.521SS..Hα-helixtrans-66.5-10.3-179.147.70000113.8T1884 N1888 Y1889 L1890T1884-T1886 PolarHBondContact O-N 3.14Å; T1886-N1888 PolarHBondContact O-N 3.49Å; T1886-Y1889 VanDerWaalsContact O-CD2 3.32Å; T1886-Y1889 WeakPolarHBondContact O-CD2 3.49Å; T1886-Y1889 PolarHBondContact O-N 3.24Å; T1886-L1890 PolarHBondContact O-N 2.97Å
1887T41.6Very low42.7Very low96.8 Ų96.895.4 Ų95.459%0.59449%0.492SS*.Hα-helixtrans-65.3-35.2176.651.70000113.3K1885 Y1889 L1890 D1891K1885-T1887 PolarHBondContact O-N 3.26Å; T1887-Y1889 VanDerWaalsContact C-N 3.25Å; T1887-Y1889 PolarHBondContact O-N 3.34Å; T1887-L1890 PolarHBondContact O-N 3.23Å; T1887-D1891 PolarHBondContact O-N 3.05Å; T1887-D1891 VanDerWaalsContact O-N 3.1Å
1888N42.9Very low42.9Very low98.2 Ų98.292.1 Ų92.153%0.52549%0.488SS..Hα-helixtrans-75.4-16.5-177.3-78.711.7000113.2K1885 T1886 L1890 D1891 C1892K1885-N1888 PolarHBondContact O-N 3.19Å; K1885-N1888 VanDerWaalsContact O-N 3.16Å; T1886-N1888 PolarHBondContact O-N 3.49Å; N1888-L1890 VanDerWaalsContact C-N 3.26Å; N1888-L1890 PolarHBondContact O-N 2.9Å; N1888-D1891 HydrophobicContact CB-CB 4.18Å; N1888-D1891 VanDerWaalsContact CG-OD2 3.24Å; N1888-D1891 PolarHBondContact ND2-OD2 3.14Å; N1888-D1891 PolarHBondContact O-N 3.24Å; N1888-D1891 PolarHBondContact OD1-OD2 3.38Å; N1888-C1892 WeakPolarHBondContact O-CB 3.37Å; N1888-C1892 PolarHBondContact O-N 2.99Å; N1888-C1892 VanDerWaalsContact O-N 3.11Å; N1888-C1892 PolarHBondContact O-SG 3.3Å
1889Y40.7Very low43.3Very low47.6 Ų47.690.8 Ų90.819%0.18749%0.493CS..Hα-helixtrans-71-42.4179.9-146.1-81.4000111.7F1878 F1883 T1886 T1887 D1891 C1892 F1893 L1956 I2063F1878-Y1889 AromaticContact CD1-CD2 3.84Å; F1878-Y1889 HydrophobicContact CD1-CD2 3.84Å; F1878-Y1889 AromaticContact CD1-CE1 3.97Å; F1878-Y1889 HydrophobicContact CD1-CE1 3.97Å; F1878-Y1889 AromaticContact CD1-CE2 3.63Å; F1878-Y1889 HydrophobicContact CD1-CE2 3.63Å; F1878-Y1889 VanDerWaalsContact CD1-CE2 3.41Å; F1878-Y1889 HydrophobicContact CE1-CD1 4.32Å; F1878-Y1889 AromaticContact CE1-CD2 3.42Å; F1878-Y1889 HydrophobicContact CE1-CD2 3.42Å; F1878-Y1889 VanDerWaalsContact CE1-CD2 3.46Å; F1878-Y1889 AromaticContact CE1-CE1 3.65Å; F1878-Y1889 HydrophobicContact CE1-CE1 4.05Å; F1878-Y1889 AromaticContact CE1-CE2 3.41Å; F1878-Y1889 HydrophobicContact CE1-CE2 3.41Å; F1878-Y1889 VanDerWaalsContact CE1-CE2 3.49Å; F1878-Y1889 HydrophobicContact CE1-CG 4.48Å; F1878-Y1889 AromaticContact CE1-CZ 3.73Å; F1878-Y1889 WeakPolarHBondContact CE1-OH 3.29Å; F1878-Y1889 HydrophobicContact CG-CE2 4.25Å; F1878-Y1889 HydrophobicContact CZ-CD2 4.41Å; F1878-Y1889 AromaticContact CZ-CE2 3.82Å; F1878-Y1889 HydrophobicContact CZ-CE2 4Å; F1878-Y1889 WeakPolarHBondContact CZ-OH 3.21Å; F1883-Y1889 WeakPolarHBondContact CA-OH 3.38Å; F1883-Y1889 HydrophobicContact CD1-CD2 4.39Å; F1883-Y1889 HydrophobicContact CD1-CE1 4.44Å; F1883-Y1889 HydrophobicContact CD1-CE2 4.18Å; F1883-Y1889 HydrophobicContact CE1-CD2 4.41Å; F1883-Y1889 HydrophobicContact CE1-CE1 4.33Å; F1883-Y1889 AromaticContact CE1-CE2 3.86Å; F1883-Y1889 HydrophobicContact CE1-CE2 3.86Å; F1883-Y1889 PolarHBondContact N-OH 2.91Å; T1886-Y1889 VanDerWaalsContact O-CD2 3.32Å; T1886-Y1889 WeakPolarHBondContact O-CD2 3.49Å; T1886-Y1889 PolarHBondContact O-N 3.24Å; T1887-Y1889 VanDerWaalsContact C-N 3.25Å; T1887-Y1889 PolarHBondContact O-N 3.34Å; Y1889-D1891 VanDerWaalsContact C-N 3.33Å; Y1889-C1892 PolarHBondContact O-N 3.09Å; Y1889-F1893 AromaticContact CD1-CD2 3.92Å; Y1889-F1893 HydrophobicContact CD1-CD2 4.04Å; Y1889-F1893 HydrophobicContact CD1-CE2 4.38Å; Y1889-F1893 AromaticContact CE1-CD2 3.5Å; Y1889-F1893 HydrophobicContact CE1-CD2 3.72Å; Y1889-F1893 VanDerWaalsContact CE1-CD2 3.49Å; Y1889-F1893 AromaticContact CE1-CE2 3.67Å; Y1889-F1893 HydrophobicContact CE1-CE2 3.67Å; Y1889-F1893 VanDerWaalsContact CE1-CE2 3.41Å; Y1889-F1893 HydrophobicContact CE1-CG 4.41Å; Y1889-F1893 HydrophobicContact CE1-CZ 4.43Å; Y1889-F1893 HydrophobicContact CE2-CE2 4.33Å; Y1889-F1893 AromaticContact CZ-CD2 3.88Å; Y1889-F1893 AromaticContact CZ-CE2 3.48Å; Y1889-F1893 VanDerWaalsContact CZ-CE2 3.42Å; Y1889-F1893 WeakPolarHBondContact O-CB 3.33Å; Y1889-F1893 PolarHBondContact O-N 3.13Å; Y1889-F1893 VanDerWaalsContact O-N 3.12Å; Y1889-F1893 VanDerWaalsContact OH-CE2 3.29Å; Y1889-F1893 WeakPolarHBondContact OH-CE2 3.41Å; Y1889-L1956 HydrophobicContact CD1-CD2 4.4Å; Y1889-L1956 HydrophobicContact CE1-CD1 4.23Å; Y1889-L1956 HydrophobicContact CE1-CD2 4.22Å; Y1889-L1956 HydrophobicContact CE1-CG 4.48Å; Y1889-L1956 HydrophobicContact CE2-CD2 4.23Å; Y1889-I2063 HydrophobicContact CD1-CD1 3.98Å; Y1889-I2063 HydrophobicContact CE1-CD1 3.68Å
1890L46.4Very low44.1Very low79.8 Ų79.893 Ų9342%0.41849%0.494SS..Hα-helixtrans-66.2-39.2177.4-165.470.7000110.7T1886 T1887 N1888 F1893 N1894 H2061T1886-L1890 PolarHBondContact O-N 2.97Å; T1887-L1890 PolarHBondContact O-N 3.23Å; N1888-L1890 VanDerWaalsContact C-N 3.26Å; N1888-L1890 PolarHBondContact O-N 2.9Å; L1890-F1893 PolarHBondContact O-N 3.15Å; L1890-N1894 WeakPolarHBondContact CG-ND2 3.42Å; L1890-N1894 WeakPolarHBondContact O-CA 3.48Å; L1890-N1894 VanDerWaalsContact O-CB 3.23Å; L1890-N1894 WeakPolarHBondContact O-CB 3.39Å; L1890-N1894 PolarHBondContact O-N 3.26Å; L1890-N1894 PolarHBondContact O-ND2 3.05Å; L1890-N1894 PolarHBondContact O-OD1 3.25Å; L1890-H2061 HydrophobicContact CD1-CB 4.3Å
1891D44.7Very low45.1Very low98.6 Ų98.685 Ų8553%0.52746%0.461SS..Hα-helixtrans-68.3-40.7176.9-71.3-18.6000112.2T1887 N1888 Y1889 F1893 N1894 S1895T1887-D1891 PolarHBondContact O-N 3.05Å; T1887-D1891 VanDerWaalsContact O-N 3.1Å; N1888-D1891 HydrophobicContact CB-CB 4.18Å; N1888-D1891 VanDerWaalsContact CG-OD2 3.24Å; N1888-D1891 PolarHBondContact ND2-OD2 3.14Å; N1888-D1891 PolarHBondContact O-N 3.24Å; N1888-D1891 PolarHBondContact OD1-OD2 3.38Å; Y1889-D1891 VanDerWaalsContact C-N 3.33Å; D1891-F1893 VanDerWaalsContact C-N 3.33Å; D1891-F1893 PolarHBondContact O-N 3.1Å; D1891-N1894 PolarHBondContact O-N 3.31Å; D1891-S1895 WeakPolarHBondContact O-CA 3.36Å; D1891-S1895 WeakPolarHBondContact O-CB 3.22Å; D1891-S1895 PolarHBondContact O-N 3.15Å; D1891-S1895 VanDerWaalsContact O-N 3.16Å; D1891-S1895 PolarHBondContact O-OG 3.08Å
1892C42.3Very low46.6Very low78.2 Ų78.279.2 Ų79.253%0.52844%0.436SS..Hα-helixtrans-64-39.2174.4-96.70000112.5N1888 Y1889 S1895 L1896N1888-C1892 WeakPolarHBondContact O-CB 3.37Å; N1888-C1892 PolarHBondContact O-N 2.99Å; N1888-C1892 VanDerWaalsContact O-N 3.11Å; N1888-C1892 PolarHBondContact O-SG 3.3Å; Y1889-C1892 PolarHBondContact O-N 3.09Å; C1892-S1895 WeakPolarHBondContact CA-OG 3.2Å; C1892-S1895 WeakPolarHBondContact O-CB 3.07Å; C1892-S1895 PolarHBondContact O-OG 3.21Å; C1892-L1896 WeakPolarHBondContact O-CB 3.02Å; C1892-L1896 WeakPolarHBondContact O-CD1 3.48Å; C1892-L1896 PolarHBondContact O-N 3.09Å; C1892-L1896 VanDerWaalsContact O-N 3.09Å
1893F45.1Very low48.5Very low19.4 Ų19.473.4 Ų73.49%0.08541%0.41CS..Hα-helixtrans-77.4-36.2177.4-107.1-90000113.2L1872 F1878 Y1889 L1890 D1891 S1895 L1896 I1897 I1952 I2063L1872-F1893 HydrophobicContact CD1-CD1 4.29Å; L1872-F1893 HydrophobicContact CD1-CE1 3.83Å; L1872-F1893 HydrophobicContact CD1-CE2 4.14Å; L1872-F1893 HydrophobicContact CD1-CZ 3.76Å; F1878-F1893 AromaticContact CZ-CE2 3.96Å; F1878-F1893 HydrophobicContact CZ-CE2 4.12Å; Y1889-F1893 AromaticContact CD1-CD2 3.92Å; Y1889-F1893 HydrophobicContact CD1-CD2 4.04Å; Y1889-F1893 HydrophobicContact CD1-CE2 4.38Å; Y1889-F1893 AromaticContact CE1-CD2 3.5Å; Y1889-F1893 HydrophobicContact CE1-CD2 3.72Å; Y1889-F1893 VanDerWaalsContact CE1-CD2 3.49Å; Y1889-F1893 AromaticContact CE1-CE2 3.67Å; Y1889-F1893 HydrophobicContact CE1-CE2 3.67Å; Y1889-F1893 VanDerWaalsContact CE1-CE2 3.41Å; Y1889-F1893 HydrophobicContact CE1-CG 4.41Å; Y1889-F1893 HydrophobicContact CE1-CZ 4.43Å; Y1889-F1893 HydrophobicContact CE2-CE2 4.33Å; Y1889-F1893 AromaticContact CZ-CD2 3.88Å; Y1889-F1893 AromaticContact CZ-CE2 3.48Å; Y1889-F1893 VanDerWaalsContact CZ-CE2 3.42Å; Y1889-F1893 WeakPolarHBondContact O-CB 3.33Å; Y1889-F1893 PolarHBondContact O-N 3.13Å; Y1889-F1893 VanDerWaalsContact O-N 3.12Å; Y1889-F1893 VanDerWaalsContact OH-CE2 3.29Å; Y1889-F1893 WeakPolarHBondContact OH-CE2 3.41Å; L1890-F1893 PolarHBondContact O-N 3.15Å; D1891-F1893 VanDerWaalsContact C-N 3.33Å; D1891-F1893 PolarHBondContact O-N 3.1Å; F1893-S1895 VanDerWaalsContact C-N 3.32Å; F1893-S1895 PolarHBondContact O-N 3.14Å; F1893-L1896 HydrophobicContact CD1-CD1 4.42Å; F1893-L1896 WeakPolarHBondContact O-CA 3.35Å; F1893-L1896 VanDerWaalsContact O-CB 3.23Å; F1893-L1896 WeakPolarHBondContact O-CB 3.43Å; F1893-L1896 PolarHBondContact O-N 2.93Å; F1893-I1897 HydrophobicContact CD1-CD1 3.55Å; F1893-I1897 HydrophobicContact CE1-CD1 3.71Å; F1893-I1897 HydrophobicContact CG-CD1 4.29Å; F1893-I1897 HydrophobicContact CZ-CD1 4.22Å; F1893-I1897 WeakPolarHBondContact O-CB 3.42Å; F1893-I1897 WeakPolarHBondContact O-CD1 3.34Å; F1893-I1897 WeakPolarHBondContact O-CG1 3.44Å; F1893-I1897 PolarHBondContact O-N 3.19Å; F1893-I1897 VanDerWaalsContact O-N 3.1Å; F1893-I1952 HydrophobicContact CE1-CD1 4.5Å; F1893-I1952 HydrophobicContact CE2-CG2 4.35Å; F1893-I1952 HydrophobicContact CZ-CD1 4.27Å; F1893-I1952 HydrophobicContact CZ-CG2 4.2Å; F1893-I2063 HydrophobicContact CD1-CD1 4.28Å; F1893-I2063 HydrophobicContact CD1-CG2 3.84Å; F1893-I2063 VanDerWaalsContact CD1-CG2 3.45Å; F1893-I2063 HydrophobicContact CD2-CD1 4.28Å; F1893-I2063 HydrophobicContact CE1-CD1 4.3Å; F1893-I2063 HydrophobicContact CE1-CG2 3.97Å; F1893-I2063 HydrophobicContact CE2-CD1 4.36Å; F1893-I2063 HydrophobicContact CG-CD1 4.06Å; F1893-I2063 HydrophobicContact CG-CG2 4.24Å; F1893-I2063 HydrophobicContact CZ-CD1 4.29Å; F1893-I2063 HydrophobicContact CZ-CG2 4.43Å
1894N48Very low50.7Low89.8 Ų89.870.8 Ų70.848%0.4840%0.399SS..Hα-helixtrans-69-27.1174.9-73.6-14.3000111.8L1890 D1891 L1896 I1897 P1898L1890-N1894 WeakPolarHBondContact CG-ND2 3.42Å; L1890-N1894 WeakPolarHBondContact O-CA 3.48Å; L1890-N1894 VanDerWaalsContact O-CB 3.23Å; L1890-N1894 WeakPolarHBondContact O-CB 3.39Å; L1890-N1894 PolarHBondContact O-N 3.26Å; L1890-N1894 PolarHBondContact O-ND2 3.05Å; L1890-N1894 PolarHBondContact O-OD1 3.25Å; D1891-N1894 PolarHBondContact O-N 3.31Å; N1894-L1896 PolarHBondContact O-N 3.3Å; N1894-I1897 CarbonylContact O-C 3.48Å; N1894-I1897 WeakPolarHBondContact O-CA 3.44Å; N1894-I1897 WeakPolarHBondContact O-CG1 3.15Å; N1894-I1897 PolarHBondContact O-N 3.12Å; N1894-I1897 VanDerWaalsContact O-N 3.16Å; N1894-P1898 VanDerWaalsContact O-CD 3.24Å; N1894-P1898 WeakPolarHBondContact O-CD 3.35Å; N1894-P1898 WeakPolarHBondContact O-CG 3.46Å
1895S46.8Very low52.6Low81.4 Ų81.469.2 Ų69.257%0.56939%0.385SS*.Hα-helixtrans-74.8-22.8172.858.40000113.7D1891 C1892 F1893 I1897 P1898D1891-S1895 WeakPolarHBondContact O-CA 3.36Å; D1891-S1895 WeakPolarHBondContact O-CB 3.22Å; D1891-S1895 PolarHBondContact O-N 3.15Å; D1891-S1895 VanDerWaalsContact O-N 3.16Å; D1891-S1895 PolarHBondContact O-OG 3.08Å; C1892-S1895 WeakPolarHBondContact CA-OG 3.2Å; C1892-S1895 WeakPolarHBondContact O-CB 3.07Å; C1892-S1895 PolarHBondContact O-OG 3.21Å; F1893-S1895 VanDerWaalsContact C-N 3.32Å; F1893-S1895 PolarHBondContact O-N 3.14Å; S1895-I1897 VanDerWaalsContact O-CG1 3.27Å; S1895-I1897 WeakPolarHBondContact O-CG1 3.33Å; S1895-I1897 PolarHBondContact O-N 3.04Å; S1895-P1898 WeakPolarHBondContact O-CD 3.45Å
1896L44Very low54.7Low81.4 Ų81.463.1 Ų63.143%0.42636%0.359SS..Hα-helixtrans-81.59.1172.9-97.891.3000113.4L1872 C1892 F1893 N1894 N1901L1872-L1896 HydrophobicContact CD1-CD1 3.73Å; L1872-L1896 HydrophobicContact CD1-CD2 4.02Å; L1872-L1896 HydrophobicContact CD1-CG 4.43Å; L1872-L1896 HydrophobicContact CD2-CD1 4.35Å; L1872-L1896 HydrophobicContact CD2-CD2 4.24Å; C1892-L1896 WeakPolarHBondContact O-CB 3.02Å; C1892-L1896 WeakPolarHBondContact O-CD1 3.48Å; C1892-L1896 PolarHBondContact O-N 3.09Å; C1892-L1896 VanDerWaalsContact O-N 3.09Å; F1893-L1896 HydrophobicContact CD1-CD1 4.42Å; F1893-L1896 WeakPolarHBondContact O-CA 3.35Å; F1893-L1896 VanDerWaalsContact O-CB 3.23Å; F1893-L1896 WeakPolarHBondContact O-CB 3.43Å; F1893-L1896 PolarHBondContact O-N 2.93Å; N1894-L1896 PolarHBondContact O-N 3.3Å; L1896-N1901 PolarHBondContact O-ND2 3.12Å
1897I48.9Very low56.8Low51.2 Ų51.259.7 Ų59.726%0.26334%0.338SS..  trans-90.351.3-179.5-52.2178000114.7M1869 F1893 N1894 S1895 G1899 K1900 N1901M1869-I1897 HydrophobicContact CG-CD1 4.5Å; F1893-I1897 HydrophobicContact CD1-CD1 3.55Å; F1893-I1897 HydrophobicContact CE1-CD1 3.71Å; F1893-I1897 HydrophobicContact CG-CD1 4.29Å; F1893-I1897 HydrophobicContact CZ-CD1 4.22Å; F1893-I1897 WeakPolarHBondContact O-CB 3.42Å; F1893-I1897 WeakPolarHBondContact O-CD1 3.34Å; F1893-I1897 WeakPolarHBondContact O-CG1 3.44Å; F1893-I1897 PolarHBondContact O-N 3.19Å; F1893-I1897 VanDerWaalsContact O-N 3.1Å; N1894-I1897 CarbonylContact O-C 3.48Å; N1894-I1897 WeakPolarHBondContact O-CA 3.44Å; N1894-I1897 WeakPolarHBondContact O-CG1 3.15Å; N1894-I1897 PolarHBondContact O-N 3.12Å; N1894-I1897 VanDerWaalsContact O-N 3.16Å; S1895-I1897 VanDerWaalsContact O-CG1 3.27Å; S1895-I1897 WeakPolarHBondContact O-CG1 3.33Å; S1895-I1897 PolarHBondContact O-N 3.04Å; I1897-G1899 PolarHBondContact O-N 3.09Å; I1897-G1899 VanDerWaalsContact O-N 3.09Å; I1897-K1900 HydrophobicContact CD1-CD 4.18Å; I1897-K1900 HydrophobicContact CG2-CB 4.23Å; I1897-K1900 HydrophobicContact CG2-CG 4.14Å; I1897-K1900 PolarHBondContact O-N 3.07Å; I1897-N1901 WeakPolarHBondContact CB-ND2 3.27Å; I1897-N1901 HydrophobicContact CG2-CB 3.89Å; I1897-N1901 WeakPolarHBondContact CG2-ND2 3.44Å; I1897-N1901 VanDerWaalsContact CG2-OD1 3.28Å; I1897-N1901 WeakPolarHBondContact CG2-OD1 3.36Å; I1897-N1901 PolarHBondContact O-ND2 3.47Å
1898P47.4Very low58.9Low98.6 Ų98.655.1 Ų55.164%0.6431%0.31SS*.THydrogen-bonded Turntrans-68.782.1-175.118.1-17.4000112.8N1894 S1895 K1900 N1901 V1902N1894-P1898 VanDerWaalsContact O-CD 3.24Å; N1894-P1898 WeakPolarHBondContact O-CD 3.35Å; N1894-P1898 WeakPolarHBondContact O-CG 3.46Å; S1895-P1898 WeakPolarHBondContact O-CD 3.45Å; P1898-K1900 VanDerWaalsContact C-N 3.33Å; P1898-K1900 PolarHBondContact O-N 3.19Å; P1898-N1901 PolarHBondContact O-N 3.47Å; P1898-V1902 VanDerWaalsContact O-CG2 3.24Å; P1898-V1902 WeakPolarHBondContact O-CG2 3.17Å; P1898-V1902 PolarHBondContact O-N 3.42Å
1899G50.7Low61Low41 Ų4153.2 Ų53.242%0.42330%0.298SS..THydrogen-bonded Turntrans106.9-55.7-179.400000113.5I1897 N1901 V1902I1897-G1899 PolarHBondContact O-N 3.09Å; I1897-G1899 VanDerWaalsContact O-N 3.09Å; G1899-N1901 VanDerWaalsContact C-N 3.26Å; G1899-N1901 PolarHBondContact O-N 3.01Å; G1899-N1901 VanDerWaalsContact O-N 3.1Å; G1899-V1902 WeakPolarHBondContact O-CB 3.3Å; G1899-V1902 PolarHBondContact O-N 3.07Å
1900K55.4Low63.3Low119.2 Ų119.251 Ų5152%0.51829%0.289SS..Hα-helixtrans-72.2-28.6-174.9-68-175.8-180178.90114.1E1816 Q1868 I1897 P1898 V1902 S1903 V1904E1816-K1900 WeakPolarHBondContact OE1-CA 3.3Å; Q1868-K1900 VanDerWaalsContact NE2-NZ 3.2Å; I1897-K1900 HydrophobicContact CD1-CD 4.18Å; I1897-K1900 HydrophobicContact CG2-CB 4.23Å; I1897-K1900 HydrophobicContact CG2-CG 4.14Å; I1897-K1900 PolarHBondContact O-N 3.07Å; P1898-K1900 VanDerWaalsContact C-N 3.33Å; P1898-K1900 PolarHBondContact O-N 3.19Å; K1900-V1902 VanDerWaalsContact C-N 3.31Å; K1900-V1902 PolarHBondContact O-N 3.18Å; K1900-S1903 WeakPolarHBondContact O-CB 3.32Å; K1900-S1903 PolarHBondContact O-N 3.34Å; K1900-S1903 PolarHBondContact O-OG 3.04Å; K1900-V1904 WeakPolarHBondContact O-CG2 3.38Å; K1900-V1904 PolarHBondContact O-N 3.1Å; K1900-V1904 VanDerWaalsContact O-N 3.09Å
1901N64.6Low65.3Low28.4 Ų28.447.2 Ų47.215%0.15227%0.27CS..Hα-helixtrans-67.4-33.2177.3-80.5-10.4000112.8L1896 I1897 P1898 G1899 S1903 V1904 Q1905 Q2064 I2067L1896-N1901 PolarHBondContact O-ND2 3.12Å; I1897-N1901 WeakPolarHBondContact CB-ND2 3.27Å; I1897-N1901 HydrophobicContact CG2-CB 3.89Å; I1897-N1901 WeakPolarHBondContact CG2-ND2 3.44Å; I1897-N1901 VanDerWaalsContact CG2-OD1 3.28Å; I1897-N1901 WeakPolarHBondContact CG2-OD1 3.36Å; I1897-N1901 PolarHBondContact O-ND2 3.47Å; P1898-N1901 PolarHBondContact O-N 3.47Å; G1899-N1901 VanDerWaalsContact C-N 3.26Å; G1899-N1901 PolarHBondContact O-N 3.01Å; G1899-N1901 VanDerWaalsContact O-N 3.1Å; N1901-S1903 VanDerWaalsContact C-N 3.29Å; N1901-S1903 PolarHBondContact O-N 3.12Å; N1901-V1904 PolarHBondContact O-N 3.2Å; N1901-V1904 VanDerWaalsContact O-N 3.16Å; N1901-Q1905 VanDerWaalsContact O-CB 3.23Å; N1901-Q1905 WeakPolarHBondContact O-CB 3.34Å; N1901-Q1905 PolarHBondContact O-N 3.23Å; N1901-Q2064 PolarHBondContact ND2-NE2 2.93Å; N1901-Q2064 PolarHBondContact ND2-OE1 3.34Å; N1901-Q2064 VanDerWaalsContact ND2-OE1 3.12Å; N1901-Q2064 PolarHBondContact OD1-NE2 3.08Å; N1901-I2067 HydrophobicContact CB-CD1 4.41Å; N1901-I2067 VanDerWaalsContact ND2-CD1 3.25Å; N1901-I2067 WeakPolarHBondContact ND2-CD1 3.46Å
1902V72.9Confident67.3Low48.4 Ų48.444.6 Ų44.629%0.29325%0.254SS..Hα-helixtrans-60.6-41.9176.2175.20000110V1820 P1898 G1899 K1900 V1904 Q1905 I1906 F2040 L2041V1820-V1902 HydrophobicContact CG1-CG1 4.13Å; V1820-V1902 HydrophobicContact CG2-CG1 4.22Å; P1898-V1902 VanDerWaalsContact O-CG2 3.24Å; P1898-V1902 WeakPolarHBondContact O-CG2 3.17Å; P1898-V1902 PolarHBondContact O-N 3.42Å; G1899-V1902 WeakPolarHBondContact O-CB 3.3Å; G1899-V1902 PolarHBondContact O-N 3.07Å; K1900-V1902 VanDerWaalsContact C-N 3.31Å; K1900-V1902 PolarHBondContact O-N 3.18Å; V1902-V1904 PolarHBondContact O-N 3.28Å; V1902-Q1905 PolarHBondContact O-N 3.16Å; V1902-I1906 HydrophobicContact CG1-CD1 3.59Å; V1902-I1906 VanDerWaalsContact CG1-CD1 3.46Å; V1902-I1906 HydrophobicContact CG1-CG1 4.32Å; V1902-I1906 VanDerWaalsContact O-CB 3.29Å; V1902-I1906 WeakPolarHBondContact O-CB 3.39Å; V1902-I1906 VanDerWaalsContact O-CG1 3.27Å; V1902-I1906 WeakPolarHBondContact O-CG1 3.35Å; V1902-I1906 VanDerWaalsContact O-CG2 3.28Å; V1902-I1906 WeakPolarHBondContact O-CG2 3.28Å; V1902-I1906 PolarHBondContact O-N 3.07Å; V1902-F2040 HydrophobicContact CB-CE1 4.44Å; V1902-F2040 HydrophobicContact CG1-CD1 4.36Å; V1902-F2040 HydrophobicContact CG1-CE1 3.38Å; V1902-F2040 HydrophobicContact CG1-CZ 3.91Å; V1902-F2040 HydrophobicContact CG2-CE1 4.2Å; V1902-F2040 HydrophobicContact CG2-CZ 4.25Å; V1902-L2041 HydrophobicContact CG1-CD1 4.45Å
1903S76.5Confident69.4Low5.6 Ų5.641.7 Ų41.74%0.03923%0.234CC..Hα-helixtrans-63.1-4217777.50000112.6E1816 R1861 K1900 N1901 I1906 S1907E1816-S1903 WeakPolarHBondContact OE1-CB 3.42Å; E1816-S1903 PolarHBondContact OE1-OG 2.67Å; R1861-S1903 PolarHBondContact NH1-OG 3.35Å; K1900-S1903 WeakPolarHBondContact O-CB 3.32Å; K1900-S1903 PolarHBondContact O-N 3.34Å; K1900-S1903 PolarHBondContact O-OG 3.04Å; N1901-S1903 VanDerWaalsContact C-N 3.29Å; N1901-S1903 PolarHBondContact O-N 3.12Å; S1903-I1906 WeakPolarHBondContact O-CG2 3.35Å; S1903-I1906 PolarHBondContact O-N 3.2Å; S1903-S1907 VanDerWaalsContact O-CB 3.29Å; S1903-S1907 WeakPolarHBondContact O-CB 3.3Å; S1903-S1907 PolarHBondContact O-N 3.28Å; S1903-S1907 PolarHBondContact O-OG 3.23Å; S1903-S1907 VanDerWaalsContact O-OG 3.09Å
1904V81.5Confident71.3Confident6.8 Ų6.840.9 Ų40.94%0.04123%0.23CC..Hα-helixtrans-66.7-46.4177.8175.60000111F1862 A1865 K1900 N1901 V1902 I1906 S1907 L1908 L1945F1862-V1904 HydrophobicContact CD1-CG1 4.1Å; F1862-V1904 HydrophobicContact CE1-CG1 4.19Å; A1865-V1904 HydrophobicContact CB-CG1 4.47Å; A1865-V1904 HydrophobicContact CB-CG2 3.8Å; K1900-V1904 WeakPolarHBondContact O-CG2 3.38Å; K1900-V1904 PolarHBondContact O-N 3.1Å; K1900-V1904 VanDerWaalsContact O-N 3.09Å; N1901-V1904 PolarHBondContact O-N 3.2Å; N1901-V1904 VanDerWaalsContact O-N 3.16Å; V1902-V1904 PolarHBondContact O-N 3.28Å; V1904-I1906 VanDerWaalsContact C-N 3.33Å; V1904-I1906 PolarHBondContact O-N 3.22Å; V1904-S1907 WeakPolarHBondContact O-CB 3.48Å; V1904-S1907 PolarHBondContact O-N 3.15Å; V1904-L1908 HydrophobicContact CG1-CD1 4.11Å; V1904-L1908 HydrophobicContact CG1-CG 4.47Å; V1904-L1908 WeakPolarHBondContact O-CB 3.35Å; V1904-L1908 VanDerWaalsContact O-CG 3.29Å; V1904-L1908 WeakPolarHBondContact O-CG 3.42Å; V1904-L1908 PolarHBondContact O-N 3Å; V1904-L1945 HydrophobicContact CG1-CD1 4.43Å; V1904-L1945 HydrophobicContact CG1-CD2 4.32Å
1905Q82.3Confident72.9Confident63.4 Ų63.436.6 Ų36.630%0.29621%0.207SC..Hα-helixtrans-62.3-43.9179.5-176.1178.1-5.300111.4N1901 V1902 L1908 Q1909 F2035 L2070N1901-Q1905 VanDerWaalsContact O-CB 3.23Å; N1901-Q1905 WeakPolarHBondContact O-CB 3.34Å; N1901-Q1905 PolarHBondContact O-N 3.23Å; V1902-Q1905 PolarHBondContact O-N 3.16Å; Q1905-L1908 PolarHBondContact O-N 3.12Å; Q1905-Q1909 WeakPolarHBondContact O-CB 3.37Å; Q1905-Q1909 PolarHBondContact O-N 3.25Å; Q1905-F2035 VanDerWaalsContact NE2-CE1 3.33Å; Q1905-L2070 HydrophobicContact CB-CD2 4.46Å; Q1905-L2070 HydrophobicContact CG-CD2 3.8Å; Q1905-L2070 VanDerWaalsContact O-CD2 3.26Å; Q1905-L2070 WeakPolarHBondContact O-CD2 3.32Å
1906I84.2Confident74.5Confident19.8 Ų19.835.2 Ų35.210%0.10219%0.192CC..Hα-helixtrans-69.4-39.1178.6-84.4174.6000111.1V1820 N1823 E1824 I1827 V1902 S1903 V1904 L1908 Q1909 F1910 F2040V1820-I1906 HydrophobicContact CB-CD1 4.39Å; V1820-I1906 HydrophobicContact CG1-CD1 3.65Å; V1820-I1906 HydrophobicContact CG2-CD1 4.29Å; V1820-I1906 WeakPolarHBondContact O-CD1 3.36Å; N1823-I1906 HydrophobicContact CB-CB 4.41Å; N1823-I1906 HydrophobicContact CB-CD1 4.25Å; N1823-I1906 HydrophobicContact CB-CG1 3.91Å; N1823-I1906 HydrophobicContact CB-CG2 3.37Å; E1824-I1906 HydrophobicContact CB-CD1 3.95Å; I1827-I1906 HydrophobicContact CD1-CD1 4.32Å; I1827-I1906 HydrophobicContact CD1-CG1 3.46Å; I1827-I1906 VanDerWaalsContact CD1-CG1 3.46Å; I1827-I1906 HydrophobicContact CD1-CG2 4Å; V1902-I1906 HydrophobicContact CG1-CD1 3.59Å; V1902-I1906 VanDerWaalsContact CG1-CD1 3.46Å; V1902-I1906 HydrophobicContact CG1-CG1 4.32Å; V1902-I1906 VanDerWaalsContact O-CB 3.29Å; V1902-I1906 WeakPolarHBondContact O-CB 3.39Å; V1902-I1906 VanDerWaalsContact O-CG1 3.27Å; V1902-I1906 WeakPolarHBondContact O-CG1 3.35Å; V1902-I1906 VanDerWaalsContact O-CG2 3.28Å; V1902-I1906 WeakPolarHBondContact O-CG2 3.28Å; V1902-I1906 PolarHBondContact O-N 3.07Å; S1903-I1906 WeakPolarHBondContact O-CG2 3.35Å; S1903-I1906 PolarHBondContact O-N 3.2Å; V1904-I1906 VanDerWaalsContact C-N 3.33Å; V1904-I1906 PolarHBondContact O-N 3.22Å; I1906-L1908 PolarHBondContact O-N 3.08Å; I1906-Q1909 PolarHBondContact O-N 3.05Å; I1906-F1910 WeakPolarHBondContact O-CB 3.37Å; I1906-F1910 PolarHBondContact O-N 3.1Å; I1906-F2040 HydrophobicContact CD1-CE1 3.7Å; I1906-F2040 HydrophobicContact CD1-CZ 4.03Å
1907S85.6Confident75.9Confident0 Ų037.5 Ų37.50%019%0.194CC..Hα-helixtrans-60.9-44.6173.4-66.50000112F1819 S1903 V1904 Q1909 F1910 L1911F1819-S1907 WeakPolarHBondContact CE1-OG 3.23Å; F1819-S1907 VanDerWaalsContact CZ-OG 3.31Å; F1819-S1907 WeakPolarHBondContact CZ-OG 3.42Å; S1903-S1907 VanDerWaalsContact O-CB 3.29Å; S1903-S1907 WeakPolarHBondContact O-CB 3.3Å; S1903-S1907 PolarHBondContact O-N 3.28Å; S1903-S1907 PolarHBondContact O-OG 3.23Å; S1903-S1907 VanDerWaalsContact O-OG 3.09Å; V1904-S1907 WeakPolarHBondContact O-CB 3.48Å; V1904-S1907 PolarHBondContact O-N 3.15Å; S1907-Q1909 VanDerWaalsContact C-N 3.34Å; S1907-Q1909 PolarHBondContact O-N 3.39Å; S1907-F1910 PolarHBondContact O-N 3Å; S1907-L1911 WeakPolarHBondContact O-CG 3.41Å; S1907-L1911 PolarHBondContact O-N 3.17Å
1908L86.6Confident77Confident0.6 Ų0.637.4 Ų37.40%0.00320%0.198CC..Hα-helixtrans-62.6-43.2174.7-74.2171000111.6F1862 V1904 Q1905 I1906 F1910 L1911 K1912 I1942 I2067 L2070 I2071 C2074F1862-L1908 HydrophobicContact CE1-CD2 3.89Å; F1862-L1908 HydrophobicContact CE1-CG 3.84Å; F1862-L1908 HydrophobicContact CZ-CD2 4.07Å; F1862-L1908 HydrophobicContact CZ-CG 4.32Å; V1904-L1908 HydrophobicContact CG1-CD1 4.11Å; V1904-L1908 HydrophobicContact CG1-CG 4.47Å; V1904-L1908 WeakPolarHBondContact O-CB 3.35Å; V1904-L1908 VanDerWaalsContact O-CG 3.29Å; V1904-L1908 WeakPolarHBondContact O-CG 3.42Å; V1904-L1908 PolarHBondContact O-N 3Å; Q1905-L1908 PolarHBondContact O-N 3.12Å; I1906-L1908 PolarHBondContact O-N 3.08Å; L1908-F1910 VanDerWaalsContact C-N 3.33Å; L1908-F1910 PolarHBondContact O-N 3.26Å; L1908-L1911 PolarHBondContact O-N 3.2Å; L1908-K1912 WeakPolarHBondContact O-CB 3.44Å; L1908-K1912 PolarHBondContact O-N 3.02Å; L1908-I1942 HydrophobicContact CD2-CD1 3.86Å; L1908-I1942 HydrophobicContact CD2-CG1 3.95Å; L1908-I1942 HydrophobicContact CD2-CG2 4.33Å; L1908-I2067 HydrophobicContact CD1-CG2 4.35Å; L1908-L2070 HydrophobicContact CB-CD2 3.58Å; L1908-L2070 HydrophobicContact CB-CG 3.88Å; L1908-L2070 HydrophobicContact CD1-CD2 4.24Å; L1908-L2070 HydrophobicContact CD1-CG 4.41Å; L1908-I2071 HydrophobicContact CD1-CD1 4.37Å; L1908-I2071 HydrophobicContact CD1-CG1 3.63Å; L1908-I2071 HydrophobicContact CD2-CG1 4.35Å; L1908-C2074 PolarHBondContact O-SG 3.36Å; L1908-C2074 VanDerWaalsContact O-SG 3.36Å
1909Q86.4Confident78.5Confident58.8 Ų58.833.4 Ų33.428%0.27517%0.172SC..Hα-helixtrans-64.1-39177.6-17669.72.900111.7I1827 Q1905 I1906 S1907 K1912 T1913 L2070I1827-Q1909 HydrophobicContact CD1-CB 3.92Å; I1827-Q1909 HydrophobicContact CD1-CG 3.74Å; I1827-Q1909 HydrophobicContact CG1-CG 4.22Å; I1827-Q1909 HydrophobicContact CG2-CG 4.33Å; Q1905-Q1909 WeakPolarHBondContact O-CB 3.37Å; Q1905-Q1909 PolarHBondContact O-N 3.25Å; I1906-Q1909 PolarHBondContact O-N 3.05Å; S1907-Q1909 VanDerWaalsContact C-N 3.34Å; S1907-Q1909 PolarHBondContact O-N 3.39Å; Q1909-K1912 WeakPolarHBondContact O-CB 3.28Å; Q1909-K1912 PolarHBondContact O-N 3.07Å; Q1909-T1913 WeakPolarHBondContact O-CG2 3.3Å; Q1909-T1913 PolarHBondContact O-N 3.12Å; Q1909-T1913 PolarHBondContact O-OG1 2.95Å; Q1909-T1913 VanDerWaalsContact O-OG1 3.13Å; Q1909-L2070 HydrophobicContact CB-CD1 4.48Å; Q1909-L2070 HydrophobicContact CB-CD2 4.42Å; Q1909-L2070 VanDerWaalsContact OE1-CD1 3.25Å
1910F88.6Confident80Confident0 Ų035.3 Ų35.30%017%0.172CC..Hα-helixtrans-62.4-50.2173.7172.1-132.7000111.4I1809 N1823 A1826 I1827 L1830 F1841 F1854 M1858 I1906 S1907 L1908 K1912 T1913 L1914I1809-F1910 HydrophobicContact CD1-CD1 4.44Å; I1809-F1910 HydrophobicContact CD1-CE1 4.1Å; N1823-F1910 VanDerWaalsContact OD1-CD1 3.25Å; N1823-F1910 WeakPolarHBondContact OD1-CD1 3.39Å; A1826-F1910 HydrophobicContact CB-CD2 3.59Å; A1826-F1910 HydrophobicContact CB-CE2 3.43Å; A1826-F1910 VanDerWaalsContact CB-CE2 3.46Å; A1826-F1910 HydrophobicContact CB-CG 4.35Å; A1826-F1910 HydrophobicContact CB-CZ 4.1Å; I1827-F1910 HydrophobicContact CD1-CB 4.29Å; I1827-F1910 HydrophobicContact CG1-CB 4.01Å; L1830-F1910 HydrophobicContact CD1-CD2 3.89Å; L1830-F1910 HydrophobicContact CD1-CE2 3.65Å; F1841-F1910 HydrophobicContact CD1-CZ 4.38Å; F1841-F1910 HydrophobicContact CE1-CE2 4.36Å; F1841-F1910 AromaticContact CE1-CZ 3.93Å; F1841-F1910 HydrophobicContact CE1-CZ 4.03Å; F1841-F1910 HydrophobicContact CE2-CE2 4.42Å; F1841-F1910 HydrophobicContact CZ-CE2 4.21Å; F1841-F1910 HydrophobicContact CZ-CZ 4.34Å; F1854-F1910 AromaticContact CE2-CE1 3.99Å; F1854-F1910 HydrophobicContact CE2-CE1 4.06Å; F1854-F1910 AromaticContact CZ-CE1 3.87Å; F1854-F1910 HydrophobicContact CZ-CE1 3.87Å; M1858-F1910 HydrophobicContact CE-CD1 4.41Å; I1906-F1910 WeakPolarHBondContact O-CB 3.37Å; I1906-F1910 PolarHBondContact O-N 3.1Å; S1907-F1910 PolarHBondContact O-N 3Å; L1908-F1910 VanDerWaalsContact C-N 3.33Å; L1908-F1910 PolarHBondContact O-N 3.26Å; F1910-K1912 VanDerWaalsContact C-N 3.31Å; F1910-K1912 PolarHBondContact O-N 3.22Å; F1910-T1913 WeakPolarHBondContact CA-OG1 3.37Å; F1910-T1913 PolarHBondContact O-N 2.95Å; F1910-T1913 VanDerWaalsContact O-N 3.09Å; F1910-T1913 PolarHBondContact O-OG1 3.13Å; F1910-L1914 HydrophobicContact CD1-CD1 4.25Å; F1910-L1914 HydrophobicContact CD2-CD1 4.17Å; F1910-L1914 HydrophobicContact CD2-CG 4.09Å; F1910-L1914 HydrophobicContact CE1-CD1 3.79Å; F1910-L1914 HydrophobicContact CE2-CD1 3.74Å; F1910-L1914 HydrophobicContact CE2-CD2 3.96Å; F1910-L1914 HydrophobicContact CE2-CG 3.66Å; F1910-L1914 HydrophobicContact CG-CD1 4.44Å; F1910-L1914 HydrophobicContact CZ-CD1 3.57Å; F1910-L1914 VanDerWaalsContact CZ-CD1 3.49Å; F1910-L1914 HydrophobicContact CZ-CD2 4.24Å; F1910-L1914 HydrophobicContact CZ-CG 3.99Å; F1910-L1914 WeakPolarHBondContact O-CB 3.32Å; F1910-L1914 WeakPolarHBondContact O-CG 3.36Å; F1910-L1914 PolarHBondContact O-N 3.07Å
1911L87.7Confident81.4Confident0.2 Ų0.236 Ų360%0.00117%0.171CC..Hα-helixtrans-60.6-39.5177.1-68.2-178000112.6M1858 F1862 S1907 L1908 L1914 C1915 L1926 L1938 I1942 F2078M1858-L1911 HydrophobicContact CE-CD1 3.87Å; M1858-L1911 HydrophobicContact CE-CD2 3.94Å; M1858-L1911 HydrophobicContact CE-CG 3.72Å; F1862-L1911 HydrophobicContact CE2-CD1 3.66Å; F1862-L1911 HydrophobicContact CZ-CD1 3.75Å; S1907-L1911 WeakPolarHBondContact O-CG 3.41Å; S1907-L1911 PolarHBondContact O-N 3.17Å; L1908-L1911 PolarHBondContact O-N 3.2Å; L1911-L1914 HydrophobicContact CD2-CD1 4.15Å; L1911-L1914 HydrophobicContact CD2-CD2 4.46Å; L1911-L1914 PolarHBondContact O-N 3.21Å; L1911-C1915 PolarHBondContact O-N 3.23Å; L1911-L1926 HydrophobicContact CB-CD1 4.49Å; L1911-L1926 HydrophobicContact CD2-CD1 4.27Å; L1911-L1926 HydrophobicContact CD2-CD2 3.7Å; L1911-L1938 HydrophobicContact CD1-CD1 4.36Å; L1911-L1938 HydrophobicContact CD2-CD1 4.46Å; L1911-I1942 HydrophobicContact CD1-CD1 4.12Å; L1911-F2078 HydrophobicContact CB-CE1 4.36Å; L1911-F2078 HydrophobicContact CB-CZ 4.09Å
1912K88.2Confident82.4Confident44.8 Ų44.834.8 Ų34.820%0.19517%0.165CC..Hα-helixtrans-57.4-51.6172.4-178.6-166.9163.2-179.30111.1L1908 Q1909 F1910 L1914 C1915 H1916 L2070 T2073 E2077L1908-K1912 WeakPolarHBondContact O-CB 3.44Å; L1908-K1912 PolarHBondContact O-N 3.02Å; Q1909-K1912 WeakPolarHBondContact O-CB 3.28Å; Q1909-K1912 PolarHBondContact O-N 3.07Å; F1910-K1912 VanDerWaalsContact C-N 3.31Å; F1910-K1912 PolarHBondContact O-N 3.22Å; K1912-L1914 VanDerWaalsContact C-N 3.3Å; K1912-L1914 PolarHBondContact O-N 3.24Å; K1912-C1915 PolarHBondContact O-N 3.19Å; K1912-H1916 PolarHBondContact O-N 3.2Å; K1912-H1916 VanDerWaalsContact O-N 3.12Å; K1912-L2070 HydrophobicContact CD-CD1 4.15Å; K1912-T2073 HydrophobicContact CD-CG2 3.9Å; K1912-T2073 VanDerWaalsContact CE-CG2 3.47Å; K1912-T2073 HydrophobicContact CG-CG2 4.49Å; K1912-E2077 HydrophobicContact CG-CG 4.13Å
1913T85Confident83.1Confident16.8 Ų16.832.5 Ų32.510%0.10315%0.151CC..Hα-helixtrans-67.2-29.7-177.752.60000113.1I1827 Q1838 Q1909 F1910 C1915 H1916I1827-T1913 HydrophobicContact CG2-CG2 4.41Å; Q1838-T1913 PolarHBondContact NE2-O 3.32Å; Q1909-T1913 WeakPolarHBondContact O-CG2 3.3Å; Q1909-T1913 PolarHBondContact O-N 3.12Å; Q1909-T1913 PolarHBondContact O-OG1 2.95Å; Q1909-T1913 VanDerWaalsContact O-OG1 3.13Å; F1910-T1913 WeakPolarHBondContact CA-OG1 3.37Å; F1910-T1913 PolarHBondContact O-N 2.95Å; F1910-T1913 VanDerWaalsContact O-N 3.09Å; F1910-T1913 PolarHBondContact O-OG1 3.13Å; T1913-C1915 VanDerWaalsContact C-N 3.33Å; T1913-C1915 PolarHBondContact O-N 3.44Å; T1913-H1916 WeakPolarHBondContact O-CB 3.49Å; T1913-H1916 PolarHBondContact O-N 3.04Å
1914L84.8Confident83.5Confident1.8 Ų1.836 Ų361%0.00917%0.166CC..Hα-helixtrans-64.7-39.7174-115.4150.9000112.2L1830 Q1838 F1841 F1910 L1911 K1912 L1922 L1926L1830-L1914 HydrophobicContact CD1-CB 4.18Å; L1830-L1914 HydrophobicContact CD1-CD1 4.23Å; L1830-L1914 HydrophobicContact CD1-CD2 3.57Å; L1830-L1914 HydrophobicContact CD1-CG 3.79Å; L1830-L1914 HydrophobicContact CD2-CD2 4.39Å; Q1838-L1914 PolarHBondContact NE2-O 3.23Å; F1841-L1914 HydrophobicContact CB-CD1 4.06Å; F1841-L1914 HydrophobicContact CB-CD2 3.91Å; F1841-L1914 HydrophobicContact CD1-CD2 4.49Å; F1841-L1914 HydrophobicContact CD2-CD1 4.25Å; F1841-L1914 HydrophobicContact CD2-CD2 3.91Å; F1841-L1914 HydrophobicContact CE2-CD2 4.5Å; F1841-L1914 HydrophobicContact CG-CD1 4.26Å; F1841-L1914 HydrophobicContact CG-CD2 3.88Å; F1910-L1914 HydrophobicContact CD1-CD1 4.25Å; F1910-L1914 HydrophobicContact CD2-CD1 4.17Å; F1910-L1914 HydrophobicContact CD2-CG 4.09Å; F1910-L1914 HydrophobicContact CE1-CD1 3.79Å; F1910-L1914 HydrophobicContact CE2-CD1 3.74Å; F1910-L1914 HydrophobicContact CE2-CD2 3.96Å; F1910-L1914 HydrophobicContact CE2-CG 3.66Å; F1910-L1914 HydrophobicContact CG-CD1 4.44Å; F1910-L1914 HydrophobicContact CZ-CD1 3.57Å; F1910-L1914 VanDerWaalsContact CZ-CD1 3.49Å; F1910-L1914 HydrophobicContact CZ-CD2 4.24Å; F1910-L1914 HydrophobicContact CZ-CG 3.99Å; F1910-L1914 WeakPolarHBondContact O-CB 3.32Å; F1910-L1914 WeakPolarHBondContact O-CG 3.36Å; F1910-L1914 PolarHBondContact O-N 3.07Å; L1911-L1914 HydrophobicContact CD2-CD1 4.15Å; L1911-L1914 HydrophobicContact CD2-CD2 4.46Å; L1911-L1914 PolarHBondContact O-N 3.21Å; K1912-L1914 VanDerWaalsContact C-N 3.3Å; K1912-L1914 PolarHBondContact O-N 3.24Å; L1914-L1922 HydrophobicContact CB-CD1 4.43Å; L1914-L1922 HydrophobicContact CD1-CD1 3.85Å; L1914-L1922 HydrophobicContact CD1-CD2 4.13Å; L1914-L1922 HydrophobicContact CD2-CB 3.8Å; L1914-L1922 HydrophobicContact CD2-CD1 4.21Å; L1914-L1922 HydrophobicContact CD2-CD2 4.08Å; L1914-L1922 HydrophobicContact CD2-CG 4.05Å; L1914-L1922 HydrophobicContact CG-CD1 4.02Å; L1914-L1922 HydrophobicContact CG-CD2 4.26Å; L1914-L1922 VanDerWaalsContact O-CD1 3.29Å; L1914-L1922 WeakPolarHBondContact O-CD1 3.23Å; L1914-L1926 HydrophobicContact CD2-CD2 4.42Å
1915C82.5Confident83.8Confident0 Ų036.3 Ų36.30%017%0.168CC..Hα-helixtrans-86.8-7.5179.1-67.50000114.5L1911 K1912 T1913 S1918 Q1923 L1926 F2078L1911-C1915 PolarHBondContact O-N 3.23Å; K1912-C1915 PolarHBondContact O-N 3.19Å; T1913-C1915 VanDerWaalsContact C-N 3.33Å; T1913-C1915 PolarHBondContact O-N 3.44Å; C1915-S1918 PolarHBondContact O-N 3.1Å; C1915-Q1923 HydrophobicContact CB-CG 4.08Å; C1915-L1926 WeakPolarHBondContact SG-CD1 3.36Å; C1915-F2078 HydrophobicContact CB-CD1 3.93Å; C1915-F2078 HydrophobicContact CB-CE1 4.19Å; C1915-F2078 VanDerWaalsContact SG-CD1 3.52Å
1916H80.4Confident83.9Confident52.4 Ų52.433.5 Ų33.524%0.24316%0.155CC..THydrogen-bonded Turntrans-60.3142.9-173.7-164.532.5000112.6S1833 Q1838 K1912 T1913 S1918 E2077S1833-H1916 VanDerWaalsContact OG-CB 3.3Å; S1833-H1916 WeakPolarHBondContact OG-CB 3.33Å; S1833-H1916 PolarHBondContact OG-CD2 3.2Å; S1833-H1916 VanDerWaalsContact OG-CG 3.29Å; S1833-H1916 PolarHBondContact OG-ND1 3.05Å; Q1838-H1916 PolarHBondContact NE2-O 3.08Å; K1912-H1916 PolarHBondContact O-N 3.2Å; K1912-H1916 VanDerWaalsContact O-N 3.12Å; T1913-H1916 WeakPolarHBondContact O-CB 3.49Å; T1913-H1916 PolarHBondContact O-N 3.04Å; H1916-S1918 VanDerWaalsContact C-N 3.33Å; H1916-E2077 WeakPolarHBondContact CA-OE2 3.46Å; H1916-E2077 IonicContact CE1-OE1 2.77Å; H1916-E2077 IonicContact CE1-OE2 3.56Å; H1916-E2077 IonicContact CG-OE2 2.9Å; H1916-E2077 VanDerWaalsContact ND1-CD 3.32Å; H1916-E2077 IonicContact ND1-OE1 3.59Å; H1916-E2077 PolarHBondContact ND1-OE1 3.24Å; H1916-E2077 VanDerWaalsContact ND1-OE1 3.13Å; H1916-E2077 IonicContact ND1-OE2 3.19Å; H1916-E2077 PolarHBondContact ND1-OE2 3.37Å
1917R73.5Confident84Confident129.2 Ų129.235.1 Ų35.149%0.48816%0.159SC..THydrogen-bonded Turntrans60.537.4-170.6-61.6-169177.4164.1-4.7114.1H1832 S1833 N1919 D2786 I2793H1832-R1917 PolarHBondContact O-NH1 3.08Å; S1833-R1917 WeakPolarHBondContact OG-CD 3.42Å; S1833-R1917 WeakPolarHBondContact OG-CG 3.41Å; S1833-R1917 PolarHBondContact OG-NE 3.27Å; S1833-R1917 VanDerWaalsContact OG-NE 3.08Å; S1833-R1917 PolarHBondContact OG-NH1 3.16Å; R1917-N1919 PolarHBondContact O-N 3.43Å; R1917-D2786 IonicContact CZ-OD1 3.65Å; R1917-D2786 IonicContact NH2-OD1 2.68Å; R1917-D2786 PolarHBondContact NH2-OD1 3.38Å; R1917-I2793 HydrophobicContact CB-CD1 4Å; R1917-I2793 HydrophobicContact CG-CD1 3.89Å
1918S71.4Confident84Confident49.2 Ų49.238 Ų3834%0.34418%0.177SC..THydrogen-bonded Turntrans5756.6166.859.30000114.8C1915 H1916 L1920C1915-S1918 PolarHBondContact O-N 3.1Å; H1916-S1918 VanDerWaalsContact C-N 3.33Å; S1918-L1920 PolarHBondContact O-N 3.19Å; S1918-L1920 VanDerWaalsContact O-N 3.14Å
1919N79.1Confident84Confident15.8 Ų15.838.2 Ų38.28%0.08418%0.178CC..  trans-80.790170.2-167.7-28.8000110.5Q1838 R1917 R1921 L1922 Q1923Q1838-N1919 PolarHBondContact OE1-ND2 3.44Å; R1917-N1919 PolarHBondContact O-N 3.43Å; N1919-R1921 PolarHBondContact O-N 3.15Å; N1919-R1921 VanDerWaalsContact O-N 3.15Å; N1919-R1921 PolarHBondContact OD1-N 3.22Å; N1919-L1922 HydrophobicContact CB-CB 4.3Å; N1919-L1922 HydrophobicContact CB-CD1 4.24Å; N1919-L1922 WeakPolarHBondContact ND2-CD1 3.33Å; N1919-L1922 PolarHBondContact O-N 2.99Å; N1919-L1922 VanDerWaalsContact O-N 3.13Å; N1919-L1922 PolarHBondContact OD1-N 3Å; N1919-Q1923 VanDerWaalsContact O-CG 3.32Å; N1919-Q1923 WeakPolarHBondContact O-CG 3.27Å; N1919-Q1923 PolarHBondContact O-N 3.04Å
1920L83Confident83.4Confident79.8 Ų79.840.2 Ų40.242%0.41820%0.196SC..Hα-helixtrans-50.2-40.2-178.2-137.4110.5000113.1S1918 L1922 Q1923 E1924 G2081 C2083S1918-L1920 PolarHBondContact O-N 3.19Å; S1918-L1920 VanDerWaalsContact O-N 3.14Å; L1920-L1922 PolarHBondContact O-N 2.85Å; L1920-Q1923 PolarHBondContact O-N 3.02Å; L1920-E1924 WeakPolarHBondContact O-CG 3.33Å; L1920-E1924 PolarHBondContact O-N 3.13Å; L1920-G2081 WeakPolarHBondContact CD2-O 3.2Å; L1920-C2083 HydrophobicContact CD1-CB 3.9Å; L1920-C2083 HydrophobicContact CD2-CB 4.07Å
1921R84.6Confident82.9Confident135 Ų13544.3 Ų44.351%0.50922%0.218SC..Hα-helixtrans-66.1-43.3-177.5-66.9-178.6158.3170.2-3.3112.3E1839 Y1842 N1919 L1925E1839-R1921 IonicContact OE1-NH1 3.45Å; E1839-R1921 IonicContact OE2-NH1 3.05Å; E1839-R1921 PolarHBondContact OE2-NH1 3.34Å; E1839-R1921 VanDerWaalsContact OE2-NH1 3.1Å; Y1842-R1921 HydrophobicContact CD2-CB 3.89Å; Y1842-R1921 HydrophobicContact CE1-CB 4.38Å; Y1842-R1921 HydrophobicContact CE2-CB 3.58Å; Y1842-R1921 VanDerWaalsContact CE2-CB 3.48Å; Y1842-R1921 HydrophobicContact CE2-CG 4.46Å; Y1842-R1921 HydrophobicContact CG-CB 4.44Å; Y1842-R1921 PolarHBondContact OH-NE 2.91Å; Y1842-R1921 PolarHBondContact OH-NH2 3.45Å; N1919-R1921 PolarHBondContact O-N 3.15Å; N1919-R1921 VanDerWaalsContact O-N 3.15Å; N1919-R1921 PolarHBondContact OD1-N 3.22Å; R1921-L1925 VanDerWaalsContact O-CB 3.27Å; R1921-L1925 WeakPolarHBondContact O-CB 3.41Å; R1921-L1925 PolarHBondContact O-N 3.09Å; R1921-L1925 VanDerWaalsContact O-N 3.1Å
1922L85.2Confident82.4Confident2.4 Ų2.445.3 Ų45.31%0.01322%0.223CC..Hα-helixtrans-70.9-40.4176.2-76170.7000111.3Q1838 Y1842 L1914 N1919 L1920 E1924 L1925 L1926Q1838-L1922 HydrophobicContact CB-CD1 3.89Å; Q1838-L1922 HydrophobicContact CG-CD1 4.34Å; Y1842-L1922 HydrophobicContact CD2-CD2 4Å; Y1842-L1922 HydrophobicContact CD2-CG 4.27Å; Y1842-L1922 HydrophobicContact CG-CD2 4.41Å; Y1842-L1922 HydrophobicContact CG-CG 4.49Å; L1914-L1922 HydrophobicContact CB-CD1 4.43Å; L1914-L1922 HydrophobicContact CD1-CD1 3.85Å; L1914-L1922 HydrophobicContact CD1-CD2 4.13Å; L1914-L1922 HydrophobicContact CD2-CB 3.8Å; L1914-L1922 HydrophobicContact CD2-CD1 4.21Å; L1914-L1922 HydrophobicContact CD2-CD2 4.08Å; L1914-L1922 HydrophobicContact CD2-CG 4.05Å; L1914-L1922 HydrophobicContact CG-CD1 4.02Å; L1914-L1922 HydrophobicContact CG-CD2 4.26Å; L1914-L1922 VanDerWaalsContact O-CD1 3.29Å; L1914-L1922 WeakPolarHBondContact O-CD1 3.23Å; N1919-L1922 HydrophobicContact CB-CB 4.3Å; N1919-L1922 HydrophobicContact CB-CD1 4.24Å; N1919-L1922 WeakPolarHBondContact ND2-CD1 3.33Å; N1919-L1922 PolarHBondContact O-N 2.99Å; N1919-L1922 VanDerWaalsContact O-N 3.13Å; N1919-L1922 PolarHBondContact OD1-N 3Å; L1920-L1922 PolarHBondContact O-N 2.85Å; L1922-E1924 VanDerWaalsContact C-N 3.3Å; L1922-E1924 PolarHBondContact O-N 3.25Å; L1922-L1925 HydrophobicContact CD2-CD2 4.35Å; L1922-L1925 WeakPolarHBondContact O-CB 3.37Å; L1922-L1925 PolarHBondContact O-N 3.17Å; L1922-L1925 VanDerWaalsContact O-N 3.12Å; L1922-L1926 WeakPolarHBondContact O-CG 3.38Å; L1922-L1926 PolarHBondContact O-N 3.24Å; L1922-L1926 VanDerWaalsContact O-N 3.1Å
1923Q87.8Confident82Confident0.6 Ų0.648.8 Ų48.80%0.00325%0.248CC..Hα-helixtrans-57.1-42.1175.6-73.7173.1-16.900112.1C1915 N1919 L1920 E2077 Q2080 N2086C1915-Q1923 HydrophobicContact CB-CG 4.08Å; N1919-Q1923 VanDerWaalsContact O-CG 3.32Å; N1919-Q1923 WeakPolarHBondContact O-CG 3.27Å; N1919-Q1923 PolarHBondContact O-N 3.04Å; L1920-Q1923 PolarHBondContact O-N 3.02Å; Q1923-E2077 PolarHBondContact NE2-O 3.05Å; Q1923-Q2080 PolarHBondContact NE2-O 3.01Å; Q1923-N2086 PolarHBondContact O-ND2 3.07Å; Q1923-N2086 VanDerWaalsContact O-ND2 3.1Å
1924E85.4Confident81.8Confident79 Ų7951.1 Ų51.137%0.36926%0.262SS..Hα-helixtrans-72.2-37.9176-70.5-169.4142.200112.4L1920 L1922 L1926 R1927 V1928 S2085L1920-E1924 WeakPolarHBondContact O-CG 3.33Å; L1920-E1924 PolarHBondContact O-N 3.13Å; L1922-E1924 VanDerWaalsContact C-N 3.3Å; L1922-E1924 PolarHBondContact O-N 3.25Å; E1924-L1926 VanDerWaalsContact C-N 3.28Å; E1924-L1926 PolarHBondContact O-N 3.23Å; E1924-R1927 PolarHBondContact O-N 3.18Å; E1924-R1927 VanDerWaalsContact O-N 3.08Å; E1924-V1928 PolarHBondContact O-N 3.16Å; E1924-S2085 VanDerWaalsContact OE1-CB 3.25Å; E1924-S2085 WeakPolarHBondContact OE1-CB 3.4Å; E1924-S2085 PolarHBondContact OE1-OG 3.1Å
1925L86.7Confident81.8Confident12.8 Ų12.855.2 Ų55.27%0.06728%0.284CS..Hα-helixtrans-63.4-29.9178.3-177.997.7000112.9Y1842 L1845 F1855 R1921 L1922 R1927 V1928 Q1929Y1842-L1925 HydrophobicContact CD2-CD1 3.91Å; Y1842-L1925 HydrophobicContact CD2-CD2 4.12Å; Y1842-L1925 HydrophobicContact CE2-CB 4.45Å; Y1842-L1925 HydrophobicContact CE2-CD1 3.86Å; Y1842-L1925 HydrophobicContact CE2-CD2 4.39Å; L1845-L1925 HydrophobicContact CB-CD1 4.31Å; L1845-L1925 HydrophobicContact CB-CD2 4.05Å; L1845-L1925 HydrophobicContact CD1-CD2 4.34Å; F1855-L1925 HydrophobicContact CE1-CD2 3.78Å; F1855-L1925 HydrophobicContact CE1-CG 4.41Å; F1855-L1925 HydrophobicContact CZ-CD1 4.43Å; F1855-L1925 HydrophobicContact CZ-CD2 3.94Å; F1855-L1925 VanDerWaalsContact CZ-CD2 3.48Å; F1855-L1925 HydrophobicContact CZ-CG 4.04Å; R1921-L1925 VanDerWaalsContact O-CB 3.27Å; R1921-L1925 WeakPolarHBondContact O-CB 3.41Å; R1921-L1925 PolarHBondContact O-N 3.09Å; R1921-L1925 VanDerWaalsContact O-N 3.1Å; L1922-L1925 HydrophobicContact CD2-CD2 4.35Å; L1922-L1925 WeakPolarHBondContact O-CB 3.37Å; L1922-L1925 PolarHBondContact O-N 3.17Å; L1922-L1925 VanDerWaalsContact O-N 3.12Å; L1925-R1927 PolarHBondContact O-N 3.2Å; L1925-V1928 WeakPolarHBondContact CA-O 3.44Å; L1925-Q1929 HydrophobicContact CD1-CB 4.37Å; L1925-Q1929 HydrophobicContact CD1-CG 4.2Å; L1925-Q1929 HydrophobicContact CG-CG 4.48Å; L1925-Q1929 WeakPolarHBondContact O-CG 3.37Å; L1925-Q1929 PolarHBondContact O-NE2 3.29Å
1926L86.1Confident81.9Confident4.8 Ų4.856.7 Ų56.73%0.02529%0.291CS..THydrogen-bonded Turntrans-68.8-18.9173.6-65.5-174.8000113.7L1911 L1914 C1915 L1922 E1924 L1938 F2078L1911-L1926 HydrophobicContact CB-CD1 4.49Å; L1911-L1926 HydrophobicContact CD2-CD1 4.27Å; L1911-L1926 HydrophobicContact CD2-CD2 3.7Å; L1914-L1926 HydrophobicContact CD2-CD2 4.42Å; C1915-L1926 WeakPolarHBondContact SG-CD1 3.36Å; L1922-L1926 WeakPolarHBondContact O-CG 3.38Å; L1922-L1926 PolarHBondContact O-N 3.24Å; L1922-L1926 VanDerWaalsContact O-N 3.1Å; E1924-L1926 VanDerWaalsContact C-N 3.28Å; E1924-L1926 PolarHBondContact O-N 3.23Å; L1926-L1938 HydrophobicContact CD2-CD1 3.97Å; L1926-L1938 PolarHBondContact O-N 3.03Å; L1926-L1938 VanDerWaalsContact O-N 3.14Å; L1926-F2078 HydrophobicContact CD1-CD1 4.09Å; L1926-F2078 HydrophobicContact CD1-CE1 3.58Å; L1926-F2078 HydrophobicContact CD1-CE2 4.49Å; L1926-F2078 HydrophobicContact CD1-CZ 3.93Å
1927R85.5Confident82.2Confident52.2 Ų52.255.5 Ų55.520%0.19729%0.286CS..THydrogen-bonded Turntrans-101-44.8179.7-171.7-169.662.5173.12.4112.3E1924 L1925 N1935 I1939 S2085 N2086E1924-R1927 PolarHBondContact O-N 3.18Å; E1924-R1927 VanDerWaalsContact O-N 3.08Å; L1925-R1927 PolarHBondContact O-N 3.2Å; R1927-N1935 PolarHBondContact O-ND2 3.15Å; R1927-N1935 VanDerWaalsContact O-ND2 3.14Å; R1927-N1935 PolarHBondContact O-OD1 2.91Å; R1927-I1939 HydrophobicContact CB-CD1 3.97Å; R1927-I1939 HydrophobicContact CG-CD1 4.42Å; R1927-S2085 VanDerWaalsContact NH1-CA 3.26Å; R1927-S2085 VanDerWaalsContact NH1-CB 3.31Å; R1927-S2085 PolarHBondContact NH1-O 2.96Å; R1927-S2085 PolarHBondContact NH2-OG 3.18Å; R1927-N2086 WeakPolarHBondContact CD-OD1 3.31Å; R1927-N2086 PolarHBondContact NE-OD1 3.15Å
1928V84.9Confident83Confident61.8 Ų61.849.4 Ų49.438%0.37526%0.263SS..  trans-133.4120.2-176.6-178.10000109.6E1924 L1925 P1930 N1935E1924-V1928 PolarHBondContact O-N 3.16Å; L1925-V1928 WeakPolarHBondContact CA-O 3.44Å; V1928-P1930 VanDerWaalsContact O-CD 3.25Å; V1928-P1930 WeakPolarHBondContact O-CD 3.29Å; V1928-N1935 VanDerWaalsContact CA-OD1 3.27Å; V1928-N1935 WeakPolarHBondContact CA-OD1 3.41Å
1929Q86.8Confident83.8Confident5 Ų547.1 Ų47.12%0.02325%0.247CC..  trans-103.888.9173.6-56.486.336.300109.6F1855 L1925 N1931 N1932 N1935 F1936F1855-Q1929 HydrophobicContact CD1-CG 4.02Å; F1855-Q1929 HydrophobicContact CD2-CG 4Å; F1855-Q1929 HydrophobicContact CE1-CG 3.82Å; F1855-Q1929 HydrophobicContact CE2-CG 3.8Å; F1855-Q1929 HydrophobicContact CG-CG 4.11Å; F1855-Q1929 HydrophobicContact CZ-CG 3.71Å; L1925-Q1929 HydrophobicContact CD1-CB 4.37Å; L1925-Q1929 HydrophobicContact CD1-CG 4.2Å; L1925-Q1929 HydrophobicContact CG-CG 4.48Å; L1925-Q1929 WeakPolarHBondContact O-CG 3.37Å; L1925-Q1929 PolarHBondContact O-NE2 3.29Å; Q1929-N1931 PolarHBondContact O-N 3.15Å; Q1929-N1931 VanDerWaalsContact O-N 3.11Å; Q1929-N1932 HydrophobicContact CB-CB 4.04Å; Q1929-N1932 WeakPolarHBondContact CB-ND2 3.37Å; Q1929-N1932 PolarHBondContact O-N 3.06Å; Q1929-N1932 VanDerWaalsContact O-N 3.16Å; Q1929-N1935 PolarHBondContact N-OD1 3.22Å; Q1929-N1935 PolarHBondContact O-OD1 3.1Å; Q1929-N1935 PolarHBondContact OE1-OD1 3Å; Q1929-F1936 PolarHBondContact NE2-O 3.28Å; Q1929-F1936 PolarHBondContact OE1-O 3.18Å
1930P74.7Confident84.1Confident101 Ų10149.3 Ų49.366%0.65626%0.257SS*.THydrogen-bonded Turntrans-63.1-10.8-170.926.4-35.9000113.6V1928V1928-P1930 VanDerWaalsContact O-CD 3.25Å; V1928-P1930 WeakPolarHBondContact O-CD 3.29Å
1931N77.2Confident84.3Confident86 Ų8646.7 Ų46.746%0.4624%0.243SC..THydrogen-bonded Turntrans-96.4-2.8-178-59.5-27.3000114.5S1846 P1848 Q1929S1846-N1931 PolarHBondContact O-ND2 3.27Å; P1848-N1931 HydrophobicContact CB-CB 4.02Å; Q1929-N1931 PolarHBondContact O-N 3.15Å; Q1929-N1931 VanDerWaalsContact O-N 3.11Å
1932N78.5Confident84.5Confident21 Ų2140.3 Ų40.311%0.11222%0.219CC..SBendtrans-90.8156.4178.5-69.31.2000111.1E1852 F1855 Q1929 T1934E1852-N1932 HydrophobicContact CB-CB 4.47Å; E1852-N1932 HydrophobicContact CG-CB 4.22Å; F1855-N1932 WeakPolarHBondContact CD2-ND2 3.48Å; Q1929-N1932 HydrophobicContact CB-CB 4.04Å; Q1929-N1932 WeakPolarHBondContact CB-ND2 3.37Å; Q1929-N1932 PolarHBondContact O-N 3.06Å; Q1929-N1932 VanDerWaalsContact O-N 3.16Å; N1932-T1934 WeakPolarHBondContact CB-O 3.32Å
1933V78.7Confident84.7Confident118.8 Ų118.840.2 Ų40.272%0.7222%0.218SC*.SBendtrans-73.9-42.9177.5-179.40000110.1E1852E1852-V1933 PolarHBondContact OE2-N 3.21Å; E1852-V1933 VanDerWaalsContact OE2-N 3.13Å
1934T80.9Confident84.7Confident63.6 Ų63.641.1 Ų41.139%0.3922%0.224SC..SBendtrans-109.1135.817363.40000110.5E1852 N1932 F1936E1852-T1934 WeakPolarHBondContact OE1-CB 3.22Å; E1852-T1934 PolarHBondContact OE1-N 3.15Å; E1852-T1934 PolarHBondContact OE1-OG1 3.18Å; N1932-T1934 WeakPolarHBondContact CB-O 3.32Å; T1934-F1936 WeakPolarHBondContact OG1-CE2 3.4Å; T1934-F1936 VanDerWaalsContact OG1-CZ 3.28Å; T1934-F1936 WeakPolarHBondContact OG1-CZ 3.42Å
1935N84.8Confident84.6Confident88.8 Ų88.837.4 Ų37.448%0.47521%0.207SC..  trans-95.8124175.4-136.16.1000109.2R1927 V1928 Q1929R1927-N1935 PolarHBondContact O-ND2 3.15Å; R1927-N1935 VanDerWaalsContact O-ND2 3.14Å; R1927-N1935 PolarHBondContact O-OD1 2.91Å; V1928-N1935 VanDerWaalsContact CA-OD1 3.27Å; V1928-N1935 WeakPolarHBondContact CA-OD1 3.41Å; Q1929-N1935 PolarHBondContact N-OD1 3.22Å; Q1929-N1935 PolarHBondContact O-OD1 3.1Å; Q1929-N1935 PolarHBondContact OE1-OD1 3Å
1936F84.9Confident84.7Confident32 Ų3236.8 Ų36.814%0.1420%0.204CC..  trans-105.4106.2177.4-62.4-80.1000109.4E1852 F1855 F1859 Q1929 T1934 L1938E1852-F1936 HydrophobicContact CG-CE2 4.01Å; F1855-F1936 HydrophobicContact CB-CB 4.05Å; F1855-F1936 HydrophobicContact CB-CD2 3.62Å; F1855-F1936 HydrophobicContact CB-CE2 4.42Å; F1855-F1936 HydrophobicContact CB-CG 4.12Å; F1859-F1936 HydrophobicContact CB-CB 4.34Å; F1859-F1936 HydrophobicContact CB-CD1 3.88Å; F1859-F1936 HydrophobicContact CB-CG 4.36Å; F1859-F1936 HydrophobicContact CD1-CD1 4.16Å; F1859-F1936 HydrophobicContact CD2-CB 4.13Å; F1859-F1936 AromaticContact CD2-CD1 3.97Å; F1859-F1936 HydrophobicContact CD2-CD1 3.97Å; F1859-F1936 HydrophobicContact CD2-CG 4.47Å; F1859-F1936 HydrophobicContact CG-CB 4.43Å; F1859-F1936 AromaticContact CG-CD1 3.74Å; F1859-F1936 HydrophobicContact CG-CD1 3.74Å; F1859-F1936 HydrophobicContact CG-CE1 4.49Å; F1859-F1936 HydrophobicContact CG-CG 4.47Å; Q1929-F1936 PolarHBondContact NE2-O 3.28Å; Q1929-F1936 PolarHBondContact OE1-O 3.18Å; T1934-F1936 WeakPolarHBondContact OG1-CE2 3.4Å; T1934-F1936 VanDerWaalsContact OG1-CZ 3.28Å; T1934-F1936 WeakPolarHBondContact OG1-CZ 3.42Å; F1936-L1938 PolarHBondContact O-N 3.21Å; F1936-L1938 VanDerWaalsContact O-N 3.11Å
1937N87.4Confident84.7Confident26.2 Ų26.237.3 Ų37.314%0.1421%0.206CC..  trans-81.489.6176.3-171.9-1.7000110.2I1939 E1940 E1941 D2089N1937-I1939 PolarHBondContact O-N 3.06Å; N1937-I1939 WeakPolarHBondContact OD1-CB 3.3Å; N1937-I1939 PolarHBondContact OD1-N 3.21Å; N1937-E1940 HydrophobicContact CB-CB 4.07Å; N1937-E1940 VanDerWaalsContact ND2-CB 3.32Å; N1937-E1940 WeakPolarHBondContact ND2-CB 3.23Å; N1937-E1940 PolarHBondContact ND2-OE2 3.09Å; N1937-E1940 VanDerWaalsContact ND2-OE2 3.11Å; N1937-E1940 PolarHBondContact O-N 3.09Å; N1937-E1940 PolarHBondContact OD1-N 3.3Å; N1937-E1940 VanDerWaalsContact OD1-N 3.17Å; N1937-E1941 PolarHBondContact O-N 3.04Å; N1937-D2089 PolarHBondContact ND2-OD2 3.38Å
1938L88.8Confident84.5Confident1 Ų135.1 Ų35.11%0.00520%0.198CC..Hα-helixtrans-65-29-180-63.3175.7000112F1855 M1858 F1859 F1862 L1911 L1926 F1936 E1940 I1942F1855-L1938 HydrophobicContact CD1-CD1 4.1Å; M1858-L1938 HydrophobicContact CB-CD1 4.46Å; M1858-L1938 HydrophobicContact CB-CD2 4.15Å; F1859-L1938 HydrophobicContact CB-CD2 3.96Å; F1859-L1938 HydrophobicContact CD2-CD2 4.42Å; F1862-L1938 HydrophobicContact CD2-CD2 4.25Å; F1862-L1938 HydrophobicContact CE2-CD2 4.4Å; L1911-L1938 HydrophobicContact CD1-CD1 4.36Å; L1911-L1938 HydrophobicContact CD2-CD1 4.46Å; L1926-L1938 HydrophobicContact CD2-CD1 3.97Å; L1926-L1938 PolarHBondContact O-N 3.03Å; L1926-L1938 VanDerWaalsContact O-N 3.14Å; F1936-L1938 PolarHBondContact O-N 3.21Å; F1936-L1938 VanDerWaalsContact O-N 3.11Å; L1938-E1940 VanDerWaalsContact C-N 3.35Å; L1938-I1942 WeakPolarHBondContact O-CB 3.44Å; L1938-I1942 WeakPolarHBondContact O-CD1 3.38Å; L1938-I1942 VanDerWaalsContact O-CG1 3.22Å; L1938-I1942 WeakPolarHBondContact O-CG1 3.38Å; L1938-I1942 PolarHBondContact O-N 3.2Å; L1938-I1942 VanDerWaalsContact O-N 3.11Å
1939I88.3Confident84.4Confident0.8 Ų0.832.4 Ų32.40%0.00418%0.182CC..Hα-helixtrans-64.7-43.7177.4-56.1-178.2000109.7R1927 N1937 E1941 I1942 K1943 L2075 F2078 N2086 D2089 I2090R1927-I1939 HydrophobicContact CB-CD1 3.97Å; R1927-I1939 HydrophobicContact CG-CD1 4.42Å; N1937-I1939 PolarHBondContact O-N 3.06Å; N1937-I1939 WeakPolarHBondContact OD1-CB 3.3Å; N1937-I1939 PolarHBondContact OD1-N 3.21Å; I1939-E1941 PolarHBondContact O-N 3.22Å; I1939-I1942 PolarHBondContact O-N 2.98Å; I1939-K1943 HydrophobicContact CG2-CD 4.41Å; I1939-K1943 HydrophobicContact CG2-CG 4.32Å; I1939-K1943 WeakPolarHBondContact O-CB 3.42Å; I1939-K1943 VanDerWaalsContact O-CG 3.28Å; I1939-K1943 WeakPolarHBondContact O-CG 3.21Å; I1939-K1943 PolarHBondContact O-N 3.26Å; I1939-L2075 HydrophobicContact CG2-CD2 4.24Å; I1939-F2078 HydrophobicContact CD1-CB 4.46Å; I1939-F2078 HydrophobicContact CD1-CD2 4.47Å; I1939-F2078 HydrophobicContact CG1-CD2 4.12Å; I1939-F2078 HydrophobicContact CG1-CE2 4.47Å; I1939-N2086 HydrophobicContact CD1-CB 4.11Å; I1939-N2086 VanDerWaalsContact CD1-CG 3.49Å; I1939-N2086 WeakPolarHBondContact CD1-OD1 3.26Å; I1939-D2089 WeakPolarHBondContact CG2-OD2 3.42Å; I1939-I2090 HydrophobicContact CG2-CG1 4.44Å
1940E87Confident84.2Confident63.6 Ų63.632.4 Ų32.430%0.29718%0.181SC..Hα-helixtrans-64.8-38.5179.4-176.7167.3-165.800114.2N1937 L1938 K1943 S1944 S2094N1937-E1940 HydrophobicContact CB-CB 4.07Å; N1937-E1940 VanDerWaalsContact ND2-CB 3.32Å; N1937-E1940 WeakPolarHBondContact ND2-CB 3.23Å; N1937-E1940 PolarHBondContact ND2-OE2 3.09Å; N1937-E1940 VanDerWaalsContact ND2-OE2 3.11Å; N1937-E1940 PolarHBondContact O-N 3.09Å; N1937-E1940 PolarHBondContact OD1-N 3.3Å; N1937-E1940 VanDerWaalsContact OD1-N 3.17Å; L1938-E1940 VanDerWaalsContact C-N 3.35Å; E1940-K1943 VanDerWaalsContact CA-CE 3.45Å; E1940-K1943 WeakPolarHBondContact O-CB 3.42Å; E1940-K1943 PolarHBondContact O-N 3.03Å; E1940-S1944 WeakPolarHBondContact O-CB 3.44Å; E1940-S1944 PolarHBondContact O-N 3.09Å; E1940-S1944 PolarHBondContact O-OG 3.11Å; E1940-S2094 WeakPolarHBondContact CG-O 3.38Å; E1940-S2094 VanDerWaalsContact OE1-O 3.08Å; E1940-S2094 PolarHBondContact OE1-OG 3.24Å; E1940-S2094 VanDerWaalsContact OE1-OG 3.08Å
1941E86.6Confident84.5Confident24.8 Ų24.832.1 Ų32.112%0.11617%0.17CC..Hα-helixtrans-68.2-43.1172.9-72.6-63139.200111.8F1859 F1862 H1863 N1937 I1939 K1943 S1944 L1945F1859-E1941 HydrophobicContact CD2-CG 3.56Å; F1859-E1941 VanDerWaalsContact CD2-CG 3.48Å; F1859-E1941 HydrophobicContact CE1-CG 4.4Å; F1859-E1941 HydrophobicContact CE2-CB 4.46Å; F1859-E1941 HydrophobicContact CE2-CG 3.14Å; F1859-E1941 HydrophobicContact CG-CG 4.32Å; F1859-E1941 HydrophobicContact CZ-CG 3.6Å; F1859-E1941 VanDerWaalsContact CZ-OE1 3.25Å; F1859-E1941 WeakPolarHBondContact CZ-OE1 3.36Å; F1862-E1941 HydrophobicContact CB-CB 4.25Å; H1863-E1941 WeakPolarHBondContact CA-OE2 3.38Å; H1863-E1941 IonicContact CG-OE2 3.09Å; H1863-E1941 IonicContact ND1-OE1 3.16Å; H1863-E1941 PolarHBondContact ND1-OE1 3.19Å; H1863-E1941 IonicContact ND1-OE2 3.49Å; H1863-E1941 PolarHBondContact ND1-OE2 3.01Å; H1863-E1941 VanDerWaalsContact ND1-OE2 3.16Å; N1937-E1941 PolarHBondContact O-N 3.04Å; I1939-E1941 PolarHBondContact O-N 3.22Å; E1941-K1943 VanDerWaalsContact C-N 3.29Å; E1941-K1943 PolarHBondContact O-N 3.19Å; E1941-S1944 WeakPolarHBondContact O-CB 3.39Å; E1941-S1944 PolarHBondContact O-N 3.12Å; E1941-S1944 VanDerWaalsContact O-N 3.14Å; E1941-L1945 VanDerWaalsContact O-CB 3.3Å; E1941-L1945 WeakPolarHBondContact O-CB 3.33Å; E1941-L1945 PolarHBondContact O-N 3.09Å
1942I88.7Confident84.4Confident0.4 Ų0.428.5 Ų28.50%0.00215%0.151CC..Hα-helixtrans-62.5-38.8176.1-68.6168.5000110.6F1862 L1908 L1911 L1938 I1939 L1945 F1946 I2071 L2075 F2078F1862-I1942 HydrophobicContact CD2-CG1 4.32Å; F1862-I1942 HydrophobicContact CE2-CD1 4.26Å; F1862-I1942 HydrophobicContact CE2-CG1 4.32Å; F1862-I1942 HydrophobicContact CG-CG1 4.49Å; F1862-I1942 HydrophobicContact CZ-CD1 4.44Å; L1908-I1942 HydrophobicContact CD2-CD1 3.86Å; L1908-I1942 HydrophobicContact CD2-CG1 3.95Å; L1908-I1942 HydrophobicContact CD2-CG2 4.33Å; L1911-I1942 HydrophobicContact CD1-CD1 4.12Å; L1938-I1942 WeakPolarHBondContact O-CB 3.44Å; L1938-I1942 WeakPolarHBondContact O-CD1 3.38Å; L1938-I1942 VanDerWaalsContact O-CG1 3.22Å; L1938-I1942 WeakPolarHBondContact O-CG1 3.38Å; L1938-I1942 PolarHBondContact O-N 3.2Å; L1938-I1942 VanDerWaalsContact O-N 3.11Å; I1939-I1942 PolarHBondContact O-N 2.98Å; I1942-L1945 PolarHBondContact O-N 3.26Å; I1942-F1946 PolarHBondContact O-N 2.88Å; I1942-F1946 VanDerWaalsContact O-N 3.1Å; I1942-I2071 HydrophobicContact CG2-CB 4.45Å; I1942-I2071 HydrophobicContact CG2-CG1 4.44Å; I1942-I2071 HydrophobicContact CG2-CG2 3.54Å; I1942-I2071 VanDerWaalsContact CG2-CG2 3.49Å; I1942-L2075 HydrophobicContact CG2-CD2 4.16Å; I1942-L2075 HydrophobicContact CG2-CG 4.38Å; I1942-F2078 HydrophobicContact CD1-CE2 3.87Å; I1942-F2078 HydrophobicContact CD1-CZ 4.26Å
1943K89.8Confident84.3Confident0.6 Ų0.627.7 Ų27.70%0.00315%0.146CC..Hα-helixtrans-59.3-48.8172.3-75.9-171.8-60.1-174.40111I1939 E1940 E1941 L1945 F1946 I1947 L2075 D2089 I2090 S2094 P2095 I2097I1939-K1943 HydrophobicContact CG2-CD 4.41Å; I1939-K1943 HydrophobicContact CG2-CG 4.32Å; I1939-K1943 WeakPolarHBondContact O-CB 3.42Å; I1939-K1943 VanDerWaalsContact O-CG 3.28Å; I1939-K1943 WeakPolarHBondContact O-CG 3.21Å; I1939-K1943 PolarHBondContact O-N 3.26Å; E1940-K1943 VanDerWaalsContact CA-CE 3.45Å; E1940-K1943 WeakPolarHBondContact O-CB 3.42Å; E1940-K1943 PolarHBondContact O-N 3.03Å; E1941-K1943 VanDerWaalsContact C-N 3.29Å; E1941-K1943 PolarHBondContact O-N 3.19Å; K1943-L1945 VanDerWaalsContact C-N 3.31Å; K1943-L1945 PolarHBondContact O-N 3.4Å; K1943-F1946 WeakPolarHBondContact O-CB 3.34Å; K1943-F1946 PolarHBondContact O-N 3.07Å; K1943-I1947 WeakPolarHBondContact O-CG1 3.31Å; K1943-I1947 PolarHBondContact O-N 3.04Å; K1943-L2075 HydrophobicContact CG-CD2 4.28Å; K1943-D2089 WeakPolarHBondContact CE-OD2 3.28Å; K1943-D2089 PolarHBondContact NZ-O 3.28Å; K1943-D2089 IonicContact NZ-OD1 3.42Å; K1943-D2089 PolarHBondContact NZ-OD1 3.3Å; K1943-D2089 VanDerWaalsContact NZ-OD1 3.11Å; K1943-D2089 IonicContact NZ-OD2 2.98Å; K1943-D2089 PolarHBondContact NZ-OD2 2.95Å; K1943-I2090 HydrophobicContact CD-CG1 4.32Å; K1943-S2094 WeakPolarHBondContact CE-O 3.44Å; K1943-S2094 PolarHBondContact NZ-O 3.24Å; K1943-P2095 HydrophobicContact CB-CG 4.34Å; K1943-I2097 VanDerWaalsContact CA-CD1 3.44Å; K1943-I2097 HydrophobicContact CB-CD1 3.46Å; K1943-I2097 VanDerWaalsContact CB-CD1 3.43Å; K1943-I2097 HydrophobicContact CB-CG1 4.22Å; K1943-I2097 HydrophobicContact CD-CD1 4.1Å; K1943-I2097 HydrophobicContact CD-CG1 4.5Å; K1943-I2097 HydrophobicContact CG-CD1 3.47Å; K1943-I2097 VanDerWaalsContact CG-CD1 3.47Å; K1943-I2097 HydrophobicContact CG-CG1 4.37Å
1944S86.2Confident84.3Confident18 Ų1824.1 Ų24.113%0.12612%0.123CC..Hα-helixtrans-63.5-40-179.6-60.20000112.2Y1866 E1940 E1941 I1947 N1948 P2095Y1866-S1944 WeakPolarHBondContact CE2-O 3.17Å; E1940-S1944 WeakPolarHBondContact O-CB 3.44Å; E1940-S1944 PolarHBondContact O-N 3.09Å; E1940-S1944 PolarHBondContact O-OG 3.11Å; E1941-S1944 WeakPolarHBondContact O-CB 3.39Å; E1941-S1944 PolarHBondContact O-N 3.12Å; E1941-S1944 VanDerWaalsContact O-N 3.14Å; S1944-I1947 PolarHBondContact O-N 3.24Å; S1944-N1948 PolarHBondContact O-N 3.13Å; S1944-N1948 VanDerWaalsContact O-N 3.1Å; S1944-P2095 WeakPolarHBondContact OG-CD 3.38Å; S1944-P2095 WeakPolarHBondContact OG-CG 3.39Å
1945L85.1Confident84Confident3.2 Ų3.227.4 Ų27.42%0.01713%0.128CC..Hα-helixtrans-62.8-44.6175.6-171119.5000111.6F1862 A1865 M1869 V1904 E1941 I1942 K1943 I1947 N1948 L1949 I2067 I2071F1862-L1945 HydrophobicContact CB-CD1 4.45Å; F1862-L1945 HydrophobicContact CD1-CD1 4.46Å; A1865-L1945 HydrophobicContact CB-CD1 3.94Å; M1869-L1945 HydrophobicContact SD-CD1 3.84Å; V1904-L1945 HydrophobicContact CG1-CD1 4.43Å; V1904-L1945 HydrophobicContact CG1-CD2 4.32Å; E1941-L1945 VanDerWaalsContact O-CB 3.3Å; E1941-L1945 WeakPolarHBondContact O-CB 3.33Å; E1941-L1945 PolarHBondContact O-N 3.09Å; I1942-L1945 PolarHBondContact O-N 3.26Å; K1943-L1945 VanDerWaalsContact C-N 3.31Å; K1943-L1945 PolarHBondContact O-N 3.4Å; L1945-I1947 PolarHBondContact O-N 3.31Å; L1945-N1948 PolarHBondContact O-N 3.16Å; L1945-L1949 HydrophobicContact CD1-CD1 4.43Å; L1945-L1949 HydrophobicContact CD2-CD1 3.48Å; L1945-L1949 VanDerWaalsContact CD2-CD1 3.47Å; L1945-L1949 HydrophobicContact CD2-CG 4.28Å; L1945-L1949 HydrophobicContact CG-CD1 4.08Å; L1945-L1949 WeakPolarHBondContact O-CB 3.4Å; L1945-L1949 WeakPolarHBondContact O-CG 3.44Å; L1945-L1949 PolarHBondContact O-N 3.24Å; L1945-I2067 HydrophobicContact CD2-CG2 4.43Å; L1945-I2071 HydrophobicContact CD2-CD1 3.55Å; L1945-I2071 HydrophobicContact CD2-CG1 4.28Å; L1945-I2071 HydrophobicContact CG-CD1 4.05Å
1946F88Confident83.3Confident0.2 Ų0.224.2 Ų24.20%0.00111%0.111CC..Hα-helixtrans-58.7-46.1174.1173.3-101.8000112.5I1942 K1943 N1948 L1949 W1950 I2068 I2071 L2072 I2097 L2100 L2101I1942-F1946 PolarHBondContact O-N 2.88Å; I1942-F1946 VanDerWaalsContact O-N 3.1Å; K1943-F1946 WeakPolarHBondContact O-CB 3.34Å; K1943-F1946 PolarHBondContact O-N 3.07Å; F1946-N1948 VanDerWaalsContact C-N 3.32Å; F1946-N1948 PolarHBondContact O-N 3.29Å; F1946-L1949 PolarHBondContact O-N 3.15Å; F1946-W1950 HydrophobicContact CE1-CB 4.49Å; F1946-W1950 HydrophobicContact CZ-CB 4.42Å; F1946-W1950 VanDerWaalsContact O-CB 3.3Å; F1946-W1950 WeakPolarHBondContact O-CB 3.4Å; F1946-W1950 PolarHBondContact O-N 3.14Å; F1946-I2068 HydrophobicContact CD2-CG2 4.26Å; F1946-I2068 HydrophobicContact CE2-CG2 3.86Å; F1946-I2071 HydrophobicContact CB-CG2 3.82Å; F1946-I2071 HydrophobicContact CD2-CG2 4.32Å; F1946-I2071 HydrophobicContact CG-CG2 4.43Å; F1946-L2072 HydrophobicContact CD2-CD2 4.28Å; F1946-L2072 HydrophobicContact CD2-CG 4.29Å; F1946-L2072 HydrophobicContact CE2-CD1 4.05Å; F1946-L2072 HydrophobicContact CE2-CD2 3.67Å; F1946-L2072 HydrophobicContact CE2-CG 3.75Å; F1946-L2072 HydrophobicContact CZ-CD1 4.5Å; F1946-L2072 HydrophobicContact CZ-CD2 3.9Å; F1946-L2072 HydrophobicContact CZ-CG 4.38Å; F1946-I2097 HydrophobicContact CB-CD1 4.46Å; F1946-I2097 HydrophobicContact CD1-CD1 4.05Å; F1946-I2097 HydrophobicContact CD1-CG1 4.43Å; F1946-I2097 HydrophobicContact CD1-CG2 4.34Å; F1946-I2097 HydrophobicContact CE1-CG2 4.21Å; F1946-L2100 HydrophobicContact CD1-CD2 4.38Å; F1946-L2100 HydrophobicContact CE1-CD2 4Å; F1946-L2101 HydrophobicContact CE1-CD2 3.91Å; F1946-L2101 HydrophobicContact CZ-CD2 3.8Å
1947I86Confident82.6Confident14.2 Ų14.222.9 Ų22.97%0.07311%0.106CC..Hα-helixtrans-61.4-42.4-178.8-68.5176.4000111K1943 S1944 L1945 W1950 K1951 P2095 I2097 L2100K1943-I1947 WeakPolarHBondContact O-CG1 3.31Å; K1943-I1947 PolarHBondContact O-N 3.04Å; S1944-I1947 PolarHBondContact O-N 3.24Å; L1945-I1947 PolarHBondContact O-N 3.31Å; I1947-W1950 PolarHBondContact O-N 3.38Å; I1947-K1951 HydrophobicContact CG2-CD 3.92Å; I1947-K1951 VanDerWaalsContact CG2-CE 3.45Å; I1947-K1951 HydrophobicContact CG2-CG 4.4Å; I1947-K1951 WeakPolarHBondContact O-CB 3.3Å; I1947-K1951 VanDerWaalsContact O-CG 3.23Å; I1947-K1951 WeakPolarHBondContact O-CG 3.38Å; I1947-K1951 PolarHBondContact O-N 2.95Å; I1947-P2095 HydrophobicContact CD1-CB 3.48Å; I1947-P2095 VanDerWaalsContact CD1-CB 3.46Å; I1947-P2095 HydrophobicContact CD1-CG 3.44Å; I1947-P2095 VanDerWaalsContact CD1-CG 3.46Å; I1947-I2097 HydrophobicContact CD1-CG1 3.75Å; I1947-I2097 HydrophobicContact CG1-CD1 4.29Å; I1947-I2097 HydrophobicContact CG1-CG1 3.85Å; I1947-L2100 HydrophobicContact CB-CD1 4.13Å; I1947-L2100 HydrophobicContact CB-CD2 4.37Å; I1947-L2100 HydrophobicContact CD1-CD1 3.95Å; I1947-L2100 HydrophobicContact CG1-CD1 3.58Å; I1947-L2100 HydrophobicContact CG1-CD2 4.01Å; I1947-L2100 HydrophobicContact CG2-CD1 3.77Å; I1947-L2100 HydrophobicContact CG2-CD2 4.34Å
1948N81.8Confident81.7Confident6 Ų624.4 Ų24.43%0.03211%0.114CC..Hα-helixtrans-69.8-44179.7-92.94.2000112.1Y1866 M1869 D1870 T1873 S1944 L1945 F1946 W1950 K1951 I1952Y1866-N1948 HydrophobicContact CD2-CB 4.2Å; Y1866-N1948 VanDerWaalsContact CD2-ND2 3.33Å; Y1866-N1948 WeakPolarHBondContact CD2-ND2 3.36Å; Y1866-N1948 HydrophobicContact CE2-CB 4.21Å; Y1866-N1948 VanDerWaalsContact CE2-CG 3.44Å; Y1866-N1948 WeakPolarHBondContact CE2-ND2 3.31Å; Y1866-N1948 PolarHBondContact O-ND2 2.86Å; M1869-N1948 VanDerWaalsContact C-ND2 3.33Å; M1869-N1948 HydrophobicContact CB-CB 4.37Å; M1869-N1948 VanDerWaalsContact CB-ND2 3.31Å; M1869-N1948 WeakPolarHBondContact CB-ND2 3.4Å; M1869-N1948 HydrophobicContact CE-CB 4.23Å; D1870-N1948 VanDerWaalsContact CA-ND2 3.31Å; D1870-N1948 WeakPolarHBondContact CA-ND2 3.33Å; D1870-N1948 WeakPolarHBondContact CB-ND2 3.33Å; D1870-N1948 PolarHBondContact N-ND2 2.87Å; D1870-N1948 PolarHBondContact OD1-ND2 3.5Å; T1873-N1948 WeakPolarHBondContact CG2-OD1 3.35Å; S1944-N1948 PolarHBondContact O-N 3.13Å; S1944-N1948 VanDerWaalsContact O-N 3.1Å; L1945-N1948 PolarHBondContact O-N 3.16Å; F1946-N1948 VanDerWaalsContact C-N 3.32Å; F1946-N1948 PolarHBondContact O-N 3.29Å; N1948-W1950 VanDerWaalsContact C-N 3.33Å; N1948-W1950 PolarHBondContact O-N 3.31Å; N1948-K1951 PolarHBondContact O-N 3.02Å; N1948-K1951 PolarHBondContact OD1-NZ 3.29Å; N1948-I1952 WeakPolarHBondContact O-CD1 3.25Å; N1948-I1952 WeakPolarHBondContact O-CG1 3.42Å; N1948-I1952 PolarHBondContact O-N 3.13Å; N1948-I1952 VanDerWaalsContact O-N 3.13Å
1949L81.6Confident80.6Confident4.8 Ų4.825.4 Ų25.43%0.02512%0.122CC..Hα-helixtrans-55-48.7171.9-84.2168.4000111.9M1869 L1945 F1946 I1952 N1953 Q2064 I2067 I2068 I2071M1869-L1949 VanDerWaalsContact CE-CA 3.46Å; M1869-L1949 HydrophobicContact CE-CB 4.12Å; M1869-L1949 HydrophobicContact CE-CD1 4.31Å; M1869-L1949 HydrophobicContact CE-CD2 3.19Å; M1869-L1949 VanDerWaalsContact CE-CD2 3.47Å; M1869-L1949 HydrophobicContact CE-CG 3.51Å; M1869-L1949 VanDerWaalsContact CE-CG 3.45Å; M1869-L1949 HydrophobicContact SD-CD1 4.18Å; M1869-L1949 HydrophobicContact SD-CD2 3.72Å; M1869-L1949 WeakPolarHBondContact SD-CD2 3.46Å; M1869-L1949 HydrophobicContact SD-CG 3.72Å; M1869-L1949 WeakPolarHBondContact SD-CG 3.33Å; L1945-L1949 HydrophobicContact CD1-CD1 4.43Å; L1945-L1949 HydrophobicContact CD2-CD1 3.48Å; L1945-L1949 VanDerWaalsContact CD2-CD1 3.47Å; L1945-L1949 HydrophobicContact CD2-CG 4.28Å; L1945-L1949 HydrophobicContact CG-CD1 4.08Å; L1945-L1949 WeakPolarHBondContact O-CB 3.4Å; L1945-L1949 WeakPolarHBondContact O-CG 3.44Å; L1945-L1949 PolarHBondContact O-N 3.24Å; F1946-L1949 PolarHBondContact O-N 3.15Å; L1949-I1952 PolarHBondContact O-N 3.02Å; L1949-N1953 PolarHBondContact O-N 3.13Å; L1949-N1953 PolarHBondContact O-ND2 3.07Å; L1949-Q2064 HydrophobicContact CD2-CB 4.45Å; L1949-I2067 HydrophobicContact CD1-CB 4.41Å; L1949-I2067 HydrophobicContact CD1-CG2 3.81Å; L1949-I2068 HydrophobicContact CB-CD1 4.15Å; L1949-I2068 HydrophobicContact CB-CG1 4.03Å; L1949-I2068 HydrophobicContact CD1-CG1 4.11Å; L1949-I2068 HydrophobicContact CD2-CG1 4.39Å; L1949-I2068 HydrophobicContact CG-CG1 4.43Å; L1949-I2071 HydrophobicContact CD1-CD1 3.5Å
1950W83.5Confident79.5Confident4.4 Ų4.426.9 Ų26.92%0.01713%0.131CC..Hα-helixtrans-68.4-41.9-178.1-175.6-99.3000112.4F1946 I1947 N1948 I1952 N1953 D1954 F2062 I2068 L2100 L2104 W2111 L2124 I2127F1946-W1950 HydrophobicContact CE1-CB 4.49Å; F1946-W1950 HydrophobicContact CZ-CB 4.42Å; F1946-W1950 VanDerWaalsContact O-CB 3.3Å; F1946-W1950 WeakPolarHBondContact O-CB 3.4Å; F1946-W1950 PolarHBondContact O-N 3.14Å; I1947-W1950 PolarHBondContact O-N 3.38Å; N1948-W1950 VanDerWaalsContact C-N 3.33Å; N1948-W1950 PolarHBondContact O-N 3.31Å; W1950-I1952 VanDerWaalsContact C-N 3.27Å; W1950-I1952 PolarHBondContact O-N 3.14Å; W1950-N1953 CarbonylContact O-C 3.52Å; W1950-N1953 PolarHBondContact O-N 3.24Å; W1950-N1953 VanDerWaalsContact O-N 3.15Å; W1950-D1954 VanDerWaalsContact O-CB 3.29Å; W1950-D1954 WeakPolarHBondContact O-CB 3.32Å; W1950-D1954 PolarHBondContact O-N 3.15Å; W1950-F2062 HydrophobicContact CZ3-CE2 4.49Å; W1950-F2062 AromaticContact CZ3-CZ 3.94Å; W1950-F2062 HydrophobicContact CZ3-CZ 3.97Å; W1950-I2068 HydrophobicContact CE3-CD1 4.48Å; W1950-L2100 HydrophobicContact CB-CD2 4.13Å; W1950-L2100 HydrophobicContact CG-CD2 4.17Å; W1950-L2100 HydrophobicContact CG-CG 4.48Å; W1950-L2104 HydrophobicContact CD2-CD1 3.85Å; W1950-L2104 HydrophobicContact CE3-CD1 3.85Å; W1950-L2104 HydrophobicContact CH2-CD1 3.43Å; W1950-L2104 VanDerWaalsContact CH2-CD1 3.42Å; W1950-L2104 HydrophobicContact CH2-CG 3.62Å; W1950-L2104 HydrophobicContact CZ2-CB 4.04Å; W1950-L2104 HydrophobicContact CZ2-CD1 3.41Å; W1950-L2104 VanDerWaalsContact CZ2-CD1 3.41Å; W1950-L2104 HydrophobicContact CZ2-CG 3.45Å; W1950-L2104 VanDerWaalsContact CZ2-CG 3.44Å; W1950-L2104 HydrophobicContact CZ3-CD1 3.65Å; W1950-L2104 HydrophobicContact CZ3-CG 4.34Å; W1950-W2111 HydrophobicContact CH2-CH2 4.35Å; W1950-W2111 AromaticContact CH2-CZ3 3.86Å; W1950-W2111 HydrophobicContact CH2-CZ3 4Å; W1950-W2111 AromaticContact CZ2-CH2 3.83Å; W1950-W2111 HydrophobicContact CZ2-CH2 3.83Å; W1950-W2111 AromaticContact CZ2-CZ3 3.71Å; W1950-W2111 HydrophobicContact CZ2-CZ3 3.71Å; W1950-L2124 HydrophobicContact CH2-CD1 3.99Å; W1950-L2124 HydrophobicContact CH2-CD2 4.1Å; W1950-I2127 HydrophobicContact CH2-CG2 4.46Å; W1950-I2127 HydrophobicContact CZ3-CD1 4.38Å; W1950-I2127 HydrophobicContact CZ3-CG2 3.97Å
1951K81.4Confident78.2Confident95 Ų9525.3 Ų25.341%0.41313%0.126SC..Hα-helixtrans-58.2-36.3177.1-80.2171.5-1801700112.8I1947 N1948 R1955I1947-K1951 HydrophobicContact CG2-CD 3.92Å; I1947-K1951 VanDerWaalsContact CG2-CE 3.45Å; I1947-K1951 HydrophobicContact CG2-CG 4.4Å; I1947-K1951 WeakPolarHBondContact O-CB 3.3Å; I1947-K1951 VanDerWaalsContact O-CG 3.23Å; I1947-K1951 WeakPolarHBondContact O-CG 3.38Å; I1947-K1951 PolarHBondContact O-N 2.95Å; N1948-K1951 PolarHBondContact O-N 3.02Å; N1948-K1951 PolarHBondContact OD1-NZ 3.29Å; K1951-R1955 WeakPolarHBondContact O-CB 3.35Å; K1951-R1955 VanDerWaalsContact O-CG 3.29Å; K1951-R1955 WeakPolarHBondContact O-CG 3.34Å; K1951-R1955 PolarHBondContact O-N 3.34Å; K1951-R1955 VanDerWaalsContact O-N 3.11Å
1952I75.1Confident76.7Confident12 Ų1228.3 Ų28.36%0.06215%0.146CC..Hα-helixtrans-66-49.9175.9-66.3164.5000109.7M1869 T1873 F1893 N1948 L1949 W1950 D1954 R1955 L1956 I2063M1869-I1952 HydrophobicContact CB-CD1 4.33Å; M1869-I1952 HydrophobicContact CE-CD1 3.58Å; M1869-I1952 VanDerWaalsContact CE-CD1 3.47Å; T1873-I1952 HydrophobicContact CG2-CD1 3.83Å; T1873-I1952 HydrophobicContact CG2-CG1 3.48Å; T1873-I1952 VanDerWaalsContact CG2-CG1 3.45Å; F1893-I1952 HydrophobicContact CE1-CD1 4.5Å; F1893-I1952 HydrophobicContact CE2-CG2 4.35Å; F1893-I1952 HydrophobicContact CZ-CD1 4.27Å; F1893-I1952 HydrophobicContact CZ-CG2 4.2Å; N1948-I1952 WeakPolarHBondContact O-CD1 3.25Å; N1948-I1952 WeakPolarHBondContact O-CG1 3.42Å; N1948-I1952 PolarHBondContact O-N 3.13Å; N1948-I1952 VanDerWaalsContact O-N 3.13Å; L1949-I1952 PolarHBondContact O-N 3.02Å; W1950-I1952 VanDerWaalsContact C-N 3.27Å; W1950-I1952 PolarHBondContact O-N 3.14Å; I1952-D1954 PolarHBondContact O-N 3.21Å; I1952-R1955 PolarHBondContact O-N 3.03Å; I1952-L1956 HydrophobicContact CG2-CD1 4.23Å; I1952-L1956 WeakPolarHBondContact O-CG 3.3Å; I1952-L1956 PolarHBondContact O-N 3.21Å; I1952-L1956 VanDerWaalsContact O-N 3.13Å; I1952-I2063 HydrophobicContact CG2-CD1 4.21Å
1953N75.9Confident74.8Confident3.4 Ų3.433 Ų332%0.01817%0.171CC..Hα-helixtrans-66.8-37.7-179.5-77.6-32000112.9L1949 W1950 L1956 I1957 F2062 I2063 I2068L1949-N1953 PolarHBondContact O-N 3.13Å; L1949-N1953 PolarHBondContact O-ND2 3.07Å; W1950-N1953 CarbonylContact O-C 3.52Å; W1950-N1953 PolarHBondContact O-N 3.24Å; W1950-N1953 VanDerWaalsContact O-N 3.15Å; N1953-L1956 WeakPolarHBondContact O-CB 3.34Å; N1953-L1956 PolarHBondContact O-N 3.17Å; N1953-I1957 VanDerWaalsContact O-CG1 3.27Å; N1953-I1957 WeakPolarHBondContact O-CG1 3.31Å; N1953-I1957 PolarHBondContact O-N 3.15Å; N1953-F2062 HydrophobicContact CB-CE2 4.08Å; N1953-F2062 HydrophobicContact CB-CZ 4.06Å; N1953-F2062 WeakPolarHBondContact ND2-CE1 3.45Å; N1953-I2063 PolarHBondContact ND2-O 3.07Å; N1953-I2063 VanDerWaalsContact ND2-O 3.14Å; N1953-I2063 WeakPolarHBondContact OD1-CB 3.17Å; N1953-I2063 PolarHBondContact OD1-N 3.09Å; N1953-I2063 VanDerWaalsContact OD1-N 3.15Å; N1953-I2068 VanDerWaalsContact ND2-CD1 3.28Å; N1953-I2068 WeakPolarHBondContact ND2-CD1 3.25Å
1954D78.4Confident72.5Confident44 Ų4436.5 Ų36.524%0.23520%0.196CC..Hα-helixtrans-63.9-41.7175.3-178.750.3000111.7W1950 I1952 L1956 I1957 N1958 W2111W1950-D1954 VanDerWaalsContact O-CB 3.29Å; W1950-D1954 WeakPolarHBondContact O-CB 3.32Å; W1950-D1954 PolarHBondContact O-N 3.15Å; I1952-D1954 PolarHBondContact O-N 3.21Å; D1954-L1956 VanDerWaalsContact C-N 3.31Å; D1954-L1956 PolarHBondContact O-N 3.02Å; D1954-I1957 PolarHBondContact O-N 3.13Å; D1954-N1958 VanDerWaalsContact CG-ND2 3.33Å; D1954-N1958 VanDerWaalsContact O-CB 3.31Å; D1954-N1958 WeakPolarHBondContact O-CB 3.33Å; D1954-N1958 VanDerWaalsContact O-CG 3.27Å; D1954-N1958 PolarHBondContact O-N 3.22Å; D1954-N1958 PolarHBondContact O-ND2 3.05Å; D1954-N1958 VanDerWaalsContact O-ND2 3.07Å; D1954-N1958 PolarHBondContact OD1-ND2 3.1Å; D1954-N1958 PolarHBondContact OD2-ND2 3.19Å; D1954-W2111 VanDerWaalsContact OD1-CH2 3.3Å; D1954-W2111 WeakPolarHBondContact OD1-CH2 3.41Å; D1954-W2111 VanDerWaalsContact OD1-CZ2 3.24Å; D1954-W2111 WeakPolarHBondContact OD1-CZ2 3.35Å
1955R74.1Confident70.2Confident131.4 Ų131.442 Ų4250%0.49622%0.224SC..Hα-helixtrans-60.7-40.4172.8-76.4176.7-178.4177.22.8112T1873 K1951 I1952 A1959T1873-R1955 PolarHBondContact O-NH1 3.12Å; T1873-R1955 VanDerWaalsContact O-NH1 3.08Å; K1951-R1955 WeakPolarHBondContact O-CB 3.35Å; K1951-R1955 VanDerWaalsContact O-CG 3.29Å; K1951-R1955 WeakPolarHBondContact O-CG 3.34Å; K1951-R1955 PolarHBondContact O-N 3.34Å; K1951-R1955 VanDerWaalsContact O-N 3.11Å; I1952-R1955 PolarHBondContact O-N 3.03Å; R1955-A1959 VanDerWaalsContact O-CB 3.31Å; R1955-A1959 WeakPolarHBondContact O-CB 3.34Å; R1955-A1959 PolarHBondContact O-N 3.27Å
1956L69.8Low67.9Low22.2 Ų22.248.2 Ų48.212%0.11626%0.257CS..Hα-helixtrans-65.6-47177.1-73.7165.1000111.8F1883 Y1889 I1952 N1953 D1954 N1958 A1959 V1960 I2063F1883-L1956 HydrophobicContact CD1-CD2 4.08Å; F1883-L1956 HydrophobicContact CE1-CD2 3.97Å; F1883-L1956 HydrophobicContact CE1-CG 4.44Å; Y1889-L1956 HydrophobicContact CD1-CD2 4.4Å; Y1889-L1956 HydrophobicContact CE1-CD1 4.23Å; Y1889-L1956 HydrophobicContact CE1-CD2 4.22Å; Y1889-L1956 HydrophobicContact CE1-CG 4.48Å; Y1889-L1956 HydrophobicContact CE2-CD2 4.23Å; I1952-L1956 HydrophobicContact CG2-CD1 4.23Å; I1952-L1956 WeakPolarHBondContact O-CG 3.3Å; I1952-L1956 PolarHBondContact O-N 3.21Å; I1952-L1956 VanDerWaalsContact O-N 3.13Å; N1953-L1956 WeakPolarHBondContact O-CB 3.34Å; N1953-L1956 PolarHBondContact O-N 3.17Å; D1954-L1956 VanDerWaalsContact C-N 3.31Å; D1954-L1956 PolarHBondContact O-N 3.02Å; L1956-N1958 VanDerWaalsContact C-N 3.33Å; L1956-N1958 PolarHBondContact O-N 3.12Å; L1956-A1959 PolarHBondContact O-N 3.28Å; L1956-V1960 VanDerWaalsContact O-CG2 3.31Å; L1956-V1960 WeakPolarHBondContact O-CG2 3.31Å; L1956-V1960 PolarHBondContact O-N 3.04Å; L1956-V1960 VanDerWaalsContact O-N 3.1Å; L1956-I2063 HydrophobicContact CD1-CD1 3.46Å; L1956-I2063 VanDerWaalsContact CD1-CD1 3.4Å; L1956-I2063 HydrophobicContact CD1-CG1 4.05Å
1957I70.9Confident65.2Low5.2 Ų5.254.9 Ų54.93%0.02729%0.293CS..Hα-helixtrans-60.6-46.1177.4-66.2163.7000110.3N1953 D1954 A1959 V1960 T1961 F2062 W2111 L2117 L2124N1953-I1957 VanDerWaalsContact O-CG1 3.27Å; N1953-I1957 WeakPolarHBondContact O-CG1 3.31Å; N1953-I1957 PolarHBondContact O-N 3.15Å; D1954-I1957 PolarHBondContact O-N 3.13Å; I1957-A1959 VanDerWaalsContact C-N 3.34Å; I1957-A1959 PolarHBondContact O-N 3.25Å; I1957-V1960 WeakPolarHBondContact O-CB 3.42Å; I1957-V1960 PolarHBondContact O-N 2.97Å; I1957-V1960 VanDerWaalsContact O-N 3.14Å; I1957-T1961 HydrophobicContact CG2-CG2 4.41Å; I1957-T1961 WeakPolarHBondContact O-CG2 3.39Å; I1957-T1961 PolarHBondContact O-N 3.07Å; I1957-T1961 VanDerWaalsContact O-N 3.11Å; I1957-T1961 PolarHBondContact O-OG1 3.11Å; I1957-F2062 HydrophobicContact CD1-CD2 4.5Å; I1957-F2062 HydrophobicContact CD1-CE2 4.04Å; I1957-W2111 HydrophobicContact CD1-CE3 4.23Å; I1957-W2111 HydrophobicContact CD1-CH2 4.43Å; I1957-W2111 HydrophobicContact CD1-CZ3 4.1Å; I1957-W2111 HydrophobicContact CG2-CB 4.37Å; I1957-W2111 HydrophobicContact CG2-CD2 3.72Å; I1957-W2111 HydrophobicContact CG2-CE3 4.2Å; I1957-W2111 HydrophobicContact CG2-CG 3.8Å; I1957-W2111 HydrophobicContact CG2-CZ2 4.4Å; I1957-L2117 HydrophobicContact CG2-CD1 4.41Å; I1957-L2124 HydrophobicContact CD1-CD2 4.17Å
1958N69.7Low62.7Low56.4 Ų56.461.8 Ų61.830%0.30233%0.33SS..Hα-helixtrans-68-34.4-179-69.1-37.5000112.7D1954 L1956 V1960 T1961 T1962 W2111D1954-N1958 VanDerWaalsContact CG-ND2 3.33Å; D1954-N1958 VanDerWaalsContact O-CB 3.31Å; D1954-N1958 WeakPolarHBondContact O-CB 3.33Å; D1954-N1958 VanDerWaalsContact O-CG 3.27Å; D1954-N1958 PolarHBondContact O-N 3.22Å; D1954-N1958 PolarHBondContact O-ND2 3.05Å; D1954-N1958 VanDerWaalsContact O-ND2 3.07Å; D1954-N1958 PolarHBondContact OD1-ND2 3.1Å; D1954-N1958 PolarHBondContact OD2-ND2 3.19Å; L1956-N1958 VanDerWaalsContact C-N 3.33Å; L1956-N1958 PolarHBondContact O-N 3.12Å; N1958-V1960 VanDerWaalsContact C-N 3.3Å; N1958-V1960 PolarHBondContact O-N 2.93Å; N1958-T1961 WeakPolarHBondContact CA-OG1 3.35Å; N1958-T1961 PolarHBondContact O-N 3.09Å; N1958-T1961 PolarHBondContact O-OG1 3.03Å; N1958-T1962 VanDerWaalsContact O-CB 3.28Å; N1958-T1962 WeakPolarHBondContact O-CB 3.33Å; N1958-T1962 VanDerWaalsContact O-CG2 3.29Å; N1958-T1962 WeakPolarHBondContact O-CG2 3.34Å; N1958-T1962 PolarHBondContact O-N 3.15Å; N1958-T1962 VanDerWaalsContact O-N 3.13Å; N1958-T1962 PolarHBondContact O-OG1 3.06Å; N1958-W2111 PolarHBondContact OD1-NE1 3.11Å
1959A65.4Low60.3Low22.4 Ų22.466.4 Ų66.419%0.18536%0.363CS..Hα-helixtrans-62.5-36.4172.800000112.2F1883 R1955 L1956 I1957 T1962 N1963F1883-A1959 HydrophobicContact CD1-CB 3.91Å; F1883-A1959 HydrophobicContact CE1-CB 3.67Å; F1883-A1959 HydrophobicContact CE2-CB 4.06Å; F1883-A1959 HydrophobicContact CG-CB 4.4Å; F1883-A1959 HydrophobicContact CZ-CB 3.61Å; R1955-A1959 VanDerWaalsContact O-CB 3.31Å; R1955-A1959 WeakPolarHBondContact O-CB 3.34Å; R1955-A1959 PolarHBondContact O-N 3.27Å; L1956-A1959 PolarHBondContact O-N 3.28Å; I1957-A1959 VanDerWaalsContact C-N 3.34Å; I1957-A1959 PolarHBondContact O-N 3.25Å; A1959-T1962 PolarHBondContact O-OG1 3.25Å; A1959-N1963 PolarHBondContact O-N 3.37Å
1960V64.1Low57.5Low33 Ų3372.2 Ų72.220%0.240%0.402CS..Hα-helixtrans-72.8-40.9178.1175.80000111.7L1956 I1957 N1958 V2060 L2117L1956-V1960 VanDerWaalsContact O-CG2 3.31Å; L1956-V1960 WeakPolarHBondContact O-CG2 3.31Å; L1956-V1960 PolarHBondContact O-N 3.04Å; L1956-V1960 VanDerWaalsContact O-N 3.1Å; I1957-V1960 WeakPolarHBondContact O-CB 3.42Å; I1957-V1960 PolarHBondContact O-N 2.97Å; I1957-V1960 VanDerWaalsContact O-N 3.14Å; N1958-V1960 VanDerWaalsContact C-N 3.3Å; N1958-V1960 PolarHBondContact O-N 2.93Å; V1960-V2060 HydrophobicContact CG1-CG2 4.31Å; V1960-V2060 HydrophobicContact CG2-CB 4.32Å; V1960-V2060 HydrophobicContact CG2-CG1 4.18Å; V1960-V2060 HydrophobicContact CG2-CG2 3.6Å; V1960-V2060 VanDerWaalsContact CG2-CG2 3.44Å; V1960-L2117 HydrophobicContact CG1-CD2 4.4Å
1961T60.9Low54.9Low30.4 Ų30.477 Ų7719%0.18744%0.436CS..Hα-helixtrans-74.6-32.2-179.158.30000112.9I1957 N1958 N1963 S1964 N2114 L2117I1957-T1961 HydrophobicContact CG2-CG2 4.41Å; I1957-T1961 WeakPolarHBondContact O-CG2 3.39Å; I1957-T1961 PolarHBondContact O-N 3.07Å; I1957-T1961 VanDerWaalsContact O-N 3.11Å; I1957-T1961 PolarHBondContact O-OG1 3.11Å; N1958-T1961 WeakPolarHBondContact CA-OG1 3.35Å; N1958-T1961 PolarHBondContact O-N 3.09Å; N1958-T1961 PolarHBondContact O-OG1 3.03Å; T1961-N1963 VanDerWaalsContact C-N 3.33Å; T1961-N1963 PolarHBondContact O-N 3.48Å; T1961-S1964 VanDerWaalsContact O-CB 3.26Å; T1961-S1964 WeakPolarHBondContact O-CB 3.25Å; T1961-S1964 PolarHBondContact O-N 3.22Å; T1961-N2114 VanDerWaalsContact CG2-ND2 3.33Å; T1961-N2114 WeakPolarHBondContact CG2-ND2 3.42Å; T1961-L2117 HydrophobicContact CG2-CD1 4.32Å
1962T54.5Low52.4Low86.4 Ų86.479.3 Ų79.353%0.5345%0.453SS..Hα-helixtrans-74.3-26-17949.40000114.1N1958 A1959 S1964 N1965N1958-T1962 VanDerWaalsContact O-CB 3.28Å; N1958-T1962 WeakPolarHBondContact O-CB 3.33Å; N1958-T1962 VanDerWaalsContact O-CG2 3.29Å; N1958-T1962 WeakPolarHBondContact O-CG2 3.34Å; N1958-T1962 PolarHBondContact O-N 3.15Å; N1958-T1962 VanDerWaalsContact O-N 3.13Å; N1958-T1962 PolarHBondContact O-OG1 3.06Å; A1959-T1962 PolarHBondContact O-OG1 3.25Å; T1962-S1964 PolarHBondContact O-N 3.14Å; T1962-S1964 VanDerWaalsContact O-N 3.12Å; T1962-N1965 PolarHBondContact O-N 3.12Å
1963N48.8Very low50.3Low100 Ų10085.8 Ų85.854%0.53549%0.488SS..THydrogen-bonded Turntrans-66.1-2.3174.2-77.2-9.7000113.5A1959 T1961 N1965A1959-N1963 PolarHBondContact O-N 3.37Å; T1961-N1963 VanDerWaalsContact C-N 3.33Å; T1961-N1963 PolarHBondContact O-N 3.48Å; N1963-N1965 VanDerWaalsContact C-N 3.32Å; N1963-N1965 PolarHBondContact O-N 2.95Å
1964S40.8Very low48.1Very low73.2 Ų73.290.2 Ų90.251%0.51252%0.519SS..THydrogen-bonded Turntrans-83.6-16.7177.1-167.30000114.5T1961 T1962T1961-S1964 VanDerWaalsContact O-CB 3.26Å; T1961-S1964 WeakPolarHBondContact O-CB 3.25Å; T1961-S1964 PolarHBondContact O-N 3.22Å; T1962-S1964 PolarHBondContact O-N 3.14Å; T1962-S1964 VanDerWaalsContact O-N 3.12Å
1965N39.1Very low45.8Very low134.4 Ų134.494.7 Ų94.772%0.71954%0.543SS*.SBendtrans-101.7-6-170.1-74.4-3.9000114.8T1962 N1963T1962-N1965 PolarHBondContact O-N 3.12Å; N1963-N1965 VanDerWaalsContact C-N 3.32Å; N1963-N1965 PolarHBondContact O-N 2.95Å
1966N35.1Very low43.6Very low132.8 Ų132.895.2 Ų95.271%0.7156%0.556SS**SBendtrans-98.5-5.5-174.2-89.86.4000115.6N1968N1966-N1968 VanDerWaalsContact C-N 3.3Å; N1966-N1968 PolarHBondContact O-N 3.2Å; N1966-N1968 VanDerWaalsContact O-N 3.13Å
1967D32.4Very low41.7Very low141.4 Ų141.4100.6 Ų100.676%0.75658%0.584SS**G310 helixtrans-8510.5-177.6-69.8-17.9000114.3
1968N33.4Very low39.6Very low158 Ų158107.1 Ų107.185%0.84562%0.619SS**  trans-115.741.2178.4-76.6-18.3000113.5N1966 C1970N1966-N1968 VanDerWaalsContact C-N 3.3Å; N1966-N1968 PolarHBondContact O-N 3.2Å; N1966-N1968 VanDerWaalsContact O-N 3.13Å; N1968-C1970 PolarHBondContact O-N 2.93Å
1969S30.4Very low37.6Very low103.8 Ų103.8111.9 Ų111.973%0.72665%0.645SS**  trans-130.386.4164.660.60000111.7S1971S1969-S1971 VanDerWaalsContact C-N 3.29Å; S1969-S1971 PolarHBondContact O-N 2.75Å
1970C24.2Very low35.7Very low126.2 Ų126.2116.7 Ų116.785%0.85367%0.672SS**  trans-104.5116.6160.3-97.50000109.6N1968N1968-C1970 PolarHBondContact O-N 2.93Å
1971S29.4Very low33.8Very low104.4 Ų104.4123.2 Ų123.273%0.7371%0.705SS**  trans108.8109.615752.10000116.1S1969S1969-S1971 VanDerWaalsContact C-N 3.29Å; S1969-S1971 PolarHBondContact O-N 2.75Å
1972N28.7Very low32.1Very low145 Ų145126.4 Ų126.478%0.77573%0.729SS**  trans61.8117.8135.9-63.50.9000118.8
1973D30.7Very low30.6Very low147.8 Ų147.8132.5 Ų132.579%0.7974%0.743SS**  143.6121.5112.7-78.3-23.3000115.3
1974S29.2Very low29.4Very low94.8 Ų94.8132 Ų13266%0.66375%0.748SS**  trans-22.9136.8157.362.20000116.6
1975N29.4Very low28.7Very low140.2 Ų140.2135 Ų13575%0.7576%0.758SS**  trans115.3111.8132.1-87.2-14.5000116.2
1976N29.7Very low28.1Very low141.8 Ų141.8134.1 Ų134.176%0.75876%0.757SS**  trans109.8111.1131.4-82-18.5000117.2
1977N28.8Very low27.6Very low134.6 Ų134.6134.4 Ų134.472%0.7276%0.759SS**  trans20.3120.6137.5-62.4-17.8000116.7
1978N27.3Very low27.2Very low142 Ų142135.6 Ų135.676%0.75976%0.76SS**  trans115.9106.6139.4-65.5-15.2000113.6T1980N1978-T1980 VanDerWaalsContact C-N 3.28Å; N1978-T1980 PolarHBondContact O-N 3.48Å
1979D27.1Very low26.8Very low158.2 Ų158.2136.7 Ų136.785%0.84676%0.757SS**  trans-135.2106.8140.2-76.9-25.5000112.9L1981D1979-L1981 PolarHBondContact O-N 3.37Å
1980T25.7Very low26.5Very low121.6 Ų121.6137.7 Ų137.775%0.74676%0.759SS**  trans-88.3107.9156.847.70000111.7N1978 S1982N1978-T1980 VanDerWaalsContact C-N 3.28Å; N1978-T1980 PolarHBondContact O-N 3.48Å; T1980-S1982 VanDerWaalsContact C-N 3.3Å; T1980-S1982 PolarHBondContact O-N 3Å
1981L24.7Very low26.4Very low169.8 Ų169.8139 Ų13989%0.88976%0.757SS**  trans-81105.1154.4-126.393.7000112.9D1979D1979-L1981 PolarHBondContact O-N 3.37Å
1982S23.8Very low26.2Very low99 Ų99142.6 Ų142.669%0.69276%0.762SS**  trans-75.1125.7161.655.50000111.1T1980 S1984T1980-S1982 VanDerWaalsContact C-N 3.3Å; T1980-S1982 PolarHBondContact O-N 3Å; S1982-S1984 VanDerWaalsContact C-N 3.29Å; S1982-S1984 PolarHBondContact O-N 3.24Å; S1982-S1984 VanDerWaalsContact O-N 3.15Å
1983Y24.3Very low25.9Very low212.8 Ų212.8140.6 Ų140.684%0.83576%0.759SS**  trans-49.7122.8138.2-122.3-102.7000110.4D1985 Y2166Y1983-D1985 WeakPolarHBondContact CE1-OD2 3.09Å; Y1983-Y2166 HydrophobicContact CE2-CE1 4.28Å
1984S23.8Very low25.6Very low91.2 Ų91.2143 Ų14364%0.63876%0.763SS**  trans-132.5146.5157.952.80000110.9S1982S1982-S1984 VanDerWaalsContact C-N 3.29Å; S1982-S1984 PolarHBondContact O-N 3.24Å; S1982-S1984 VanDerWaalsContact O-N 3.15Å
1985D25.7Very low25.2Very low134.2 Ų134.2147.1 Ų147.172%0.71877%0.771SS**  trans60.2123.4157.2-70.4-41.5000117.2Y1983 N1987Y1983-D1985 WeakPolarHBondContact CE1-OD2 3.09Å; D1985-N1987 PolarHBondContact O-N 3.04Å
1986V25.7Very low24.9Very low116 Ų116148.6 Ų148.670%0.70377%0.774SS**  trans-36.5107147.7174.30000112.6H1988V1986-H1988 PolarHBondContact O-N 2.92Å
1987N24.6Very low24.4Very low139 Ų139147.4 Ų147.474%0.74378%0.775SS**  trans-42.6105.1158.3-80.2-28.3000114.9D1985 K1989D1985-N1987 PolarHBondContact O-N 3.04Å; N1987-K1989 PolarHBondContact O-N 3.44Å; N1987-K1989 VanDerWaalsContact O-N 3.11Å
1988H24.8Very low24.1Very low167.4 Ų167.4150.5 Ų150.578%0.77578%0.783SS**  trans-24.3112.4144.9-84.8-74.3000114.6V1986 T1990V1986-H1988 PolarHBondContact O-N 2.92Å; H1988-T1990 PolarHBondContact O-N 3.05Å
1989K24.9Very low23.8Very low181.4 Ų181.4148.3 Ų148.379%0.78978%0.778SS**  trans-102.5106.1155.5-75.1178.4-180176.20113.6N1987 L1991N1987-K1989 PolarHBondContact O-N 3.44Å; N1987-K1989 VanDerWaalsContact O-N 3.11Å; K1989-L1991 PolarHBondContact O-N 3.13Å; K1989-L1991 VanDerWaalsContact O-N 3.15Å
1990T23.7Very low23.5Very low124 Ų124145.7 Ų145.776%0.76177%0.772SS**  trans15.9119.2143.647.10000116.8H1988 Q1992H1988-T1990 PolarHBondContact O-N 3.05Å; T1990-Q1992 VanDerWaalsContact C-N 3.26Å; T1990-Q1992 PolarHBondContact O-N 3.23Å
1991L23.6Very low23.3Very low154.4 Ų154.4146 Ų14681%0.80877%0.774SS**  trans8.2101.7155.2-100.4112.4000113.6K1989 S1993K1989-L1991 PolarHBondContact O-N 3.13Å; K1989-L1991 VanDerWaalsContact O-N 3.15Å; L1991-S1993 PolarHBondContact O-N 3.19Å
1992Q23.2Very low23.3Very low180.2 Ų180.2144.8 Ų144.884%0.84277%0.769SS**  trans-54.2114.7135.5-82-179.6-3.300111.4T1990 K1994T1990-Q1992 VanDerWaalsContact C-N 3.26Å; T1990-Q1992 PolarHBondContact O-N 3.23Å; Q1992-K1994 PolarHBondContact O-N 2.71Å
1993S23.4Very low23.3Very low103 Ų103146.4 Ų146.472%0.7277%0.774SS**  trans-169.9124.9151.259.10000113.2L1991L1991-S1993 PolarHBondContact O-N 3.19Å
1994K23.5Very low23.2Very low197.8 Ų197.8144.1 Ų144.186%0.8677%0.771SS**  trans58.197.1153-69.3177.8177.7177.80114.9Q1992 Q1996Q1992-K1994 PolarHBondContact O-N 2.71Å; K1994-Q1996 PolarHBondContact O-N 3.07Å; K1994-Q1996 VanDerWaalsContact O-N 3.17Å
1995Q22.2Very low23.3Very low181.2 Ų181.2147 Ų14785%0.84778%0.779SS**  -8.4112115.1-114.3172-10.800112.3
1996Q22.5Very low23.2Very low170.6 Ų170.6147.6 Ų147.680%0.79778%0.782SS**  trans-174.9111.5143.5-91.4175.6-1400110.7K1994 F1998K1994-Q1996 PolarHBondContact O-N 3.07Å; K1994-Q1996 VanDerWaalsContact O-N 3.17Å; Q1996-F1998 HydrophobicContact CB-CD2 4.37Å; Q1996-F1998 HydrophobicContact CG-CD2 4.42Å; Q1996-F1998 HydrophobicContact CG-CE2 4.26Å; Q1996-F1998 PolarHBondContact O-N 3.27Å
1997C20.2Very low23.1Very low117.4 Ų117.4147.4 Ų147.479%0.79378%0.783SS**  trans-9.3112.6153.5-64.30000112.2S1999C1997-S1999 PolarHBondContact O-N 3.47Å
1998F21.5Very low23Very low199.6 Ų199.6151.2 Ų151.288%0.87579%0.787SS**  -79.6113.5114.2-86.8-90.9000110.8Q1996Q1996-F1998 HydrophobicContact CB-CD2 4.37Å; Q1996-F1998 HydrophobicContact CG-CD2 4.42Å; Q1996-F1998 HydrophobicContact CG-CE2 4.26Å; Q1996-F1998 PolarHBondContact O-N 3.27Å
1999S20.8Very low23Very low95.8 Ų95.8152.7 Ų152.767%0.6779%0.792SS**  trans-87.1137155.953.60000112.1C1997C1997-S1999 PolarHBondContact O-N 3.47Å
2000S21Very low23Very low102.6 Ų102.6149.6 Ų149.672%0.71779%0.788SS**  trans52.5113.8149.952.20000117.4
2001T22.4Very low22.9Very low128.75 Ų128.75152 Ų15279%0.7979%0.791SS**  -154127116.525.90000107.8V2003T2001-V2003 PolarHBondContact O-N 3.24Å
2002N22.8Very low23Very low144.5 Ų144.5151.3 Ų151.377%0.77379%0.788SS**  trans-4.7113.8164.2-55.4-19.4000113.5
2003V25.6Very low23.1Very low132.5 Ų132.5148 Ų14880%0.80378%0.784SS**  trans-13999.4130.7-1790000107.9T2001T2001-V2003 PolarHBondContact O-N 3.24Å
2004E21.5Very low23.2Very low165 Ų165148.8 Ų148.877%0.77179%0.785SS**  trans-58.5130.4157.8-69.3170.6160.800110.4
2005N26.3Very low23.2Very low151.5 Ų151.5147 Ų14781%0.8178%0.784SS**  trans135100.2144.3-68.4-36.2000115.5
2006L22.4Very low23.3Very low146.5 Ų146.5147.6 Ų147.677%0.76778%0.784SS**  trans-88.6140.4146.4-137.870000111R2008L2006-R2008 HydrophobicContact CD2-CB 3.79Å; L2006-R2008 VanDerWaalsContact CD2-CD 3.43Å; L2006-R2008 HydrophobicContact CD2-CG 3.72Å; L2006-R2008 HydrophobicContact CG-CB 4.32Å; L2006-R2008 HydrophobicContact CG-CG 4.16Å; L2006-R2008 PolarHBondContact O-N 3.1Å
2007P25.2Very low23.5Very low113 Ų113147.1 Ų147.173%0.73479%0.785SS**  trans-103.2131.2149.732-26.3000112.5F2009P2007-F2009 HydrophobicContact CB-CD2 4.31Å; P2007-F2009 PolarHBondContact O-N 2.81Å
2008R22.2Very low23.7Very low217.5 Ų217.5146.8 Ų146.882%0.82178%0.779SS**  trans-69.5127.6164.4-76.6171.8177.3164.9-2.2108.9L2006 T2010L2006-R2008 HydrophobicContact CD2-CB 3.79Å; L2006-R2008 VanDerWaalsContact CD2-CD 3.43Å; L2006-R2008 HydrophobicContact CD2-CG 3.72Å; L2006-R2008 HydrophobicContact CG-CB 4.32Å; L2006-R2008 HydrophobicContact CG-CG 4.16Å; L2006-R2008 PolarHBondContact O-N 3.1Å; R2008-T2010 HydrophobicContact CB-CG2 4.3Å; R2008-T2010 PolarHBondContact O-N 3.24Å; R2008-T2010 VanDerWaalsContact O-N 3.1Å
2009F24.6Very low23.9Very low200 Ų200144.9 Ų144.988%0.87777%0.773SS**  trans-99.1104.3156.4-83.9-88.5000107.7P2007 E2011P2007-F2009 HydrophobicContact CB-CD2 4.31Å; P2007-F2009 PolarHBondContact O-N 2.81Å; F2009-E2011 PolarHBondContact O-N 2.93Å
2010T24.3Very low24.1Very low115.25 Ų115.25147.1 Ų147.171%0.70778%0.777SS**  -16.4111128.454.70000111.8R2008 N2012R2008-T2010 HydrophobicContact CB-CG2 4.3Å; R2008-T2010 PolarHBondContact O-N 3.24Å; R2008-T2010 VanDerWaalsContact O-N 3.1Å; T2010-N2012 PolarHBondContact O-N 2.79Å; T2010-N2012 VanDerWaalsContact O-N 3.12Å
2011E22.5Very low24.3Very low175.75 Ų175.75149.2 Ų149.282%0.82178%0.78SS**  trans-5.9133149.2-64.3174160.800116.3F2009F2009-E2011 PolarHBondContact O-N 2.93Å
2012N24.2Very low24.4Very low138.75 Ų138.75150.3 Ų150.374%0.74278%0.779SS**  trans141.386.4153.1-72-28.8000113.6T2010T2010-N2012 PolarHBondContact O-N 2.79Å; T2010-N2012 VanDerWaalsContact O-N 3.12Å
2013S26Very low24.4Very low111.25 Ų111.25150.8 Ų150.878%0.77878%0.781SS**  trans-151.595.8146.255.40000109.8L2015S2013-L2015 PolarHBondContact O-N 2.82Å
2014T25.1Very low24.4Very low119.25 Ų119.25150.3 Ų150.373%0.73277%0.773SS**  trans-5121.9149.448.60000114.6D1651 K2016D1651-T2014 WeakPolarHBondContact OD2-CG2 3.36Å; D1651-T2014 PolarHBondContact OD2-OG1 3.28Å; T2014-K2016 PolarHBondContact O-N 3.36Å
2015L23.2Very low24.5Very low161 Ų161149.4 Ų149.484%0.84377%0.77SS**  trans0.796.7151.4-76.9154.1000113.7S2013 I2017S2013-L2015 PolarHBondContact O-N 2.82Å; L2015-I2017 PolarHBondContact O-N 3.19Å
2016K24.4Very low24.4Very low193 Ų193147.4 Ų147.484%0.83976%0.756SS**  trans-73.9120.3141.6-84.3173.1-178174.90109.1T2014 V2018T2014-K2016 PolarHBondContact O-N 3.36Å; K2016-V2018 VanDerWaalsContact C-N 3.34Å; K2016-V2018 PolarHBondContact O-N 3.16Å; K2016-V2018 VanDerWaalsContact O-N 3.13Å
2017I26.2Very low24.5Very low159.25 Ų159.25144.8 Ų144.882%0.81775%0.748SS**  trans-81.988.6166.9-63.3162.2000108.8L2015 Q2019L2015-I2017 PolarHBondContact O-N 3.19Å; I2017-Q2019 HydrophobicContact CG2-CG 4.27Å; I2017-Q2019 PolarHBondContact O-N 3.24Å
2018V25.9Very low24.5Very low112 Ų112143.6 Ų143.668%0.67974%0.739SS**  trans-82.189.8148.61770000108.4K2016 N2020K2016-V2018 VanDerWaalsContact C-N 3.34Å; K2016-V2018 PolarHBondContact O-N 3.16Å; K2016-V2018 VanDerWaalsContact O-N 3.13Å; V2018-N2020 PolarHBondContact O-N 3.12Å
2019Q24.4Very low24.6Very low160.5 Ų160.5136.2 Ų136.275%0.7572%0.718SS**  trans-74.693.2160.9-85.3170.9-28.700112.3I2017 K2034I2017-Q2019 HydrophobicContact CG2-CG 4.27Å; I2017-Q2019 PolarHBondContact O-N 3.24Å; Q2019-K2034 WeakPolarHBondContact O-CE 3.49Å; Q2019-K2034 PolarHBondContact O-NZ 3.44Å
2020N25.6Very low24.7Very low141 Ų141131.5 Ų131.575%0.75470%0.701SS**  trans-112.2113.2167.4-71.1-21.1000110.6V2018 M2022V2018-N2020 PolarHBondContact O-N 3.12Å; N2020-M2022 PolarHBondContact O-N 3.35Å
2021N26.3Very low24.8Very low146.5 Ų146.5129.2 Ų129.278%0.78369%0.688SS**  trans-127.1104.8160-71-11.8000111.1N2023 K2034N2021-N2023 PolarHBondContact O-N 3.37Å; N2021-K2034 PolarHBondContact OD1-NZ 3.4Å
2022M22.7Very low25Very low152.25 Ų152.25127.7 Ų127.775%0.7568%0.682SS**  trans-99.383.9173.9-83-102.6-93.800110.6N2020 I2024 K2507N2020-M2022 PolarHBondContact O-N 3.35Å; M2022-I2024 HydrophobicContact CE-CD1 3.55Å; M2022-I2024 HydrophobicContact SD-CD1 3.93Å; M2022-I2024 HydrophobicContact SD-CG1 4.2Å; M2022-K2507 PolarHBondContact O-NZ 3.31Å
2023N24.7Very low25.1Very low155.5 Ų155.5127.6 Ų127.683%0.83267%0.671SS**  trans-109.893.5162.1-77.3-10.6000108.6N2021 M2025N2021-N2023 PolarHBondContact O-N 3.37Å; N2023-M2025 PolarHBondContact O-N 3.03Å
2024I25.5Very low25.1Very low122 Ų122129.3 Ų129.363%0.62666%0.664SS**  trans-94.793.2176.7-58168.8000108.1M2022 N2179 V2511M2022-I2024 HydrophobicContact CE-CD1 3.55Å; M2022-I2024 HydrophobicContact SD-CD1 3.93Å; M2022-I2024 HydrophobicContact SD-CG1 4.2Å; I2024-N2179 VanDerWaalsContact CD1-ND2 3.3Å; I2024-N2179 WeakPolarHBondContact CD1-ND2 3.41Å; I2024-V2511 HydrophobicContact CG2-CG1 4.17Å
2025M23.5Very low25.2Very low145 Ų145129.7 Ų129.771%0.71466%0.656SS**SBendtrans-137.2117.2152.7-124.7-169113.100106.5N2023 P2027N2023-M2025 PolarHBondContact O-N 3.03Å; M2025-P2027 WeakPolarHBondContact O-CD 3.3Å
2026E23.5Very low25.4Very low111 Ų111127.1 Ų127.152%0.51964%0.643SS.*  trans9.5122.9173.6-70.6176.2154.600115.5T2028 W2496 R2508E2026-T2028 VanDerWaalsContact C-N 3.28Å; E2026-T2028 PolarHBondContact O-N 3.03Å; E2026-T2028 VanDerWaalsContact O-N 3.1Å; E2026-W2496 WeakPolarHBondContact OE1-CH2 3.36Å; E2026-W2496 WeakPolarHBondContact OE1-CZ3 3.27Å; E2026-W2496 WeakPolarHBondContact OE2-CH2 3.41Å; E2026-W2496 WeakPolarHBondContact OE2-CZ3 3.45Å; E2026-R2508 IonicContact OE1-CZ 2.7Å; E2026-R2508 IonicContact OE1-NE 3.93Å; E2026-R2508 PolarHBondContact OE1-NE 3.42Å; E2026-R2508 IonicContact OE1-NH2 2.72Å; E2026-R2508 PolarHBondContact OE1-NH2 3.46Å; E2026-R2508 IonicContact OE2-NH2 2.79Å
2027P24.6Very low25.5Very low91.25 Ų91.25126.5 Ų126.559%0.59364%0.64SS**  trans-95.4108.7164.630.2-22.1000108.4M2025 T2029 I2030M2025-P2027 WeakPolarHBondContact O-CD 3.3Å; P2027-T2029 VanDerWaalsContact C-N 3.32Å; P2027-T2029 HydrophobicContact CB-CG2 4.47Å; P2027-T2029 WeakPolarHBondContact CB-OG1 3.22Å; P2027-T2029 WeakPolarHBondContact CG-OG1 3.17Å; P2027-T2029 PolarHBondContact O-N 3.27Å; P2027-I2030 HydrophobicContact CG-CD1 4.39Å; P2027-I2030 HydrophobicContact CG-CG1 4.22Å
2028T24.2Very low25.5Very low87.25 Ų87.25123.7 Ų123.754%0.53564%0.635SS.*  trans-66.796.6152.143.70000107E2026 I2030E2026-T2028 VanDerWaalsContact C-N 3.28Å; E2026-T2028 PolarHBondContact O-N 3.03Å; E2026-T2028 VanDerWaalsContact O-N 3.1Å; T2028-I2030 PolarHBondContact O-N 3.18Å
2029T26Very low25.5Very low62.75 Ų62.75122.1 Ų122.139%0.38563%0.629SS.*  trans-100.830.1173.556.80000113.2P2027 C2031 R2033 K2133 L2784P2027-T2029 VanDerWaalsContact C-N 3.32Å; P2027-T2029 HydrophobicContact CB-CG2 4.47Å; P2027-T2029 WeakPolarHBondContact CB-OG1 3.22Å; P2027-T2029 WeakPolarHBondContact CG-OG1 3.17Å; P2027-T2029 PolarHBondContact O-N 3.27Å; T2029-C2031 PolarHBondContact O-N 3.27Å; T2029-R2033 WeakPolarHBondContact O-CB 3.35Å; T2029-R2033 WeakPolarHBondContact O-CD 3.48Å; T2029-R2033 VanDerWaalsContact O-CG 3.23Å; T2029-R2033 WeakPolarHBondContact O-CG 3.36Å; T2029-R2033 PolarHBondContact O-N 2.93Å; T2029-R2033 VanDerWaalsContact OG1-CZ 3.29Å; T2029-R2033 PolarHBondContact OG1-NH1 3.44Å; T2029-K2133 PolarHBondContact O-NZ 3.36Å; T2029-K2133 PolarHBondContact OG1-NZ 2.81Å; T2029-K2133 VanDerWaalsContact OG1-NZ 3.14Å; T2029-L2784 HydrophobicContact CG2-CD1 4.18Å; T2029-L2784 HydrophobicContact CG2-CD2 4.02Å
2030I27Very low25.5Very low101.75 Ų101.75120.1 Ų120.152%0.52262%0.618SS.*  trans-87.637.9170.4-63.6171.6000109P2027 T2028 Q2032 T2073P2027-I2030 HydrophobicContact CG-CD1 4.39Å; P2027-I2030 HydrophobicContact CG-CG1 4.22Å; T2028-I2030 PolarHBondContact O-N 3.18Å; I2030-Q2032 PolarHBondContact O-N 3.11Å; I2030-T2073 HydrophobicContact CD1-CG2 3.48Å; I2030-T2073 VanDerWaalsContact CD1-CG2 3.48Å; I2030-T2073 HydrophobicContact CG1-CG2 4.01Å; I2030-T2073 HydrophobicContact CG2-CG2 4.39Å
2031C25.1Very low25.5Very low65.75 Ų65.75119.5 Ų119.544%0.44461%0.614SS.*  trans-78.940.6172.5-74.40000112.2T2029 R2033 K2034 E2126 H2180T2029-C2031 PolarHBondContact O-N 3.27Å; C2031-R2033 VanDerWaalsContact C-N 3.31Å; C2031-R2033 PolarHBondContact O-N 3.27Å; C2031-K2034 PolarHBondContact O-N 2.93Å; C2031-E2126 PolarHBondContact SG-OE1 3.46Å; C2031-H2180 VanDerWaalsContact CB-NE2 3.26Å; C2031-H2180 WeakPolarHBondContact CB-NE2 3.31Å; C2031-H2180 VanDerWaalsContact SG-CD2 3.55Å; C2031-H2180 PolarHBondContact SG-NE2 3.39Å
2032Q27.1Very low25.3Very low145.5 Ų145.5120 Ų12068%0.6861%0.611SS**G310 helixtrans-64.837.4151.5-77177-14.400108.1I2030 K2034 F2035 D2036 D2787I2030-Q2032 PolarHBondContact O-N 3.11Å; Q2032-K2034 VanDerWaalsContact C-N 3.26Å; Q2032-K2034 PolarHBondContact O-N 3.22Å; Q2032-F2035 PolarHBondContact O-N 3.14Å; Q2032-D2036 PolarHBondContact O-N 3.34Å; Q2032-D2787 PolarHBondContact NE2-OD1 3.45Å
2033R25.5Very low25.4Very low135.25 Ų135.25118 Ų11851%0.5161%0.608SS.*G310 helixtrans-60.959.3155.2-81.6-178.3179.71651108.8T2029 C2031 F2035 E2066 S2123T2029-R2033 WeakPolarHBondContact O-CB 3.35Å; T2029-R2033 WeakPolarHBondContact O-CD 3.48Å; T2029-R2033 VanDerWaalsContact O-CG 3.23Å; T2029-R2033 WeakPolarHBondContact O-CG 3.36Å; T2029-R2033 PolarHBondContact O-N 2.93Å; T2029-R2033 VanDerWaalsContact OG1-CZ 3.29Å; T2029-R2033 PolarHBondContact OG1-NH1 3.44Å; C2031-R2033 VanDerWaalsContact C-N 3.31Å; C2031-R2033 PolarHBondContact O-N 3.27Å; R2033-F2035 VanDerWaalsContact C-N 3.3Å; R2033-F2035 WeakPolarHBondContact O-CD2 3.38Å; R2033-F2035 PolarHBondContact O-N 3.32Å; R2033-E2066 IonicContact CZ-OE1 3.8Å; R2033-E2066 IonicContact NH1-OE1 3.44Å; R2033-E2066 PolarHBondContact NH1-OE1 3.23Å; R2033-S2123 PolarHBondContact NH2-OG 3.38Å
2034K25.7Very low25.3Very low148.25 Ų148.25114.6 Ų114.665%0.64560%0.596SS**G310 helixtrans-6944.4170.1-82.1-174.1173.9-176.60108.9Q2019 N2021 C2031 Q2032 D2036Q2019-K2034 WeakPolarHBondContact O-CE 3.49Å; Q2019-K2034 PolarHBondContact O-NZ 3.44Å; N2021-K2034 PolarHBondContact OD1-NZ 3.4Å; C2031-K2034 PolarHBondContact O-N 2.93Å; Q2032-K2034 VanDerWaalsContact C-N 3.26Å; Q2032-K2034 PolarHBondContact O-N 3.22Å; K2034-D2036 PolarHBondContact O-N 3.27Å
2035F28.8Very low25.2Very low126 Ų126117 Ų11755%0.55360%0.604SS**  trans-80.138.2168.1-80.9-80.3000107Q1905 Q2032 R2033 K2037 S2038 F2040 E2066Q1905-F2035 VanDerWaalsContact NE2-CE1 3.33Å; Q2032-F2035 PolarHBondContact O-N 3.14Å; R2033-F2035 VanDerWaalsContact C-N 3.3Å; R2033-F2035 WeakPolarHBondContact O-CD2 3.38Å; R2033-F2035 PolarHBondContact O-N 3.32Å; F2035-K2037 VanDerWaalsContact C-N 3.27Å; F2035-K2037 WeakPolarHBondContact O-CA 3.25Å; F2035-K2037 PolarHBondContact O-N 3.31Å; F2035-S2038 PolarHBondContact O-OG 3.41Å; F2035-S2038 VanDerWaalsContact O-OG 3.13Å; F2035-F2040 HydrophobicContact CD1-CE2 4.21Å; F2035-E2066 HydrophobicContact CE1-CG 4.3Å; F2035-E2066 HydrophobicContact CZ-CG 4.35Å
2036D26.2Very low25.2Very low107.75 Ų107.75117.2 Ų117.258%0.57661%0.608SS**  trans-69.154.1173.1-80.2-34.7000109K1831 Q2032 K2034 S2038 S2039K1831-D2036 IonicContact NZ-OD1 3.09Å; K1831-D2036 PolarHBondContact NZ-OD1 2.89Å; Q2032-D2036 PolarHBondContact O-N 3.34Å; K2034-D2036 PolarHBondContact O-N 3.27Å; D2036-S2038 PolarHBondContact O-N 3.05Å; D2036-S2039 PolarHBondContact O-N 3.33Å; D2036-S2039 PolarHBondContact O-OG 3.4Å; D2036-S2039 VanDerWaalsContact O-OG 3.14Å
2037K27.1Very low25.2Very low179.75 Ų179.75121.3 Ų121.378%0.78263%0.628SS**THydrogen-bonded Turntrans-88.312.2-179.8-82.7-173.4172.6-174.80112.5F2035 S2039F2035-K2037 VanDerWaalsContact C-N 3.27Å; F2035-K2037 WeakPolarHBondContact O-CA 3.25Å; F2035-K2037 PolarHBondContact O-N 3.31Å; K2037-S2039 VanDerWaalsContact C-N 3.3Å; K2037-S2039 PolarHBondContact O-N 2.91Å
2038S26Very low25.2Very low99.75 Ų99.75125.5 Ų125.570%0.69864%0.639SS**THydrogen-bonded Turntrans-94.413.5172.253.40000113.5F2035 D2036 F2040F2035-S2038 PolarHBondContact O-OG 3.41Å; F2035-S2038 VanDerWaalsContact O-OG 3.13Å; D2036-S2038 PolarHBondContact O-N 3.05Å; S2038-F2040 VanDerWaalsContact C-N 3.27Å; S2038-F2040 PolarHBondContact O-N 3.36Å
2039S25.5Very low25.1Very low80 Ų80126.5 Ų126.556%0.55965%0.65SS**  trans-111.325.817162.30000112.8D2036 K2037 L2041D2036-S2039 PolarHBondContact O-N 3.33Å; D2036-S2039 PolarHBondContact O-OG 3.4Å; D2036-S2039 VanDerWaalsContact O-OG 3.14Å; K2037-S2039 VanDerWaalsContact C-N 3.3Å; K2037-S2039 PolarHBondContact O-N 2.91Å; S2039-L2041 PolarHBondContact O-N 3.21Å
2040F25Very low25.1Very low118.5 Ų118.5129.6 Ų129.652%0.5267%0.668SS.*  trans-114.286164.5-99.7-88.2000109.3M1769 V1902 I1906 F2035 S2038 E2042M1769-F2040 HydrophobicContact SD-CE2 4.26Å; V1902-F2040 HydrophobicContact CB-CE1 4.44Å; V1902-F2040 HydrophobicContact CG1-CD1 4.36Å; V1902-F2040 HydrophobicContact CG1-CE1 3.38Å; V1902-F2040 HydrophobicContact CG1-CZ 3.91Å; V1902-F2040 HydrophobicContact CG2-CE1 4.2Å; V1902-F2040 HydrophobicContact CG2-CZ 4.25Å; I1906-F2040 HydrophobicContact CD1-CE1 3.7Å; I1906-F2040 HydrophobicContact CD1-CZ 4.03Å; F2035-F2040 HydrophobicContact CD1-CE2 4.21Å; S2038-F2040 VanDerWaalsContact C-N 3.27Å; S2038-F2040 PolarHBondContact O-N 3.36Å; F2040-E2042 HydrophobicContact CD1-CB 4.18Å; F2040-E2042 HydrophobicContact CD1-CG 3.8Å; F2040-E2042 HydrophobicContact CE1-CB 4.49Å; F2040-E2042 HydrophobicContact CE1-CG 4.09Å; F2040-E2042 WeakPolarHBondContact CE1-OE1 3.16Å; F2040-E2042 PolarHBondContact O-N 2.94Å
2041L24.7Very low24.8Very low127.5 Ų127.5133.4 Ų133.467%0.66868%0.684SS**  trans-10.168.2156.7-83.6162.2000112.2V1902 S2039 V2043V1902-L2041 HydrophobicContact CG1-CD1 4.45Å; S2039-L2041 PolarHBondContact O-N 3.21Å; L2041-V2043 VanDerWaalsContact C-N 3.28Å; L2041-V2043 HydrophobicContact CB-CG2 4.18Å; L2041-V2043 HydrophobicContact CD2-CG2 4.06Å; L2041-V2043 HydrophobicContact CG-CG2 4.32Å; L2041-V2043 PolarHBondContact O-N 3Å
2042E23.1Very low24.9Very low156.25 Ų156.25137.4 Ų137.473%0.7370%0.699SS**  trans-84.992.8146.1-91.1-176-17600107F2040 S2044F2040-E2042 HydrophobicContact CD1-CB 4.18Å; F2040-E2042 HydrophobicContact CD1-CG 3.8Å; F2040-E2042 HydrophobicContact CE1-CB 4.49Å; F2040-E2042 HydrophobicContact CE1-CG 4.09Å; F2040-E2042 WeakPolarHBondContact CE1-OE1 3.16Å; F2040-E2042 PolarHBondContact O-N 2.94Å; E2042-S2044 PolarHBondContact O-N 3.13Å
2043V24.9Very low24.8Very low111.25 Ų111.25138.9 Ų138.967%0.67471%0.706SS**  trans-68.272.5160.4-177.70000106.8L2041 H2045L2041-V2043 VanDerWaalsContact C-N 3.28Å; L2041-V2043 HydrophobicContact CB-CG2 4.18Å; L2041-V2043 HydrophobicContact CD2-CG2 4.06Å; L2041-V2043 HydrophobicContact CG-CG2 4.32Å; L2041-V2043 PolarHBondContact O-N 3Å; V2043-H2045 VanDerWaalsContact C-N 3.28Å; V2043-H2045 PolarHBondContact O-N 3.32Å; V2043-H2045 VanDerWaalsContact O-N 3.09Å
2044S22.3Very low24.7Very low83.75 Ų83.75142.3 Ų142.359%0.58673%0.725SS**  trans-8910016553.60000106.8E2042 N2046E2042-S2044 PolarHBondContact O-N 3.13Å; S2044-N2046 VanDerWaalsContact C-N 3.29Å; S2044-N2046 PolarHBondContact O-N 3.25Å
2045H23.9Very low24.8Very low172.75 Ų172.75142.3 Ų142.380%0.873%0.732SS**  trans-55.496163.4-79.9-82.1000108.9V2043V2043-H2045 VanDerWaalsContact C-N 3.28Å; V2043-H2045 PolarHBondContact O-N 3.32Å; V2043-H2045 VanDerWaalsContact O-N 3.09Å
2046N23.8Very low24.8Very low149.75 Ų149.75141.7 Ų141.780%0.80174%0.743SS**  trans-148.299.9160.6-90.9-29.4000109.5S2044 Q2048S2044-N2046 VanDerWaalsContact C-N 3.29Å; S2044-N2046 PolarHBondContact O-N 3.25Å; N2046-Q2048 PolarHBondContact O-N 3.2Å; N2046-Q2048 VanDerWaalsContact O-N 3.13Å
2047Q23.8Very low25.1Very low197 Ų197143.3 Ų143.392%0.92175%0.752SS**  trans-65.1101.7167.3-67.6172.7-28.600108.9
2048Q23.9Very low25.5Very low179 Ų179141.1 Ų141.184%0.83675%0.749SS**  trans-142.9106.6154.9-93.1173.511.800110.4N2046 V2050N2046-Q2048 PolarHBondContact O-N 3.2Å; N2046-Q2048 VanDerWaalsContact O-N 3.13Å; Q2048-V2050 PolarHBondContact O-N 3.05Å
2049S22.2Very low26.2Very low108.5 Ų108.5139.3 Ų139.376%0.75974%0.736SS**  trans-29.9113.1165.8520000114.4Q2051S2049-Q2051 PolarHBondContact O-N 2.82Å
2050V24.5Very low27.3Very low127.5 Ų127.5137.4 Ų137.477%0.77372%0.721SS**  trans-94.4103.9156.3177.20000107.4Q2048 I2052Q2048-V2050 PolarHBondContact O-N 3.05Å; V2050-I2052 HydrophobicContact CG1-CD1 3.85Å; V2050-I2052 HydrophobicContact CG1-CG1 3.95Å; V2050-I2052 PolarHBondContact O-N 3.03Å
2051Q21.6Very low28.6Very low182.25 Ų182.25137.6 Ų137.685%0.85272%0.723SS**  trans-69.1108.1166.9-69-179.8-10.900108.1S2049 Q2053S2049-Q2051 PolarHBondContact O-N 2.82Å; Q2051-Q2053 PolarHBondContact O-N 3.08Å; Q2051-Q2053 VanDerWaalsContact O-N 3.11Å
2052I26.9Very low30.3Very low148.75 Ų148.75132.7 Ų132.776%0.76370%0.696SS**  trans-102.6116.4162.1-72162.9000107.8V2050 K2054V2050-I2052 HydrophobicContact CG1-CD1 3.85Å; V2050-I2052 HydrophobicContact CG1-CG1 3.95Å; V2050-I2052 PolarHBondContact O-N 3.03Å; I2052-K2054 PolarHBondContact O-N 3.43Å; I2052-K2054 VanDerWaalsContact O-N 3.16Å
2053Q24.4Very low32.1Very low177.5 Ų177.5126.5 Ų126.583%0.82967%0.668SS**  trans-39.6123.8170.5-76.4171.8-39.400113.6Q2051 N2055Q2051-Q2053 PolarHBondContact O-N 3.08Å; Q2051-Q2053 VanDerWaalsContact O-N 3.11Å; Q2053-N2055 PolarHBondContact O-N 3.24Å; Q2053-N2055 VanDerWaalsContact O-N 3.14Å
2054K24.5Very low34.2Very low206.25 Ų206.25123.5 Ų123.590%0.89765%0.647SS**  trans-59.1102.9164.4-66.6174176.6177.30110.5I2052 S2056I2052-K2054 PolarHBondContact O-N 3.43Å; I2052-K2054 VanDerWaalsContact O-N 3.16Å; K2054-S2056 PolarHBondContact O-N 3.42Å
2055N26.9Very low36.7Very low148.75 Ų148.75120.4 Ų120.480%0.79563%0.625SS**  trans-121.1107.6152.4-93.4-9.2000109Q2053 N2057Q2053-N2055 PolarHBondContact O-N 3.24Å; Q2053-N2055 VanDerWaalsContact O-N 3.14Å; N2055-N2057 PolarHBondContact O-N 2.94Å
2056S28.7Very low39.2Very low112.25 Ų112.25116.8 Ų116.879%0.78561%0.608SS**  trans-91.481.9168.5560000111.2K2054K2054-S2056 PolarHBondContact O-N 3.42Å
2057N32.3Very low41.9Very low143.25 Ų143.25110 Ų11077%0.76657%0.572SS**  trans-106131.3166.3-75.1-20.9000108.4N2055 S2059N2055-N2057 PolarHBondContact O-N 2.94Å; N2057-S2059 VanDerWaalsContact C-N 3.33Å; N2057-S2059 PolarHBondContact O-N 3.32Å; N2057-S2059 PolarHBondContact O-OG 3.09Å
2058N36.3Very low44.8Very low132.75 Ų132.75100.7 Ų100.771%0.7153%0.528SS*.  trans-61.258.1180-68.4-21.3000114.1V2060N2058-V2060 PolarHBondContact O-N 3.2Å
2059S41.4Very low47.8Very low61.5 Ų61.593.2 Ų93.243%0.4349%0.494SS..  trans-80.4110.2170.4570000109.7N2057N2057-S2059 VanDerWaalsContact C-N 3.33Å; N2057-S2059 PolarHBondContact O-N 3.32Å; N2057-S2059 PolarHBondContact O-OG 3.09Å
2060V47.6Very low50.9Low41 Ų4188.7 Ų88.725%0.24846%0.461CS..PPolyproline II helixtrans-77.4129173.4-179.30000108.5V1960 N2058 I2120V1960-V2060 HydrophobicContact CG1-CG2 4.31Å; V1960-V2060 HydrophobicContact CG2-CB 4.32Å; V1960-V2060 HydrophobicContact CG2-CG1 4.18Å; V1960-V2060 HydrophobicContact CG2-CG2 3.6Å; V1960-V2060 VanDerWaalsContact CG2-CG2 3.44Å; N2058-V2060 PolarHBondContact O-N 3.2Å; V2060-I2120 HydrophobicContact CB-CD1 4.39Å; V2060-I2120 HydrophobicContact CG1-CD1 4.2Å; V2060-I2120 WeakPolarHBondContact O-CD1 3.43Å
2061H53.2Low54Low122 Ų12282.6 Ų82.657%0.56542%0.424SS*.PPolyproline II helixtrans-96.5133.5172.4-77.7-84000110.2L1890L1890-H2061 HydrophobicContact CD1-CB 4.3Å
2062F59.4Low57.2Low23.75 Ų23.7573.9 Ų73.910%0.10438%0.384CS..PPolyproline II helixtrans-71.3129.3170.6-161.2-95.2000109.1W1950 N1953 I1957 Q2064 P2065 I2068 I2120 L2124 I2127W1950-F2062 HydrophobicContact CZ3-CE2 4.49Å; W1950-F2062 AromaticContact CZ3-CZ 3.94Å; W1950-F2062 HydrophobicContact CZ3-CZ 3.97Å; N1953-F2062 HydrophobicContact CB-CE2 4.08Å; N1953-F2062 HydrophobicContact CB-CZ 4.06Å; N1953-F2062 WeakPolarHBondContact ND2-CE1 3.45Å; I1957-F2062 HydrophobicContact CD1-CD2 4.5Å; I1957-F2062 HydrophobicContact CD1-CE2 4.04Å; F2062-Q2064 PolarHBondContact O-N 3.4Å; F2062-P2065 HydrophobicContact CD1-CB 3.62Å; F2062-P2065 HydrophobicContact CD1-CG 4.15Å; F2062-P2065 HydrophobicContact CE1-CB 4.01Å; F2062-P2065 WeakPolarHBondContact O-CD 3.44Å; F2062-I2068 HydrophobicContact CE1-CD1 3.96Å; F2062-I2068 HydrophobicContact CZ-CD1 4.37Å; F2062-I2120 HydrophobicContact CB-CD1 4.01Å; F2062-I2120 HydrophobicContact CB-CG1 4.02Å; F2062-I2120 HydrophobicContact CB-CG2 3.93Å; F2062-I2120 HydrophobicContact CD2-CD1 4.34Å; F2062-I2120 HydrophobicContact CD2-CG2 3.42Å; F2062-I2120 HydrophobicContact CE2-CG2 4.18Å; F2062-I2120 HydrophobicContact CG-CG2 3.96Å; F2062-L2124 HydrophobicContact CE2-CD2 4.16Å; F2062-L2124 HydrophobicContact CE2-CG 4.38Å; F2062-I2127 HydrophobicContact CE1-CD1 3.66Å; F2062-I2127 HydrophobicContact CZ-CD1 3.65Å
2063I62.1Low60.2Low26 Ų2667.8 Ų67.813%0.13335%0.353CS..SBendtrans-83.8120.7-174.8-56.7177.8000109.2Y1889 F1893 I1952 N1953 L1956Y1889-I2063 HydrophobicContact CD1-CD1 3.98Å; Y1889-I2063 HydrophobicContact CE1-CD1 3.68Å; F1893-I2063 HydrophobicContact CD1-CD1 4.28Å; F1893-I2063 HydrophobicContact CD1-CG2 3.84Å; F1893-I2063 VanDerWaalsContact CD1-CG2 3.45Å; F1893-I2063 HydrophobicContact CD2-CD1 4.28Å; F1893-I2063 HydrophobicContact CE1-CD1 4.3Å; F1893-I2063 HydrophobicContact CE1-CG2 3.97Å; F1893-I2063 HydrophobicContact CE2-CD1 4.36Å; F1893-I2063 HydrophobicContact CG-CD1 4.06Å; F1893-I2063 HydrophobicContact CG-CG2 4.24Å; F1893-I2063 HydrophobicContact CZ-CD1 4.29Å; F1893-I2063 HydrophobicContact CZ-CG2 4.43Å; I1952-I2063 HydrophobicContact CG2-CD1 4.21Å; N1953-I2063 PolarHBondContact ND2-O 3.07Å; N1953-I2063 VanDerWaalsContact ND2-O 3.14Å; N1953-I2063 WeakPolarHBondContact OD1-CB 3.17Å; N1953-I2063 PolarHBondContact OD1-N 3.09Å; N1953-I2063 VanDerWaalsContact OD1-N 3.15Å; L1956-I2063 HydrophobicContact CD1-CD1 3.46Å; L1956-I2063 VanDerWaalsContact CD1-CD1 3.4Å; L1956-I2063 HydrophobicContact CD1-CG1 4.05Å
2064Q67.9Low63.2Low48.75 Ų48.7559.3 Ų59.323%0.22831%0.314CS..  trans48.355.8174.5-62.3-179.6-24.900115N1901 L1949 F2062 E2066 I2067 I2068N1901-Q2064 PolarHBondContact ND2-NE2 2.93Å; N1901-Q2064 PolarHBondContact ND2-OE1 3.34Å; N1901-Q2064 VanDerWaalsContact ND2-OE1 3.12Å; N1901-Q2064 PolarHBondContact OD1-NE2 3.08Å; L1949-Q2064 HydrophobicContact CD2-CB 4.45Å; F2062-Q2064 PolarHBondContact O-N 3.4Å; Q2064-E2066 PolarHBondContact O-N 3.34Å; Q2064-I2067 HydrophobicContact CB-CB 4.43Å; Q2064-I2067 HydrophobicContact CB-CD1 4.29Å; Q2064-I2067 HydrophobicContact CB-CG1 4.45Å; Q2064-I2067 HydrophobicContact CG-CD1 4.34Å; Q2064-I2067 PolarHBondContact O-N 3.19Å; Q2064-I2068 PolarHBondContact O-N 3.36Å
2065P74.8Confident66.3Low19 Ų1949.5 Ų49.512%0.12327%0.271CS..Hα-helixtrans-57.9-33.4176.122-29.2000112.4F2062 I2067 I2068 I2069F2062-P2065 HydrophobicContact CD1-CB 3.62Å; F2062-P2065 HydrophobicContact CD1-CG 4.15Å; F2062-P2065 HydrophobicContact CE1-CB 4.01Å; F2062-P2065 WeakPolarHBondContact O-CD 3.44Å; P2065-I2067 VanDerWaalsContact C-N 3.34Å; P2065-I2067 PolarHBondContact O-N 3.31Å; P2065-I2068 PolarHBondContact O-N 3.12Å; P2065-I2069 HydrophobicContact CB-CD1 4.45Å; P2065-I2069 WeakPolarHBondContact O-CB 3.32Å; P2065-I2069 WeakPolarHBondContact O-CD1 3.28Å; P2065-I2069 VanDerWaalsContact O-CG1 3.28Å; P2065-I2069 WeakPolarHBondContact O-CG1 3.27Å; P2065-I2069 PolarHBondContact O-N 2.96Å
2066E76.5Confident69.3Low96.25 Ų96.2542.9 Ų42.945%0.4524%0.236SC..Hα-helixtrans-60.4-42.1-177.3-62.8123.3-159.900112.3R2033 F2035 Q2064 L2070R2033-E2066 IonicContact CZ-OE1 3.8Å; R2033-E2066 IonicContact NH1-OE1 3.44Å; R2033-E2066 PolarHBondContact NH1-OE1 3.23Å; F2035-E2066 HydrophobicContact CE1-CG 4.3Å; F2035-E2066 HydrophobicContact CZ-CG 4.35Å; Q2064-E2066 PolarHBondContact O-N 3.34Å; E2066-L2070 VanDerWaalsContact O-CB 3.26Å; E2066-L2070 WeakPolarHBondContact O-CB 3.35Å; E2066-L2070 PolarHBondContact O-N 3.04Å
2067I81.8Confident72.1Confident9 Ų938.3 Ų38.35%0.04620%0.202CC..Hα-helixtrans-70-40.3179.7-61.7179.6000110N1901 L1908 L1945 L1949 Q2064 P2065 L2070 I2071N1901-I2067 HydrophobicContact CB-CD1 4.41Å; N1901-I2067 VanDerWaalsContact ND2-CD1 3.25Å; N1901-I2067 WeakPolarHBondContact ND2-CD1 3.46Å; L1908-I2067 HydrophobicContact CD1-CG2 4.35Å; L1945-I2067 HydrophobicContact CD2-CG2 4.43Å; L1949-I2067 HydrophobicContact CD1-CB 4.41Å; L1949-I2067 HydrophobicContact CD1-CG2 3.81Å; Q2064-I2067 HydrophobicContact CB-CB 4.43Å; Q2064-I2067 HydrophobicContact CB-CD1 4.29Å; Q2064-I2067 HydrophobicContact CB-CG1 4.45Å; Q2064-I2067 HydrophobicContact CG-CD1 4.34Å; Q2064-I2067 PolarHBondContact O-N 3.19Å; P2065-I2067 VanDerWaalsContact C-N 3.34Å; P2065-I2067 PolarHBondContact O-N 3.31Å; I2067-L2070 PolarHBondContact O-N 3.1Å; I2067-I2071 HydrophobicContact CG2-CD1 3.76Å; I2067-I2071 HydrophobicContact CG2-CG1 4.3Å; I2067-I2071 WeakPolarHBondContact O-CB 3.44Å; I2067-I2071 WeakPolarHBondContact O-CD1 3.34Å; I2067-I2071 VanDerWaalsContact O-CG1 3.24Å; I2067-I2071 WeakPolarHBondContact O-CG1 3.21Å; I2067-I2071 PolarHBondContact O-N 3.17Å
2068I84.2Confident74.7Confident0 Ų031.5 Ų31.50%017%0.165CC..Hα-helixtrans-64.1-45.8177.6-66175.7000110.9F1946 L1949 W1950 N1953 F2062 Q2064 P2065 L2070 I2071 L2072 I2127F1946-I2068 HydrophobicContact CD2-CG2 4.26Å; F1946-I2068 HydrophobicContact CE2-CG2 3.86Å; L1949-I2068 HydrophobicContact CB-CD1 4.15Å; L1949-I2068 HydrophobicContact CB-CG1 4.03Å; L1949-I2068 HydrophobicContact CD1-CG1 4.11Å; L1949-I2068 HydrophobicContact CD2-CG1 4.39Å; L1949-I2068 HydrophobicContact CG-CG1 4.43Å; W1950-I2068 HydrophobicContact CE3-CD1 4.48Å; N1953-I2068 VanDerWaalsContact ND2-CD1 3.28Å; N1953-I2068 WeakPolarHBondContact ND2-CD1 3.25Å; F2062-I2068 HydrophobicContact CE1-CD1 3.96Å; F2062-I2068 HydrophobicContact CZ-CD1 4.37Å; Q2064-I2068 PolarHBondContact O-N 3.36Å; P2065-I2068 PolarHBondContact O-N 3.12Å; I2068-L2070 VanDerWaalsContact C-N 3.31Å; I2068-L2070 PolarHBondContact O-N 2.95Å; I2068-I2071 PolarHBondContact O-N 3.43Å; I2068-L2072 HydrophobicContact CG2-CD1 4.26Å; I2068-L2072 WeakPolarHBondContact O-CB 3.32Å; I2068-L2072 WeakPolarHBondContact O-CG 3.36Å; I2068-L2072 PolarHBondContact O-N 3.12Å; I2068-I2127 HydrophobicContact CB-CD1 4.47Å; I2068-I2127 HydrophobicContact CG2-CD1 3.94Å; I2068-I2127 HydrophobicContact CG2-CG1 4.12Å; I2068-I2127 HydrophobicContact CG2-CG2 4.36Å
2069I86.2Confident77Confident21.25 Ų21.2525.2 Ų25.211%0.10913%0.131CC..Hα-helixtrans-59.5-44.4175.1-73.5165.9000110.3P2065 L2072 T2073 E2126 I2127 L2130P2065-I2069 HydrophobicContact CB-CD1 4.45Å; P2065-I2069 WeakPolarHBondContact O-CB 3.32Å; P2065-I2069 WeakPolarHBondContact O-CD1 3.28Å; P2065-I2069 VanDerWaalsContact O-CG1 3.28Å; P2065-I2069 WeakPolarHBondContact O-CG1 3.27Å; P2065-I2069 PolarHBondContact O-N 2.96Å; I2069-L2072 PolarHBondContact O-N 3.04Å; I2069-T2073 WeakPolarHBondContact O-CB 3.4Å; I2069-T2073 PolarHBondContact O-N 3.09Å; I2069-T2073 PolarHBondContact O-OG1 3.23Å; I2069-E2126 HydrophobicContact CD1-CB 4.45Å; I2069-E2126 HydrophobicContact CD1-CG 4.19Å; I2069-E2126 WeakPolarHBondContact CD1-OE2 3.27Å; I2069-E2126 HydrophobicContact CG1-CG 4.38Å; I2069-I2127 HydrophobicContact CG1-CG1 3.93Å; I2069-L2130 HydrophobicContact CB-CD1 4.26Å; I2069-L2130 HydrophobicContact CG1-CD1 4.28Å; I2069-L2130 HydrophobicContact CG2-CD1 3.81Å
2070L87.8Confident79Confident14.75 Ų14.7524.4 Ų24.48%0.07712%0.121CC..Hα-helixtrans-64.6-45.6178.7-177.458.8000111.8Q1905 L1908 Q1909 K1912 E2066 I2067 I2068 L2072 T2073 C2074Q1905-L2070 HydrophobicContact CB-CD2 4.46Å; Q1905-L2070 HydrophobicContact CG-CD2 3.8Å; Q1905-L2070 VanDerWaalsContact O-CD2 3.26Å; Q1905-L2070 WeakPolarHBondContact O-CD2 3.32Å; L1908-L2070 HydrophobicContact CB-CD2 3.58Å; L1908-L2070 HydrophobicContact CB-CG 3.88Å; L1908-L2070 HydrophobicContact CD1-CD2 4.24Å; L1908-L2070 HydrophobicContact CD1-CG 4.41Å; Q1909-L2070 HydrophobicContact CB-CD1 4.48Å; Q1909-L2070 HydrophobicContact CB-CD2 4.42Å; Q1909-L2070 VanDerWaalsContact OE1-CD1 3.25Å; K1912-L2070 HydrophobicContact CD-CD1 4.15Å; E2066-L2070 VanDerWaalsContact O-CB 3.26Å; E2066-L2070 WeakPolarHBondContact O-CB 3.35Å; E2066-L2070 PolarHBondContact O-N 3.04Å; I2067-L2070 PolarHBondContact O-N 3.1Å; I2068-L2070 VanDerWaalsContact C-N 3.31Å; I2068-L2070 PolarHBondContact O-N 2.95Å; L2070-L2072 PolarHBondContact O-N 3.09Å; L2070-T2073 CarbonylContact O-C 3.56Å; L2070-T2073 WeakPolarHBondContact O-CA 3.29Å; L2070-T2073 WeakPolarHBondContact O-CB 3.3Å; L2070-T2073 PolarHBondContact O-N 3.17Å; L2070-T2073 VanDerWaalsContact O-N 3.12Å; L2070-C2074 PolarHBondContact O-N 3.24Å; L2070-C2074 PolarHBondContact O-SG 3.09Å
2071I88.5Confident80.3Confident0 Ų023 Ų230%012%0.115CC..Hα-helixtrans-60.7-47.5177.3-67.5161.6000111L1908 I1942 L1945 F1946 L1949 I2067 I2068 T2073 C2074 L2075L1908-I2071 HydrophobicContact CD1-CD1 4.37Å; L1908-I2071 HydrophobicContact CD1-CG1 3.63Å; L1908-I2071 HydrophobicContact CD2-CG1 4.35Å; I1942-I2071 HydrophobicContact CG2-CB 4.45Å; I1942-I2071 HydrophobicContact CG2-CG1 4.44Å; I1942-I2071 HydrophobicContact CG2-CG2 3.54Å; I1942-I2071 VanDerWaalsContact CG2-CG2 3.49Å; L1945-I2071 HydrophobicContact CD2-CD1 3.55Å; L1945-I2071 HydrophobicContact CD2-CG1 4.28Å; L1945-I2071 HydrophobicContact CG-CD1 4.05Å; F1946-I2071 HydrophobicContact CB-CG2 3.82Å; F1946-I2071 HydrophobicContact CD2-CG2 4.32Å; F1946-I2071 HydrophobicContact CG-CG2 4.43Å; L1949-I2071 HydrophobicContact CD1-CD1 3.5Å; I2067-I2071 HydrophobicContact CG2-CD1 3.76Å; I2067-I2071 HydrophobicContact CG2-CG1 4.3Å; I2067-I2071 WeakPolarHBondContact O-CB 3.44Å; I2067-I2071 WeakPolarHBondContact O-CD1 3.34Å; I2067-I2071 VanDerWaalsContact O-CG1 3.24Å; I2067-I2071 WeakPolarHBondContact O-CG1 3.21Å; I2067-I2071 PolarHBondContact O-N 3.17Å; I2068-I2071 PolarHBondContact O-N 3.43Å; I2071-T2073 VanDerWaalsContact C-N 3.26Å; I2071-T2073 PolarHBondContact O-N 3.09Å; I2071-C2074 WeakPolarHBondContact O-CB 3.36Å; I2071-C2074 PolarHBondContact O-N 3.17Å; I2071-C2074 VanDerWaalsContact O-N 3.11Å; I2071-L2075 HydrophobicContact CG2-CD1 4.07Å; I2071-L2075 HydrophobicContact CG2-CG 4.33Å; I2071-L2075 WeakPolarHBondContact O-CG 3.28Å; I2071-L2075 PolarHBondContact O-N 3.03Å
2072L89.9Confident81.3Confident0 Ų019.3 Ų19.30%010%0.101CC..Hα-helixtrans-59.3-40.5176.5-75.1173.1000111.2F1946 I2068 I2069 L2070 L2075 I2076 L2101 I2127 L2130 L2134F1946-L2072 HydrophobicContact CD2-CD2 4.28Å; F1946-L2072 HydrophobicContact CD2-CG 4.29Å; F1946-L2072 HydrophobicContact CE2-CD1 4.05Å; F1946-L2072 HydrophobicContact CE2-CD2 3.67Å; F1946-L2072 HydrophobicContact CE2-CG 3.75Å; F1946-L2072 HydrophobicContact CZ-CD1 4.5Å; F1946-L2072 HydrophobicContact CZ-CD2 3.9Å; F1946-L2072 HydrophobicContact CZ-CG 4.38Å; I2068-L2072 HydrophobicContact CG2-CD1 4.26Å; I2068-L2072 WeakPolarHBondContact O-CB 3.32Å; I2068-L2072 WeakPolarHBondContact O-CG 3.36Å; I2068-L2072 PolarHBondContact O-N 3.12Å; I2069-L2072 PolarHBondContact O-N 3.04Å; L2070-L2072 PolarHBondContact O-N 3.09Å; L2072-L2075 PolarHBondContact O-N 2.94Å; L2072-I2076 WeakPolarHBondContact O-CD1 3.4Å; L2072-I2076 VanDerWaalsContact O-CG1 3.24Å; L2072-I2076 WeakPolarHBondContact O-CG1 3.42Å; L2072-I2076 PolarHBondContact O-N 3.1Å; L2072-L2101 HydrophobicContact CD2-CD2 3.92Å; L2072-I2127 HydrophobicContact CD1-CB 4.46Å; L2072-I2127 HydrophobicContact CD1-CG2 3.86Å; L2072-L2130 HydrophobicContact CB-CB 4.03Å; L2072-L2130 HydrophobicContact CB-CD1 4.39Å; L2072-L2130 HydrophobicContact CD1-CB 4.03Å; L2072-L2134 HydrophobicContact CD2-CD2 3.98Å
2073T89.2Confident82.5Confident19.25 Ų19.2518.2 Ų18.212%0.11810%0.096CC..Hα-helixtrans-64.7-42175.7-52.90000111.9K1912 I2030 I2069 L2070 I2071 I2076 E2077K1912-T2073 HydrophobicContact CD-CG2 3.9Å; K1912-T2073 VanDerWaalsContact CE-CG2 3.47Å; K1912-T2073 HydrophobicContact CG-CG2 4.49Å; I2030-T2073 HydrophobicContact CD1-CG2 3.48Å; I2030-T2073 VanDerWaalsContact CD1-CG2 3.48Å; I2030-T2073 HydrophobicContact CG1-CG2 4.01Å; I2030-T2073 HydrophobicContact CG2-CG2 4.39Å; I2069-T2073 WeakPolarHBondContact O-CB 3.4Å; I2069-T2073 PolarHBondContact O-N 3.09Å; I2069-T2073 PolarHBondContact O-OG1 3.23Å; L2070-T2073 CarbonylContact O-C 3.56Å; L2070-T2073 WeakPolarHBondContact O-CA 3.29Å; L2070-T2073 WeakPolarHBondContact O-CB 3.3Å; L2070-T2073 PolarHBondContact O-N 3.17Å; L2070-T2073 VanDerWaalsContact O-N 3.12Å; I2071-T2073 VanDerWaalsContact C-N 3.26Å; I2071-T2073 PolarHBondContact O-N 3.09Å; T2073-I2076 PolarHBondContact O-N 3.19Å; T2073-E2077 VanDerWaalsContact O-CG 3.29Å; T2073-E2077 WeakPolarHBondContact O-CG 3.4Å; T2073-E2077 PolarHBondContact O-N 3.07Å
2074C88.7Confident83.5Confident0 Ų020 Ų200%011%0.109CC..Hα-helixtrans-59.9-48.7174.4-64.60000111.2L1908 L2070 I2071 I2076 E2077 F2078L1908-C2074 PolarHBondContact O-SG 3.36Å; L1908-C2074 VanDerWaalsContact O-SG 3.36Å; L2070-C2074 PolarHBondContact O-N 3.24Å; L2070-C2074 PolarHBondContact O-SG 3.09Å; I2071-C2074 WeakPolarHBondContact O-CB 3.36Å; I2071-C2074 PolarHBondContact O-N 3.17Å; I2071-C2074 VanDerWaalsContact O-N 3.11Å; C2074-I2076 VanDerWaalsContact C-N 3.28Å; C2074-I2076 PolarHBondContact O-N 3.13Å; C2074-E2077 CarbonylContact O-C 3.46Å; C2074-E2077 PolarHBondContact O-N 2.97Å; C2074-E2077 VanDerWaalsContact O-N 3.15Å; C2074-F2078 HydrophobicContact CB-CE1 4.35Å; C2074-F2078 HydrophobicContact CB-CE2 3.98Å; C2074-F2078 HydrophobicContact CB-CZ 3.89Å; C2074-F2078 WeakPolarHBondContact O-CB 3.25Å; C2074-F2078 WeakPolarHBondContact O-CD1 3.36Å; C2074-F2078 VanDerWaalsContact O-CD2 3.3Å; C2074-F2078 WeakPolarHBondContact O-CD2 3.35Å; C2074-F2078 WeakPolarHBondContact O-CG 3.35Å; C2074-F2078 PolarHBondContact O-N 2.98Å
2075L89.9Confident84.4Confident0.5 Ų0.518.8 Ų18.80%0.00311%0.106CC..Hα-helixtrans-61.7-36.6179.2-68.3175.7000112.2I1939 I1942 K1943 I2071 L2072 F2078 C2079 I2090 I2097 L2134I1939-L2075 HydrophobicContact CG2-CD2 4.24Å; I1942-L2075 HydrophobicContact CG2-CD2 4.16Å; I1942-L2075 HydrophobicContact CG2-CG 4.38Å; K1943-L2075 HydrophobicContact CG-CD2 4.28Å; I2071-L2075 HydrophobicContact CG2-CD1 4.07Å; I2071-L2075 HydrophobicContact CG2-CG 4.33Å; I2071-L2075 WeakPolarHBondContact O-CG 3.28Å; I2071-L2075 PolarHBondContact O-N 3.03Å; L2072-L2075 PolarHBondContact O-N 2.94Å; L2075-F2078 HydrophobicContact CD2-CD2 4.3Å; L2075-F2078 PolarHBondContact O-N 3.15Å; L2075-C2079 PolarHBondContact O-N 3.14Å; L2075-C2079 PolarHBondContact O-SG 3.24Å; L2075-I2090 HydrophobicContact CB-CD1 4.32Å; L2075-I2090 HydrophobicContact CD2-CD1 4.25Å; L2075-I2097 HydrophobicContact CD1-CD1 4.3Å; L2075-L2134 HydrophobicContact CB-CD1 3.92Å; L2075-L2134 HydrophobicContact CB-CD2 3.98Å; L2075-L2134 HydrophobicContact CD1-CD2 4.14Å
2076I88.3Confident85Confident10.5 Ų10.518 Ų185%0.05410%0.1CC..Hα-helixtrans-61.7-52.7172.6-69.7162.5000109.9L2072 T2073 C2074 F2078 C2079 Q2080 L2130 K2133 L2134 A2137L2072-I2076 WeakPolarHBondContact O-CD1 3.4Å; L2072-I2076 VanDerWaalsContact O-CG1 3.24Å; L2072-I2076 WeakPolarHBondContact O-CG1 3.42Å; L2072-I2076 PolarHBondContact O-N 3.1Å; T2073-I2076 PolarHBondContact O-N 3.19Å; C2074-I2076 VanDerWaalsContact C-N 3.28Å; C2074-I2076 PolarHBondContact O-N 3.13Å; I2076-F2078 PolarHBondContact O-N 2.97Å; I2076-C2079 CarbonylContact O-C 3.48Å; I2076-C2079 PolarHBondContact O-N 3.15Å; I2076-Q2080 VanDerWaalsContact CG2-CD 3.41Å; I2076-Q2080 HydrophobicContact CG2-CG 3.85Å; I2076-Q2080 VanDerWaalsContact CG2-NE2 3.3Å; I2076-Q2080 VanDerWaalsContact O-CB 3.3Å; I2076-Q2080 WeakPolarHBondContact O-CB 3.37Å; I2076-Q2080 VanDerWaalsContact O-CG 3.3Å; I2076-Q2080 WeakPolarHBondContact O-CG 3.4Å; I2076-Q2080 PolarHBondContact O-N 3.05Å; I2076-L2130 HydrophobicContact CD1-CB 4.28Å; I2076-L2130 HydrophobicContact CD1-CD2 3.77Å; I2076-K2133 HydrophobicContact CD1-CB 3.89Å; I2076-L2134 HydrophobicContact CD1-CB 4.44Å; I2076-L2134 HydrophobicContact CG1-CB 3.8Å; I2076-L2134 HydrophobicContact CG1-CD1 4.03Å; I2076-L2134 HydrophobicContact CG1-CG 4.46Å; I2076-A2137 HydrophobicContact CG2-CB 4.44Å
2077E87.3Confident85.5Confident14.75 Ų14.7513.4 Ų13.47%0.0698%0.079CC..Hα-helixtrans-64.7-25.9-179.3-64.9-82.1173.600112.9K1912 H1916 Q1923 T2073 C2074 C2079 Q2080K1912-E2077 HydrophobicContact CG-CG 4.13Å; H1916-E2077 WeakPolarHBondContact CA-OE2 3.46Å; H1916-E2077 IonicContact CE1-OE1 2.77Å; H1916-E2077 IonicContact CE1-OE2 3.56Å; H1916-E2077 IonicContact CG-OE2 2.9Å; H1916-E2077 VanDerWaalsContact ND1-CD 3.32Å; H1916-E2077 IonicContact ND1-OE1 3.59Å; H1916-E2077 PolarHBondContact ND1-OE1 3.24Å; H1916-E2077 VanDerWaalsContact ND1-OE1 3.13Å; H1916-E2077 IonicContact ND1-OE2 3.19Å; H1916-E2077 PolarHBondContact ND1-OE2 3.37Å; Q1923-E2077 PolarHBondContact NE2-O 3.05Å; T2073-E2077 VanDerWaalsContact O-CG 3.29Å; T2073-E2077 WeakPolarHBondContact O-CG 3.4Å; T2073-E2077 PolarHBondContact O-N 3.07Å; C2074-E2077 CarbonylContact O-C 3.46Å; C2074-E2077 PolarHBondContact O-N 2.97Å; C2074-E2077 VanDerWaalsContact O-N 3.15Å; E2077-C2079 VanDerWaalsContact C-N 3.27Å; E2077-C2079 PolarHBondContact O-N 3.17Å; E2077-Q2080 PolarHBondContact OE2-OE1 3.19Å
2078F88.1Confident85.7Confident0.75 Ų0.7515.5 Ų15.50%0.0039%0.09CC..Hα-helixtrans-74.6-21.9173.8-60.2-19.2000113.3L1911 C1915 L1926 I1939 I1942 C2074 L2075 I2076 N2086L1911-F2078 HydrophobicContact CB-CE1 4.36Å; L1911-F2078 HydrophobicContact CB-CZ 4.09Å; C1915-F2078 HydrophobicContact CB-CD1 3.93Å; C1915-F2078 HydrophobicContact CB-CE1 4.19Å; C1915-F2078 VanDerWaalsContact SG-CD1 3.52Å; L1926-F2078 HydrophobicContact CD1-CD1 4.09Å; L1926-F2078 HydrophobicContact CD1-CE1 3.58Å; L1926-F2078 HydrophobicContact CD1-CE2 4.49Å; L1926-F2078 HydrophobicContact CD1-CZ 3.93Å; I1939-F2078 HydrophobicContact CD1-CB 4.46Å; I1939-F2078 HydrophobicContact CD1-CD2 4.47Å; I1939-F2078 HydrophobicContact CG1-CD2 4.12Å; I1939-F2078 HydrophobicContact CG1-CE2 4.47Å; I1942-F2078 HydrophobicContact CD1-CE2 3.87Å; I1942-F2078 HydrophobicContact CD1-CZ 4.26Å; C2074-F2078 HydrophobicContact CB-CE1 4.35Å; C2074-F2078 HydrophobicContact CB-CE2 3.98Å; C2074-F2078 HydrophobicContact CB-CZ 3.89Å; C2074-F2078 WeakPolarHBondContact O-CB 3.25Å; C2074-F2078 WeakPolarHBondContact O-CD1 3.36Å; C2074-F2078 VanDerWaalsContact O-CD2 3.3Å; C2074-F2078 WeakPolarHBondContact O-CD2 3.35Å; C2074-F2078 WeakPolarHBondContact O-CG 3.35Å; C2074-F2078 PolarHBondContact O-N 2.98Å; L2075-F2078 HydrophobicContact CD2-CD2 4.3Å; L2075-F2078 PolarHBondContact O-N 3.15Å; I2076-F2078 PolarHBondContact O-N 2.97Å; F2078-N2086 WeakPolarHBondContact O-CB 3.39Å; F2078-N2086 PolarHBondContact O-ND2 3.06Å
2079C84.8Confident85.7Confident0 Ų016.6 Ų16.60%010%0.096CC..Hα-helixtrans-102.8-24.8179-74.90000114.1L2075 I2076 E2077 G2081 C2083 Q2087 I2090 A2137L2075-C2079 PolarHBondContact O-N 3.14Å; L2075-C2079 PolarHBondContact O-SG 3.24Å; I2076-C2079 CarbonylContact O-C 3.48Å; I2076-C2079 PolarHBondContact O-N 3.15Å; E2077-C2079 VanDerWaalsContact C-N 3.27Å; E2077-C2079 PolarHBondContact O-N 3.17Å; C2079-G2081 VanDerWaalsContact O-O 3.14Å; C2079-C2083 PolarHBondContact O-N 2.95Å; C2079-Q2087 HydrophobicContact CB-CG 4.13Å; C2079-Q2087 PolarHBondContact O-NE2 2.95Å; C2079-I2090 WeakPolarHBondContact SG-CD1 3.28Å; C2079-A2137 HydrophobicContact CB-CB 4.25Å
2080Q83.4Confident85.7Confident45.25 Ų45.2515.7 Ų15.721%0.2119%0.092CC..THydrogen-bonded Turntrans-65.5141-177.6-100.9-178300111.9Q1923 I2076 E2077 A2137Q1923-Q2080 PolarHBondContact NE2-O 3.01Å; I2076-Q2080 VanDerWaalsContact CG2-CD 3.41Å; I2076-Q2080 HydrophobicContact CG2-CG 3.85Å; I2076-Q2080 VanDerWaalsContact CG2-NE2 3.3Å; I2076-Q2080 VanDerWaalsContact O-CB 3.3Å; I2076-Q2080 WeakPolarHBondContact O-CB 3.37Å; I2076-Q2080 VanDerWaalsContact O-CG 3.3Å; I2076-Q2080 WeakPolarHBondContact O-CG 3.4Å; I2076-Q2080 PolarHBondContact O-N 3.05Å; E2077-Q2080 PolarHBondContact OE2-OE1 3.19Å; Q2080-A2137 HydrophobicContact CG-CB 4.24Å
2081G74.6Confident85.4Confident10.75 Ų10.7515.1 Ų15.111%0.1119%0.089CC..THydrogen-bonded Turntrans76.2100.7-169.200000111.3L1920 C2079 C2083 Q2087 E2140L1920-G2081 WeakPolarHBondContact CD2-O 3.2Å; C2079-G2081 VanDerWaalsContact O-O 3.14Å; G2081-C2083 VanDerWaalsContact C-N 3.26Å; G2081-C2083 PolarHBondContact O-N 2.83Å; G2081-Q2087 PolarHBondContact O-NE2 3.42Å; G2081-E2140 PolarHBondContact N-OE1 2.9Å; G2081-E2140 PolarHBondContact N-OE2 3.18Å
2082P74.1Confident85.1Confident44 Ų4420.1 Ų20.129%0.28611%0.11SC..THydrogen-bonded Turntrans-39.982.4-154.328.5-42000115.6V2084 R2296P2082-V2084 PolarHBondContact O-N 3.02Å; P2082-R2296 VanDerWaalsContact CG-NH1 3.25Å
2083C83.9Confident84.4Confident0.75 Ų0.7520.8 Ų20.81%0.00512%0.118CC..  trans-92.880.5172.1-170.30000110.2L1920 C2079 G2081 S2085 N2086 Q2087L1920-C2083 HydrophobicContact CD1-CB 3.9Å; L1920-C2083 HydrophobicContact CD2-CB 4.07Å; C2079-C2083 PolarHBondContact O-N 2.95Å; G2081-C2083 VanDerWaalsContact C-N 3.26Å; G2081-C2083 PolarHBondContact O-N 2.83Å; C2083-S2085 PolarHBondContact O-N 3.34Å; C2083-S2085 VanDerWaalsContact O-N 3.13Å; C2083-N2086 HydrophobicContact CB-CB 4.29Å; C2083-N2086 PolarHBondContact O-N 3.22Å; C2083-N2086 VanDerWaalsContact O-N 3.1Å; C2083-N2086 VanDerWaalsContact SG-CG 3.56Å; C2083-N2086 PolarHBondContact SG-ND2 2.96Å; C2083-Q2087 VanDerWaalsContact O-CB 3.31Å; C2083-Q2087 WeakPolarHBondContact O-CB 3.46Å; C2083-Q2087 VanDerWaalsContact O-CG 3.28Å; C2083-Q2087 WeakPolarHBondContact O-CG 3.33Å; C2083-Q2087 PolarHBondContact O-N 3.01Å
2084V84.2Confident83.7Confident64.25 Ų64.2523.7 Ų23.739%0.38914%0.138SC..Hα-helixtrans-47.7-42.3178.3171.60000111.2P2082 N2088 R2142P2082-V2084 PolarHBondContact O-N 3.02Å; V2084-N2088 WeakPolarHBondContact O-CB 3.44Å; V2084-N2088 VanDerWaalsContact O-CG 3.27Å; V2084-N2088 PolarHBondContact O-N 2.99Å; V2084-N2088 PolarHBondContact O-ND2 3.18Å; V2084-R2142 VanDerWaalsContact CA-NH2 3.34Å; V2084-R2142 PolarHBondContact O-NH2 3.02Å
2085S85.6Confident83.2Confident24.75 Ų24.7525.4 Ų25.417%0.17315%0.15CC..Hα-helixtrans-51.8-57.8175.3-72.90000113.5E1924 R1927 C2083 N2088 D2089E1924-S2085 VanDerWaalsContact OE1-CB 3.25Å; E1924-S2085 WeakPolarHBondContact OE1-CB 3.4Å; E1924-S2085 PolarHBondContact OE1-OG 3.1Å; R1927-S2085 VanDerWaalsContact NH1-CA 3.26Å; R1927-S2085 VanDerWaalsContact NH1-CB 3.31Å; R1927-S2085 PolarHBondContact NH1-O 2.96Å; R1927-S2085 PolarHBondContact NH2-OG 3.18Å; C2083-S2085 PolarHBondContact O-N 3.34Å; C2083-S2085 VanDerWaalsContact O-N 3.13Å; S2085-N2088 PolarHBondContact O-N 3.31Å; S2085-D2089 PolarHBondContact O-N 3.26Å
2086N87.3Confident82.7Confident0.25 Ų0.2529.5 Ų29.50%0.00117%0.172CC..Hα-helixtrans-75.1-36.6-176.9-69-7.5000112Q1923 R1927 I1939 F2078 C2083 N2088 D2089 I2090Q1923-N2086 PolarHBondContact O-ND2 3.07Å; Q1923-N2086 VanDerWaalsContact O-ND2 3.1Å; R1927-N2086 WeakPolarHBondContact CD-OD1 3.31Å; R1927-N2086 PolarHBondContact NE-OD1 3.15Å; I1939-N2086 HydrophobicContact CD1-CB 4.11Å; I1939-N2086 VanDerWaalsContact CD1-CG 3.49Å; I1939-N2086 WeakPolarHBondContact CD1-OD1 3.26Å; F2078-N2086 WeakPolarHBondContact O-CB 3.39Å; F2078-N2086 PolarHBondContact O-ND2 3.06Å; C2083-N2086 HydrophobicContact CB-CB 4.29Å; C2083-N2086 PolarHBondContact O-N 3.22Å; C2083-N2086 VanDerWaalsContact O-N 3.1Å; C2083-N2086 VanDerWaalsContact SG-CG 3.56Å; C2083-N2086 PolarHBondContact SG-ND2 2.96Å; N2086-N2088 VanDerWaalsContact C-N 3.3Å; N2086-N2088 PolarHBondContact O-N 3.18Å; N2086-D2089 WeakPolarHBondContact O-CB 3.24Å; N2086-D2089 PolarHBondContact O-N 3.12Å; N2086-D2089 VanDerWaalsContact O-N 3.09Å; N2086-I2090 PolarHBondContact O-N 3.02Å; N2086-I2090 VanDerWaalsContact O-N 3.09Å
2087Q88.2Confident82.4Confident0 Ų029.1 Ų29.10%017%0.169CC..Hα-helixtrans-58.4-41.6174.1-69.3172-15.600111.6C2079 G2081 C2083 D2089 I2090 L2091 A2137 E2140 R2142C2079-Q2087 HydrophobicContact CB-CG 4.13Å; C2079-Q2087 PolarHBondContact O-NE2 2.95Å; G2081-Q2087 PolarHBondContact O-NE2 3.42Å; C2083-Q2087 VanDerWaalsContact O-CB 3.31Å; C2083-Q2087 WeakPolarHBondContact O-CB 3.46Å; C2083-Q2087 VanDerWaalsContact O-CG 3.28Å; C2083-Q2087 WeakPolarHBondContact O-CG 3.33Å; C2083-Q2087 PolarHBondContact O-N 3.01Å; Q2087-D2089 VanDerWaalsContact C-N 3.32Å; Q2087-D2089 PolarHBondContact O-N 3.39Å; Q2087-I2090 PolarHBondContact O-N 3.15Å; Q2087-L2091 WeakPolarHBondContact O-CB 3.35Å; Q2087-L2091 WeakPolarHBondContact O-CD1 3.33Å; Q2087-L2091 VanDerWaalsContact O-CG 3.28Å; Q2087-L2091 WeakPolarHBondContact O-CG 3.33Å; Q2087-L2091 PolarHBondContact O-N 3.1Å; Q2087-A2137 PolarHBondContact NE2-O 3.03Å; Q2087-A2137 VanDerWaalsContact NE2-O 3.16Å; Q2087-E2140 PolarHBondContact NE2-O 3.35Å; Q2087-R2142 VanDerWaalsContact CB-NH2 3.32Å
2088N86Confident82.2Confident52.75 Ų52.7528.5 Ų28.528%0.28217%0.167SC..Hα-helixtrans-63.2-37.1174.9-79.2-14.8000112.2V2084 S2085 N2086 I2090 L2091 F2092 R2142V2084-N2088 WeakPolarHBondContact O-CB 3.44Å; V2084-N2088 VanDerWaalsContact O-CG 3.27Å; V2084-N2088 PolarHBondContact O-N 2.99Å; V2084-N2088 PolarHBondContact O-ND2 3.18Å; S2085-N2088 PolarHBondContact O-N 3.31Å; N2086-N2088 VanDerWaalsContact C-N 3.3Å; N2086-N2088 PolarHBondContact O-N 3.18Å; N2088-I2090 VanDerWaalsContact C-N 3.33Å; N2088-L2091 PolarHBondContact O-N 3.2Å; N2088-F2092 HydrophobicContact CB-CD2 4.35Å; N2088-F2092 WeakPolarHBondContact O-CB 3.47Å; N2088-F2092 PolarHBondContact O-N 3.18Å; N2088-R2142 VanDerWaalsContact CG-NH2 3.31Å; N2088-R2142 VanDerWaalsContact OD1-CZ 3.28Å; N2088-R2142 PolarHBondContact OD1-NH1 3.15Å; N2088-R2142 PolarHBondContact OD1-NH2 3.18Å
2089D84.6Confident81.9Confident23.75 Ų23.7529.3 Ų29.313%0.12718%0.175CC..Hα-helixtrans-69.9-31.5177.8-175.455000112.6N1937 I1939 K1943 S2085 N2086 Q2087 G2093N1937-D2089 PolarHBondContact ND2-OD2 3.38Å; I1939-D2089 WeakPolarHBondContact CG2-OD2 3.42Å; K1943-D2089 WeakPolarHBondContact CE-OD2 3.28Å; K1943-D2089 PolarHBondContact NZ-O 3.28Å; K1943-D2089 IonicContact NZ-OD1 3.42Å; K1943-D2089 PolarHBondContact NZ-OD1 3.3Å; K1943-D2089 VanDerWaalsContact NZ-OD1 3.11Å; K1943-D2089 IonicContact NZ-OD2 2.98Å; K1943-D2089 PolarHBondContact NZ-OD2 2.95Å; S2085-D2089 PolarHBondContact O-N 3.26Å; N2086-D2089 WeakPolarHBondContact O-CB 3.24Å; N2086-D2089 PolarHBondContact O-N 3.12Å; N2086-D2089 VanDerWaalsContact O-N 3.09Å; Q2087-D2089 VanDerWaalsContact C-N 3.32Å; Q2087-D2089 PolarHBondContact O-N 3.39Å; D2089-G2093 VanDerWaalsContact O-CA 3.24Å; D2089-G2093 WeakPolarHBondContact O-CA 3.36Å; D2089-G2093 PolarHBondContact O-N 2.96Å; D2089-G2093 VanDerWaalsContact O-N 3.08Å
2090I85.3Confident81.7Confident3.25 Ų3.2531 Ų312%0.01718%0.184CC..Hα-helixtrans-75.9-36.3172.7-65-175.8000111.9I1939 K1943 L2075 C2079 N2086 Q2087 N2088 L2134 V2138I1939-I2090 HydrophobicContact CG2-CG1 4.44Å; K1943-I2090 HydrophobicContact CD-CG1 4.32Å; L2075-I2090 HydrophobicContact CB-CD1 4.32Å; L2075-I2090 HydrophobicContact CD2-CD1 4.25Å; C2079-I2090 WeakPolarHBondContact SG-CD1 3.28Å; N2086-I2090 PolarHBondContact O-N 3.02Å; N2086-I2090 VanDerWaalsContact O-N 3.09Å; Q2087-I2090 PolarHBondContact O-N 3.15Å; N2088-I2090 VanDerWaalsContact C-N 3.33Å; I2090-L2134 HydrophobicContact CD1-CD1 4.13Å; I2090-V2138 HydrophobicContact CB-CG2 4.29Å; I2090-V2138 HydrophobicContact CD1-CG2 4.44Å; I2090-V2138 HydrophobicContact CG2-CG2 3.85Å
2091L81.7Confident81.8Confident1.75 Ų1.7529 Ų291%0.00918%0.175CC..Hα-helixtrans-74-53.9-180-75.7164.4000113.2Q2087 N2088 L2098 V2138 V2147 Q2150Q2087-L2091 WeakPolarHBondContact O-CB 3.35Å; Q2087-L2091 WeakPolarHBondContact O-CD1 3.33Å; Q2087-L2091 VanDerWaalsContact O-CG 3.28Å; Q2087-L2091 WeakPolarHBondContact O-CG 3.33Å; Q2087-L2091 PolarHBondContact O-N 3.1Å; N2088-L2091 PolarHBondContact O-N 3.2Å; L2091-L2098 HydrophobicContact CD2-CD1 3.38Å; L2091-L2098 HydrophobicContact CD2-CD2 4.01Å; L2091-V2138 HydrophobicContact CD1-CG1 3.61Å; L2091-V2138 HydrophobicContact CD2-CG1 3.38Å; L2091-V2138 VanDerWaalsContact CD2-CG1 3.42Å; L2091-V2138 HydrophobicContact CG-CG1 3.33Å; L2091-V2147 HydrophobicContact CD1-CB 4.21Å; L2091-V2147 HydrophobicContact CD1-CG1 3.46Å; L2091-V2147 VanDerWaalsContact CD1-CG1 3.46Å; L2091-V2147 HydrophobicContact CD1-CG2 3.79Å; L2091-V2147 HydrophobicContact CD2-CG1 3.88Å; L2091-V2147 HydrophobicContact CG-CG1 4.32Å; L2091-Q2150 PolarHBondContact O-NE2 3.32Å
2092F81.5Confident82.2Confident104.25 Ų104.2528.6 Ų28.646%0.45717%0.171SC..Hα-helixtrans-109.6-13.6-169.2-55.9-70.2000113.2N2088 V2147 Q2150N2088-F2092 HydrophobicContact CB-CD2 4.35Å; N2088-F2092 WeakPolarHBondContact O-CB 3.47Å; N2088-F2092 PolarHBondContact O-N 3.18Å; F2092-V2147 HydrophobicContact CE2-CG2 4.26Å; F2092-V2147 HydrophobicContact CZ-CG2 4.13Å; F2092-Q2150 VanDerWaalsContact CD1-OE1 3.31Å
2093G75.6Confident82.5Confident14.75 Ų14.7531.3 Ų31.315%0.15218%0.182CC..SBendtrans-73152.4-176.200000113.3D2089 P2095 N2096D2089-G2093 VanDerWaalsContact O-CA 3.24Å; D2089-G2093 WeakPolarHBondContact O-CA 3.36Å; D2089-G2093 PolarHBondContact O-N 2.96Å; D2089-G2093 VanDerWaalsContact O-N 3.08Å; G2093-P2095 CarbonylContact O-C 3.48Å; G2093-P2095 VanDerWaalsContact O-C 3.31Å; G2093-N2096 PolarHBondContact O-N 2.85Å
2094S74.1Confident82.5Confident79.75 Ų79.7531.3 Ų31.356%0.55818%0.182SC*.SBendtrans-75.2145.4162.9460000110E1940 K1943E1940-S2094 WeakPolarHBondContact CG-O 3.38Å; E1940-S2094 VanDerWaalsContact OE1-O 3.08Å; E1940-S2094 PolarHBondContact OE1-OG 3.24Å; E1940-S2094 VanDerWaalsContact OE1-OG 3.08Å; K1943-S2094 WeakPolarHBondContact CE-O 3.44Å; K1943-S2094 PolarHBondContact NZ-O 3.24Å
2095P78.2Confident82.5Confident37.25 Ų37.2528.4 Ų28.424%0.24217%0.165CC..SBendcis-73.3146.7-20.733.3-36000112.4K1943 S1944 I1947 G2093 I2097K1943-P2095 HydrophobicContact CB-CG 4.34Å; S1944-P2095 WeakPolarHBondContact OG-CD 3.38Å; S1944-P2095 WeakPolarHBondContact OG-CG 3.39Å; I1947-P2095 HydrophobicContact CD1-CB 3.48Å; I1947-P2095 VanDerWaalsContact CD1-CB 3.46Å; I1947-P2095 HydrophobicContact CD1-CG 3.44Å; I1947-P2095 VanDerWaalsContact CD1-CG 3.46Å; G2093-P2095 CarbonylContact O-C 3.48Å; G2093-P2095 VanDerWaalsContact O-C 3.31Å; P2095-I2097 PolarHBondContact O-N 3.03Å; P2095-I2097 VanDerWaalsContact O-N 3.12Å
2096N78.8Confident82.3Confident86.75 Ų86.7528.2 Ų28.246%0.46416%0.162SC..  trans-70.9102-178.4-177-4.9000111.7G2093 L2098 G2099G2093-N2096 PolarHBondContact O-N 2.85Å; N2096-L2098 VanDerWaalsContact OD1-CB 3.29Å; N2096-L2098 WeakPolarHBondContact OD1-CB 3.34Å; N2096-L2098 PolarHBondContact OD1-N 3.14Å; N2096-G2099 PolarHBondContact OD1-N 3.24Å
2097I83.2Confident81.9Confident0.5 Ų0.529.6 Ų29.60%0.00317%0.171CC..  trans-78.6-27.8175.6-75.6-170.3000112.4K1943 F1946 I1947 L2075 P2095 G2099 L2100 L2101K1943-I2097 VanDerWaalsContact CA-CD1 3.44Å; K1943-I2097 HydrophobicContact CB-CD1 3.46Å; K1943-I2097 VanDerWaalsContact CB-CD1 3.43Å; K1943-I2097 HydrophobicContact CB-CG1 4.22Å; K1943-I2097 HydrophobicContact CD-CD1 4.1Å; K1943-I2097 HydrophobicContact CD-CG1 4.5Å; K1943-I2097 HydrophobicContact CG-CD1 3.47Å; K1943-I2097 VanDerWaalsContact CG-CD1 3.47Å; K1943-I2097 HydrophobicContact CG-CG1 4.37Å; F1946-I2097 HydrophobicContact CB-CD1 4.46Å; F1946-I2097 HydrophobicContact CD1-CD1 4.05Å; F1946-I2097 HydrophobicContact CD1-CG1 4.43Å; F1946-I2097 HydrophobicContact CD1-CG2 4.34Å; F1946-I2097 HydrophobicContact CE1-CG2 4.21Å; I1947-I2097 HydrophobicContact CD1-CG1 3.75Å; I1947-I2097 HydrophobicContact CG1-CD1 4.29Å; I1947-I2097 HydrophobicContact CG1-CG1 3.85Å; L2075-I2097 HydrophobicContact CD1-CD1 4.3Å; P2095-I2097 PolarHBondContact O-N 3.03Å; P2095-I2097 VanDerWaalsContact O-N 3.12Å; I2097-G2099 VanDerWaalsContact C-N 3.33Å; I2097-G2099 PolarHBondContact O-N 3.06Å; I2097-L2100 WeakPolarHBondContact O-CA 3.2Å; I2097-L2100 VanDerWaalsContact O-CB 3.29Å; I2097-L2100 WeakPolarHBondContact O-CB 3.35Å; I2097-L2100 PolarHBondContact O-N 3.13Å; I2097-L2101 HydrophobicContact CG2-CD1 3.49Å; I2097-L2101 VanDerWaalsContact CG2-CD1 3.43Å; I2097-L2101 HydrophobicContact CG2-CD2 4.2Å; I2097-L2101 HydrophobicContact CG2-CG 3.54Å; I2097-L2101 PolarHBondContact O-N 3.27Å
2098L82.6Confident81.4Confident2.5 Ų2.529.6 Ų29.61%0.01317%0.171CC..Hα-helixtrans-61-43-167.6-16880.7000112.2L2091 N2096 L2100 L2101 V2102 L2135 Q2150 L2151 L2154L2091-L2098 HydrophobicContact CD2-CD1 3.38Å; L2091-L2098 HydrophobicContact CD2-CD2 4.01Å; N2096-L2098 VanDerWaalsContact OD1-CB 3.29Å; N2096-L2098 WeakPolarHBondContact OD1-CB 3.34Å; N2096-L2098 PolarHBondContact OD1-N 3.14Å; L2098-L2100 VanDerWaalsContact C-N 3.29Å; L2098-L2100 PolarHBondContact O-N 3.1Å; L2098-L2101 PolarHBondContact O-N 3.23Å; L2098-V2102 HydrophobicContact CD2-CG2 4.15Å; L2098-V2102 WeakPolarHBondContact O-CB 3.29Å; L2098-V2102 VanDerWaalsContact O-CG2 3.28Å; L2098-V2102 WeakPolarHBondContact O-CG2 3.36Å; L2098-V2102 PolarHBondContact O-N 3.24Å; L2098-L2135 HydrophobicContact CD1-CD2 3.55Å; L2098-L2135 HydrophobicContact CG-CD2 4.31Å; L2098-Q2150 HydrophobicContact CD2-CG 4.36Å; L2098-L2151 HydrophobicContact CD1-CD2 3.71Å; L2098-L2151 VanDerWaalsContact CD1-CD2 3.42Å; L2098-L2151 HydrophobicContact CD1-CG 4.05Å; L2098-L2151 HydrophobicContact CD2-CD2 3.87Å; L2098-L2151 HydrophobicContact CD2-CG 4.36Å; L2098-L2151 HydrophobicContact CG-CD2 4.12Å; L2098-L2154 HydrophobicContact CB-CD1 3.97Å; L2098-L2154 HydrophobicContact CD2-CB 4.23Å; L2098-L2154 HydrophobicContact CD2-CD1 3.34Å; L2098-L2154 VanDerWaalsContact CD2-CD1 3.5Å; L2098-L2154 HydrophobicContact CD2-CG 4.31Å; L2098-L2154 HydrophobicContact CG-CD1 3.52Å; L2098-L2154 VanDerWaalsContact CG-CD1 3.48Å
2099G81.5Confident80.7Confident17.5 Ų17.527.4 Ų27.418%0.1816%0.16CC..Hα-helixtrans-62.2-33.3174.500000113.4N2096 I2097 N2103N2096-G2099 PolarHBondContact OD1-N 3.24Å; I2097-G2099 VanDerWaalsContact C-N 3.33Å; I2097-G2099 PolarHBondContact O-N 3.06Å; G2099-N2103 VanDerWaalsContact O-CB 3.3Å; G2099-N2103 WeakPolarHBondContact O-CB 3.39Å; G2099-N2103 VanDerWaalsContact O-CG 3.27Å; G2099-N2103 PolarHBondContact O-N 3.17Å; G2099-N2103 VanDerWaalsContact O-N 3.14Å; G2099-N2103 PolarHBondContact O-ND2 3.07Å; G2099-N2103 VanDerWaalsContact O-ND2 3.13Å
2100L81.6Confident80.1Confident37 Ų3733.4 Ų33.419%0.19419%0.185CC..Hα-helixtrans-72.1-45177.2-118.6115.7000111.6F1946 I1947 W1950 I2097 L2098 V2102 N2103 L2104F1946-L2100 HydrophobicContact CD1-CD2 4.38Å; F1946-L2100 HydrophobicContact CE1-CD2 4Å; I1947-L2100 HydrophobicContact CB-CD1 4.13Å; I1947-L2100 HydrophobicContact CB-CD2 4.37Å; I1947-L2100 HydrophobicContact CD1-CD1 3.95Å; I1947-L2100 HydrophobicContact CG1-CD1 3.58Å; I1947-L2100 HydrophobicContact CG1-CD2 4.01Å; I1947-L2100 HydrophobicContact CG2-CD1 3.77Å; I1947-L2100 HydrophobicContact CG2-CD2 4.34Å; W1950-L2100 HydrophobicContact CB-CD2 4.13Å; W1950-L2100 HydrophobicContact CG-CD2 4.17Å; W1950-L2100 HydrophobicContact CG-CG 4.48Å; I2097-L2100 WeakPolarHBondContact O-CA 3.2Å; I2097-L2100 VanDerWaalsContact O-CB 3.29Å; I2097-L2100 WeakPolarHBondContact O-CB 3.35Å; I2097-L2100 PolarHBondContact O-N 3.13Å; L2098-L2100 VanDerWaalsContact C-N 3.29Å; L2098-L2100 PolarHBondContact O-N 3.1Å; L2100-V2102 PolarHBondContact O-N 2.98Å; L2100-N2103 PolarHBondContact O-N 3.27Å; L2100-L2104 VanDerWaalsContact O-CB 3.27Å; L2100-L2104 WeakPolarHBondContact O-CB 3.33Å; L2100-L2104 PolarHBondContact O-N 3.11Å
2101L84.6Confident79.5Confident1.75 Ų1.7534.3 Ų34.31%0.00919%0.188CC..Hα-helixtrans-62.6-43.2177.1-65.3175.1000111.8F1946 L2072 I2097 L2098 L2104 V2105 L2134 L2135F1946-L2101 HydrophobicContact CE1-CD2 3.91Å; F1946-L2101 HydrophobicContact CZ-CD2 3.8Å; L2072-L2101 HydrophobicContact CD2-CD2 3.92Å; I2097-L2101 HydrophobicContact CG2-CD1 3.49Å; I2097-L2101 VanDerWaalsContact CG2-CD1 3.43Å; I2097-L2101 HydrophobicContact CG2-CD2 4.2Å; I2097-L2101 HydrophobicContact CG2-CG 3.54Å; I2097-L2101 PolarHBondContact O-N 3.27Å; L2098-L2101 PolarHBondContact O-N 3.23Å; L2101-L2104 WeakPolarHBondContact O-CB 3.38Å; L2101-L2104 PolarHBondContact O-N 3.17Å; L2101-V2105 VanDerWaalsContact O-CG2 3.3Å; L2101-V2105 WeakPolarHBondContact O-CG2 3.44Å; L2101-V2105 PolarHBondContact O-N 3.21Å; L2101-L2134 HydrophobicContact CD1-CD2 3.66Å; L2101-L2134 HydrophobicContact CD1-CG 4.15Å; L2101-L2134 HydrophobicContact CD2-CD2 4.41Å; L2101-L2135 HydrophobicContact CB-CD2 4.43Å; L2101-L2135 HydrophobicContact CD1-CD2 4.31Å; L2101-L2135 HydrophobicContact CD1-CG 4.48Å
2102V82.7Confident78.9Confident3.75 Ų3.7534.6 Ų34.62%0.02319%0.19CC..Hα-helixtrans-63.8-45.8177.5171.10000110.6L2098 L2100 L2104 V2105 L2106 L2135 L2154 C2155L2098-V2102 HydrophobicContact CD2-CG2 4.15Å; L2098-V2102 WeakPolarHBondContact O-CB 3.29Å; L2098-V2102 VanDerWaalsContact O-CG2 3.28Å; L2098-V2102 WeakPolarHBondContact O-CG2 3.36Å; L2098-V2102 PolarHBondContact O-N 3.24Å; L2100-V2102 PolarHBondContact O-N 2.98Å; V2102-L2104 VanDerWaalsContact C-N 3.32Å; V2102-L2104 PolarHBondContact O-N 3.04Å; V2102-V2105 PolarHBondContact O-N 3.1Å; V2102-L2106 HydrophobicContact CG1-CD1 3.78Å; V2102-L2106 HydrophobicContact CG1-CG 4.29Å; V2102-L2106 WeakPolarHBondContact O-CB 3.38Å; V2102-L2106 VanDerWaalsContact O-CG 3.27Å; V2102-L2106 WeakPolarHBondContact O-CG 3.26Å; V2102-L2106 PolarHBondContact O-N 3.09Å; V2102-L2135 HydrophobicContact CG2-CD1 4.45Å; V2102-L2135 HydrophobicContact CG2-CD2 4.38Å; V2102-L2154 WeakPolarHBondContact CG1-O 3.39Å; V2102-L2154 HydrophobicContact CG2-CB 4.44Å; V2102-C2155 HydrophobicContact CG1-CB 4.13Å; V2102-C2155 WeakPolarHBondContact CG1-SG 3.34Å; V2102-C2155 HydrophobicContact CG2-CB 4.34Å; V2102-C2155 WeakPolarHBondContact CG2-SG 3.47Å
2103N82.2Confident77.9Confident99.25 Ų99.2531.7 Ų31.753%0.53119%0.189SC..Hα-helixtrans-61.5-40.8176.3-76.8-21.9000112G2099 L2100 V2105 L2106 S2107G2099-N2103 VanDerWaalsContact O-CB 3.3Å; G2099-N2103 WeakPolarHBondContact O-CB 3.39Å; G2099-N2103 VanDerWaalsContact O-CG 3.27Å; G2099-N2103 PolarHBondContact O-N 3.17Å; G2099-N2103 VanDerWaalsContact O-N 3.14Å; G2099-N2103 PolarHBondContact O-ND2 3.07Å; G2099-N2103 VanDerWaalsContact O-ND2 3.13Å; L2100-N2103 PolarHBondContact O-N 3.27Å; N2103-V2105 PolarHBondContact O-N 3.49Å; N2103-L2106 PolarHBondContact O-N 3.27Å; N2103-S2107 VanDerWaalsContact O-CB 3.22Å; N2103-S2107 WeakPolarHBondContact O-CB 3.41Å; N2103-S2107 PolarHBondContact O-N 3.19Å; N2103-S2107 PolarHBondContact O-OG 2.91Å
2104L83.4Confident77.4Confident1.25 Ų1.2534.3 Ų34.31%0.00720%0.2CC..Hα-helixtrans-57.7-52.2174.5-176.3164.4000110.7W1950 L2100 L2101 V2102 L2106 S2107 T2108 I2127W1950-L2104 HydrophobicContact CD2-CD1 3.85Å; W1950-L2104 HydrophobicContact CE3-CD1 3.85Å; W1950-L2104 HydrophobicContact CH2-CD1 3.43Å; W1950-L2104 VanDerWaalsContact CH2-CD1 3.42Å; W1950-L2104 HydrophobicContact CH2-CG 3.62Å; W1950-L2104 HydrophobicContact CZ2-CB 4.04Å; W1950-L2104 HydrophobicContact CZ2-CD1 3.41Å; W1950-L2104 VanDerWaalsContact CZ2-CD1 3.41Å; W1950-L2104 HydrophobicContact CZ2-CG 3.45Å; W1950-L2104 VanDerWaalsContact CZ2-CG 3.44Å; W1950-L2104 HydrophobicContact CZ3-CD1 3.65Å; W1950-L2104 HydrophobicContact CZ3-CG 4.34Å; L2100-L2104 VanDerWaalsContact O-CB 3.27Å; L2100-L2104 WeakPolarHBondContact O-CB 3.33Å; L2100-L2104 PolarHBondContact O-N 3.11Å; L2101-L2104 WeakPolarHBondContact O-CB 3.38Å; L2101-L2104 PolarHBondContact O-N 3.17Å; V2102-L2104 VanDerWaalsContact C-N 3.32Å; V2102-L2104 PolarHBondContact O-N 3.04Å; L2104-L2106 VanDerWaalsContact C-N 3.31Å; L2104-L2106 PolarHBondContact O-N 3.14Å; L2104-S2107 PolarHBondContact O-N 2.96Å; L2104-S2107 PolarHBondContact O-OG 3.1Å; L2104-T2108 HydrophobicContact CD2-CG2 3.91Å; L2104-T2108 HydrophobicContact CG-CG2 4.27Å; L2104-T2108 VanDerWaalsContact O-CB 3.26Å; L2104-T2108 WeakPolarHBondContact O-CB 3.37Å; L2104-T2108 VanDerWaalsContact O-CG2 3.31Å; L2104-T2108 WeakPolarHBondContact O-CG2 3.35Å; L2104-T2108 PolarHBondContact O-N 3.1Å; L2104-T2108 PolarHBondContact O-OG1 3.21Å; L2104-I2127 HydrophobicContact CD1-CG2 3.71Å; L2104-I2127 HydrophobicContact CD2-CG2 4.23Å; L2104-I2127 HydrophobicContact CG-CG2 4.46Å
2105V82.7Confident76.7Confident3.75 Ų3.7537.5 Ų37.52%0.02321%0.206CC..Hα-helixtrans-63.8-36.6-178.61720000112.2L2101 V2102 N2103 T2108 P2109 I2132 Y2167 L2192L2101-V2105 VanDerWaalsContact O-CG2 3.3Å; L2101-V2105 WeakPolarHBondContact O-CG2 3.44Å; L2101-V2105 PolarHBondContact O-N 3.21Å; V2102-V2105 PolarHBondContact O-N 3.1Å; N2103-V2105 PolarHBondContact O-N 3.49Å; V2105-T2108 PolarHBondContact O-OG1 3.19Å; V2105-T2108 VanDerWaalsContact O-OG1 3.06Å; V2105-P2109 WeakPolarHBondContact O-CD 3.39Å; V2105-I2132 HydrophobicContact CB-CG1 4.47Å; V2105-I2132 HydrophobicContact CG1-CD1 4.05Å; V2105-I2132 HydrophobicContact CG1-CG1 3.85Å; V2105-I2132 HydrophobicContact CG2-CD1 4.45Å; V2105-I2132 HydrophobicContact CG2-CG1 3.67Å; V2105-Y2167 HydrophobicContact CG1-CE2 4.38Å; V2105-Y2167 PolarHBondContact O-OH 3.2Å; V2105-L2192 HydrophobicContact CG1-CD1 3.69Å; V2105-L2192 HydrophobicContact CG1-CD2 4.33Å
2106L82.7Confident75.8Confident21 Ų2143.1 Ų43.111%0.1123%0.226CC..Hα-helixtrans-79.4-27.5179-65.3178.1000113.6V2102 N2103 L2104 K2159 L2160 S2163V2102-L2106 HydrophobicContact CG1-CD1 3.78Å; V2102-L2106 HydrophobicContact CG1-CG 4.29Å; V2102-L2106 WeakPolarHBondContact O-CB 3.38Å; V2102-L2106 VanDerWaalsContact O-CG 3.27Å; V2102-L2106 WeakPolarHBondContact O-CG 3.26Å; V2102-L2106 PolarHBondContact O-N 3.09Å; N2103-L2106 PolarHBondContact O-N 3.27Å; L2104-L2106 VanDerWaalsContact C-N 3.31Å; L2104-L2106 PolarHBondContact O-N 3.14Å; L2106-K2159 HydrophobicContact CD1-CB 4.27Å; L2106-K2159 HydrophobicContact CD1-CD 4.27Å; L2106-K2159 HydrophobicContact CD2-CB 4.08Å; L2106-L2160 HydrophobicContact CD2-CD2 4.14Å; L2106-S2163 VanDerWaalsContact CD2-OG 3.27Å; L2106-S2163 WeakPolarHBondContact CD2-OG 3.42Å
2107S79.2Confident74.9Confident28.75 Ų28.7539.3 Ų39.320%0.20121%0.206CC..Hα-helixtrans-91.2-30.5-177.77.30000113N2103 L2104 P2109 K2110 W2111N2103-S2107 VanDerWaalsContact O-CB 3.22Å; N2103-S2107 WeakPolarHBondContact O-CB 3.41Å; N2103-S2107 PolarHBondContact O-N 3.19Å; N2103-S2107 PolarHBondContact O-OG 2.91Å; L2104-S2107 PolarHBondContact O-N 2.96Å; L2104-S2107 PolarHBondContact O-OG 3.1Å; S2107-P2109 VanDerWaalsContact C-CD 3.47Å; S2107-P2109 VanDerWaalsContact C-N 3.34Å; S2107-K2110 WeakPolarHBondContact O-CA 3.22Å; S2107-K2110 WeakPolarHBondContact O-CB 3.37Å; S2107-K2110 PolarHBondContact O-N 2.81Å; S2107-W2111 PolarHBondContact O-N 3.12Å; S2107-W2111 VanDerWaalsContact O-N 3.12Å; S2107-W2111 VanDerWaalsContact OG-CH2 3.24Å; S2107-W2111 WeakPolarHBondContact OG-CH2 3.24Å; S2107-W2111 VanDerWaalsContact OG-CZ2 3.23Å; S2107-W2111 WeakPolarHBondContact OG-CZ2 3.38Å; S2107-W2111 VanDerWaalsContact OG-CZ3 3.31Å; S2107-W2111 WeakPolarHBondContact OG-CZ3 3.46Å
2108T77.1Confident74Confident0 Ų045.1 Ų45.10%023%0.233CC..Hα-helixtrans-50.6-45.4-177.9-14.50000113.8L2104 V2105 K2110 W2111 I2112 L2124 Y2167L2104-T2108 HydrophobicContact CD2-CG2 3.91Å; L2104-T2108 HydrophobicContact CG-CG2 4.27Å; L2104-T2108 VanDerWaalsContact O-CB 3.26Å; L2104-T2108 WeakPolarHBondContact O-CB 3.37Å; L2104-T2108 VanDerWaalsContact O-CG2 3.31Å; L2104-T2108 WeakPolarHBondContact O-CG2 3.35Å; L2104-T2108 PolarHBondContact O-N 3.1Å; L2104-T2108 PolarHBondContact O-OG1 3.21Å; V2105-T2108 PolarHBondContact O-OG1 3.19Å; V2105-T2108 VanDerWaalsContact O-OG1 3.06Å; T2108-K2110 VanDerWaalsContact C-N 3.27Å; T2108-K2110 PolarHBondContact O-N 3.21Å; T2108-W2111 HydrophobicContact CG2-CE3 4.05Å; T2108-W2111 HydrophobicContact CG2-CZ3 4.22Å; T2108-W2111 PolarHBondContact O-N 3.19Å; T2108-W2111 VanDerWaalsContact O-N 3.12Å; T2108-I2112 HydrophobicContact CG2-CD1 3.52Å; T2108-I2112 HydrophobicContact CG2-CG1 4.27Å; T2108-I2112 WeakPolarHBondContact O-CD1 3.42Å; T2108-I2112 VanDerWaalsContact O-CG1 3.31Å; T2108-I2112 WeakPolarHBondContact O-CG1 3.43Å; T2108-I2112 PolarHBondContact O-N 3.23Å; T2108-I2112 VanDerWaalsContact O-N 3.08Å; T2108-L2124 HydrophobicContact CG2-CB 4.24Å; T2108-L2124 HydrophobicContact CG2-CD1 3.95Å; T2108-L2124 HydrophobicContact CG2-CD2 4.02Å; T2108-L2124 HydrophobicContact CG2-CG 3.73Å; T2108-Y2167 WeakPolarHBondContact CB-OH 3.12Å; T2108-Y2167 PolarHBondContact OG1-OH 3.27Å
2109P71.4Confident73.1Confident7.75 Ų7.7550.6 Ų50.65%0.0526%0.262CS..Hα-helixtrans-61.6-32.9178.1-20.431.5000113.3V2105 S2107 G2113 Y2166 Y2167 L2170V2105-P2109 WeakPolarHBondContact O-CD 3.39Å; S2107-P2109 VanDerWaalsContact C-CD 3.47Å; S2107-P2109 VanDerWaalsContact C-N 3.34Å; P2109-G2113 PolarHBondContact O-N 3.07Å; P2109-Y2166 HydrophobicContact CB-CG 4.32Å; P2109-Y2167 HydrophobicContact CG-CD1 4.4Å; P2109-Y2167 HydrophobicContact CG-CD2 4.16Å; P2109-Y2167 HydrophobicContact CG-CE1 4.12Å; P2109-Y2167 HydrophobicContact CG-CE2 3.73Å; P2109-Y2167 HydrophobicContact CG-CG 4.4Å; P2109-L2170 HydrophobicContact CB-CD1 4.16Å
2110K73Confident72.5Confident149.5 Ų149.550.1 Ų50.165%0.6526%0.255SS*.Hα-helixtrans-71.5-34.2178-57.6-178.5179.8-178.60112S2107 T2108 N2114S2107-K2110 WeakPolarHBondContact O-CA 3.22Å; S2107-K2110 WeakPolarHBondContact O-CB 3.37Å; S2107-K2110 PolarHBondContact O-N 2.81Å; T2108-K2110 VanDerWaalsContact C-N 3.27Å; T2108-K2110 PolarHBondContact O-N 3.21Å; K2110-N2114 PolarHBondContact O-ND2 3.12Å
2111W71.9Confident72.2Confident21 Ų2148.7 Ų48.78%0.0825%0.249CC..Hα-helixtrans-73-41.4177.4-62.3-30.5000111.8W1950 D1954 I1957 N1958 S2107 T2108 G2113 N2114 L2117 L2124W1950-W2111 HydrophobicContact CH2-CH2 4.35Å; W1950-W2111 AromaticContact CH2-CZ3 3.86Å; W1950-W2111 HydrophobicContact CH2-CZ3 4Å; W1950-W2111 AromaticContact CZ2-CH2 3.83Å; W1950-W2111 HydrophobicContact CZ2-CH2 3.83Å; W1950-W2111 AromaticContact CZ2-CZ3 3.71Å; W1950-W2111 HydrophobicContact CZ2-CZ3 3.71Å; D1954-W2111 VanDerWaalsContact OD1-CH2 3.3Å; D1954-W2111 WeakPolarHBondContact OD1-CH2 3.41Å; D1954-W2111 VanDerWaalsContact OD1-CZ2 3.24Å; D1954-W2111 WeakPolarHBondContact OD1-CZ2 3.35Å; I1957-W2111 HydrophobicContact CD1-CE3 4.23Å; I1957-W2111 HydrophobicContact CD1-CH2 4.43Å; I1957-W2111 HydrophobicContact CD1-CZ3 4.1Å; I1957-W2111 HydrophobicContact CG2-CB 4.37Å; I1957-W2111 HydrophobicContact CG2-CD2 3.72Å; I1957-W2111 HydrophobicContact CG2-CE3 4.2Å; I1957-W2111 HydrophobicContact CG2-CG 3.8Å; I1957-W2111 HydrophobicContact CG2-CZ2 4.4Å; N1958-W2111 PolarHBondContact OD1-NE1 3.11Å; S2107-W2111 PolarHBondContact O-N 3.12Å; S2107-W2111 VanDerWaalsContact O-N 3.12Å; S2107-W2111 VanDerWaalsContact OG-CH2 3.24Å; S2107-W2111 WeakPolarHBondContact OG-CH2 3.24Å; S2107-W2111 VanDerWaalsContact OG-CZ2 3.23Å; S2107-W2111 WeakPolarHBondContact OG-CZ2 3.38Å; S2107-W2111 VanDerWaalsContact OG-CZ3 3.31Å; S2107-W2111 WeakPolarHBondContact OG-CZ3 3.46Å; T2108-W2111 HydrophobicContact CG2-CE3 4.05Å; T2108-W2111 HydrophobicContact CG2-CZ3 4.22Å; T2108-W2111 PolarHBondContact O-N 3.19Å; T2108-W2111 VanDerWaalsContact O-N 3.12Å; W2111-G2113 VanDerWaalsContact C-N 3.28Å; W2111-G2113 PolarHBondContact O-N 3.1Å; W2111-N2114 WeakPolarHBondContact O-CB 3.41Å; W2111-N2114 PolarHBondContact O-N 3Å; W2111-N2114 VanDerWaalsContact O-N 3.11Å; W2111-N2114 PolarHBondContact O-ND2 3.09Å; W2111-L2117 HydrophobicContact CB-CD1 4.26Å; W2111-L2117 WeakPolarHBondContact O-CD1 3.34Å; W2111-L2124 HydrophobicContact CB-CD2 4.22Å; W2111-L2124 HydrophobicContact CE3-CD1 4.24Å; W2111-L2124 HydrophobicContact CE3-CD2 4.14Å; W2111-L2124 HydrophobicContact CZ3-CD1 4.39Å; W2111-L2124 HydrophobicContact CZ3-CD2 4.24Å
2112I68.8Low71.7Confident8.5 Ų8.550.9 Ų50.94%0.04426%0.263CS..Hα-helixtrans-64.5-33.1-178.4-66.7156.7000112T2108 N2114 T2121 L2124 Y2167 L2170 F2176 F2185T2108-I2112 HydrophobicContact CG2-CD1 3.52Å; T2108-I2112 HydrophobicContact CG2-CG1 4.27Å; T2108-I2112 WeakPolarHBondContact O-CD1 3.42Å; T2108-I2112 VanDerWaalsContact O-CG1 3.31Å; T2108-I2112 WeakPolarHBondContact O-CG1 3.43Å; T2108-I2112 PolarHBondContact O-N 3.23Å; T2108-I2112 VanDerWaalsContact O-N 3.08Å; I2112-N2114 CarbonylContact O-C 3.6Å; I2112-N2114 PolarHBondContact O-N 3.31Å; I2112-T2121 HydrophobicContact CG2-CG2 4.25Å; I2112-L2124 HydrophobicContact CD1-CD2 4.36Å; I2112-L2124 HydrophobicContact CG1-CD2 3.9Å; I2112-Y2167 HydrophobicContact CD1-CE1 4.44Å; I2112-L2170 HydrophobicContact CB-CD1 4.22Å; I2112-L2170 HydrophobicContact CB-CD2 4.44Å; I2112-L2170 HydrophobicContact CD1-CD1 4.35Å; I2112-L2170 HydrophobicContact CG2-CD1 4.1Å; I2112-L2170 HydrophobicContact CG2-CD2 3.88Å; I2112-F2176 HydrophobicContact CG2-CE1 4.36Å; I2112-F2176 HydrophobicContact CG2-CZ 4.07Å; I2112-F2185 HydrophobicContact CD1-CD1 4.34Å; I2112-F2185 HydrophobicContact CD1-CE1 3.39Å; I2112-F2185 VanDerWaalsContact CD1-CE1 3.49Å; I2112-F2185 HydrophobicContact CD1-CE2 4.35Å; I2112-F2185 HydrophobicContact CD1-CZ 3.73Å; I2112-F2185 HydrophobicContact CG1-CE1 4.35Å; I2112-F2185 HydrophobicContact CG1-CZ 4.18Å; I2112-F2185 HydrophobicContact CG2-CE1 4.19Å; I2112-F2185 HydrophobicContact CG2-CE2 4.47Å; I2112-F2185 HydrophobicContact CG2-CZ 4.09Å
2113G61.5Low71.4Confident43 Ų4351.6 Ų51.644%0.44327%0.268SS..THydrogen-bonded Turntrans-60.3-13.3174.900000114.5P2109 W2111 H2115P2109-G2113 PolarHBondContact O-N 3.07Å; W2111-G2113 VanDerWaalsContact C-N 3.28Å; W2111-G2113 PolarHBondContact O-N 3.1Å; G2113-H2115 PolarHBondContact O-N 3.18Å
2114N64.3Low71.3Confident69.25 Ų69.2546.9 Ų46.937%0.3724%0.244SC..SBendtrans-87.8104.7173.2-63.4-34.8000110.2T1961 K2110 W2111 I2112 K2116 L2117T1961-N2114 VanDerWaalsContact CG2-ND2 3.33Å; T1961-N2114 WeakPolarHBondContact CG2-ND2 3.42Å; K2110-N2114 PolarHBondContact O-ND2 3.12Å; W2111-N2114 WeakPolarHBondContact O-CB 3.41Å; W2111-N2114 PolarHBondContact O-N 3Å; W2111-N2114 VanDerWaalsContact O-N 3.11Å; W2111-N2114 PolarHBondContact O-ND2 3.09Å; I2112-N2114 CarbonylContact O-C 3.6Å; I2112-N2114 PolarHBondContact O-N 3.31Å; N2114-K2116 PolarHBondContact O-N 2.92Å; N2114-L2117 HydrophobicContact CB-CD1 4.44Å; N2114-L2117 PolarHBondContact O-N 3.05Å; N2114-L2117 VanDerWaalsContact O-N 3.09Å
2115H60.1Low71.2Confident148.25 Ų148.2546.9 Ų46.969%0.68624%0.243SC*.G310 helixtrans-50.7-20.8-179.9-68.9-82.8000115.3G2113 L2117 E2118 D2175G2113-H2115 PolarHBondContact O-N 3.18Å; H2115-L2117 PolarHBondContact O-N 3.05Å; H2115-L2117 VanDerWaalsContact O-N 3.13Å; H2115-E2118 PolarHBondContact O-N 3.2Å; H2115-D2175 IonicContact CE1-OD2 2.82Å; H2115-D2175 PolarHBondContact CE1-OD2 3.26Å; H2115-D2175 VanDerWaalsContact CE1-OD2 3.3Å
2116K57.8Low71.2Confident154.5 Ų154.549 Ų4967%0.67225%0.253SS*.G310 helixtrans-64.7-12.4176.2-66.4-177179.7175.70114.4N2114N2114-K2116 PolarHBondContact O-N 2.92Å
2117L61.1Low71.3Confident6.5 Ų6.548 Ų483%0.03425%0.248CC..G310 helixtrans-104.413.4-174.7-71.8168.4000114.3I1957 V1960 T1961 W2111 N2114 H2115 N2119 I2120 T2121I1957-L2117 HydrophobicContact CG2-CD1 4.41Å; V1960-L2117 HydrophobicContact CG1-CD2 4.4Å; T1961-L2117 HydrophobicContact CG2-CD1 4.32Å; W2111-L2117 HydrophobicContact CB-CD1 4.26Å; W2111-L2117 WeakPolarHBondContact O-CD1 3.34Å; N2114-L2117 HydrophobicContact CB-CD1 4.44Å; N2114-L2117 PolarHBondContact O-N 3.05Å; N2114-L2117 VanDerWaalsContact O-N 3.09Å; H2115-L2117 PolarHBondContact O-N 3.05Å; H2115-L2117 VanDerWaalsContact O-N 3.13Å; L2117-N2119 VanDerWaalsContact C-N 3.3Å; L2117-N2119 PolarHBondContact O-N 3.03Å; L2117-N2119 VanDerWaalsContact O-N 3.13Å; L2117-I2120 HydrophobicContact CD2-CD1 4.06Å; L2117-I2120 WeakPolarHBondContact O-CA 3.11Å; L2117-I2120 PolarHBondContact O-N 2.95Å; L2117-T2121 WeakPolarHBondContact O-CG2 3.4Å; L2117-T2121 PolarHBondContact O-N 3.05Å; L2117-T2121 VanDerWaalsContact O-N 3.15Å
2118E63.2Low71.7Confident122 Ų12246.6 Ų46.657%0.5724%0.238SC*.G310 helixtrans-48.2-46.1-173.1-162.4176.4176.100113.5H2115 I2120 T2121H2115-E2118 PolarHBondContact O-N 3.2Å; E2118-I2120 VanDerWaalsContact C-N 3.25Å; E2118-I2120 PolarHBondContact O-N 3.13Å; E2118-I2120 VanDerWaalsContact O-N 3.14Å; E2118-T2121 WeakPolarHBondContact O-CB 3.43Å; E2118-T2121 PolarHBondContact O-N 3.12Å; E2118-T2121 VanDerWaalsContact O-N 3.16Å; E2118-T2121 PolarHBondContact O-OG1 3.16Å
2119N64.1Low72.2Confident118 Ų11847.3 Ų47.363%0.63124%0.242SC*.G310 helixtrans-62.5-24179.5-69.6-9.1000114.6L2117L2117-N2119 VanDerWaalsContact C-N 3.3Å; L2117-N2119 PolarHBondContact O-N 3.03Å; L2117-N2119 VanDerWaalsContact O-N 3.13Å
2120I69.6Low73.1Confident7 Ų747.8 Ų47.84%0.03625%0.245CC..G310 helixtrans-99-17.3-176.4-58.9-179.6000111.2V2060 F2062 L2117 E2118 C2122 S2123 L2124V2060-I2120 HydrophobicContact CB-CD1 4.39Å; V2060-I2120 HydrophobicContact CG1-CD1 4.2Å; V2060-I2120 WeakPolarHBondContact O-CD1 3.43Å; F2062-I2120 HydrophobicContact CB-CD1 4.01Å; F2062-I2120 HydrophobicContact CB-CG1 4.02Å; F2062-I2120 HydrophobicContact CB-CG2 3.93Å; F2062-I2120 HydrophobicContact CD2-CD1 4.34Å; F2062-I2120 HydrophobicContact CD2-CG2 3.42Å; F2062-I2120 HydrophobicContact CE2-CG2 4.18Å; F2062-I2120 HydrophobicContact CG-CG2 3.96Å; L2117-I2120 HydrophobicContact CD2-CD1 4.06Å; L2117-I2120 WeakPolarHBondContact O-CA 3.11Å; L2117-I2120 PolarHBondContact O-N 2.95Å; E2118-I2120 VanDerWaalsContact C-N 3.25Å; E2118-I2120 PolarHBondContact O-N 3.13Å; E2118-I2120 VanDerWaalsContact O-N 3.14Å; I2120-C2122 VanDerWaalsContact C-N 3.32Å; I2120-C2122 PolarHBondContact O-N 3.17Å; I2120-S2123 PolarHBondContact O-N 3.11Å; I2120-S2123 VanDerWaalsContact O-N 3.12Å; I2120-L2124 HydrophobicContact CB-CD1 4.38Å; I2120-L2124 HydrophobicContact CG2-CB 4.34Å; I2120-L2124 HydrophobicContact CG2-CD1 3.54Å; I2120-L2124 VanDerWaalsContact CG2-CD1 3.47Å; I2120-L2124 HydrophobicContact CG2-CG 3.77Å; I2120-L2124 WeakPolarHBondContact O-CB 3.39Å; I2120-L2124 PolarHBondContact O-N 3.16Å
2121T74.2Confident73.9Confident8.25 Ų8.2540.7 Ų40.75%0.05121%0.214CC..Hα-helixtrans-51.6-45.2-173.956.90000113.5I2112 L2117 E2118 S2123 L2124 A2125 F2176I2112-T2121 HydrophobicContact CG2-CG2 4.25Å; L2117-T2121 WeakPolarHBondContact O-CG2 3.4Å; L2117-T2121 PolarHBondContact O-N 3.05Å; L2117-T2121 VanDerWaalsContact O-N 3.15Å; E2118-T2121 WeakPolarHBondContact O-CB 3.43Å; E2118-T2121 PolarHBondContact O-N 3.12Å; E2118-T2121 VanDerWaalsContact O-N 3.16Å; E2118-T2121 PolarHBondContact O-OG1 3.16Å; T2121-S2123 PolarHBondContact O-N 3.13Å; T2121-L2124 PolarHBondContact O-N 3.31Å; T2121-A2125 VanDerWaalsContact O-CB 3.29Å; T2121-A2125 WeakPolarHBondContact O-CB 3.37Å; T2121-A2125 PolarHBondContact O-N 3.13Å; T2121-F2176 HydrophobicContact CG2-CE1 4.32Å
2122C75.6Confident74.7Confident46.75 Ų46.7539.7 Ų39.732%0.31621%0.21SC..Hα-helixtrans-60.9-49.1178.9-700000112.6I2120 L2124 A2125 E2126I2120-C2122 VanDerWaalsContact C-N 3.32Å; I2120-C2122 PolarHBondContact O-N 3.17Å; C2122-L2124 VanDerWaalsContact C-N 3.29Å; C2122-L2124 PolarHBondContact O-N 3.25Å; C2122-A2125 WeakPolarHBondContact O-CB 3.32Å; C2122-A2125 PolarHBondContact O-N 3.21Å; C2122-E2126 WeakPolarHBondContact O-CG 3.17Å; C2122-E2126 PolarHBondContact O-N 3.15Å
2123S75.3Confident75.7Confident19 Ų1943.1 Ų43.113%0.13322%0.224CC..Hα-helixtrans-66.7-37.7179.9-59.50000111.6R2033 I2120 T2121 A2125 E2126 I2127R2033-S2123 PolarHBondContact NH2-OG 3.38Å; I2120-S2123 PolarHBondContact O-N 3.11Å; I2120-S2123 VanDerWaalsContact O-N 3.12Å; T2121-S2123 PolarHBondContact O-N 3.13Å; S2123-A2125 VanDerWaalsContact C-N 3.34Å; S2123-A2125 PolarHBondContact O-N 2.86Å; S2123-E2126 PolarHBondContact O-N 2.99Å; S2123-I2127 WeakPolarHBondContact O-CB 3.41Å; S2123-I2127 WeakPolarHBondContact O-CD1 3.35Å; S2123-I2127 VanDerWaalsContact O-CG1 3.24Å; S2123-I2127 WeakPolarHBondContact O-CG1 3.23Å; S2123-I2127 PolarHBondContact O-N 3.06Å
2124L80.5Confident77Confident1.75 Ų1.7541.1 Ų41.11%0.00920%0.204CC..Hα-helixtrans-65.9-37.9174.9-126.8114.1000112.1W1950 I1957 F2062 T2108 W2111 I2112 I2120 T2121 C2122 I2127 S2128W1950-L2124 HydrophobicContact CH2-CD1 3.99Å; W1950-L2124 HydrophobicContact CH2-CD2 4.1Å; I1957-L2124 HydrophobicContact CD1-CD2 4.17Å; F2062-L2124 HydrophobicContact CE2-CD2 4.16Å; F2062-L2124 HydrophobicContact CE2-CG 4.38Å; T2108-L2124 HydrophobicContact CG2-CB 4.24Å; T2108-L2124 HydrophobicContact CG2-CD1 3.95Å; T2108-L2124 HydrophobicContact CG2-CD2 4.02Å; T2108-L2124 HydrophobicContact CG2-CG 3.73Å; W2111-L2124 HydrophobicContact CB-CD2 4.22Å; W2111-L2124 HydrophobicContact CE3-CD1 4.24Å; W2111-L2124 HydrophobicContact CE3-CD2 4.14Å; W2111-L2124 HydrophobicContact CZ3-CD1 4.39Å; W2111-L2124 HydrophobicContact CZ3-CD2 4.24Å; I2112-L2124 HydrophobicContact CD1-CD2 4.36Å; I2112-L2124 HydrophobicContact CG1-CD2 3.9Å; I2120-L2124 HydrophobicContact CB-CD1 4.38Å; I2120-L2124 HydrophobicContact CG2-CB 4.34Å; I2120-L2124 HydrophobicContact CG2-CD1 3.54Å; I2120-L2124 VanDerWaalsContact CG2-CD1 3.47Å; I2120-L2124 HydrophobicContact CG2-CG 3.77Å; I2120-L2124 WeakPolarHBondContact O-CB 3.39Å; I2120-L2124 PolarHBondContact O-N 3.16Å; T2121-L2124 PolarHBondContact O-N 3.31Å; C2122-L2124 VanDerWaalsContact C-N 3.29Å; C2122-L2124 PolarHBondContact O-N 3.25Å; L2124-I2127 PolarHBondContact O-N 2.98Å; L2124-S2128 WeakPolarHBondContact O-CB 3.18Å; L2124-S2128 PolarHBondContact O-N 3.06Å; L2124-S2128 PolarHBondContact O-OG 3.33Å
2125A80.6Confident78.2Confident0 Ų038 Ų380%019%0.187CC..Hα-helixtrans-63-43.8173.800000111.6T2121 C2122 S2123 S2128 C2129 F2185 C2188T2121-A2125 VanDerWaalsContact O-CB 3.29Å; T2121-A2125 WeakPolarHBondContact O-CB 3.37Å; T2121-A2125 PolarHBondContact O-N 3.13Å; C2122-A2125 WeakPolarHBondContact O-CB 3.32Å; C2122-A2125 PolarHBondContact O-N 3.21Å; S2123-A2125 VanDerWaalsContact C-N 3.34Å; S2123-A2125 PolarHBondContact O-N 2.86Å; A2125-S2128 WeakPolarHBondContact CA-OG 3.27Å; A2125-S2128 PolarHBondContact O-N 3.22Å; A2125-S2128 PolarHBondContact O-OG 3.2Å; A2125-C2129 VanDerWaalsContact O-CB 3.3Å; A2125-C2129 WeakPolarHBondContact O-CB 3.28Å; A2125-C2129 PolarHBondContact O-N 3.05Å; A2125-F2185 HydrophobicContact CB-CD1 3.91Å; A2125-F2185 HydrophobicContact CB-CE1 3.41Å; A2125-F2185 VanDerWaalsContact CB-CE1 3.45Å; A2125-F2185 HydrophobicContact CB-CE2 4.29Å; A2125-F2185 HydrophobicContact CB-CZ 3.88Å; A2125-C2188 PolarHBondContact O-SG 2.88Å
2126E83.1Confident79.5Confident48.5 Ų48.532.4 Ų32.423%0.22716%0.162CC..Hα-helixtrans-65.7-45.4177.2-92.4174-167.900112.1C2031 I2069 C2122 S2123 S2128 C2129 L2130 H2180C2031-E2126 PolarHBondContact SG-OE1 3.46Å; I2069-E2126 HydrophobicContact CD1-CB 4.45Å; I2069-E2126 HydrophobicContact CD1-CG 4.19Å; I2069-E2126 WeakPolarHBondContact CD1-OE2 3.27Å; I2069-E2126 HydrophobicContact CG1-CG 4.38Å; C2122-E2126 WeakPolarHBondContact O-CG 3.17Å; C2122-E2126 PolarHBondContact O-N 3.15Å; S2123-E2126 PolarHBondContact O-N 2.99Å; E2126-S2128 VanDerWaalsContact C-N 3.33Å; E2126-S2128 PolarHBondContact O-N 3.18Å; E2126-C2129 WeakPolarHBondContact O-CB 3.24Å; E2126-C2129 PolarHBondContact O-N 3.15Å; E2126-L2130 HydrophobicContact CG-CD1 4.12Å; E2126-L2130 WeakPolarHBondContact O-CB 3.3Å; E2126-L2130 WeakPolarHBondContact O-CG 3.17Å; E2126-L2130 PolarHBondContact O-N 3.1Å; E2126-H2180 IonicContact OE1-CE1 2.91Å; E2126-H2180 PolarHBondContact OE1-CE1 3.1Å; E2126-H2180 VanDerWaalsContact OE1-CE1 3.27Å; E2126-H2180 IonicContact OE1-ND1 2.74Å
2127I85.9Confident80.9Confident0 Ų025.3 Ų25.30%013%0.132CC..Hα-helixtrans-61.8-41.8176.7-69.3167.3000110.7W1950 F2062 I2068 I2069 L2072 L2104 S2123 L2124 L2130 S2131W1950-I2127 HydrophobicContact CH2-CG2 4.46Å; W1950-I2127 HydrophobicContact CZ3-CD1 4.38Å; W1950-I2127 HydrophobicContact CZ3-CG2 3.97Å; F2062-I2127 HydrophobicContact CE1-CD1 3.66Å; F2062-I2127 HydrophobicContact CZ-CD1 3.65Å; I2068-I2127 HydrophobicContact CB-CD1 4.47Å; I2068-I2127 HydrophobicContact CG2-CD1 3.94Å; I2068-I2127 HydrophobicContact CG2-CG1 4.12Å; I2068-I2127 HydrophobicContact CG2-CG2 4.36Å; I2069-I2127 HydrophobicContact CG1-CG1 3.93Å; L2072-I2127 HydrophobicContact CD1-CB 4.46Å; L2072-I2127 HydrophobicContact CD1-CG2 3.86Å; L2104-I2127 HydrophobicContact CD1-CG2 3.71Å; L2104-I2127 HydrophobicContact CD2-CG2 4.23Å; L2104-I2127 HydrophobicContact CG-CG2 4.46Å; S2123-I2127 WeakPolarHBondContact O-CB 3.41Å; S2123-I2127 WeakPolarHBondContact O-CD1 3.35Å; S2123-I2127 VanDerWaalsContact O-CG1 3.24Å; S2123-I2127 WeakPolarHBondContact O-CG1 3.23Å; S2123-I2127 PolarHBondContact O-N 3.06Å; L2124-I2127 PolarHBondContact O-N 2.98Å; I2127-L2130 PolarHBondContact O-N 3.11Å; I2127-S2131 VanDerWaalsContact O-CB 3.29Å; I2127-S2131 WeakPolarHBondContact O-CB 3.26Å; I2127-S2131 PolarHBondContact O-N 2.98Å; I2127-S2131 PolarHBondContact O-OG 3.13Å
2128S86.7Confident82.1Confident0 Ų025 Ų250%013%0.131CC..Hα-helixtrans-66.5-40.8176.264.70000112.1L2124 A2125 E2126 L2130 S2131 I2132 Y2167 C2188L2124-S2128 WeakPolarHBondContact O-CB 3.18Å; L2124-S2128 PolarHBondContact O-N 3.06Å; L2124-S2128 PolarHBondContact O-OG 3.33Å; A2125-S2128 WeakPolarHBondContact CA-OG 3.27Å; A2125-S2128 PolarHBondContact O-N 3.22Å; A2125-S2128 PolarHBondContact O-OG 3.2Å; E2126-S2128 VanDerWaalsContact C-N 3.33Å; E2126-S2128 PolarHBondContact O-N 3.18Å; S2128-L2130 PolarHBondContact O-N 3.16Å; S2128-S2131 WeakPolarHBondContact O-CB 3.4Å; S2128-S2131 PolarHBondContact O-N 3.15Å; S2128-I2132 VanDerWaalsContact O-CG1 3.29Å; S2128-I2132 WeakPolarHBondContact O-CG1 3.27Å; S2128-I2132 PolarHBondContact O-N 3.1Å; S2128-Y2167 WeakPolarHBondContact CB-OH 3.43Å; S2128-Y2167 PolarHBondContact OG-OH 3.22Å; S2128-C2188 PolarHBondContact OG-SG 3.22Å; S2128-C2188 VanDerWaalsContact OG-SG 3.4Å
2129C88Confident83.1Confident13.25 Ų13.2519.6 Ų19.69%0.0911%0.106CC..Hα-helixtrans-59.4-48.4174-171.70000111.7A2125 E2126 S2131 I2132 K2133 C2188A2125-C2129 VanDerWaalsContact O-CB 3.3Å; A2125-C2129 WeakPolarHBondContact O-CB 3.28Å; A2125-C2129 PolarHBondContact O-N 3.05Å; E2126-C2129 WeakPolarHBondContact O-CB 3.24Å; E2126-C2129 PolarHBondContact O-N 3.15Å; C2129-S2131 VanDerWaalsContact C-N 3.34Å; C2129-S2131 PolarHBondContact O-N 3.27Å; C2129-I2132 PolarHBondContact O-N 3.14Å; C2129-K2133 WeakPolarHBondContact O-CG 3.26Å; C2129-K2133 PolarHBondContact O-N 3.09Å; C2129-C2188 VanDerWaalsContact CA-SG 3.54Å; C2129-C2188 VanDerWaalsContact CB-SG 3.56Å; C2129-C2188 WeakPolarHBondContact CB-SG 3.37Å; C2129-C2188 PolarHBondContact N-SG 3Å; C2129-C2188 VanDerWaalsContact N-SG 3.45Å
2130L89.2Confident84Confident19.5 Ų19.515.9 Ų15.910%0.1029%0.085CC..Hα-helixtrans-65.6-36.9177.3-70.1169.7000112I2069 L2072 I2076 E2126 I2127 S2128 I2132 K2133 L2134I2069-L2130 HydrophobicContact CB-CD1 4.26Å; I2069-L2130 HydrophobicContact CG1-CD1 4.28Å; I2069-L2130 HydrophobicContact CG2-CD1 3.81Å; L2072-L2130 HydrophobicContact CB-CB 4.03Å; L2072-L2130 HydrophobicContact CB-CD1 4.39Å; L2072-L2130 HydrophobicContact CD1-CB 4.03Å; I2076-L2130 HydrophobicContact CD1-CB 4.28Å; I2076-L2130 HydrophobicContact CD1-CD2 3.77Å; E2126-L2130 HydrophobicContact CG-CD1 4.12Å; E2126-L2130 WeakPolarHBondContact O-CB 3.3Å; E2126-L2130 WeakPolarHBondContact O-CG 3.17Å; E2126-L2130 PolarHBondContact O-N 3.1Å; I2127-L2130 PolarHBondContact O-N 3.11Å; S2128-L2130 PolarHBondContact O-N 3.16Å; L2130-I2132 VanDerWaalsContact C-N 3.35Å; L2130-I2132 PolarHBondContact O-N 3.14Å; L2130-K2133 HydrophobicContact CD2-CD 4.37Å; L2130-K2133 PolarHBondContact O-N 2.81Å; L2130-L2134 WeakPolarHBondContact O-CB 3.3Å; L2130-L2134 PolarHBondContact O-N 3.09Å
2131S90.1Very high84.4Confident0 Ų016.2 Ų16.20%09%0.089CC..Hα-helixtrans-61.9-43.8174.5-60.20000111.3I2127 S2128 C2129 L2134 L2135I2127-S2131 VanDerWaalsContact O-CB 3.29Å; I2127-S2131 WeakPolarHBondContact O-CB 3.26Å; I2127-S2131 PolarHBondContact O-N 2.98Å; I2127-S2131 PolarHBondContact O-OG 3.13Å; S2128-S2131 WeakPolarHBondContact O-CB 3.4Å; S2128-S2131 PolarHBondContact O-N 3.15Å; C2129-S2131 VanDerWaalsContact C-N 3.34Å; C2129-S2131 PolarHBondContact O-N 3.27Å; S2131-L2134 PolarHBondContact O-N 3.08Å; S2131-L2135 WeakPolarHBondContact O-CG 3.39Å; S2131-L2135 PolarHBondContact O-N 3.07Å; S2131-L2135 VanDerWaalsContact O-N 3.07Å
2132I89.8Confident84.6Confident0 Ų016 Ų160%09%0.088CC..Hα-helixtrans-66.6-40.7175.2-59.4160.8000110.8V2105 S2128 C2129 L2130 L2134 L2135 L2136 C2188 L2191 L2192V2105-I2132 HydrophobicContact CB-CG1 4.47Å; V2105-I2132 HydrophobicContact CG1-CD1 4.05Å; V2105-I2132 HydrophobicContact CG1-CG1 3.85Å; V2105-I2132 HydrophobicContact CG2-CD1 4.45Å; V2105-I2132 HydrophobicContact CG2-CG1 3.67Å; S2128-I2132 VanDerWaalsContact O-CG1 3.29Å; S2128-I2132 WeakPolarHBondContact O-CG1 3.27Å; S2128-I2132 PolarHBondContact O-N 3.1Å; C2129-I2132 PolarHBondContact O-N 3.14Å; L2130-I2132 VanDerWaalsContact C-N 3.35Å; L2130-I2132 PolarHBondContact O-N 3.14Å; I2132-L2134 VanDerWaalsContact C-N 3.31Å; I2132-L2134 PolarHBondContact O-N 3.19Å; I2132-L2135 WeakPolarHBondContact O-CB 3.38Å; I2132-L2135 PolarHBondContact O-N 3.29Å; I2132-L2136 HydrophobicContact CG2-CD1 4.26Å; I2132-L2136 WeakPolarHBondContact O-CG 3.39Å; I2132-L2136 PolarHBondContact O-N 3.29Å; I2132-C2188 HydrophobicContact CD1-CB 4.09Å; I2132-L2191 HydrophobicContact CB-CB 4.38Å; I2132-L2191 HydrophobicContact CG2-CB 3.59Å; I2132-L2192 HydrophobicContact CD1-CB 4.25Å; I2132-L2192 HydrophobicContact CD1-CD1 4.24Å; I2132-L2192 HydrophobicContact CG1-CD1 4.45Å
2133K89.3Confident84.4Confident79.25 Ų79.2518.1 Ų18.135%0.3459%0.093SC..Hα-helixtrans-60.6-39174.3-75179.5178.7-177.60112.2T2029 I2076 C2129 L2130 L2136 A2137 L2191T2029-K2133 PolarHBondContact O-NZ 3.36Å; T2029-K2133 PolarHBondContact OG1-NZ 2.81Å; T2029-K2133 VanDerWaalsContact OG1-NZ 3.14Å; I2076-K2133 HydrophobicContact CD1-CB 3.89Å; C2129-K2133 WeakPolarHBondContact O-CG 3.26Å; C2129-K2133 PolarHBondContact O-N 3.09Å; L2130-K2133 HydrophobicContact CD2-CD 4.37Å; L2130-K2133 PolarHBondContact O-N 2.81Å; K2133-L2136 PolarHBondContact O-N 3.15Å; K2133-A2137 VanDerWaalsContact O-CB 3.32Å; K2133-A2137 WeakPolarHBondContact O-CB 3.31Å; K2133-A2137 PolarHBondContact O-N 3.24Å; K2133-L2191 HydrophobicContact CG-CD1 3.97Å
2134L89.4Confident84.4Confident0.75 Ų0.7521.6 Ų21.60%0.00411%0.107CC..Hα-helixtrans-65.4-42.9175.5-178.456.1000111.2L2072 L2075 I2076 I2090 L2101 L2130 S2131 I2132 L2136 A2137 V2138L2072-L2134 HydrophobicContact CD2-CD2 3.98Å; L2075-L2134 HydrophobicContact CB-CD1 3.92Å; L2075-L2134 HydrophobicContact CB-CD2 3.98Å; L2075-L2134 HydrophobicContact CD1-CD2 4.14Å; I2076-L2134 HydrophobicContact CD1-CB 4.44Å; I2076-L2134 HydrophobicContact CG1-CB 3.8Å; I2076-L2134 HydrophobicContact CG1-CD1 4.03Å; I2076-L2134 HydrophobicContact CG1-CG 4.46Å; I2090-L2134 HydrophobicContact CD1-CD1 4.13Å; L2101-L2134 HydrophobicContact CD1-CD2 3.66Å; L2101-L2134 HydrophobicContact CD1-CG 4.15Å; L2101-L2134 HydrophobicContact CD2-CD2 4.41Å; L2130-L2134 WeakPolarHBondContact O-CB 3.3Å; L2130-L2134 PolarHBondContact O-N 3.09Å; S2131-L2134 PolarHBondContact O-N 3.08Å; I2132-L2134 VanDerWaalsContact C-N 3.31Å; I2132-L2134 PolarHBondContact O-N 3.19Å; L2134-L2136 VanDerWaalsContact C-N 3.29Å; L2134-L2136 PolarHBondContact O-N 3.09Å; L2134-A2137 PolarHBondContact O-N 3.01Å; L2134-V2138 HydrophobicContact CD1-CG2 4.36Å; L2134-V2138 WeakPolarHBondContact O-CB 3.45Å; L2134-V2138 VanDerWaalsContact O-CG2 3.26Å; L2134-V2138 WeakPolarHBondContact O-CG2 3.4Å; L2134-V2138 PolarHBondContact O-N 3.09Å
2135L88.7Confident84.1Confident4.5 Ų4.526.2 Ų26.22%0.02413%0.132CC..Hα-helixtrans-59.2-40173.3-67172.5000112L2098 L2101 V2102 S2131 I2132 V2138 L2139 L2151 L2195L2098-L2135 HydrophobicContact CD1-CD2 3.55Å; L2098-L2135 HydrophobicContact CG-CD2 4.31Å; L2101-L2135 HydrophobicContact CB-CD2 4.43Å; L2101-L2135 HydrophobicContact CD1-CD2 4.31Å; L2101-L2135 HydrophobicContact CD1-CG 4.48Å; V2102-L2135 HydrophobicContact CG2-CD1 4.45Å; V2102-L2135 HydrophobicContact CG2-CD2 4.38Å; S2131-L2135 WeakPolarHBondContact O-CG 3.39Å; S2131-L2135 PolarHBondContact O-N 3.07Å; S2131-L2135 VanDerWaalsContact O-N 3.07Å; I2132-L2135 WeakPolarHBondContact O-CB 3.38Å; I2132-L2135 PolarHBondContact O-N 3.29Å; L2135-V2138 PolarHBondContact O-N 3.42Å; L2135-L2139 WeakPolarHBondContact O-CG 3.31Å; L2135-L2139 PolarHBondContact O-N 3Å; L2135-L2151 HydrophobicContact CD2-CD2 4.06Å; L2135-L2195 HydrophobicContact CB-CD1 4.4Å; L2135-L2195 HydrophobicContact CB-CD2 4.25Å; L2135-L2195 HydrophobicContact CD1-CD2 4Å
2136L88.1Confident84Confident30 Ų3033.3 Ų33.316%0.15716%0.162CC..Hα-helixtrans-69.9-41.1175.3-71.2169.7000112.5I2132 K2133 L2134 V2138 L2139 E2140 L2191 I2194 L2195 Y2198I2132-L2136 HydrophobicContact CG2-CD1 4.26Å; I2132-L2136 WeakPolarHBondContact O-CG 3.39Å; I2132-L2136 PolarHBondContact O-N 3.29Å; K2133-L2136 PolarHBondContact O-N 3.15Å; L2134-L2136 VanDerWaalsContact C-N 3.29Å; L2134-L2136 PolarHBondContact O-N 3.09Å; L2136-V2138 VanDerWaalsContact C-N 3.27Å; L2136-V2138 PolarHBondContact O-N 3.02Å; L2136-L2139 CarbonylContact O-C 3.36Å; L2136-L2139 WeakPolarHBondContact O-CB 3.36Å; L2136-L2139 PolarHBondContact O-N 3.18Å; L2136-L2139 VanDerWaalsContact O-N 3.11Å; L2136-E2140 PolarHBondContact O-N 3.26Å; L2136-L2191 HydrophobicContact CD1-CB 4.31Å; L2136-L2191 HydrophobicContact CD1-CD2 3.87Å; L2136-I2194 HydrophobicContact CD1-CG2 4.37Å; L2136-I2194 HydrophobicContact CD2-CG2 4.03Å; L2136-L2195 HydrophobicContact CD2-CB 3.98Å; L2136-L2195 HydrophobicContact CD2-CD1 3.96Å; L2136-L2195 HydrophobicContact CG-CB 4.48Å; L2136-L2195 HydrophobicContact CG-CD1 4.42Å; L2136-Y2198 HydrophobicContact CD2-CD2 3.97Å; L2136-Y2198 HydrophobicContact CD2-CE2 4.24Å
2137A87Confident83.9Confident5.5 Ų5.531 Ų315%0.04515%0.152CC..Hα-helixtrans-64.6-32.1177.100000112.3I2076 C2079 Q2080 Q2087 K2133 L2134 L2139 E2140I2076-A2137 HydrophobicContact CG2-CB 4.44Å; C2079-A2137 HydrophobicContact CB-CB 4.25Å; Q2080-A2137 HydrophobicContact CG-CB 4.24Å; Q2087-A2137 PolarHBondContact NE2-O 3.03Å; Q2087-A2137 VanDerWaalsContact NE2-O 3.16Å; K2133-A2137 VanDerWaalsContact O-CB 3.32Å; K2133-A2137 WeakPolarHBondContact O-CB 3.31Å; K2133-A2137 PolarHBondContact O-N 3.24Å; L2134-A2137 PolarHBondContact O-N 3.01Å; A2137-L2139 VanDerWaalsContact C-N 3.31Å; A2137-L2139 PolarHBondContact O-N 3.35Å; A2137-E2140 WeakPolarHBondContact O-CB 3.36Å; A2137-E2140 PolarHBondContact O-N 3.2Å
2138V86.4Confident83.6Confident2 Ų231.5 Ų31.51%0.01215%0.154CC..Hα-helixtrans-68.4-28.7173.5168.10000112.4I2090 L2091 L2134 L2135 L2136I2090-V2138 HydrophobicContact CB-CG2 4.29Å; I2090-V2138 HydrophobicContact CD1-CG2 4.44Å; I2090-V2138 HydrophobicContact CG2-CG2 3.85Å; L2091-V2138 HydrophobicContact CD1-CG1 3.61Å; L2091-V2138 HydrophobicContact CD2-CG1 3.38Å; L2091-V2138 VanDerWaalsContact CD2-CG1 3.42Å; L2091-V2138 HydrophobicContact CG-CG1 3.33Å; L2134-V2138 HydrophobicContact CD1-CG2 4.36Å; L2134-V2138 WeakPolarHBondContact O-CB 3.45Å; L2134-V2138 VanDerWaalsContact O-CG2 3.26Å; L2134-V2138 WeakPolarHBondContact O-CG2 3.4Å; L2134-V2138 PolarHBondContact O-N 3.09Å; L2135-V2138 PolarHBondContact O-N 3.42Å; L2136-V2138 VanDerWaalsContact C-N 3.27Å; L2136-V2138 PolarHBondContact O-N 3.02Å
2139L83.6Confident83.2Confident8.5 Ų8.535.6 Ų35.65%0.04517%0.173CC..Hα-helixtrans-85.8-14.4175.7-71.6178.4000113.9L2135 L2136 A2137 G2141 R2142 V2147 Y2148 L2151 L2195 L2199L2135-L2139 WeakPolarHBondContact O-CG 3.31Å; L2135-L2139 PolarHBondContact O-N 3Å; L2136-L2139 CarbonylContact O-C 3.36Å; L2136-L2139 WeakPolarHBondContact O-CB 3.36Å; L2136-L2139 PolarHBondContact O-N 3.18Å; L2136-L2139 VanDerWaalsContact O-N 3.11Å; A2137-L2139 VanDerWaalsContact C-N 3.31Å; A2137-L2139 PolarHBondContact O-N 3.35Å; L2139-G2141 PolarHBondContact O-N 3.25Å; L2139-G2141 VanDerWaalsContact O-N 3.15Å; L2139-R2142 PolarHBondContact O-N 3.08Å; L2139-R2142 VanDerWaalsContact O-N 3.14Å; L2139-V2147 HydrophobicContact CD2-CG1 3.9Å; L2139-Y2148 HydrophobicContact CD1-CE1 4.32Å; L2139-Y2148 HydrophobicContact CD2-CD1 3.87Å; L2139-Y2148 HydrophobicContact CD2-CE1 3.53Å; L2139-Y2148 VanDerWaalsContact CD2-CE1 3.45Å; L2139-Y2148 HydrophobicContact CG-CE1 4.32Å; L2139-L2151 HydrophobicContact CD1-CD1 4.01Å; L2139-L2151 HydrophobicContact CD2-CD1 3.45Å; L2139-L2151 VanDerWaalsContact CD2-CD1 3.46Å; L2139-L2151 HydrophobicContact CG-CD1 3.84Å; L2139-L2195 HydrophobicContact CD1-CD1 3.53Å; L2139-L2195 VanDerWaalsContact CD1-CD1 3.43Å; L2139-L2199 HydrophobicContact CD1-CD2 4.4Å
2140E83.2Confident82.8Confident38.75 Ų38.7537.1 Ų37.118%0.18118%0.178CC..THydrogen-bonded Turntrans-59.5120.4-176.3-166.7179.4172.500110.7G2081 Q2087 L2136 A2137 R2142 L2791G2081-E2140 PolarHBondContact N-OE1 2.9Å; G2081-E2140 PolarHBondContact N-OE2 3.18Å; Q2087-E2140 PolarHBondContact NE2-O 3.35Å; L2136-E2140 PolarHBondContact O-N 3.26Å; A2137-E2140 WeakPolarHBondContact O-CB 3.36Å; A2137-E2140 PolarHBondContact O-N 3.2Å; E2140-R2142 VanDerWaalsContact C-N 3.28Å; E2140-R2142 PolarHBondContact O-N 3.4Å; E2140-L2791 HydrophobicContact CG-CD1 3.73Å; E2140-L2791 HydrophobicContact CG-CG 4.21Å; E2140-L2791 WeakPolarHBondContact OE1-CG 3.49Å; E2140-L2791 PolarHBondContact OE1-N 3.35Å
2141G77.4Confident82.4Confident13.25 Ų13.2536.2 Ų36.214%0.13717%0.174CC..THydrogen-bonded Turntrans75.111.4-179.400000117L2139 E2302L2139-G2141 PolarHBondContact O-N 3.25Å; L2139-G2141 VanDerWaalsContact O-N 3.15Å; G2141-E2302 VanDerWaalsContact CA-OE1 3.25Å; G2141-E2302 WeakPolarHBondContact CA-OE1 3.3Å; G2141-E2302 VanDerWaalsContact CA-OE2 3.27Å; G2141-E2302 WeakPolarHBondContact CA-OE2 3.24Å; G2141-E2302 PolarHBondContact N-OE1 3.06Å
2142R79.2Confident81.8Confident5.25 Ų5.2537.4 Ų37.42%0.0218%0.18CC..  trans-100.3141.3-179-66.6-58.8-167.9116.425.1113.7V2084 Q2087 N2088 L2139 E2140 E2144 Y2148V2084-R2142 VanDerWaalsContact CA-NH2 3.34Å; V2084-R2142 PolarHBondContact O-NH2 3.02Å; Q2087-R2142 VanDerWaalsContact CB-NH2 3.32Å; N2088-R2142 VanDerWaalsContact CG-NH2 3.31Å; N2088-R2142 VanDerWaalsContact OD1-CZ 3.28Å; N2088-R2142 PolarHBondContact OD1-NH1 3.15Å; N2088-R2142 PolarHBondContact OD1-NH2 3.18Å; L2139-R2142 PolarHBondContact O-N 3.08Å; L2139-R2142 VanDerWaalsContact O-N 3.14Å; E2140-R2142 VanDerWaalsContact C-N 3.28Å; E2140-R2142 PolarHBondContact O-N 3.4Å; R2142-E2144 IonicContact CZ-OE1 3.84Å; R2142-E2144 IonicContact NH1-OE1 3.37Å; R2142-E2144 PolarHBondContact NH1-OE1 3.21Å; R2142-E2144 IonicContact NH1-OE2 2.68Å; R2142-Y2148 WeakPolarHBondContact O-CE2 3.48Å; R2142-Y2148 PolarHBondContact O-OH 3.09Å
2143H71.9Confident81.3Confident91 Ų9144.3 Ų44.342%0.42121%0.212SC..  trans-130.24.3176.4-54.2-61.3000112.9D2145 I2301H2143-D2145 PolarHBondContact O-N 3.39Å; H2143-I2301 PolarHBondContact CE1-O 3.39Å
2144E74.9Confident80.8Confident92.75 Ų92.7543.4 Ų43.443%0.43321%0.211SC..  trans-81.8118.7-177.1-68.4172.1-134.100111.2R2142 K2146 V2147 Y2148R2142-E2144 IonicContact CZ-OE1 3.84Å; R2142-E2144 IonicContact NH1-OE1 3.37Å; R2142-E2144 PolarHBondContact NH1-OE1 3.21Å; R2142-E2144 IonicContact NH1-OE2 2.68Å; E2144-K2146 PolarHBondContact O-N 3.28Å; E2144-K2146 VanDerWaalsContact O-N 3.12Å; E2144-V2147 HydrophobicContact CB-CG2 4.24Å; E2144-V2147 PolarHBondContact O-N 3.28Å; E2144-Y2148 VanDerWaalsContact O-CD2 3.25Å; E2144-Y2148 WeakPolarHBondContact O-CD2 3.32Å
2145D73.5Confident80.2Confident98 Ų9843.6 Ų43.652%0.52421%0.212SC..Hα-helixtrans-52.2-34.4-179.2-65.8-20.8000113.4H2143 V2147 Y2148 Q2149 F2203H2143-D2145 PolarHBondContact O-N 3.39Å; D2145-V2147 VanDerWaalsContact C-N 3.31Å; D2145-V2147 PolarHBondContact O-N 3.04Å; D2145-Y2148 PolarHBondContact O-N 3.01Å; D2145-Q2149 WeakPolarHBondContact O-CB 3.42Å; D2145-Q2149 WeakPolarHBondContact O-CG 3.44Å; D2145-Q2149 PolarHBondContact O-N 3.28Å; D2145-F2203 HydrophobicContact CB-CE1 4.37Å; D2145-F2203 HydrophobicContact CB-CZ 4.12Å; D2145-F2203 VanDerWaalsContact O-CZ 3.31Å; D2145-F2203 WeakPolarHBondContact O-CZ 3.49Å
2146K79.1Confident79.5Confident148.75 Ų148.7545.6 Ų45.665%0.64723%0.226SC*.Hα-helixtrans-56.7-40.8-179.7-67.4-177.9179.8178.80113.2E2144 Q2149 Q2150E2144-K2146 PolarHBondContact O-N 3.28Å; E2144-K2146 VanDerWaalsContact O-N 3.12Å; K2146-Q2149 WeakPolarHBondContact O-CB 3.19Å; K2146-Q2149 PolarHBondContact O-N 3.31Å; K2146-Q2150 PolarHBondContact O-N 3.16Å; K2146-Q2150 VanDerWaalsContact O-N 3.1Å
2147V80.2Confident78.8Confident0 Ų045.2 Ų45.20%022%0.223CC..Hα-helixtrans-66-46.9-1791760000110.2L2091 F2092 L2139 E2144 D2145 Q2149 Q2150 L2151L2091-V2147 HydrophobicContact CD1-CB 4.21Å; L2091-V2147 HydrophobicContact CD1-CG1 3.46Å; L2091-V2147 VanDerWaalsContact CD1-CG1 3.46Å; L2091-V2147 HydrophobicContact CD1-CG2 3.79Å; L2091-V2147 HydrophobicContact CD2-CG1 3.88Å; L2091-V2147 HydrophobicContact CG-CG1 4.32Å; F2092-V2147 HydrophobicContact CE2-CG2 4.26Å; F2092-V2147 HydrophobicContact CZ-CG2 4.13Å; L2139-V2147 HydrophobicContact CD2-CG1 3.9Å; E2144-V2147 HydrophobicContact CB-CG2 4.24Å; E2144-V2147 PolarHBondContact O-N 3.28Å; D2145-V2147 VanDerWaalsContact C-N 3.31Å; D2145-V2147 PolarHBondContact O-N 3.04Å; V2147-Q2149 VanDerWaalsContact C-N 3.27Å; V2147-Q2149 PolarHBondContact O-N 3.19Å; V2147-Q2150 PolarHBondContact O-N 3.1Å; V2147-L2151 HydrophobicContact CG1-CD1 4.39Å; V2147-L2151 PolarHBondContact O-N 3.19Å; V2147-L2151 VanDerWaalsContact O-N 3.13Å
2148Y79.4Confident78.1Confident9.75 Ų9.7549.8 Ų49.84%0.03825%0.247CC..Hα-helixtrans-66.3-37.2178.2-65.2-79.7000111.6L2139 R2142 E2144 D2145 Q2150 L2151 I2152 L2199 C2202L2139-Y2148 HydrophobicContact CD1-CE1 4.32Å; L2139-Y2148 HydrophobicContact CD2-CD1 3.87Å; L2139-Y2148 HydrophobicContact CD2-CE1 3.53Å; L2139-Y2148 VanDerWaalsContact CD2-CE1 3.45Å; L2139-Y2148 HydrophobicContact CG-CE1 4.32Å; R2142-Y2148 WeakPolarHBondContact O-CE2 3.48Å; R2142-Y2148 PolarHBondContact O-OH 3.09Å; E2144-Y2148 VanDerWaalsContact O-CD2 3.25Å; E2144-Y2148 WeakPolarHBondContact O-CD2 3.32Å; D2145-Y2148 PolarHBondContact O-N 3.01Å; Y2148-Q2150 PolarHBondContact O-N 3.15Å; Y2148-L2151 PolarHBondContact O-N 3.21Å; Y2148-I2152 WeakPolarHBondContact O-CD1 3.46Å; Y2148-I2152 VanDerWaalsContact O-CG1 3.29Å; Y2148-I2152 WeakPolarHBondContact O-CG1 3.29Å; Y2148-I2152 PolarHBondContact O-N 3.16Å; Y2148-L2199 HydrophobicContact CD1-CD2 4.2Å; Y2148-C2202 HydrophobicContact CD1-CB 4.15Å; Y2148-C2202 VanDerWaalsContact CD1-SG 3.54Å; Y2148-C2202 HydrophobicContact CD2-CB 4.07Å; Y2148-C2202 VanDerWaalsContact CD2-SG 3.58Å; Y2148-C2202 HydrophobicContact CE1-CB 4.35Å; Y2148-C2202 VanDerWaalsContact CE1-SG 3.55Å; Y2148-C2202 HydrophobicContact CE2-CB 4.23Å; Y2148-C2202 WeakPolarHBondContact CE2-SG 3.29Å; Y2148-C2202 HydrophobicContact CG-CB 3.88Å
2149Q78.8Confident77.7Confident87.75 Ų87.7555.4 Ų55.441%0.4127%0.272SS..Hα-helixtrans-61.1-49.4176.7-133.3173.3-11.400110.9D2145 K2146 V2147 L2151 I2152 E2153 F2203D2145-Q2149 WeakPolarHBondContact O-CB 3.42Å; D2145-Q2149 WeakPolarHBondContact O-CG 3.44Å; D2145-Q2149 PolarHBondContact O-N 3.28Å; K2146-Q2149 WeakPolarHBondContact O-CB 3.19Å; K2146-Q2149 PolarHBondContact O-N 3.31Å; V2147-Q2149 VanDerWaalsContact C-N 3.27Å; V2147-Q2149 PolarHBondContact O-N 3.19Å; Q2149-L2151 VanDerWaalsContact C-N 3.3Å; Q2149-L2151 PolarHBondContact O-N 2.96Å; Q2149-I2152 PolarHBondContact O-N 3.24Å; Q2149-I2152 VanDerWaalsContact O-N 3.11Å; Q2149-E2153 HydrophobicContact CG-CG 4.48Å; Q2149-E2153 WeakPolarHBondContact CG-OE1 3.43Å; Q2149-E2153 PolarHBondContact NE2-OE1 3.29Å; Q2149-E2153 WeakPolarHBondContact O-CB 3.47Å; Q2149-E2153 WeakPolarHBondContact O-CG 3.29Å; Q2149-E2153 PolarHBondContact O-N 3.02Å; Q2149-F2203 HydrophobicContact CB-CE2 4.39Å; Q2149-F2203 HydrophobicContact CB-CZ 4.04Å; Q2149-F2203 HydrophobicContact CG-CE1 3.86Å; Q2149-F2203 HydrophobicContact CG-CE2 3.64Å; Q2149-F2203 HydrophobicContact CG-CZ 4.02Å
2150Q79.9Confident77.5Confident43.25 Ų43.2555.1 Ų55.120%0.20227%0.27CS..Hα-helixtrans-60.2-40.4178.7-149.9-173.70.700112.1L2091 F2092 L2098 K2146 V2147 Y2148 E2153 L2154L2091-Q2150 PolarHBondContact O-NE2 3.32Å; F2092-Q2150 VanDerWaalsContact CD1-OE1 3.31Å; L2098-Q2150 HydrophobicContact CD2-CG 4.36Å; K2146-Q2150 PolarHBondContact O-N 3.16Å; K2146-Q2150 VanDerWaalsContact O-N 3.1Å; V2147-Q2150 PolarHBondContact O-N 3.1Å; Y2148-Q2150 PolarHBondContact O-N 3.15Å; Q2150-E2153 PolarHBondContact O-N 2.75Å; Q2150-L2154 HydrophobicContact CG-CD1 4.41Å; Q2150-L2154 WeakPolarHBondContact O-CB 3.44Å; Q2150-L2154 WeakPolarHBondContact O-CG 3.45Å; Q2150-L2154 PolarHBondContact O-N 3.06Å; Q2150-L2154 VanDerWaalsContact O-N 3.1Å
2151L80.4Confident77.1Confident2 Ų255.5 Ų55.51%0.0127%0.273CS..Hα-helixtrans-65.8-38.7175.8-81.3165.5000112.8L2098 L2135 L2139 V2147 Y2148 Q2149 L2154 C2155 L2199L2098-L2151 HydrophobicContact CD1-CD2 3.71Å; L2098-L2151 VanDerWaalsContact CD1-CD2 3.42Å; L2098-L2151 HydrophobicContact CD1-CG 4.05Å; L2098-L2151 HydrophobicContact CD2-CD2 3.87Å; L2098-L2151 HydrophobicContact CD2-CG 4.36Å; L2098-L2151 HydrophobicContact CG-CD2 4.12Å; L2135-L2151 HydrophobicContact CD2-CD2 4.06Å; L2139-L2151 HydrophobicContact CD1-CD1 4.01Å; L2139-L2151 HydrophobicContact CD2-CD1 3.45Å; L2139-L2151 VanDerWaalsContact CD2-CD1 3.46Å; L2139-L2151 HydrophobicContact CG-CD1 3.84Å; V2147-L2151 HydrophobicContact CG1-CD1 4.39Å; V2147-L2151 PolarHBondContact O-N 3.19Å; V2147-L2151 VanDerWaalsContact O-N 3.13Å; Y2148-L2151 PolarHBondContact O-N 3.21Å; Q2149-L2151 VanDerWaalsContact C-N 3.3Å; Q2149-L2151 PolarHBondContact O-N 2.96Å; L2151-L2154 PolarHBondContact O-N 3.06Å; L2151-C2155 WeakPolarHBondContact O-CA 3.29Å; L2151-C2155 VanDerWaalsContact O-CB 3.23Å; L2151-C2155 WeakPolarHBondContact O-CB 3.32Å; L2151-C2155 PolarHBondContact O-N 3.27Å; L2151-C2155 PolarHBondContact O-SG 2.87Å; L2151-L2199 HydrophobicContact CB-CD2 3.8Å; L2151-L2199 HydrophobicContact CD1-CD2 4.26Å
2152I78.2Confident77.1Confident23.75 Ų23.7556.9 Ų56.912%0.12228%0.281CS..Hα-helixtrans-70.9-38.3177.8-70.8169.4000111.4Y2148 Q2149 L2154 C2155 L2157 L2199 F2203 I2206Y2148-I2152 WeakPolarHBondContact O-CD1 3.46Å; Y2148-I2152 VanDerWaalsContact O-CG1 3.29Å; Y2148-I2152 WeakPolarHBondContact O-CG1 3.29Å; Y2148-I2152 PolarHBondContact O-N 3.16Å; Q2149-I2152 PolarHBondContact O-N 3.24Å; Q2149-I2152 VanDerWaalsContact O-N 3.11Å; I2152-L2154 VanDerWaalsContact C-N 3.33Å; I2152-L2154 PolarHBondContact O-N 3.33Å; I2152-C2155 CarbonylContact O-C 3.45Å; I2152-C2155 VanDerWaalsContact O-C 3.31Å; I2152-C2155 PolarHBondContact O-N 2.92Å; I2152-L2157 HydrophobicContact CG2-CD1 4.42Å; I2152-L2199 HydrophobicContact CD1-CB 4.38Å; I2152-L2199 HydrophobicContact CG1-CB 4.29Å; I2152-L2199 HydrophobicContact CG1-CD1 4.44Å; I2152-L2199 HydrophobicContact CG1-CD2 4.17Å; I2152-L2199 HydrophobicContact CG1-CG 4.46Å; I2152-F2203 HydrophobicContact CD1-CB 4.22Å; I2152-F2203 HydrophobicContact CD1-CD2 3.26Å; I2152-F2203 HydrophobicContact CD1-CE2 3.89Å; I2152-F2203 HydrophobicContact CD1-CG 4.01Å; I2152-I2206 HydrophobicContact CD1-CD1 4.22Å; I2152-I2206 HydrophobicContact CG2-CD1 4.39Å
2153E79.3Confident77.2Confident144.5 Ų144.556.9 Ų56.968%0.67528%0.281SS*.Hα-helixtrans-61.3-38.1174.9-75.1175.4-173.100111.7Q2149 Q2150Q2149-E2153 HydrophobicContact CG-CG 4.48Å; Q2149-E2153 WeakPolarHBondContact CG-OE1 3.43Å; Q2149-E2153 PolarHBondContact NE2-OE1 3.29Å; Q2149-E2153 WeakPolarHBondContact O-CB 3.47Å; Q2149-E2153 WeakPolarHBondContact O-CG 3.29Å; Q2149-E2153 PolarHBondContact O-N 3.02Å; Q2150-E2153 PolarHBondContact O-N 2.75Å
2154L77.4Confident77.6Confident61 Ų6152.6 Ų52.632%0.31926%0.261SS..Hα-helixtrans-80.2-33.2176.5-67.5169.3000112.8L2098 V2102 Q2150 L2151 I2152 P2156L2098-L2154 HydrophobicContact CB-CD1 3.97Å; L2098-L2154 HydrophobicContact CD2-CB 4.23Å; L2098-L2154 HydrophobicContact CD2-CD1 3.34Å; L2098-L2154 VanDerWaalsContact CD2-CD1 3.5Å; L2098-L2154 HydrophobicContact CD2-CG 4.31Å; L2098-L2154 HydrophobicContact CG-CD1 3.52Å; L2098-L2154 VanDerWaalsContact CG-CD1 3.48Å; V2102-L2154 WeakPolarHBondContact CG1-O 3.39Å; V2102-L2154 HydrophobicContact CG2-CB 4.44Å; Q2150-L2154 HydrophobicContact CG-CD1 4.41Å; Q2150-L2154 WeakPolarHBondContact O-CB 3.44Å; Q2150-L2154 WeakPolarHBondContact O-CG 3.45Å; Q2150-L2154 PolarHBondContact O-N 3.06Å; Q2150-L2154 VanDerWaalsContact O-N 3.1Å; L2151-L2154 PolarHBondContact O-N 3.06Å; I2152-L2154 VanDerWaalsContact C-N 3.33Å; I2152-L2154 PolarHBondContact O-N 3.33Å; L2154-P2156 VanDerWaalsContact O-CD 3.28Å; L2154-P2156 WeakPolarHBondContact O-CD 3.28Å
2155C77.3Confident77.8Confident5 Ų554 Ų543%0.03426%0.263CS..SBendtrans-118.281.9-176.4-104.50000111.7V2102 L2151 I2152 L2157 L2160 L2199V2102-C2155 HydrophobicContact CG1-CB 4.13Å; V2102-C2155 WeakPolarHBondContact CG1-SG 3.34Å; V2102-C2155 HydrophobicContact CG2-CB 4.34Å; V2102-C2155 WeakPolarHBondContact CG2-SG 3.47Å; L2151-C2155 WeakPolarHBondContact O-CA 3.29Å; L2151-C2155 VanDerWaalsContact O-CB 3.23Å; L2151-C2155 WeakPolarHBondContact O-CB 3.32Å; L2151-C2155 PolarHBondContact O-N 3.27Å; L2151-C2155 PolarHBondContact O-SG 2.87Å; I2152-C2155 CarbonylContact O-C 3.45Å; I2152-C2155 VanDerWaalsContact O-C 3.31Å; I2152-C2155 PolarHBondContact O-N 2.92Å; C2155-L2157 PolarHBondContact O-N 3.14Å; C2155-L2160 HydrophobicContact CB-CD1 4.02Å; C2155-L2160 HydrophobicContact CB-CD2 4.14Å; C2155-L2160 HydrophobicContact CB-CG 4.19Å; C2155-L2160 WeakPolarHBondContact SG-CD2 3.21Å; C2155-L2160 WeakPolarHBondContact SG-CG 3.44Å; C2155-L2199 HydrophobicContact CB-CD1 4.48Å
2156P75.3Confident78.2Confident47.75 Ų47.7554.2 Ų54.231%0.3126%0.257SS..  trans-61.8132.4175.725.1-33.4000110.5L2154 D2158 K2159 L2160L2154-P2156 VanDerWaalsContact O-CD 3.28Å; L2154-P2156 WeakPolarHBondContact O-CD 3.28Å; P2156-D2158 VanDerWaalsContact C-N 3.25Å; P2156-D2158 PolarHBondContact O-N 3.14Å; P2156-D2158 VanDerWaalsContact O-N 3.13Å; P2156-K2159 HydrophobicContact CG-CB 4.23Å; P2156-K2159 HydrophobicContact CG-CD 3.74Å; P2156-K2159 HydrophobicContact CG-CG 3.93Å; P2156-K2159 WeakPolarHBondContact O-CB 3.27Å; P2156-K2159 PolarHBondContact O-N 3.2Å; P2156-L2160 PolarHBondContact O-N 3.19Å
2157L72.3Confident78.4Confident20 Ų2047.1 Ų47.111%0.10523%0.226CC..Hα-helixtrans-55.6-34.4-171.3-73.6135.1000113.8I2152 C2155 K2159 L2160 I2161 T2196 F2207 M2210I2152-L2157 HydrophobicContact CG2-CD1 4.42Å; C2155-L2157 PolarHBondContact O-N 3.14Å; L2157-K2159 VanDerWaalsContact C-N 3.32Å; L2157-K2159 PolarHBondContact O-N 3.4Å; L2157-L2160 WeakPolarHBondContact O-CB 3.42Å; L2157-L2160 PolarHBondContact O-N 3.22Å; L2157-I2161 VanDerWaalsContact O-CG1 3.28Å; L2157-I2161 WeakPolarHBondContact O-CG1 3.33Å; L2157-I2161 PolarHBondContact O-N 3.02Å; L2157-T2196 HydrophobicContact CD2-CG2 4.11Å; L2157-F2207 HydrophobicContact CB-CE2 4.1Å; L2157-F2207 HydrophobicContact CB-CZ 3.57Å; L2157-F2207 HydrophobicContact CD1-CD2 4.02Å; L2157-F2207 HydrophobicContact CD1-CE2 3.81Å; L2157-F2207 HydrophobicContact CD1-CZ 3.5Å; L2157-F2207 VanDerWaalsContact CD1-CZ 3.5Å; L2157-F2207 HydrophobicContact CD2-CE2 4Å; L2157-F2207 HydrophobicContact CD2-CZ 3.85Å; L2157-F2207 HydrophobicContact CG-CE2 3.74Å; L2157-F2207 HydrophobicContact CG-CZ 3.78Å; L2157-M2210 HydrophobicContact CB-CE 4.46Å
2158D73Confident78.5Confident103 Ų10347.6 Ų47.655%0.55123%0.228SC*.Hα-helixtrans-62.8-38.7177.8-61.1-39.2000112.1P2156 S2162 M2210P2156-D2158 VanDerWaalsContact C-N 3.25Å; P2156-D2158 PolarHBondContact O-N 3.14Å; P2156-D2158 VanDerWaalsContact O-N 3.13Å; D2158-S2162 WeakPolarHBondContact O-CB 3.34Å; D2158-S2162 PolarHBondContact O-N 3.28Å; D2158-S2162 VanDerWaalsContact O-N 3.11Å; D2158-S2162 PolarHBondContact O-OG 2.92Å; D2158-M2210 WeakPolarHBondContact OD2-CE 3.41Å
2159K77.6Confident78.5Confident120 Ų12050.6 Ų50.652%0.52224%0.244SC..Hα-helixtrans-71.4-38.7176.3-65.6-172.5-172.8172.50111.2L2106 P2156 L2157 I2161 S2162 S2163L2106-K2159 HydrophobicContact CD1-CB 4.27Å; L2106-K2159 HydrophobicContact CD1-CD 4.27Å; L2106-K2159 HydrophobicContact CD2-CB 4.08Å; P2156-K2159 HydrophobicContact CG-CB 4.23Å; P2156-K2159 HydrophobicContact CG-CD 3.74Å; P2156-K2159 HydrophobicContact CG-CG 3.93Å; P2156-K2159 WeakPolarHBondContact O-CB 3.27Å; P2156-K2159 PolarHBondContact O-N 3.2Å; L2157-K2159 VanDerWaalsContact C-N 3.32Å; L2157-K2159 PolarHBondContact O-N 3.4Å; K2159-I2161 PolarHBondContact O-N 3.3Å; K2159-S2162 WeakPolarHBondContact CA-OG 3.32Å; K2159-S2162 PolarHBondContact O-N 3.11Å; K2159-S2162 PolarHBondContact O-OG 3.21Å; K2159-S2163 WeakPolarHBondContact O-CB 3.22Å; K2159-S2163 PolarHBondContact O-N 3.23Å; K2159-S2163 PolarHBondContact O-OG 3.18Å
2160L79.1Confident78.5Confident2 Ų247.1 Ų47.11%0.0123%0.228CC..Hα-helixtrans-59.4-50.6174.4-75.3172.9000111.3L2106 C2155 P2156 L2157 S2162 S2163 I2164 L2192 L2199L2106-L2160 HydrophobicContact CD2-CD2 4.14Å; C2155-L2160 HydrophobicContact CB-CD1 4.02Å; C2155-L2160 HydrophobicContact CB-CD2 4.14Å; C2155-L2160 HydrophobicContact CB-CG 4.19Å; C2155-L2160 WeakPolarHBondContact SG-CD2 3.21Å; C2155-L2160 WeakPolarHBondContact SG-CG 3.44Å; P2156-L2160 PolarHBondContact O-N 3.19Å; L2157-L2160 WeakPolarHBondContact O-CB 3.42Å; L2157-L2160 PolarHBondContact O-N 3.22Å; L2160-S2162 VanDerWaalsContact C-N 3.29Å; L2160-S2162 PolarHBondContact O-N 3.2Å; L2160-S2163 WeakPolarHBondContact O-CB 3.4Å; L2160-S2163 PolarHBondContact O-N 3.06Å; L2160-S2163 VanDerWaalsContact O-N 3.13Å; L2160-I2164 VanDerWaalsContact O-CG1 3.32Å; L2160-I2164 WeakPolarHBondContact O-CG1 3.4Å; L2160-I2164 PolarHBondContact O-N 3.33Å; L2160-L2192 HydrophobicContact CB-CD2 4.26Å; L2160-L2192 HydrophobicContact CD2-CD1 3.85Å; L2160-L2192 HydrophobicContact CD2-CD2 4.06Å; L2160-L2192 HydrophobicContact CD2-CG 4.01Å; L2160-L2192 WeakPolarHBondContact O-CD2 3.43Å; L2160-L2199 HydrophobicContact CD1-CD1 3.85Å
2161I75.8Confident78.4Confident45.75 Ų45.7545.6 Ų45.624%0.23522%0.223CC..Hα-helixtrans-60.4-41.3179.5-66.5166.2000110.7L2157 K2159 S2163 I2164 R2165 I2279 L2282L2157-I2161 VanDerWaalsContact O-CG1 3.28Å; L2157-I2161 WeakPolarHBondContact O-CG1 3.33Å; L2157-I2161 PolarHBondContact O-N 3.02Å; K2159-I2161 PolarHBondContact O-N 3.3Å; I2161-S2163 VanDerWaalsContact C-N 3.31Å; I2161-S2163 PolarHBondContact O-N 3.2Å; I2161-I2164 PolarHBondContact O-N 3.06Å; I2161-R2165 PolarHBondContact O-N 3.26Å; I2161-R2165 VanDerWaalsContact O-N 3.12Å; I2161-I2279 HydrophobicContact CG2-CD1 4.5Å; I2161-L2282 HydrophobicContact CG2-CD1 4.29Å
2162S77.6Confident78.2Confident44.5 Ų44.550.9 Ų50.931%0.31125%0.248SC..Hα-helixtrans-62.8-41.2175.174.90000112.1D2158 K2159 L2160 I2164 R2165 Y2166D2158-S2162 WeakPolarHBondContact O-CB 3.34Å; D2158-S2162 PolarHBondContact O-N 3.28Å; D2158-S2162 VanDerWaalsContact O-N 3.11Å; D2158-S2162 PolarHBondContact O-OG 2.92Å; K2159-S2162 WeakPolarHBondContact CA-OG 3.32Å; K2159-S2162 PolarHBondContact O-N 3.11Å; K2159-S2162 PolarHBondContact O-OG 3.21Å; L2160-S2162 VanDerWaalsContact C-N 3.29Å; L2160-S2162 PolarHBondContact O-N 3.2Å; S2162-I2164 PolarHBondContact O-N 3.39Å; S2162-R2165 WeakPolarHBondContact O-CB 3.45Å; S2162-R2165 PolarHBondContact O-N 3.3Å; S2162-R2165 VanDerWaalsContact O-N 3.15Å; S2162-Y2166 WeakPolarHBondContact O-CD2 3.2Å; S2162-Y2166 PolarHBondContact O-N 3.17Å
2163S80.4Confident77.8Confident4 Ų452.7 Ų52.73%0.02826%0.257CS..Hα-helixtrans-66.3-39.1177.6-63.30000112.6L2106 K2159 L2160 I2161 R2165 Y2166 Y2167L2106-S2163 VanDerWaalsContact CD2-OG 3.27Å; L2106-S2163 WeakPolarHBondContact CD2-OG 3.42Å; K2159-S2163 WeakPolarHBondContact O-CB 3.22Å; K2159-S2163 PolarHBondContact O-N 3.23Å; K2159-S2163 PolarHBondContact O-OG 3.18Å; L2160-S2163 WeakPolarHBondContact O-CB 3.4Å; L2160-S2163 PolarHBondContact O-N 3.06Å; L2160-S2163 VanDerWaalsContact O-N 3.13Å; I2161-S2163 VanDerWaalsContact C-N 3.31Å; I2161-S2163 PolarHBondContact O-N 3.2Å; S2163-R2165 VanDerWaalsContact C-N 3.28Å; S2163-R2165 PolarHBondContact O-N 2.92Å; S2163-Y2166 PolarHBondContact O-N 3.18Å; S2163-Y2167 WeakPolarHBondContact O-CD2 3.45Å; S2163-Y2167 PolarHBondContact O-N 3.01Å
2164I81.1Confident77Confident0.5 Ų0.550.4 Ų50.40%0.00326%0.257CS..Hα-helixtrans-57.5-44.4172.2-65.2169.2000110.1L2160 I2161 S2162 Y2167 H2168 L2192 F2193 L2282 Y2285L2160-I2164 VanDerWaalsContact O-CG1 3.32Å; L2160-I2164 WeakPolarHBondContact O-CG1 3.4Å; L2160-I2164 PolarHBondContact O-N 3.33Å; I2161-I2164 PolarHBondContact O-N 3.06Å; S2162-I2164 PolarHBondContact O-N 3.39Å; I2164-Y2167 PolarHBondContact O-N 3.48Å; I2164-H2168 WeakPolarHBondContact O-CB 3.46Å; I2164-H2168 PolarHBondContact O-N 3.3Å; I2164-L2192 HydrophobicContact CB-CD2 4.4Å; I2164-L2192 HydrophobicContact CD1-CD2 3.92Å; I2164-L2192 HydrophobicContact CD1-CG 4.4Å; I2164-L2192 HydrophobicContact CG1-CB 4.12Å; I2164-L2192 HydrophobicContact CG1-CD2 3.53Å; I2164-L2192 HydrophobicContact CG1-CG 3.9Å; I2164-F2193 HydrophobicContact CD1-CB 4.18Å; I2164-F2193 HydrophobicContact CD1-CD2 4.28Å; I2164-L2282 HydrophobicContact CD1-CD2 4.48Å; I2164-L2282 HydrophobicContact CG2-CD2 4.23Å; I2164-Y2285 HydrophobicContact CG2-CD2 3.58Å; I2164-Y2285 HydrophobicContact CG2-CE2 3.58Å
2165R79.1Confident76.2Confident122 Ų12252.1 Ų52.146%0.4627%0.266SS..Hα-helixtrans-62.7-45.1176.7-176.3-176.6149.1-178.90.4111.7I2161 S2162 S2163 Y2167 H2168 I2169 N2278I2161-R2165 PolarHBondContact O-N 3.26Å; I2161-R2165 VanDerWaalsContact O-N 3.12Å; S2162-R2165 WeakPolarHBondContact O-CB 3.45Å; S2162-R2165 PolarHBondContact O-N 3.3Å; S2162-R2165 VanDerWaalsContact O-N 3.15Å; S2163-R2165 VanDerWaalsContact C-N 3.28Å; S2163-R2165 PolarHBondContact O-N 2.92Å; R2165-Y2167 PolarHBondContact O-N 3.47Å; R2165-H2168 WeakPolarHBondContact O-CB 3.38Å; R2165-H2168 PolarHBondContact O-N 3.16Å; R2165-H2168 VanDerWaalsContact O-N 3.17Å; R2165-I2169 HydrophobicContact CG-CD1 4Å; R2165-I2169 WeakPolarHBondContact O-CG1 3.45Å; R2165-I2169 PolarHBondContact O-N 3.29Å; R2165-N2278 PolarHBondContact NH1-OD1 3.12Å; R2165-N2278 VanDerWaalsContact NH1-OD1 3.15Å
2166Y82Confident75.4Confident102 Ų10253.4 Ų53.440%0.427%0.272SS..Hα-helixtrans-64.1-43.3179-68.9-61.9000112.4Y1983 P2109 S2162 S2163 H2168 I2169 L2170Y1983-Y2166 HydrophobicContact CE2-CE1 4.28Å; P2109-Y2166 HydrophobicContact CB-CG 4.32Å; S2162-Y2166 WeakPolarHBondContact O-CD2 3.2Å; S2162-Y2166 PolarHBondContact O-N 3.17Å; S2163-Y2166 PolarHBondContact O-N 3.18Å; Y2166-H2168 VanDerWaalsContact C-N 3.27Å; Y2166-H2168 PolarHBondContact O-N 3.27Å; Y2166-I2169 PolarHBondContact O-N 3.12Å; Y2166-L2170 WeakPolarHBondContact O-CB 3.42Å; Y2166-L2170 VanDerWaalsContact O-CG 3.29Å; Y2166-L2170 WeakPolarHBondContact O-CG 3.35Å; Y2166-L2170 PolarHBondContact O-N 3.26Å
2167Y83.5Confident74.2Confident0 Ų057.6 Ų57.60%030%0.296CS..Hα-helixtrans-62.8-33.7174.7-78.5-62.9000112.8V2105 T2108 P2109 I2112 S2128 S2163 I2164 R2165 S2171 F2185 C2188 L2192V2105-Y2167 HydrophobicContact CG1-CE2 4.38Å; V2105-Y2167 PolarHBondContact O-OH 3.2Å; T2108-Y2167 WeakPolarHBondContact CB-OH 3.12Å; T2108-Y2167 PolarHBondContact OG1-OH 3.27Å; P2109-Y2167 HydrophobicContact CG-CD1 4.4Å; P2109-Y2167 HydrophobicContact CG-CD2 4.16Å; P2109-Y2167 HydrophobicContact CG-CE1 4.12Å; P2109-Y2167 HydrophobicContact CG-CE2 3.73Å; P2109-Y2167 HydrophobicContact CG-CG 4.4Å; I2112-Y2167 HydrophobicContact CD1-CE1 4.44Å; S2128-Y2167 WeakPolarHBondContact CB-OH 3.43Å; S2128-Y2167 PolarHBondContact OG-OH 3.22Å; S2163-Y2167 WeakPolarHBondContact O-CD2 3.45Å; S2163-Y2167 PolarHBondContact O-N 3.01Å; I2164-Y2167 PolarHBondContact O-N 3.48Å; R2165-Y2167 PolarHBondContact O-N 3.47Å; Y2167-S2171 WeakPolarHBondContact O-CB 3.4Å; Y2167-S2171 PolarHBondContact O-N 3.15Å; Y2167-S2171 VanDerWaalsContact O-N 3.14Å; Y2167-S2171 PolarHBondContact O-OG 3.44Å; Y2167-F2185 HydrophobicContact CD1-CB 4.36Å; Y2167-F2185 AromaticContact CD1-CD1 3.83Å; Y2167-F2185 HydrophobicContact CD1-CD1 4.08Å; Y2167-F2185 HydrophobicContact CD1-CG 4.48Å; Y2167-F2185 AromaticContact CE1-CD1 3.84Å; Y2167-F2185 HydrophobicContact CE1-CD1 4.05Å; Y2167-F2185 HydrophobicContact CE1-CE1 4.43Å; Y2167-C2188 HydrophobicContact CD1-CB 3.86Å; Y2167-C2188 HydrophobicContact CD2-CB 4.46Å; Y2167-C2188 HydrophobicContact CE1-CB 3.87Å; Y2167-C2188 HydrophobicContact CE2-CB 4.47Å; Y2167-C2188 HydrophobicContact CG-CB 4.18Å; Y2167-L2192 HydrophobicContact CD2-CD2 4.18Å; Y2167-L2192 HydrophobicContact CE2-CD1 4.11Å; Y2167-L2192 HydrophobicContact CE2-CD2 4.28Å
2168H80.6Confident73.5Confident10.75 Ų10.7559 Ų595%0.0531%0.311CS..Hα-helixtrans-65.8-48.8174.5-172.648.8000111.8I2164 R2165 Y2166 L2170 S2171 E2172 S2281 H2284 Y2285I2164-H2168 WeakPolarHBondContact O-CB 3.46Å; I2164-H2168 PolarHBondContact O-N 3.3Å; R2165-H2168 WeakPolarHBondContact O-CB 3.38Å; R2165-H2168 PolarHBondContact O-N 3.16Å; R2165-H2168 VanDerWaalsContact O-N 3.17Å; Y2166-H2168 VanDerWaalsContact C-N 3.27Å; Y2166-H2168 PolarHBondContact O-N 3.27Å; H2168-L2170 VanDerWaalsContact C-N 3.34Å; H2168-L2170 PolarHBondContact O-N 3.28Å; H2168-S2171 CarbonylContact O-C 3.56Å; H2168-S2171 WeakPolarHBondContact O-CA 3.17Å; H2168-S2171 WeakPolarHBondContact O-CB 3.33Å; H2168-S2171 PolarHBondContact O-N 3.16Å; H2168-S2171 PolarHBondContact O-OG 3.2Å; H2168-E2172 IonicContact CE1-OE1 3.41Å; H2168-E2172 PolarHBondContact CE1-OE1 3.23Å; H2168-E2172 IonicContact CE1-OE2 3.42Å; H2168-E2172 PolarHBondContact CE1-OE2 3.25Å; H2168-E2172 VanDerWaalsContact CE1-OE2 3.22Å; H2168-E2172 IonicContact ND1-OE1 3.65Å; H2168-E2172 IonicContact ND1-OE2 3.62Å; H2168-E2172 PolarHBondContact ND1-OE2 3.17Å; H2168-E2172 VanDerWaalsContact ND1-OE2 3.13Å; H2168-E2172 IonicContact NE2-OE1 3.4Å; H2168-E2172 PolarHBondContact NE2-OE1 3.4Å; H2168-E2172 IonicContact NE2-OE2 3.77Å; H2168-E2172 PolarHBondContact O-N 3.11Å; H2168-E2172 VanDerWaalsContact O-N 3.14Å; H2168-S2281 VanDerWaalsContact CB-CB 3.5Å; H2168-S2281 VanDerWaalsContact CD2-CA 3.49Å; H2168-S2281 WeakPolarHBondContact CD2-CA 3.22Å; H2168-S2281 WeakPolarHBondContact CD2-CB 3.37Å; H2168-S2281 VanDerWaalsContact CG-CB 3.48Å; H2168-H2284 AromaticContact CD2-CD2 3.74Å; H2168-H2284 AromaticContact CE1-CD2 3.63Å; H2168-H2284 AromaticContact CE1-CG 3.94Å; H2168-H2284 AromaticContact ND1-CD2 3.91Å; H2168-H2284 AromaticContact NE2-CD2 3.4Å; H2168-H2284 PolarHBondContact NE2-CD2 3.15Å; H2168-H2284 AromaticContact NE2-CG 3.73Å; H2168-Y2285 HydrophobicContact CB-CE2 4.06Å; H2168-Y2285 AromaticContact CD2-CE2 3.87Å; H2168-Y2285 AromaticContact CD2-CZ 3.9Å
2169I80.3Confident72.9Confident72.5 Ų72.559.9 Ų59.937%0.37232%0.316SS..Hα-helixtrans-58.3-48.2177.3-65.5165.1000110.2R2165 Y2166 S2171 E2172 D2173R2165-I2169 HydrophobicContact CG-CD1 4Å; R2165-I2169 WeakPolarHBondContact O-CG1 3.45Å; R2165-I2169 PolarHBondContact O-N 3.29Å; Y2166-I2169 PolarHBondContact O-N 3.12Å; I2169-S2171 PolarHBondContact O-N 3.11Å; I2169-S2171 VanDerWaalsContact O-N 3.14Å; I2169-E2172 PolarHBondContact O-N 3.18Å; I2169-E2172 VanDerWaalsContact O-N 3.08Å; I2169-D2173 PolarHBondContact O-N 3.37Å; I2169-D2173 VanDerWaalsContact O-N 3.08Å
2170L79.3Confident72.3Confident14.75 Ų14.7558.2 Ų58.28%0.07731%0.309CS..Hα-helixtrans-61.4-25.3176.4-70.3172.1000113.5P2109 I2112 Y2166 H2168 F2176 F2185P2109-L2170 HydrophobicContact CB-CD1 4.16Å; I2112-L2170 HydrophobicContact CB-CD1 4.22Å; I2112-L2170 HydrophobicContact CB-CD2 4.44Å; I2112-L2170 HydrophobicContact CD1-CD1 4.35Å; I2112-L2170 HydrophobicContact CG2-CD1 4.1Å; I2112-L2170 HydrophobicContact CG2-CD2 3.88Å; Y2166-L2170 WeakPolarHBondContact O-CB 3.42Å; Y2166-L2170 VanDerWaalsContact O-CG 3.29Å; Y2166-L2170 WeakPolarHBondContact O-CG 3.35Å; Y2166-L2170 PolarHBondContact O-N 3.26Å; H2168-L2170 VanDerWaalsContact C-N 3.34Å; H2168-L2170 PolarHBondContact O-N 3.28Å; L2170-F2176 HydrophobicContact CD2-CE2 4.37Å; L2170-F2176 HydrophobicContact CD2-CZ 4.38Å; L2170-F2185 HydrophobicContact CB-CD2 4.35Å; L2170-F2185 HydrophobicContact CB-CG 4.42Å; L2170-F2185 WeakPolarHBondContact O-CD2 3.48Å
2171S77.3Confident71.8Confident12 Ų1258.3 Ų58.38%0.08431%0.311CS..Hα-helixtrans-81.8-17.4175.576.90000113.6Y2167 H2168 I2169 R2182Y2167-S2171 WeakPolarHBondContact O-CB 3.4Å; Y2167-S2171 PolarHBondContact O-N 3.15Å; Y2167-S2171 VanDerWaalsContact O-N 3.14Å; Y2167-S2171 PolarHBondContact O-OG 3.44Å; H2168-S2171 CarbonylContact O-C 3.56Å; H2168-S2171 WeakPolarHBondContact O-CA 3.17Å; H2168-S2171 WeakPolarHBondContact O-CB 3.33Å; H2168-S2171 PolarHBondContact O-N 3.16Å; H2168-S2171 PolarHBondContact O-OG 3.2Å; I2169-S2171 PolarHBondContact O-N 3.11Å; I2169-S2171 VanDerWaalsContact O-N 3.14Å; S2171-R2182 WeakPolarHBondContact O-CD 3.26Å; S2171-R2182 WeakPolarHBondContact O-CG 3.29Å; S2171-R2182 PolarHBondContact O-NE 3.17Å; S2171-R2182 PolarHBondContact O-NH2 3.48Å
2172E76.5Confident71.6Confident113.75 Ų113.7560.5 Ų60.553%0.53232%0.316SS..Hα-helixtrans-97.1-20176.8-67.5-172.4152.800112.9H2168 I2169 S2174H2168-E2172 IonicContact CE1-OE1 3.41Å; H2168-E2172 PolarHBondContact CE1-OE1 3.23Å; H2168-E2172 IonicContact CE1-OE2 3.42Å; H2168-E2172 PolarHBondContact CE1-OE2 3.25Å; H2168-E2172 VanDerWaalsContact CE1-OE2 3.22Å; H2168-E2172 IonicContact ND1-OE1 3.65Å; H2168-E2172 IonicContact ND1-OE2 3.62Å; H2168-E2172 PolarHBondContact ND1-OE2 3.17Å; H2168-E2172 VanDerWaalsContact ND1-OE2 3.13Å; H2168-E2172 IonicContact NE2-OE1 3.4Å; H2168-E2172 PolarHBondContact NE2-OE1 3.4Å; H2168-E2172 IonicContact NE2-OE2 3.77Å; H2168-E2172 PolarHBondContact O-N 3.11Å; H2168-E2172 VanDerWaalsContact O-N 3.14Å; I2169-E2172 PolarHBondContact O-N 3.18Å; I2169-E2172 VanDerWaalsContact O-N 3.08Å; E2172-S2174 PolarHBondContact O-N 3.28Å
2173D70.1Confident71.6Confident60 Ų6062.3 Ų62.332%0.32132%0.32SS..  trans-56.7126.5-178.3-103.1-25.1000112.7I2169 D2175 F2176 R2182I2169-D2173 PolarHBondContact O-N 3.37Å; I2169-D2173 VanDerWaalsContact O-N 3.08Å; D2173-D2175 VanDerWaalsContact C-N 3.26Å; D2173-D2175 PolarHBondContact O-N 3.13Å; D2173-D2175 PolarHBondContact OD1-N 3.36Å; D2173-F2176 HydrophobicContact CB-CD2 4.17Å; D2173-F2176 HydrophobicContact CB-CE2 4.17Å; D2173-R2182 VanDerWaalsContact O-CZ 3.29Å; D2173-R2182 PolarHBondContact O-NE 3.42Å; D2173-R2182 PolarHBondContact O-NH2 3.35Å
2174S62.5Low71.4Confident96.75 Ų96.7562.8 Ų62.868%0.67732%0.323SS*.THydrogen-bonded Turntrans-73.6-16.4-175.451.70000114.1E2172 F2176 R2182E2172-S2174 PolarHBondContact O-N 3.28Å; S2174-F2176 VanDerWaalsContact C-N 3.33Å; S2174-F2176 PolarHBondContact O-N 3.13Å; S2174-R2182 PolarHBondContact O-NH2 3.15Å
2175D60.6Low71.5Confident96.25 Ų96.2562.8 Ų62.852%0.51532%0.323SS..THydrogen-bonded Turntrans-69.1-26.4-173.6-67.8-4.2000112.8H2115 D2173 T2177H2115-D2175 IonicContact CE1-OD2 2.82Å; H2115-D2175 PolarHBondContact CE1-OD2 3.26Å; H2115-D2175 VanDerWaalsContact CE1-OD2 3.3Å; D2173-D2175 VanDerWaalsContact C-N 3.26Å; D2173-D2175 PolarHBondContact O-N 3.13Å; D2173-D2175 PolarHBondContact OD1-N 3.36Å; D2175-T2177 PolarHBondContact O-N 3.2Å
2176F59Low71.7Confident33.5 Ų33.558.9 Ų58.915%0.14731%0.31CS..  trans-77.288.3175.6-60.3-69.4000110.9I2112 T2121 L2170 D2173 S2174 A2178 P2181 R2182 F2185I2112-F2176 HydrophobicContact CG2-CE1 4.36Å; I2112-F2176 HydrophobicContact CG2-CZ 4.07Å; T2121-F2176 HydrophobicContact CG2-CE1 4.32Å; L2170-F2176 HydrophobicContact CD2-CE2 4.37Å; L2170-F2176 HydrophobicContact CD2-CZ 4.38Å; D2173-F2176 HydrophobicContact CB-CD2 4.17Å; D2173-F2176 HydrophobicContact CB-CE2 4.17Å; S2174-F2176 VanDerWaalsContact C-N 3.33Å; S2174-F2176 PolarHBondContact O-N 3.13Å; F2176-A2178 PolarHBondContact O-N 3.09Å; F2176-A2178 VanDerWaalsContact O-N 3.13Å; F2176-P2181 HydrophobicContact CB-CG 4.29Å; F2176-P2181 HydrophobicContact CD1-CB 4.47Å; F2176-P2181 HydrophobicContact CD1-CG 4.4Å; F2176-R2182 HydrophobicContact CB-CG 3.87Å; F2176-R2182 HydrophobicContact CD2-CG 4.44Å; F2176-R2182 PolarHBondContact O-NE 3.18Å; F2176-R2182 VanDerWaalsContact O-NE 3.14Å; F2176-R2182 PolarHBondContact O-NH2 3.22Å; F2176-F2185 HydrophobicContact CD2-CE2 4.36Å; F2176-F2185 HydrophobicContact CE1-CE2 4.27Å; F2176-F2185 HydrophobicContact CE2-CE2 4.25Å; F2176-F2185 AromaticContact CZ-CE2 3.95Å; F2176-F2185 HydrophobicContact CZ-CE2 4.2Å; F2176-F2185 HydrophobicContact CZ-CZ 4.48Å
2177T51.4Low71.8Confident134.75 Ų134.7558.1 Ų58.183%0.82731%0.309SS*.  trans-60.1-21.3179.358.90000114D2175D2175-T2177 PolarHBondContact O-N 3.2Å
2178A56.7Low71.9Confident49.5 Ų49.558.1 Ų58.141%0.40931%0.309SS..SBendtrans-93.5130.7177.600000112.2F2176 H2180 P2181F2176-A2178 PolarHBondContact O-N 3.09Å; F2176-A2178 VanDerWaalsContact O-N 3.13Å; A2178-H2180 VanDerWaalsContact C-N 3.27Å; A2178-H2180 PolarHBondContact O-N 3.19Å; A2178-H2180 VanDerWaalsContact O-N 3.11Å; A2178-P2181 HydrophobicContact CB-CG 4.29Å; A2178-P2181 VanDerWaalsContact O-CD 3.25Å; A2178-P2181 WeakPolarHBondContact O-CD 3.39Å; A2178-P2181 WeakPolarHBondContact O-CG 3.28Å
2179N60Low72.1Confident123.5 Ų123.557.6 Ų57.666%0.6631%0.306SS*.Hα-helixtrans-60.9-27.5177.8-69-23.7000113.8I2024 R2182 E2183I2024-N2179 VanDerWaalsContact CD1-ND2 3.3Å; I2024-N2179 WeakPolarHBondContact CD1-ND2 3.41Å; N2179-R2182 PolarHBondContact O-N 3.14Å; N2179-E2183 PolarHBondContact O-N 3.03Å; N2179-E2183 VanDerWaalsContact O-N 3.1Å
2180H65.5Low72.3Confident82.5 Ų82.554.7 Ų54.738%0.38229%0.291SS..Hα-helixtrans-66.2-52.2-170.9-164.3-77.5000114.8C2031 E2126 A2178 R2182 E2183 S2184C2031-H2180 VanDerWaalsContact CB-NE2 3.26Å; C2031-H2180 WeakPolarHBondContact CB-NE2 3.31Å; C2031-H2180 VanDerWaalsContact SG-CD2 3.55Å; C2031-H2180 PolarHBondContact SG-NE2 3.39Å; E2126-H2180 IonicContact OE1-CE1 2.91Å; E2126-H2180 PolarHBondContact OE1-CE1 3.1Å; E2126-H2180 VanDerWaalsContact OE1-CE1 3.27Å; E2126-H2180 IonicContact OE1-ND1 2.74Å; A2178-H2180 VanDerWaalsContact C-N 3.27Å; A2178-H2180 PolarHBondContact O-N 3.19Å; A2178-H2180 VanDerWaalsContact O-N 3.11Å; H2180-R2182 VanDerWaalsContact C-N 3.27Å; H2180-R2182 PolarHBondContact O-N 3.18Å; H2180-E2183 PolarHBondContact O-N 3.12Å; H2180-S2184 WeakPolarHBondContact O-CB 3.4Å; H2180-S2184 PolarHBondContact O-N 3.26Å; H2180-S2184 VanDerWaalsContact O-N 3.1Å; H2180-S2184 PolarHBondContact O-OG 3.3Å
2181P68.4Low72.8Confident5.75 Ų5.7555.4 Ų55.44%0.03730%0.295CS..Hα-helixtrans-60.7-40.8175.421.9-34000112.2F2176 A2178 E2183 S2184 F2185F2176-P2181 HydrophobicContact CB-CG 4.29Å; F2176-P2181 HydrophobicContact CD1-CB 4.47Å; F2176-P2181 HydrophobicContact CD1-CG 4.4Å; A2178-P2181 HydrophobicContact CB-CG 4.29Å; A2178-P2181 VanDerWaalsContact O-CD 3.25Å; A2178-P2181 WeakPolarHBondContact O-CD 3.39Å; A2178-P2181 WeakPolarHBondContact O-CG 3.28Å; P2181-E2183 VanDerWaalsContact C-N 3.35Å; P2181-E2183 PolarHBondContact O-N 3.03Å; P2181-S2184 WeakPolarHBondContact O-CB 3.41Å; P2181-S2184 PolarHBondContact O-N 3.22Å; P2181-S2184 VanDerWaalsContact O-N 3.14Å; P2181-F2185 HydrophobicContact CB-CD2 4.46Å; P2181-F2185 HydrophobicContact CB-CE2 3.98Å; P2181-F2185 HydrophobicContact CB-CZ 4.38Å; P2181-F2185 WeakPolarHBondContact O-CD2 3.42Å; P2181-F2185 WeakPolarHBondContact O-CG 3.25Å; P2181-F2185 PolarHBondContact O-N 3.16Å
2182R72.7Confident73.2Confident91 Ų9154.8 Ų54.834%0.34329%0.291SS..Hα-helixtrans-58.5-46.1178.8-117.9-175.5-177.7174.25.7112.2S2171 D2173 S2174 F2176 N2179 H2180 S2184 F2185 H2186S2171-R2182 WeakPolarHBondContact O-CD 3.26Å; S2171-R2182 WeakPolarHBondContact O-CG 3.29Å; S2171-R2182 PolarHBondContact O-NE 3.17Å; S2171-R2182 PolarHBondContact O-NH2 3.48Å; D2173-R2182 VanDerWaalsContact O-CZ 3.29Å; D2173-R2182 PolarHBondContact O-NE 3.42Å; D2173-R2182 PolarHBondContact O-NH2 3.35Å; S2174-R2182 PolarHBondContact O-NH2 3.15Å; F2176-R2182 HydrophobicContact CB-CG 3.87Å; F2176-R2182 HydrophobicContact CD2-CG 4.44Å; F2176-R2182 PolarHBondContact O-NE 3.18Å; F2176-R2182 VanDerWaalsContact O-NE 3.14Å; F2176-R2182 PolarHBondContact O-NH2 3.22Å; N2179-R2182 PolarHBondContact O-N 3.14Å; H2180-R2182 VanDerWaalsContact C-N 3.27Å; H2180-R2182 PolarHBondContact O-N 3.18Å; R2182-S2184 VanDerWaalsContact C-N 3.31Å; R2182-S2184 PolarHBondContact O-N 3.02Å; R2182-F2185 PolarHBondContact O-N 3.14Å; R2182-H2186 WeakPolarHBondContact O-CB 3.47Å; R2182-H2186 PolarHBondContact O-N 3.22Å; R2182-H2186 VanDerWaalsContact O-N 3.07Å
2183E76.3Confident73.6Confident83 Ų8349.8 Ų49.839%0.38827%0.267SS..Hα-helixtrans-65.8-38.1177.2-163.7-173.7151.800111.7N2179 H2180 P2181 H2186 K2187N2179-E2183 PolarHBondContact O-N 3.03Å; N2179-E2183 VanDerWaalsContact O-N 3.1Å; H2180-E2183 PolarHBondContact O-N 3.12Å; P2181-E2183 VanDerWaalsContact C-N 3.35Å; P2181-E2183 PolarHBondContact O-N 3.03Å; E2183-H2186 PolarHBondContact O-N 3Å; E2183-K2187 HydrophobicContact CG-CD 4.44Å; E2183-K2187 WeakPolarHBondContact O-CB 3.45Å; E2183-K2187 VanDerWaalsContact O-CG 3.29Å; E2183-K2187 WeakPolarHBondContact O-CG 3.29Å; E2183-K2187 PolarHBondContact O-N 3.08Å; E2183-K2187 WeakPolarHBondContact OE1-CE 3.45Å; E2183-K2187 IonicContact OE1-NZ 3.48Å; E2183-K2187 PolarHBondContact OE1-NZ 3.12Å
2184S76.2Confident74.3Confident14.75 Ų14.7547.2 Ų47.210%0.10325%0.253CS..Hα-helixtrans-65.2-42.7176.2-63.50000112.3H2180 P2181 R2182 K2187 C2188H2180-S2184 WeakPolarHBondContact O-CB 3.4Å; H2180-S2184 PolarHBondContact O-N 3.26Å; H2180-S2184 VanDerWaalsContact O-N 3.1Å; H2180-S2184 PolarHBondContact O-OG 3.3Å; P2181-S2184 WeakPolarHBondContact O-CB 3.41Å; P2181-S2184 PolarHBondContact O-N 3.22Å; P2181-S2184 VanDerWaalsContact O-N 3.14Å; R2182-S2184 VanDerWaalsContact C-N 3.31Å; R2182-S2184 PolarHBondContact O-N 3.02Å; S2184-K2187 WeakPolarHBondContact O-CB 3.36Å; S2184-K2187 PolarHBondContact O-N 3.14Å; S2184-C2188 PolarHBondContact O-N 3.2Å; S2184-C2188 PolarHBondContact O-SG 3.17Å
2185F82.6Confident75.4Confident0 Ų042.8 Ų42.80%022%0.222CC..Hα-helixtrans-66.3-40.6175.3-65.1-47000112.4I2112 A2125 Y2167 L2170 F2176 P2181 R2182 K2187 C2188 G2189I2112-F2185 HydrophobicContact CD1-CD1 4.34Å; I2112-F2185 HydrophobicContact CD1-CE1 3.39Å; I2112-F2185 VanDerWaalsContact CD1-CE1 3.49Å; I2112-F2185 HydrophobicContact CD1-CE2 4.35Å; I2112-F2185 HydrophobicContact CD1-CZ 3.73Å; I2112-F2185 HydrophobicContact CG1-CE1 4.35Å; I2112-F2185 HydrophobicContact CG1-CZ 4.18Å; I2112-F2185 HydrophobicContact CG2-CE1 4.19Å; I2112-F2185 HydrophobicContact CG2-CE2 4.47Å; I2112-F2185 HydrophobicContact CG2-CZ 4.09Å; A2125-F2185 HydrophobicContact CB-CD1 3.91Å; A2125-F2185 HydrophobicContact CB-CE1 3.41Å; A2125-F2185 VanDerWaalsContact CB-CE1 3.45Å; A2125-F2185 HydrophobicContact CB-CE2 4.29Å; A2125-F2185 HydrophobicContact CB-CZ 3.88Å; Y2167-F2185 HydrophobicContact CD1-CB 4.36Å; Y2167-F2185 AromaticContact CD1-CD1 3.83Å; Y2167-F2185 HydrophobicContact CD1-CD1 4.08Å; Y2167-F2185 HydrophobicContact CD1-CG 4.48Å; Y2167-F2185 AromaticContact CE1-CD1 3.84Å; Y2167-F2185 HydrophobicContact CE1-CD1 4.05Å; Y2167-F2185 HydrophobicContact CE1-CE1 4.43Å; L2170-F2185 HydrophobicContact CB-CD2 4.35Å; L2170-F2185 HydrophobicContact CB-CG 4.42Å; L2170-F2185 WeakPolarHBondContact O-CD2 3.48Å; F2176-F2185 HydrophobicContact CD2-CE2 4.36Å; F2176-F2185 HydrophobicContact CE1-CE2 4.27Å; F2176-F2185 HydrophobicContact CE2-CE2 4.25Å; F2176-F2185 AromaticContact CZ-CE2 3.95Å; F2176-F2185 HydrophobicContact CZ-CE2 4.2Å; F2176-F2185 HydrophobicContact CZ-CZ 4.48Å; P2181-F2185 HydrophobicContact CB-CD2 4.46Å; P2181-F2185 HydrophobicContact CB-CE2 3.98Å; P2181-F2185 HydrophobicContact CB-CZ 4.38Å; P2181-F2185 WeakPolarHBondContact O-CD2 3.42Å; P2181-F2185 WeakPolarHBondContact O-CG 3.25Å; P2181-F2185 PolarHBondContact O-N 3.16Å; R2182-F2185 PolarHBondContact O-N 3.14Å; F2185-K2187 VanDerWaalsContact C-N 3.33Å; F2185-K2187 PolarHBondContact O-N 3.04Å; F2185-C2188 WeakPolarHBondContact O-CB 3.23Å; F2185-C2188 PolarHBondContact O-N 3.19Å; F2185-C2188 VanDerWaalsContact O-N 3.16Å; F2185-G2189 PolarHBondContact O-N 3.27Å
2186H83.4Confident76.3Confident40.75 Ų40.7538.9 Ų38.919%0.18920%0.202CC..Hα-helixtrans-59.4-45.4173.6-177.4-92.3000111.2R2182 E2183 C2188 G2189 H2190 H2284 Y2285R2182-H2186 WeakPolarHBondContact O-CB 3.47Å; R2182-H2186 PolarHBondContact O-N 3.22Å; R2182-H2186 VanDerWaalsContact O-N 3.07Å; E2183-H2186 PolarHBondContact O-N 3Å; H2186-C2188 PolarHBondContact O-N 3.02Å; H2186-G2189 PolarHBondContact O-N 3.05Å; H2186-H2190 WeakPolarHBondContact O-CB 3.37Å; H2186-H2190 PolarHBondContact O-N 3.06Å; H2186-H2284 AromaticContact CD2-NE2 3.84Å; H2186-H2284 AromaticContact NE2-CD2 3.74Å; H2186-H2284 AromaticContact NE2-NE2 3.21Å; H2186-H2284 PolarHBondContact NE2-NE2 3.27Å; H2186-H2284 VanDerWaalsContact NE2-NE2 3.19Å; H2186-Y2285 AromaticContact CD2-CE1 3.97Å; H2186-Y2285 AromaticContact NE2-CE1 3.76Å
2187K84.3Confident77.3Confident85 Ų8539.4 Ų39.437%0.3720%0.204SC..Hα-helixtrans-59.6-43.4173.1-74.9170.5-177166.70112.1E2183 S2184 F2185 H2190 L2191E2183-K2187 HydrophobicContact CG-CD 4.44Å; E2183-K2187 WeakPolarHBondContact O-CB 3.45Å; E2183-K2187 VanDerWaalsContact O-CG 3.29Å; E2183-K2187 WeakPolarHBondContact O-CG 3.29Å; E2183-K2187 PolarHBondContact O-N 3.08Å; E2183-K2187 WeakPolarHBondContact OE1-CE 3.45Å; E2183-K2187 IonicContact OE1-NZ 3.48Å; E2183-K2187 PolarHBondContact OE1-NZ 3.12Å; S2184-K2187 WeakPolarHBondContact O-CB 3.36Å; S2184-K2187 PolarHBondContact O-N 3.14Å; F2185-K2187 VanDerWaalsContact C-N 3.33Å; F2185-K2187 PolarHBondContact O-N 3.04Å; K2187-H2190 PolarHBondContact O-N 3.28Å; K2187-L2191 WeakPolarHBondContact O-CB 3.43Å; K2187-L2191 VanDerWaalsContact O-CG 3.26Å; K2187-L2191 WeakPolarHBondContact O-CG 3.42Å; K2187-L2191 PolarHBondContact O-N 3.07Å
2188C85.4Confident78.7Confident0 Ų034.8 Ų34.80%017%0.172CC..Hα-helixtrans-60.5-49.8177-680000111.8A2125 S2128 C2129 I2132 Y2167 S2184 F2185 H2186 H2190 L2191 L2192A2125-C2188 PolarHBondContact O-SG 2.88Å; S2128-C2188 PolarHBondContact OG-SG 3.22Å; S2128-C2188 VanDerWaalsContact OG-SG 3.4Å; C2129-C2188 VanDerWaalsContact CA-SG 3.54Å; C2129-C2188 VanDerWaalsContact CB-SG 3.56Å; C2129-C2188 WeakPolarHBondContact CB-SG 3.37Å; C2129-C2188 PolarHBondContact N-SG 3Å; C2129-C2188 VanDerWaalsContact N-SG 3.45Å; I2132-C2188 HydrophobicContact CD1-CB 4.09Å; Y2167-C2188 HydrophobicContact CD1-CB 3.86Å; Y2167-C2188 HydrophobicContact CD2-CB 4.46Å; Y2167-C2188 HydrophobicContact CE1-CB 3.87Å; Y2167-C2188 HydrophobicContact CE2-CB 4.47Å; Y2167-C2188 HydrophobicContact CG-CB 4.18Å; S2184-C2188 PolarHBondContact O-N 3.2Å; S2184-C2188 PolarHBondContact O-SG 3.17Å; F2185-C2188 WeakPolarHBondContact O-CB 3.23Å; F2185-C2188 PolarHBondContact O-N 3.19Å; F2185-C2188 VanDerWaalsContact O-N 3.16Å; H2186-C2188 PolarHBondContact O-N 3.02Å; C2188-H2190 VanDerWaalsContact C-N 3.28Å; C2188-H2190 PolarHBondContact O-N 3.17Å; C2188-L2191 PolarHBondContact O-N 2.84Å; C2188-L2192 VanDerWaalsContact O-CB 3.28Å; C2188-L2192 WeakPolarHBondContact O-CB 3.37Å; C2188-L2192 PolarHBondContact O-N 2.97Å
2189G85Confident79.7Confident0 Ų032.5 Ų32.50%015%0.153CC..Hα-helixtrans-60.1-39.1178.200000112.5F2185 H2186 F2193F2185-G2189 PolarHBondContact O-N 3.27Å; H2186-G2189 PolarHBondContact O-N 3.05Å; G2189-F2193 WeakPolarHBondContact O-CB 3.35Å; G2189-F2193 PolarHBondContact O-N 3.04Å
2190H86.1Confident80.2Confident10.25 Ų10.2528 Ų285%0.04713%0.127CC..Hα-helixtrans-70.5-44.7177.9-159.5137.3000112.8H2186 K2187 C2188 L2192 F2193 I2194 Y2285 N2288 T2289 P2307H2186-H2190 WeakPolarHBondContact O-CB 3.37Å; H2186-H2190 PolarHBondContact O-N 3.06Å; K2187-H2190 PolarHBondContact O-N 3.28Å; C2188-H2190 VanDerWaalsContact C-N 3.28Å; C2188-H2190 PolarHBondContact O-N 3.17Å; H2190-L2192 VanDerWaalsContact C-N 3.3Å; H2190-L2192 PolarHBondContact O-N 2.9Å; H2190-F2193 WeakPolarHBondContact O-CB 3.17Å; H2190-F2193 PolarHBondContact O-N 3.14Å; H2190-F2193 VanDerWaalsContact O-N 3.16Å; H2190-I2194 WeakPolarHBondContact O-CG1 3.35Å; H2190-I2194 PolarHBondContact O-N 3.29Å; H2190-Y2285 HydrophobicContact CB-CD1 3.82Å; H2190-Y2285 HydrophobicContact CB-CE1 3.82Å; H2190-Y2285 AromaticContact CD2-CD1 3.88Å; H2190-Y2285 AromaticContact CG-CD1 3.83Å; H2190-Y2285 AromaticContact ND1-CD1 3.56Å; H2190-N2288 PolarHBondContact CE1-O 3.17Å; H2190-N2288 VanDerWaalsContact CE1-O 3.28Å; H2190-N2288 PolarHBondContact NE2-O 3.07Å; H2190-T2289 PolarHBondContact CD2-OG1 3.09Å; H2190-T2289 VanDerWaalsContact CE1-CG2 3.46Å; H2190-T2289 WeakPolarHBondContact CE1-CG2 3.39Å; H2190-T2289 WeakPolarHBondContact NE2-CG2 3.32Å; H2190-T2289 PolarHBondContact NE2-OG1 3.26Å; H2190-P2307 VanDerWaalsContact CE1-CA 3.49Å; H2190-P2307 WeakPolarHBondContact CE1-CA 3.48Å; H2190-P2307 WeakPolarHBondContact CE1-CB 3.33Å; H2190-P2307 WeakPolarHBondContact ND1-CB 3.33Å; H2190-P2307 VanDerWaalsContact NE2-CA 3.3Å; H2190-P2307 WeakPolarHBondContact NE2-CA 3.46Å; H2190-P2307 WeakPolarHBondContact NE2-CB 3.35Å
2191L88.4Confident80.2Confident29.5 Ų29.528.4 Ų28.415%0.15413%0.125CC..Hα-helixtrans-63.5-36.8175.7-70.7170.1000111.8I2132 K2133 L2136 K2187 C2188 F2193 I2194 L2195I2132-L2191 HydrophobicContact CB-CB 4.38Å; I2132-L2191 HydrophobicContact CG2-CB 3.59Å; K2133-L2191 HydrophobicContact CG-CD1 3.97Å; L2136-L2191 HydrophobicContact CD1-CB 4.31Å; L2136-L2191 HydrophobicContact CD1-CD2 3.87Å; K2187-L2191 WeakPolarHBondContact O-CB 3.43Å; K2187-L2191 VanDerWaalsContact O-CG 3.26Å; K2187-L2191 WeakPolarHBondContact O-CG 3.42Å; K2187-L2191 PolarHBondContact O-N 3.07Å; C2188-L2191 PolarHBondContact O-N 2.84Å; L2191-F2193 VanDerWaalsContact C-N 3.33Å; L2191-I2194 WeakPolarHBondContact O-CB 3.46Å; L2191-I2194 PolarHBondContact O-N 3.28Å; L2191-L2195 PolarHBondContact O-N 2.97Å
2192L85.7Confident80Confident0.75 Ų0.7529.9 Ų29.90%0.00414%0.136CC..Hα-helixtrans-68.6-35.3175.7-166.481.1000111.8V2105 I2132 L2160 I2164 Y2167 C2188 H2190 L2195 T2196V2105-L2192 HydrophobicContact CG1-CD1 3.69Å; V2105-L2192 HydrophobicContact CG1-CD2 4.33Å; I2132-L2192 HydrophobicContact CD1-CB 4.25Å; I2132-L2192 HydrophobicContact CD1-CD1 4.24Å; I2132-L2192 HydrophobicContact CG1-CD1 4.45Å; L2160-L2192 HydrophobicContact CB-CD2 4.26Å; L2160-L2192 HydrophobicContact CD2-CD1 3.85Å; L2160-L2192 HydrophobicContact CD2-CD2 4.06Å; L2160-L2192 HydrophobicContact CD2-CG 4.01Å; L2160-L2192 WeakPolarHBondContact O-CD2 3.43Å; I2164-L2192 HydrophobicContact CB-CD2 4.4Å; I2164-L2192 HydrophobicContact CD1-CD2 3.92Å; I2164-L2192 HydrophobicContact CD1-CG 4.4Å; I2164-L2192 HydrophobicContact CG1-CB 4.12Å; I2164-L2192 HydrophobicContact CG1-CD2 3.53Å; I2164-L2192 HydrophobicContact CG1-CG 3.9Å; Y2167-L2192 HydrophobicContact CD2-CD2 4.18Å; Y2167-L2192 HydrophobicContact CE2-CD1 4.11Å; Y2167-L2192 HydrophobicContact CE2-CD2 4.28Å; C2188-L2192 VanDerWaalsContact O-CB 3.28Å; C2188-L2192 WeakPolarHBondContact O-CB 3.37Å; C2188-L2192 PolarHBondContact O-N 2.97Å; H2190-L2192 VanDerWaalsContact C-N 3.3Å; H2190-L2192 PolarHBondContact O-N 2.9Å; L2192-L2195 HydrophobicContact CD1-CD2 4.32Å; L2192-L2195 PolarHBondContact O-N 3.18Å; L2192-T2196 WeakPolarHBondContact O-CB 3.35Å; L2192-T2196 PolarHBondContact O-N 3.11Å; L2192-T2196 PolarHBondContact O-OG1 3.12Å
2193F84.8Confident79.4Confident8 Ų827.2 Ų27.24%0.03513%0.126CC..Hα-helixtrans-63.8-44170.8179.5-102.5000111.6I2164 G2189 H2190 L2191 L2195 T2196 Q2197 I2268 I2272 L2282 Y2285 T2286 T2289I2164-F2193 HydrophobicContact CD1-CB 4.18Å; I2164-F2193 HydrophobicContact CD1-CD2 4.28Å; G2189-F2193 WeakPolarHBondContact O-CB 3.35Å; G2189-F2193 PolarHBondContact O-N 3.04Å; H2190-F2193 WeakPolarHBondContact O-CB 3.17Å; H2190-F2193 PolarHBondContact O-N 3.14Å; H2190-F2193 VanDerWaalsContact O-N 3.16Å; L2191-F2193 VanDerWaalsContact C-N 3.33Å; F2193-L2195 PolarHBondContact O-N 3.14Å; F2193-T2196 WeakPolarHBondContact O-CB 3.31Å; F2193-T2196 PolarHBondContact O-N 3.36Å; F2193-T2196 VanDerWaalsContact O-N 3.15Å; F2193-Q2197 HydrophobicContact CE1-CG 4.37Å; F2193-Q2197 HydrophobicContact CZ-CG 4.29Å; F2193-Q2197 WeakPolarHBondContact O-CG 3.39Å; F2193-Q2197 PolarHBondContact O-N 3.22Å; F2193-I2268 HydrophobicContact CE2-CD1 4.34Å; F2193-I2268 HydrophobicContact CZ-CD1 3.96Å; F2193-I2272 HydrophobicContact CE2-CD1 4.03Å; F2193-L2282 HydrophobicContact CD2-CD2 4.16Å; F2193-L2282 HydrophobicContact CE2-CD2 4.22Å; F2193-Y2285 HydrophobicContact CB-CD2 4.5Å; F2193-Y2285 HydrophobicContact CB-CG 4.34Å; F2193-Y2285 HydrophobicContact CG-CG 4.44Å; F2193-T2286 HydrophobicContact CE1-CG2 4.3Å; F2193-T2286 HydrophobicContact CE2-CG2 4.02Å; F2193-T2286 HydrophobicContact CZ-CG2 3.43Å; F2193-T2286 VanDerWaalsContact CZ-CG2 3.43Å; F2193-T2286 WeakPolarHBondContact CZ-OG1 3.41Å; F2193-T2289 HydrophobicContact CD1-CG2 3.6Å; F2193-T2289 HydrophobicContact CE1-CG2 4.06Å; F2193-T2289 WeakPolarHBondContact CE1-OG1 3.25Å
2194I84.9Confident78.6Confident6.25 Ų6.2526.9 Ų26.93%0.03213%0.132CC..Hα-helixtrans-58.6-47174-69.1170.4000110.9L2136 H2190 L2191 T2196 Q2197 Y2198 T2289 V2305L2136-I2194 HydrophobicContact CD1-CG2 4.37Å; L2136-I2194 HydrophobicContact CD2-CG2 4.03Å; H2190-I2194 WeakPolarHBondContact O-CG1 3.35Å; H2190-I2194 PolarHBondContact O-N 3.29Å; L2191-I2194 WeakPolarHBondContact O-CB 3.46Å; L2191-I2194 PolarHBondContact O-N 3.28Å; I2194-T2196 VanDerWaalsContact C-N 3.3Å; I2194-T2196 PolarHBondContact O-N 3.13Å; I2194-Q2197 WeakPolarHBondContact O-CB 3.4Å; I2194-Q2197 PolarHBondContact O-N 2.95Å; I2194-Q2197 VanDerWaalsContact O-N 3.15Å; I2194-Y2198 HydrophobicContact CG2-CD2 3.82Å; I2194-Y2198 HydrophobicContact CG2-CE2 3.55Å; I2194-Y2198 VanDerWaalsContact CG2-CE2 3.42Å; I2194-Y2198 VanDerWaalsContact O-CD2 3.28Å; I2194-Y2198 WeakPolarHBondContact O-CD2 3.37Å; I2194-Y2198 PolarHBondContact O-N 3.14Å; I2194-Y2198 VanDerWaalsContact O-N 3.09Å; I2194-T2289 HydrophobicContact CG1-CG2 4.29Å; I2194-V2305 HydrophobicContact CB-CG1 4.46Å; I2194-V2305 HydrophobicContact CG1-CB 4.49Å; I2194-V2305 HydrophobicContact CG1-CG1 4.06Å; I2194-V2305 HydrophobicContact CG2-CB 4.09Å; I2194-V2305 HydrophobicContact CG2-CG1 4.04Å
2195L85.4Confident77.2Confident3 Ų329.4 Ų29.42%0.01615%0.15CC..Hα-helixtrans-57.4-45.1175.5-179.165.6000111.3L2135 L2136 L2139 L2191 L2192 F2193 Q2197 Y2198 L2199L2135-L2195 HydrophobicContact CB-CD1 4.4Å; L2135-L2195 HydrophobicContact CB-CD2 4.25Å; L2135-L2195 HydrophobicContact CD1-CD2 4Å; L2136-L2195 HydrophobicContact CD2-CB 3.98Å; L2136-L2195 HydrophobicContact CD2-CD1 3.96Å; L2136-L2195 HydrophobicContact CG-CB 4.48Å; L2136-L2195 HydrophobicContact CG-CD1 4.42Å; L2139-L2195 HydrophobicContact CD1-CD1 3.53Å; L2139-L2195 VanDerWaalsContact CD1-CD1 3.43Å; L2191-L2195 PolarHBondContact O-N 2.97Å; L2192-L2195 HydrophobicContact CD1-CD2 4.32Å; L2192-L2195 PolarHBondContact O-N 3.18Å; F2193-L2195 PolarHBondContact O-N 3.14Å; L2195-Q2197 VanDerWaalsContact C-N 3.3Å; L2195-Q2197 PolarHBondContact O-N 3.08Å; L2195-Y2198 PolarHBondContact O-N 3Å; L2195-Y2198 VanDerWaalsContact O-N 3.17Å; L2195-L2199 HydrophobicContact CG-CD1 4.32Å; L2195-L2199 WeakPolarHBondContact O-CG 3.31Å; L2195-L2199 PolarHBondContact O-N 3.1Å
2196T81Confident75.6Confident16 Ų1632.7 Ų32.710%0.09817%0.166CC..Hα-helixtrans-62.1-37.1178.3-55.80000111.8L2157 L2192 F2193 I2194 L2199 Y2200L2157-T2196 HydrophobicContact CD2-CG2 4.11Å; L2192-T2196 WeakPolarHBondContact O-CB 3.35Å; L2192-T2196 PolarHBondContact O-N 3.11Å; L2192-T2196 PolarHBondContact O-OG1 3.12Å; F2193-T2196 WeakPolarHBondContact O-CB 3.31Å; F2193-T2196 PolarHBondContact O-N 3.36Å; F2193-T2196 VanDerWaalsContact O-N 3.15Å; I2194-T2196 VanDerWaalsContact C-N 3.3Å; I2194-T2196 PolarHBondContact O-N 3.13Å; T2196-L2199 PolarHBondContact O-N 3.16Å; T2196-Y2200 VanDerWaalsContact O-CB 3.27Å; T2196-Y2200 WeakPolarHBondContact O-CB 3.4Å; T2196-Y2200 PolarHBondContact O-N 3.13Å
2197Q79.3Confident73.8Confident42.25 Ų42.2533 Ų3320%0.19717%0.167CC..Hα-helixtrans-65.6-41.2175.1-122.9-179.3-4.700112.4F2193 I2194 L2195 Y2200 R2201 I2268 V2305F2193-Q2197 HydrophobicContact CE1-CG 4.37Å; F2193-Q2197 HydrophobicContact CZ-CG 4.29Å; F2193-Q2197 WeakPolarHBondContact O-CG 3.39Å; F2193-Q2197 PolarHBondContact O-N 3.22Å; I2194-Q2197 WeakPolarHBondContact O-CB 3.4Å; I2194-Q2197 PolarHBondContact O-N 2.95Å; I2194-Q2197 VanDerWaalsContact O-N 3.15Å; L2195-Q2197 VanDerWaalsContact C-N 3.3Å; L2195-Q2197 PolarHBondContact O-N 3.08Å; Q2197-Y2200 PolarHBondContact O-N 3.08Å; Q2197-R2201 PolarHBondContact O-N 2.89Å; Q2197-R2201 VanDerWaalsContact O-N 3.14Å; Q2197-I2268 HydrophobicContact CB-CD1 4.07Å; Q2197-I2268 HydrophobicContact CG-CD1 3.92Å; Q2197-V2305 VanDerWaalsContact OE1-CG1 3.25Å
2198Y80Confident71.9Confident39 Ų3936.9 Ų36.915%0.15318%0.184CC..Hα-helixtrans-62.4-47.3174-80-68000111.9L2136 I2194 L2195 Y2200 R2201 R2303 I2304 V2305L2136-Y2198 HydrophobicContact CD2-CD2 3.97Å; L2136-Y2198 HydrophobicContact CD2-CE2 4.24Å; I2194-Y2198 HydrophobicContact CG2-CD2 3.82Å; I2194-Y2198 HydrophobicContact CG2-CE2 3.55Å; I2194-Y2198 VanDerWaalsContact CG2-CE2 3.42Å; I2194-Y2198 VanDerWaalsContact O-CD2 3.28Å; I2194-Y2198 WeakPolarHBondContact O-CD2 3.37Å; I2194-Y2198 PolarHBondContact O-N 3.14Å; I2194-Y2198 VanDerWaalsContact O-N 3.09Å; L2195-Y2198 PolarHBondContact O-N 3Å; L2195-Y2198 VanDerWaalsContact O-N 3.17Å; Y2198-Y2200 VanDerWaalsContact C-N 3.33Å; Y2198-Y2200 PolarHBondContact O-N 3.16Å; Y2198-R2201 PolarHBondContact O-N 3.15Å; Y2198-R2303 PolarHBondContact OH-O 3.2Å; Y2198-I2304 WeakPolarHBondContact OH-CA 3.09Å; Y2198-V2305 HydrophobicContact CD2-CG2 4.47Å; Y2198-V2305 HydrophobicContact CE1-CG2 4.2Å; Y2198-V2305 HydrophobicContact CE2-CB 3.86Å; Y2198-V2305 HydrophobicContact CE2-CG2 3.96Å; Y2198-V2305 PolarHBondContact OH-N 3.17Å
2199L77.9Confident69.5Low2.25 Ų2.2544.1 Ų44.11%0.01222%0.217CC..Hα-helixtrans-62.6-41.4178.9-65.2177.8000112.3L2139 Y2148 L2151 I2152 C2155 L2160 L2195 T2196 R2201 C2202 F2203L2139-L2199 HydrophobicContact CD1-CD2 4.4Å; Y2148-L2199 HydrophobicContact CD1-CD2 4.2Å; L2151-L2199 HydrophobicContact CB-CD2 3.8Å; L2151-L2199 HydrophobicContact CD1-CD2 4.26Å; I2152-L2199 HydrophobicContact CD1-CB 4.38Å; I2152-L2199 HydrophobicContact CG1-CB 4.29Å; I2152-L2199 HydrophobicContact CG1-CD1 4.44Å; I2152-L2199 HydrophobicContact CG1-CD2 4.17Å; I2152-L2199 HydrophobicContact CG1-CG 4.46Å; C2155-L2199 HydrophobicContact CB-CD1 4.48Å; L2160-L2199 HydrophobicContact CD1-CD1 3.85Å; L2195-L2199 HydrophobicContact CG-CD1 4.32Å; L2195-L2199 WeakPolarHBondContact O-CG 3.31Å; L2195-L2199 PolarHBondContact O-N 3.1Å; T2196-L2199 PolarHBondContact O-N 3.16Å; L2199-R2201 VanDerWaalsContact C-N 3.31Å; L2199-R2201 PolarHBondContact O-N 3.24Å; L2199-C2202 PolarHBondContact O-N 3.43Å; L2199-F2203 PolarHBondContact O-N 3.34Å
2200Y70.2Confident67Low27 Ų2749 Ų4911%0.10624%0.242CC..Hα-helixtrans-60.9-40.4-179.8179.6-82.5000112.5T2196 Q2197 Y2198 C2202 F2203 F2207 T2266 I2267 I2268 L2271T2196-Y2200 VanDerWaalsContact O-CB 3.27Å; T2196-Y2200 WeakPolarHBondContact O-CB 3.4Å; T2196-Y2200 PolarHBondContact O-N 3.13Å; Q2197-Y2200 PolarHBondContact O-N 3.08Å; Y2198-Y2200 VanDerWaalsContact C-N 3.33Å; Y2198-Y2200 PolarHBondContact O-N 3.16Å; Y2200-C2202 VanDerWaalsContact C-N 3.31Å; Y2200-C2202 PolarHBondContact O-N 3.26Å; Y2200-F2203 CarbonylContact O-C 3.5Å; Y2200-F2203 PolarHBondContact O-N 3.18Å; Y2200-F2207 AromaticContact CD2-CD2 3.71Å; Y2200-F2207 HydrophobicContact CD2-CD2 3.71Å; Y2200-F2207 AromaticContact CD2-CE2 3.79Å; Y2200-F2207 HydrophobicContact CD2-CE2 3.79Å; Y2200-F2207 HydrophobicContact CE2-CB 4.45Å; Y2200-F2207 AromaticContact CE2-CD2 3.84Å; Y2200-F2207 HydrophobicContact CE2-CD2 3.84Å; Y2200-F2207 HydrophobicContact CE2-CE2 4.29Å; Y2200-F2207 HydrophobicContact CE2-CG 4.25Å; Y2200-T2266 PolarHBondContact OH-O 3.49Å; Y2200-I2267 HydrophobicContact CD1-CB 4.2Å; Y2200-I2267 HydrophobicContact CD1-CD1 3.92Å; Y2200-I2267 HydrophobicContact CD1-CG1 4.09Å; Y2200-I2267 HydrophobicContact CD1-CG2 3.31Å; Y2200-I2267 HydrophobicContact CD2-CG2 4.05Å; Y2200-I2267 HydrophobicContact CE1-CB 3.81Å; Y2200-I2267 HydrophobicContact CE1-CD1 3.69Å; Y2200-I2267 VanDerWaalsContact CE1-CD1 3.41Å; Y2200-I2267 HydrophobicContact CE1-CG1 3.42Å; Y2200-I2267 HydrophobicContact CE1-CG2 3.21Å; Y2200-I2267 HydrophobicContact CE2-CB 4.47Å; Y2200-I2267 HydrophobicContact CE2-CG2 3.9Å; Y2200-I2267 HydrophobicContact CG-CG2 3.77Å; Y2200-I2267 WeakPolarHBondContact OH-CA 3.3Å; Y2200-I2267 WeakPolarHBondContact OH-CB 3.41Å; Y2200-I2267 WeakPolarHBondContact OH-CG2 3.39Å; Y2200-I2268 HydrophobicContact CD1-CD1 3.43Å; Y2200-I2268 VanDerWaalsContact CD1-CD1 3.43Å; Y2200-I2268 HydrophobicContact CD1-CG1 3.1Å; Y2200-I2268 HydrophobicContact CD2-CG1 4.11Å; Y2200-I2268 HydrophobicContact CE1-CD1 4.2Å; Y2200-I2268 HydrophobicContact CE1-CG1 3.35Å; Y2200-I2268 HydrophobicContact CE2-CG1 4.3Å; Y2200-I2268 HydrophobicContact CG-CD1 3.65Å; Y2200-I2268 HydrophobicContact CG-CG1 3.54Å; Y2200-L2271 HydrophobicContact CD2-CD1 3.81Å; Y2200-L2271 HydrophobicContact CD2-CD2 4.5Å; Y2200-L2271 HydrophobicContact CD2-CG 4.35Å; Y2200-L2271 HydrophobicContact CE2-CD1 3.87Å; Y2200-L2271 HydrophobicContact CE2-CD2 4.04Å; Y2200-L2271 HydrophobicContact CE2-CG 4.13Å; Y2200-L2271 WeakPolarHBondContact OH-CD1 3.44Å
2201R67.3Low64.7Low91.3333 Ų91.333355.9 Ų55.935%0.34527%0.271SS..Hα-helixtrans-68.2-31.3-171.6-170170151.9153.60.1112.9Q2197 Y2198 L2199 R2303 D2767Q2197-R2201 PolarHBondContact O-N 2.89Å; Q2197-R2201 VanDerWaalsContact O-N 3.14Å; Y2198-R2201 PolarHBondContact O-N 3.15Å; L2199-R2201 VanDerWaalsContact C-N 3.31Å; L2199-R2201 PolarHBondContact O-N 3.24Å; R2201-R2303 VanDerWaalsContact CZ-CZ 3.48Å; R2201-R2303 PolarHBondContact NH1-O 3.33Å; R2201-R2303 VanDerWaalsContact NH1-O 3.15Å; R2201-D2767 IonicContact CZ-OD2 2.69Å; R2201-D2767 IonicContact NH1-OD1 3.65Å; R2201-D2767 PolarHBondContact NH1-OD1 3.22Å; R2201-D2767 IonicContact NH1-OD2 3.87Å; R2201-D2767 IonicContact NH2-OD1 2.69Å; R2201-D2767 IonicContact NH2-OD2 2.81Å; R2201-D2767 PolarHBondContact NH2-OD2 3.37Å
2202C63.1Low62Low38 Ų3860.9 Ų60.926%0.25730%0.297SS..Hα-helixtrans-77.1-26.5-179.3-62.90000113.2Y2148 L2199 Y2200 P2204Y2148-C2202 HydrophobicContact CD1-CB 4.15Å; Y2148-C2202 VanDerWaalsContact CD1-SG 3.54Å; Y2148-C2202 HydrophobicContact CD2-CB 4.07Å; Y2148-C2202 VanDerWaalsContact CD2-SG 3.58Å; Y2148-C2202 HydrophobicContact CE1-CB 4.35Å; Y2148-C2202 VanDerWaalsContact CE1-SG 3.55Å; Y2148-C2202 HydrophobicContact CE2-CB 4.23Å; Y2148-C2202 WeakPolarHBondContact CE2-SG 3.29Å; Y2148-C2202 HydrophobicContact CG-CB 3.88Å; L2199-C2202 PolarHBondContact O-N 3.43Å; Y2200-C2202 VanDerWaalsContact C-N 3.31Å; Y2200-C2202 PolarHBondContact O-N 3.26Å; C2202-P2204 VanDerWaalsContact C-CD 3.45Å; C2202-P2204 WeakPolarHBondContact O-CD 3.32Å
2203F60.3Low59.3Low33.3333 Ų33.333366 Ų6615%0.14633%0.333CS..  trans-126.866.1-178.8-67.4-81.8000114.2D2145 Q2149 I2152 L2199 Y2200 S2205 I2206D2145-F2203 HydrophobicContact CB-CE1 4.37Å; D2145-F2203 HydrophobicContact CB-CZ 4.12Å; D2145-F2203 VanDerWaalsContact O-CZ 3.31Å; D2145-F2203 WeakPolarHBondContact O-CZ 3.49Å; Q2149-F2203 HydrophobicContact CB-CE2 4.39Å; Q2149-F2203 HydrophobicContact CB-CZ 4.04Å; Q2149-F2203 HydrophobicContact CG-CE1 3.86Å; Q2149-F2203 HydrophobicContact CG-CE2 3.64Å; Q2149-F2203 HydrophobicContact CG-CZ 4.02Å; I2152-F2203 HydrophobicContact CD1-CB 4.22Å; I2152-F2203 HydrophobicContact CD1-CD2 3.26Å; I2152-F2203 HydrophobicContact CD1-CE2 3.89Å; I2152-F2203 HydrophobicContact CD1-CG 4.01Å; L2199-F2203 PolarHBondContact O-N 3.34Å; Y2200-F2203 CarbonylContact O-C 3.5Å; Y2200-F2203 PolarHBondContact O-N 3.18Å; F2203-S2205 PolarHBondContact O-N 3.14Å; F2203-S2205 VanDerWaalsContact O-N 3.14Å; F2203-I2206 HydrophobicContact CB-CB 4.26Å; F2203-I2206 HydrophobicContact CB-CD1 3.67Å; F2203-I2206 HydrophobicContact CB-CG1 4.02Å; F2203-I2206 HydrophobicContact CD1-CD1 4.09Å; F2203-I2206 HydrophobicContact CD1-CG1 4.22Å; F2203-I2206 HydrophobicContact CD2-CD1 4.28Å; F2203-I2206 HydrophobicContact CG-CD1 3.91Å; F2203-I2206 HydrophobicContact CG-CG1 4.25Å; F2203-I2206 PolarHBondContact O-N 3.31Å
2204P59.2Low56.7Low77.3333 Ų77.333374.2 Ų74.250%0.50237%0.371SS..Hα-helixtrans-64-20.2171.527.2-33.5000112.7C2202C2202-P2204 VanDerWaalsContact C-CD 3.45Å; C2202-P2204 WeakPolarHBondContact O-CD 3.32Å
2205S47Very low54.2Low68.3333 Ų68.333380.4 Ų80.448%0.47841%0.405SS..Hα-helixtrans-71.5-34.6-177.746.50000114.2F2203 F2207 K2208F2203-S2205 PolarHBondContact O-N 3.14Å; F2203-S2205 VanDerWaalsContact O-N 3.14Å; S2205-F2207 VanDerWaalsContact C-N 3.3Å; S2205-F2207 PolarHBondContact O-N 3.19Å; S2205-F2207 VanDerWaalsContact O-N 3.15Å; S2205-K2208 VanDerWaalsContact O-CB 3.3Å; S2205-K2208 WeakPolarHBondContact O-CB 3.32Å; S2205-K2208 PolarHBondContact O-N 3.23Å
2206I48.1Very low51.6Low68.3333 Ų68.333387.7 Ų87.735%0.3544%0.438SS..Hα-helixtrans-60.9-32.8-177.7-65.9175000111.1I2152 F2203 K2208 H2209 M2210I2152-I2206 HydrophobicContact CD1-CD1 4.22Å; I2152-I2206 HydrophobicContact CG2-CD1 4.39Å; F2203-I2206 HydrophobicContact CB-CB 4.26Å; F2203-I2206 HydrophobicContact CB-CD1 3.67Å; F2203-I2206 HydrophobicContact CB-CG1 4.02Å; F2203-I2206 HydrophobicContact CD1-CD1 4.09Å; F2203-I2206 HydrophobicContact CD1-CG1 4.22Å; F2203-I2206 HydrophobicContact CD2-CD1 4.28Å; F2203-I2206 HydrophobicContact CG-CD1 3.91Å; F2203-I2206 HydrophobicContact CG-CG1 4.25Å; F2203-I2206 PolarHBondContact O-N 3.31Å; I2206-K2208 VanDerWaalsContact C-N 3.34Å; I2206-K2208 PolarHBondContact O-N 3.02Å; I2206-H2209 PolarHBondContact O-N 3.01Å; I2206-M2210 PolarHBondContact O-N 3.24Å
2207F46.3Very low49.3Very low47.3333 Ų47.333393.9 Ų93.921%0.20847%0.471CS..Hα-helixtrans-85.4-12.1177-83.3-80.2000115.2L2157 Y2200 S2205 H2209 M2210 L2271L2157-F2207 HydrophobicContact CB-CE2 4.1Å; L2157-F2207 HydrophobicContact CB-CZ 3.57Å; L2157-F2207 HydrophobicContact CD1-CD2 4.02Å; L2157-F2207 HydrophobicContact CD1-CE2 3.81Å; L2157-F2207 HydrophobicContact CD1-CZ 3.5Å; L2157-F2207 VanDerWaalsContact CD1-CZ 3.5Å; L2157-F2207 HydrophobicContact CD2-CE2 4Å; L2157-F2207 HydrophobicContact CD2-CZ 3.85Å; L2157-F2207 HydrophobicContact CG-CE2 3.74Å; L2157-F2207 HydrophobicContact CG-CZ 3.78Å; Y2200-F2207 AromaticContact CD2-CD2 3.71Å; Y2200-F2207 HydrophobicContact CD2-CD2 3.71Å; Y2200-F2207 AromaticContact CD2-CE2 3.79Å; Y2200-F2207 HydrophobicContact CD2-CE2 3.79Å; Y2200-F2207 HydrophobicContact CE2-CB 4.45Å; Y2200-F2207 AromaticContact CE2-CD2 3.84Å; Y2200-F2207 HydrophobicContact CE2-CD2 3.84Å; Y2200-F2207 HydrophobicContact CE2-CE2 4.29Å; Y2200-F2207 HydrophobicContact CE2-CG 4.25Å; S2205-F2207 VanDerWaalsContact C-N 3.3Å; S2205-F2207 PolarHBondContact O-N 3.19Å; S2205-F2207 VanDerWaalsContact O-N 3.15Å; F2207-H2209 VanDerWaalsContact C-N 3.28Å; F2207-H2209 PolarHBondContact O-N 3.15Å; F2207-M2210 HydrophobicContact CD1-CB 4.03Å; F2207-M2210 HydrophobicContact CD1-CE 4.42Å; F2207-M2210 HydrophobicContact CD1-CG 4.34Å; F2207-M2210 HydrophobicContact CD1-SD 3.76Å; F2207-M2210 HydrophobicContact CE1-CB 4.22Å; F2207-M2210 HydrophobicContact CE1-CE 3.88Å; F2207-M2210 HydrophobicContact CE1-CG 4.43Å; F2207-M2210 HydrophobicContact CE1-SD 3.4Å; F2207-M2210 VanDerWaalsContact CE1-SD 3.54Å; F2207-M2210 WeakPolarHBondContact CE1-SD 3.23Å; F2207-M2210 HydrophobicContact CZ-CE 4.26Å; F2207-M2210 HydrophobicContact CZ-SD 4.16Å; F2207-M2210 PolarHBondContact O-N 2.94Å; F2207-L2271 HydrophobicContact CD1-CD2 4.32Å; F2207-L2271 HydrophobicContact CD2-CD2 4.19Å; F2207-L2271 HydrophobicContact CE1-CD2 3.92Å; F2207-L2271 HydrophobicContact CE2-CD2 3.9Å; F2207-L2271 HydrophobicContact CG-CD2 4.45Å; F2207-L2271 HydrophobicContact CZ-CD2 3.59Å
2208K44.7Very low47Very low166.667 Ų166.66798.4 Ų98.473%0.72550%0.496SS*.Hα-helixtrans-65.5-28.4168.9-119.9-179.9-178.5-179.20111S2205 I2206S2205-K2208 VanDerWaalsContact O-CB 3.3Å; S2205-K2208 WeakPolarHBondContact O-CB 3.32Å; S2205-K2208 PolarHBondContact O-N 3.23Å; I2206-K2208 VanDerWaalsContact C-N 3.34Å; I2206-K2208 PolarHBondContact O-N 3.02Å
2209H35Very low44.7Very low150.333 Ų150.333103.7 Ų103.770%0.69653%0.527SS*.Hα-helixtrans-84.5-26175.6-78.1-82.4000114.3I2206 F2207 K2211 I2212I2206-H2209 PolarHBondContact O-N 3.01Å; F2207-H2209 VanDerWaalsContact C-N 3.28Å; F2207-H2209 PolarHBondContact O-N 3.15Å; H2209-K2211 VanDerWaalsContact C-N 3.29Å; H2209-K2211 PolarHBondContact O-N 3.38Å; H2209-K2211 VanDerWaalsContact O-N 3.16Å; H2209-I2212 PolarHBondContact O-N 3.26Å
2210M33Very low42.5Very low104.667 Ų104.667110.4 Ų110.452%0.51656%0.563SS.*THydrogen-bonded Turntrans-71.9-8.5171.9-83-168.1-173.300113.9L2157 D2158 I2206 F2207 I2212L2157-M2210 HydrophobicContact CB-CE 4.46Å; D2158-M2210 WeakPolarHBondContact OD2-CE 3.41Å; I2206-M2210 PolarHBondContact O-N 3.24Å; F2207-M2210 HydrophobicContact CD1-CB 4.03Å; F2207-M2210 HydrophobicContact CD1-CE 4.42Å; F2207-M2210 HydrophobicContact CD1-CG 4.34Å; F2207-M2210 HydrophobicContact CD1-SD 3.76Å; F2207-M2210 HydrophobicContact CE1-CB 4.22Å; F2207-M2210 HydrophobicContact CE1-CE 3.88Å; F2207-M2210 HydrophobicContact CE1-CG 4.43Å; F2207-M2210 HydrophobicContact CE1-SD 3.4Å; F2207-M2210 VanDerWaalsContact CE1-SD 3.54Å; F2207-M2210 WeakPolarHBondContact CE1-SD 3.23Å; F2207-M2210 HydrophobicContact CZ-CE 4.26Å; F2207-M2210 HydrophobicContact CZ-SD 4.16Å; F2207-M2210 PolarHBondContact O-N 2.94Å; M2210-I2212 VanDerWaalsContact C-N 3.27Å; M2210-I2212 PolarHBondContact O-N 2.92Å
2211K36.2Very low40.7Very low153.333 Ų153.333118.2 Ų118.267%0.66760%0.6SS**THydrogen-bonded Turntrans-75.81.4174.9-100.4-173.8173.3-169.30114.8H2209 S2213H2209-K2211 VanDerWaalsContact C-N 3.29Å; H2209-K2211 PolarHBondContact O-N 3.38Å; H2209-K2211 VanDerWaalsContact O-N 3.16Å; K2211-S2213 PolarHBondContact O-N 3.26Å
2212I31.8Very low39Very low136.333 Ų136.333121.9 Ų121.970%0.69963%0.626SS**  trans-112.348.9-173.4-45.7175.1000111.5H2209 M2210H2209-I2212 PolarHBondContact O-N 3.26Å; M2210-I2212 VanDerWaalsContact C-N 3.27Å; M2210-I2212 PolarHBondContact O-N 2.92Å
2213S29.3Very low37.3Very low107.333 Ų107.333127.3 Ų127.375%0.75165%0.652SS**  trans-134.136.1163.51140000112.1K2211 N2215K2211-S2213 PolarHBondContact O-N 3.26Å; S2213-N2215 PolarHBondContact O-N 3.03Å
2214E31.3Very low35.6Very low179 Ų179137 Ų13784%0.83669%0.687SS**  trans-87.576.7155.7-74.8-179.3173.100107.6H2216E2214-H2216 VanDerWaalsContact C-N 3.27Å; E2214-H2216 PolarHBondContact O-N 2.95Å
2215N31.6Very low34.1Very low138 Ų138139.1 Ų139.174%0.73870%0.698SS**  trans-108.5107.4168.1-104.6-8.5000108.4S2213 N2217S2213-N2215 PolarHBondContact O-N 3.03Å; N2215-N2217 PolarHBondContact O-N 3.25Å
2216H32.1Very low32.9Very low156.333 Ų156.333144.1 Ų144.172%0.72471%0.711SS**  trans19.193.7157.3-68.9-72.8000116E2214E2214-H2216 VanDerWaalsContact C-N 3.27Å; E2214-H2216 PolarHBondContact O-N 2.95Å
2217N32Very low31.8Very low145.333 Ų145.333151.3 Ų151.378%0.77773%0.734SS**  -147.9122.1123.9-88.7-22.4000109.8N2215 N2219N2215-N2217 PolarHBondContact O-N 3.25Å; N2217-N2219 PolarHBondContact O-N 3.39Å
2218N31.4Very low30.8Very low136 Ų136153.7 Ų153.773%0.72776%0.757SS**  trans-38.891.9170.1-59.7-32.6000114
2219N31.6Very low29.7Very low150.667 Ų150.667154.3 Ų154.381%0.80676%0.763SS**  trans-155.492.4142.1-79.7-15.3000110.4N2217 Q2221N2217-N2219 PolarHBondContact O-N 3.39Å; N2219-Q2221 PolarHBondContact O-N 2.88Å
2220D31.1Very low29.2Very low142.667 Ų142.667152.7 Ų152.776%0.76377%0.765SS**  trans-31.996.2167-72.5-25.6000114.3L2222D2220-L2222 PolarHBondContact O-N 3.18Å
2221Q31.9Very low28.8Very low190.667 Ų190.667154.5 Ų154.589%0.89178%0.777SS**  trans-114.87.7172.3-77.5178.32.400114.7N2219 L2223N2219-Q2221 PolarHBondContact O-N 2.88Å; Q2221-L2223 VanDerWaalsContact C-N 3.34Å; Q2221-L2223 PolarHBondContact O-N 3.42Å
2222L31.9Very low28.3Very low169.333 Ų169.333152.1 Ų152.189%0.88778%0.78SS**  trans-99.529.3178.7-83.4160.8000114.3D2220D2220-L2222 PolarHBondContact O-N 3.18Å
2223L27.5Very low27.9Very low152.667 Ų152.667155.9 Ų155.980%0.79979%0.787SS**  trans-12367.7173.1-81.3170000112Q2221Q2221-L2223 VanDerWaalsContact C-N 3.34Å; Q2221-L2223 PolarHBondContact O-N 3.42Å
2224R24.8Very low27.9Very low236 Ų236157.7 Ų157.789%0.89179%0.788SS**  trans-179.480.1151.7-84.5179.5-104.6-155.3-1.6112K2226R2224-K2226 PolarHBondContact O-N 3.37Å
2225V27.4Very low27.6Very low121 Ų121154.5 Ų154.573%0.73378%0.781SS**  trans-121.394.6153.4-176.10000105.7W2227V2225-W2227 VanDerWaalsContact O-CD1 3.27Å; V2225-W2227 PolarHBondContact O-N 3.33Å
2226K22.4Very low27.3Very low173.333 Ų173.333153.8 Ų153.875%0.75478%0.782SS**  trans-19.7144.8130.6-141.7178.2-174.2-177.10109.9R2224 S2228R2224-K2226 PolarHBondContact O-N 3.37Å; K2226-S2228 PolarHBondContact O-N 3.04Å
2227W24.4Very low27.1Very low219.667 Ų219.667153.6 Ų153.683%0.83278%0.781SS**  trans53.2118.4173.4-47.599000110.7V2225 E2229V2225-W2227 VanDerWaalsContact O-CD1 3.27Å; V2225-W2227 PolarHBondContact O-N 3.33Å; W2227-E2229 PolarHBondContact O-N 2.84Å; W2227-E2229 VanDerWaalsContact O-N 3.14Å
2228S24.8Very low26.7Very low97.6667 Ų97.6667149.8 Ų149.868%0.68378%0.776SS**  cis-155.6135.8-1.541.30000103.9K2226 P2230K2226-S2228 PolarHBondContact O-N 3.04Å; S2228-P2230 WeakPolarHBondContact O-CD 3.42Å; S2228-P2230 VanDerWaalsContact O-N 3.08Å
2229E23.2Very low26.5Very low181 Ų181152.2 Ų152.285%0.84678%0.783SS**  trans-47.5134.1164.4-65.5172.6161.200109W2227 N2231W2227-E2229 PolarHBondContact O-N 2.84Å; W2227-E2229 VanDerWaalsContact O-N 3.14Å; E2229-N2231 PolarHBondContact O-N 2.9Å
2230P24.3Very low26.2Very low114.667 Ų114.667151 Ų15175%0.74578%0.776SS**  -125.3135.212429.1-14.8000112.7S2228 S2232S2228-P2230 WeakPolarHBondContact O-CD 3.42Å; S2228-P2230 VanDerWaalsContact O-N 3.08Å; P2230-S2232 PolarHBondContact O-N 2.69Å
2231N24Very low25.9Very low143 Ų143149.5 Ų149.577%0.76578%0.776SS**  trans-19.8133.5148.8-68.9-32.5000115.4E2229E2229-N2231 PolarHBondContact O-N 2.9Å
2232S26.1Very low25.5Very low104 Ų104147.3 Ų147.373%0.72776%0.763SS**  trans105.1106.9143.461.90000115P2230P2230-S2232 PolarHBondContact O-N 2.69Å
2233Y23.9Very low25.3Very low215.667 Ų215.667148.6 Ų148.685%0.84676%0.758SS**  trans-77.3121.8152.5-68.1-88.7000109.3T2235Y2233-T2235 PolarHBondContact O-N 2.62Å
2234N27.4Very low25.2Very low144 Ų144147.2 Ų147.277%0.7775%0.748SS**  trans-135.5110.4148-85.2-22000108.5
2235T25.5Very low25.2Very low113 Ų113144 Ų14469%0.69375%0.745SS**  trans-45112.1141.545.70000110.4Y2233 E2237 L2430Y2233-T2235 PolarHBondContact O-N 2.62Å; T2235-E2237 PolarHBondContact O-N 2.87Å; T2235-L2430 HydrophobicContact CG2-CD1 3.51Å
2236T26.5Very low25.1Very low123.333 Ų123.333145.8 Ų145.876%0.75774%0.743SS**  -148.9141.1114.928.10000109.4
2237E26Very low25.2Very low152.667 Ų152.667142.4 Ų142.471%0.71374%0.74SS**  trans97.6104156.6-67.4176-174.800114.3T2235T2235-E2237 PolarHBondContact O-N 2.87Å
2238G24.8Very low25.3Very low65 Ų65136.7 Ų136.767%0.6773%0.729SS**  100.552.9114.300000116.3N2240G2238-N2240 VanDerWaalsContact C-N 3.3Å; G2238-N2240 PolarHBondContact O-N 3Å
2239Q27Very low25.5Very low185.333 Ų185.333139.5 Ų139.587%0.86674%0.737SS**  trans-129.4108.5158.9-96.1172.67.200111.4C2241Q2239-C2241 PolarHBondContact O-N 2.81Å
2240N24.8Very low25.7Very low125.333 Ų125.333139.3 Ų139.367%0.6774%0.735SS**  trans-48.2107.8159.9-74.4-22.5000112.8G2238 F2242 S2426G2238-N2240 VanDerWaalsContact C-N 3.3Å; G2238-N2240 PolarHBondContact O-N 3Å; N2240-F2242 VanDerWaalsContact C-N 3.31Å; N2240-F2242 PolarHBondContact O-N 3.28Å; N2240-F2242 VanDerWaalsContact O-N 3.09Å; N2240-S2426 VanDerWaalsContact ND2-CB 3.29Å; N2240-S2426 WeakPolarHBondContact ND2-CB 3.48Å
2241C25.2Very low25.9Very low111.333 Ų111.333140.3 Ų140.375%0.75273%0.734SS**  trans-62.474.1152.5-69.70000112.7Q2239 Y2243Q2239-C2241 PolarHBondContact O-N 2.81Å; C2241-Y2243 PolarHBondContact O-N 2.99Å
2242F23.6Very low26.1Very low144.667 Ų144.667139.1 Ų139.164%0.63574%0.737SS**  trans-91.399.9155.2-137-94.2000107N2240 E2244N2240-F2242 VanDerWaalsContact C-N 3.31Å; N2240-F2242 PolarHBondContact O-N 3.28Å; N2240-F2242 VanDerWaalsContact O-N 3.09Å; F2242-E2244 HydrophobicContact CD1-CB 3.77Å; F2242-E2244 HydrophobicContact CD1-CG 3.98Å; F2242-E2244 HydrophobicContact CE1-CB 4.23Å; F2242-E2244 VanDerWaalsContact CE1-CD 3.45Å; F2242-E2244 HydrophobicContact CE1-CG 3.59Å; F2242-E2244 WeakPolarHBondContact CE1-OE2 3.49Å; F2242-E2244 HydrophobicContact CZ-CG 4.12Å; F2242-E2244 PolarHBondContact O-N 3.12Å
2243Y27.6Very low26.1Very low196.333 Ų196.333141 Ų14177%0.7774%0.738SS**  trans-98.987.1163.1-89.4-80.3000108.4C2241 M2245C2241-Y2243 PolarHBondContact O-N 2.99Å; Y2243-M2245 PolarHBondContact O-N 2.83Å
2244E24.6Very low26.2Very low125 Ų125136 Ų13658%0.58473%0.732SS**  trans-68.4115154.9-80.2179.6135.900107.7F2242 K2246F2242-E2244 HydrophobicContact CD1-CB 3.77Å; F2242-E2244 HydrophobicContact CD1-CG 3.98Å; F2242-E2244 HydrophobicContact CE1-CB 4.23Å; F2242-E2244 VanDerWaalsContact CE1-CD 3.45Å; F2242-E2244 HydrophobicContact CE1-CG 3.59Å; F2242-E2244 WeakPolarHBondContact CE1-OE2 3.49Å; F2242-E2244 HydrophobicContact CZ-CG 4.12Å; F2242-E2244 PolarHBondContact O-N 3.12Å; E2244-K2246 PolarHBondContact O-N 2.93Å; E2244-K2246 IonicContact OE1-NZ 3.33Å; E2244-K2246 PolarHBondContact OE1-NZ 3.12Å
2245M25.6Very low26.2Very low168 Ų168138 Ų13883%0.82873%0.734SS**  trans-82.474.3162.3-164131136.400108.1Y2243 C2247Y2243-M2245 PolarHBondContact O-N 2.83Å; M2245-C2247 PolarHBondContact O-N 3.4Å
2246K24.7Very low26.3Very low158.667 Ų158.667140.2 Ų140.269%0.6974%0.741SS**  trans-75.8102.4156.4-88.4-179.2179.9162.70106.6E2244 T2248E2244-K2246 PolarHBondContact O-N 2.93Å; E2244-K2246 IonicContact OE1-NZ 3.33Å; E2244-K2246 PolarHBondContact OE1-NZ 3.12Å; K2246-T2248 HydrophobicContact CB-CG2 4.11Å; K2246-T2248 HydrophobicContact CG-CG2 4.48Å; K2246-T2248 PolarHBondContact O-N 3.07Å; K2246-T2248 VanDerWaalsContact O-N 3.1Å
2247C24.8Very low26.3Very low102.333 Ų102.333136.9 Ų136.969%0.69173%0.732SS**  trans-70.982.1166.5-58.20000108.7M2245 D2249M2245-C2247 PolarHBondContact O-N 3.4Å; C2247-D2249 PolarHBondContact O-N 3.06Å
2248T26.6Very low26.4Very low100.333 Ų100.333136 Ų13662%0.61674%0.737SS**  trans-133.5101.8163.648.30000108.5K2246K2246-T2248 HydrophobicContact CB-CG2 4.11Å; K2246-T2248 HydrophobicContact CG-CG2 4.48Å; K2246-T2248 PolarHBondContact O-N 3.07Å; K2246-T2248 VanDerWaalsContact O-N 3.1Å
2249D29.2Very low26.7Very low156.333 Ų156.333135.9 Ų135.984%0.83674%0.736SS**  trans168.6114145.9-71-26.5000112.4C2247 N2251C2247-D2249 PolarHBondContact O-N 3.06Å; D2249-N2251 PolarHBondContact O-N 3.27Å
2250H27.1Very low26.8Very low176 Ų176136.4 Ų136.482%0.81574%0.735SS**  trans-76.9131.9177.4-73.2-87.5000111.3
2251N29.3Very low27.1Very low136.667 Ų136.667136.6 Ų136.673%0.73174%0.735SS**SBendtrans123.9107.2159.4-65.4-27.7000114.2D2249 I2253D2249-N2251 PolarHBondContact O-N 3.27Å; N2251-I2253 PolarHBondContact O-N 3.06Å
2252S27.5Very low27.5Very low118 Ų118136.9 Ų136.983%0.82573%0.729SS**  trans22.487.315657.10000116
2253I26.7Very low28.1Very low143.333 Ų143.333134.7 Ų134.774%0.73572%0.724SS**  trans-119.4121.4158.5-57.6177.3000107.2N2251 F2255N2251-I2253 PolarHBondContact O-N 3.06Å; I2253-F2255 PolarHBondContact O-N 3.04Å
2254P26.6Very low28.5Very low110.667 Ų110.667129.9 Ų129.972%0.71971%0.711SS**  trans-77114.5-171.230.2-32.4000111N2256P2254-N2256 PolarHBondContact O-N 3.21Å
2255F27.3Very low29.5Very low186 Ų186127.1 Ų127.182%0.81670%0.701SS**  trans-75.669.8174-103.6-88.5000111.5I2253 G2257I2253-F2255 PolarHBondContact O-N 3.04Å; F2255-G2257 PolarHBondContact O-N 3.16Å; F2255-G2257 VanDerWaalsContact O-N 3.15Å
2256N25.9Very low30.6Very low159.333 Ų159.333121.7 Ų121.785%0.85268%0.677SS**  trans-75.578.4160.5-89.8-7.4000109P2254P2254-N2256 PolarHBondContact O-N 3.21Å
2257G27.8Very low31.6Very low53.6667 Ų53.6667117.5 Ų117.555%0.55366%0.662SS**  trans-143.358.1174.200000109.6F2255 G2259F2255-G2257 PolarHBondContact O-N 3.16Å; F2255-G2257 VanDerWaalsContact O-N 3.15Å; G2257-G2259 VanDerWaalsContact C-N 3.29Å; G2257-G2259 PolarHBondContact O-N 3.06Å
2258T28.3Very low32.7Very low133.667 Ų133.667114.2 Ų114.282%0.8264%0.637SS**  trans-71.476.8-177.853.30000111.1K2260T2258-K2260 PolarHBondContact O-N 3.17Å
2259G29.9Very low33.6Very low62.6667 Ų62.6667114.6 Ų114.665%0.64663%0.63SS**  trans-73.7109155.300000107.9G2257 L2261G2257-G2259 VanDerWaalsContact C-N 3.29Å; G2257-G2259 PolarHBondContact O-N 3.06Å; G2259-L2261 VanDerWaalsContact C-N 3.27Å; G2259-L2261 PolarHBondContact O-N 3.17Å
2260K29.2Very low34.4Very low196.333 Ų196.333114.4 Ų114.485%0.85462%0.617SS**  trans-59.590.3172-77.9175.1175.8173.10108.6T2258 D2262T2258-K2260 PolarHBondContact O-N 3.17Å; K2260-D2262 VanDerWaalsContact C-N 3.3Å; K2260-D2262 PolarHBondContact O-N 3.26Å
2261L30.9Very low35.4Very low128.333 Ų128.333108.2 Ų108.267%0.67259%0.59SS**  trans-85.3105.9160.7-110.8139.4000106.1G2259 L2263 M2287G2259-L2261 VanDerWaalsContact C-N 3.27Å; G2259-L2261 PolarHBondContact O-N 3.17Å; L2261-L2263 HydrophobicContact CB-CD1 4.45Å; L2261-L2263 HydrophobicContact CD2-CD1 4.16Å; L2261-L2263 PolarHBondContact O-N 3.18Å; L2261-M2287 HydrophobicContact CD1-CE 3.59Å; L2261-M2287 HydrophobicContact CD2-CE 4.15Å
2262D35.5Very low36.4Very low117.667 Ų117.667103.7 Ų103.763%0.62957%0.566SS**  trans-32.977.5160.2-81-22.7000111.1K2260 N2264 N2265K2260-D2262 VanDerWaalsContact C-N 3.3Å; K2260-D2262 PolarHBondContact O-N 3.26Å; D2262-N2264 VanDerWaalsContact CG-ND2 3.26Å; D2262-N2264 PolarHBondContact O-N 3.12Å; D2262-N2264 PolarHBondContact OD1-ND2 2.89Å; D2262-N2265 PolarHBondContact O-N 2.98Å
2263L34.8Very low37.3Very low98.3333 Ų98.3333106.5 Ų106.552%0.51556%0.563SS.*  trans-66.740.2167.2-151.584.7000108.6L2261 N2265 K2269L2261-L2263 HydrophobicContact CB-CD1 4.45Å; L2261-L2263 HydrophobicContact CD2-CD1 4.16Å; L2261-L2263 PolarHBondContact O-N 3.18Å; L2263-N2265 VanDerWaalsContact C-N 3.29Å; L2263-K2269 HydrophobicContact CB-CD 3.99Å; L2263-K2269 HydrophobicContact CD2-CB 3.89Å; L2263-K2269 HydrophobicContact CD2-CD 3.84Å; L2263-K2269 HydrophobicContact CD2-CG 3.77Å; L2263-K2269 HydrophobicContact CG-CD 4.32Å; L2263-K2269 WeakPolarHBondContact O-CD 3.41Å; L2263-K2269 WeakPolarHBondContact O-CE 3.45Å; L2263-K2269 PolarHBondContact O-NZ 3.28Å
2264N37.3Very low38.2Very low96 Ų96104 Ų10451%0.51356%0.558SS.*  trans-94.51.6-176.6-81.1-16.9000113.4D2262 T2266D2262-N2264 VanDerWaalsContact CG-ND2 3.26Å; D2262-N2264 PolarHBondContact O-N 3.12Å; D2262-N2264 PolarHBondContact OD1-ND2 2.89Å; N2264-T2266 WeakPolarHBondContact O-CA 3.25Å; N2264-T2266 WeakPolarHBondContact O-CG2 3.47Å; N2264-T2266 PolarHBondContact O-N 3.34Å
2265N44Very low39.3Very low67 Ų67105.5 Ų105.536%0.35855%0.553SS.*SBendtrans-80.593.4166-84.5-50.8000111.6D2262 L2263 I2267 D2762 V2766D2262-N2265 PolarHBondContact O-N 2.98Å; L2263-N2265 VanDerWaalsContact C-N 3.29Å; N2265-I2267 VanDerWaalsContact C-N 3.28Å; N2265-I2267 PolarHBondContact O-N 2.81Å; N2265-D2762 PolarHBondContact ND2-OD1 3.39Å; N2265-D2762 PolarHBondContact OD1-OD1 3.37Å; N2265-V2766 HydrophobicContact CB-CG2 4.17Å; N2265-V2766 WeakPolarHBondContact ND2-CG2 3.47Å; N2265-V2766 WeakPolarHBondContact OD1-CG2 2.89Å
2266T48.9Very low40.4Very low55.3333 Ų55.333399.6 Ų99.634%0.33954%0.535SS..THydrogen-bonded Turntrans-29.156.7173.6610000117Y2200 N2264 I2268 K2269 R2270Y2200-T2266 PolarHBondContact OH-O 3.49Å; N2264-T2266 WeakPolarHBondContact O-CA 3.25Å; N2264-T2266 WeakPolarHBondContact O-CG2 3.47Å; N2264-T2266 PolarHBondContact O-N 3.34Å; T2266-I2268 CarbonylContact O-C 3.44Å; T2266-I2268 PolarHBondContact O-N 3.21Å; T2266-K2269 PolarHBondContact O-N 3.45Å; T2266-R2270 VanDerWaalsContact CG2-NH2 3.29Å; T2266-R2270 WeakPolarHBondContact O-CD 3.49Å; T2266-R2270 WeakPolarHBondContact O-CG 3.25Å; T2266-R2270 PolarHBondContact O-NE 3.19Å; T2266-R2270 PolarHBondContact O-NH1 3.37Å; T2266-R2270 PolarHBondContact OG1-NH1 2.97Å; T2266-R2270 PolarHBondContact OG1-NH2 2.9Å
2267I46.5Very low41.7Very low70 Ų7098.2 Ų98.236%0.35953%0.528SS..THydrogen-bonded Turntrans-93-53173.7-62.5-179.6000110.6Y2200 N2265 K2269 R2270 L2271Y2200-I2267 HydrophobicContact CD1-CB 4.2Å; Y2200-I2267 HydrophobicContact CD1-CD1 3.92Å; Y2200-I2267 HydrophobicContact CD1-CG1 4.09Å; Y2200-I2267 HydrophobicContact CD1-CG2 3.31Å; Y2200-I2267 HydrophobicContact CD2-CG2 4.05Å; Y2200-I2267 HydrophobicContact CE1-CB 3.81Å; Y2200-I2267 HydrophobicContact CE1-CD1 3.69Å; Y2200-I2267 VanDerWaalsContact CE1-CD1 3.41Å; Y2200-I2267 HydrophobicContact CE1-CG1 3.42Å; Y2200-I2267 HydrophobicContact CE1-CG2 3.21Å; Y2200-I2267 HydrophobicContact CE2-CB 4.47Å; Y2200-I2267 HydrophobicContact CE2-CG2 3.9Å; Y2200-I2267 HydrophobicContact CG-CG2 3.77Å; Y2200-I2267 WeakPolarHBondContact OH-CA 3.3Å; Y2200-I2267 WeakPolarHBondContact OH-CB 3.41Å; Y2200-I2267 WeakPolarHBondContact OH-CG2 3.39Å; N2265-I2267 VanDerWaalsContact C-N 3.28Å; N2265-I2267 PolarHBondContact O-N 2.81Å; I2267-K2269 PolarHBondContact O-N 3.11Å; I2267-R2270 PolarHBondContact O-N 3.06Å; I2267-R2270 VanDerWaalsContact O-N 3.17Å; I2267-L2271 HydrophobicContact CG2-CD1 4.14Å; I2267-L2271 HydrophobicContact CG2-CG 4.32Å; I2267-L2271 PolarHBondContact O-N 2.86Å
2268I47.7Very low42.9Very low33.3333 Ų33.333399.5 Ų99.517%0.17152%0.522CS..Hα-helixtrans-70.9-37.7179.4-48.2-175.5000111.1F2193 Q2197 Y2200 T2266 R2270 L2271 I2272 T2286F2193-I2268 HydrophobicContact CE2-CD1 4.34Å; F2193-I2268 HydrophobicContact CZ-CD1 3.96Å; Q2197-I2268 HydrophobicContact CB-CD1 4.07Å; Q2197-I2268 HydrophobicContact CG-CD1 3.92Å; Y2200-I2268 HydrophobicContact CD1-CD1 3.43Å; Y2200-I2268 VanDerWaalsContact CD1-CD1 3.43Å; Y2200-I2268 HydrophobicContact CD1-CG1 3.1Å; Y2200-I2268 HydrophobicContact CD2-CG1 4.11Å; Y2200-I2268 HydrophobicContact CE1-CD1 4.2Å; Y2200-I2268 HydrophobicContact CE1-CG1 3.35Å; Y2200-I2268 HydrophobicContact CE2-CG1 4.3Å; Y2200-I2268 HydrophobicContact CG-CD1 3.65Å; Y2200-I2268 HydrophobicContact CG-CG1 3.54Å; T2266-I2268 CarbonylContact O-C 3.44Å; T2266-I2268 PolarHBondContact O-N 3.21Å; I2268-R2270 PolarHBondContact O-N 3.08Å; I2268-R2270 VanDerWaalsContact O-N 3.14Å; I2268-L2271 CarbonylContact O-C 3.56Å; I2268-L2271 PolarHBondContact O-N 3.24Å; I2268-I2272 HydrophobicContact CB-CD1 3.89Å; I2268-I2272 HydrophobicContact CG2-CB 4.25Å; I2268-I2272 HydrophobicContact CG2-CD1 3.28Å; I2268-I2272 VanDerWaalsContact CG2-CD1 3.45Å; I2268-I2272 HydrophobicContact CG2-CG1 3.68Å; I2268-I2272 VanDerWaalsContact CG2-CG1 3.45Å; I2268-I2272 WeakPolarHBondContact O-CA 3.32Å; I2268-I2272 WeakPolarHBondContact O-CB 3.31Å; I2268-I2272 WeakPolarHBondContact O-CD1 3.38Å; I2268-I2272 WeakPolarHBondContact O-CG1 3.29Å; I2268-I2272 PolarHBondContact O-N 2.96Å; I2268-T2286 HydrophobicContact CD1-CG2 4.08Å; I2268-T2286 WeakPolarHBondContact CD1-OG1 3.25Å
2269K45.9Very low44.6Very low108.667 Ų108.66795.3 Ų95.347%0.47249%0.494SS..Hα-helixtrans-59.9-24.5173.9-133.7178.1-171176.20113.3L2263 T2266 I2267 K2273L2263-K2269 HydrophobicContact CB-CD 3.99Å; L2263-K2269 HydrophobicContact CD2-CB 3.89Å; L2263-K2269 HydrophobicContact CD2-CD 3.84Å; L2263-K2269 HydrophobicContact CD2-CG 3.77Å; L2263-K2269 HydrophobicContact CG-CD 4.32Å; L2263-K2269 WeakPolarHBondContact O-CD 3.41Å; L2263-K2269 WeakPolarHBondContact O-CE 3.45Å; L2263-K2269 PolarHBondContact O-NZ 3.28Å; T2266-K2269 PolarHBondContact O-N 3.45Å; I2267-K2269 PolarHBondContact O-N 3.11Å; K2269-K2273 WeakPolarHBondContact O-CB 3.33Å; K2269-K2273 PolarHBondContact O-N 2.94Å
2270R46.5Very low46.5Very low151 Ų15198.1 Ų98.157%0.5749%0.493SS*.Hα-helixtrans-83.4-31.3174.4-68.7-176.7-176.3137.8-1.9112.8T2266 I2267 I2268 S2274T2266-R2270 VanDerWaalsContact CG2-NH2 3.29Å; T2266-R2270 WeakPolarHBondContact O-CD 3.49Å; T2266-R2270 WeakPolarHBondContact O-CG 3.25Å; T2266-R2270 PolarHBondContact O-NE 3.19Å; T2266-R2270 PolarHBondContact O-NH1 3.37Å; T2266-R2270 PolarHBondContact OG1-NH1 2.97Å; T2266-R2270 PolarHBondContact OG1-NH2 2.9Å; I2267-R2270 PolarHBondContact O-N 3.06Å; I2267-R2270 VanDerWaalsContact O-N 3.17Å; I2268-R2270 PolarHBondContact O-N 3.08Å; I2268-R2270 VanDerWaalsContact O-N 3.14Å; R2270-S2274 PolarHBondContact O-N 3.31Å
2271L46.8Very low48.5Very low46.6667 Ų46.666789.1 Ų89.124%0.24446%0.455CS..Hα-helixtrans-83.2-35.1175.9-69.5172.6000112.8Y2200 F2207 I2267 I2268 K2273 S2274 K2275Y2200-L2271 HydrophobicContact CD2-CD1 3.81Å; Y2200-L2271 HydrophobicContact CD2-CD2 4.5Å; Y2200-L2271 HydrophobicContact CD2-CG 4.35Å; Y2200-L2271 HydrophobicContact CE2-CD1 3.87Å; Y2200-L2271 HydrophobicContact CE2-CD2 4.04Å; Y2200-L2271 HydrophobicContact CE2-CG 4.13Å; Y2200-L2271 WeakPolarHBondContact OH-CD1 3.44Å; F2207-L2271 HydrophobicContact CD1-CD2 4.32Å; F2207-L2271 HydrophobicContact CD2-CD2 4.19Å; F2207-L2271 HydrophobicContact CE1-CD2 3.92Å; F2207-L2271 HydrophobicContact CE2-CD2 3.9Å; F2207-L2271 HydrophobicContact CG-CD2 4.45Å; F2207-L2271 HydrophobicContact CZ-CD2 3.59Å; I2267-L2271 HydrophobicContact CG2-CD1 4.14Å; I2267-L2271 HydrophobicContact CG2-CG 4.32Å; I2267-L2271 PolarHBondContact O-N 2.86Å; I2268-L2271 CarbonylContact O-C 3.56Å; I2268-L2271 PolarHBondContact O-N 3.24Å; L2271-K2273 VanDerWaalsContact C-N 3.33Å; L2271-K2273 PolarHBondContact O-N 3.49Å; L2271-S2274 PolarHBondContact O-N 3.43Å; L2271-S2274 PolarHBondContact O-OG 2.76Å; L2271-K2275 PolarHBondContact O-N 3.34Å
2272I50.2Low50.5Low42 Ų4283.7 Ų83.722%0.21543%0.427CS..Hα-helixtrans-71.9-25.7-178-74.9179000112F2193 I2268 S2274 K2275 S2276 I2279 L2282 T2286F2193-I2272 HydrophobicContact CE2-CD1 4.03Å; I2268-I2272 HydrophobicContact CB-CD1 3.89Å; I2268-I2272 HydrophobicContact CG2-CB 4.25Å; I2268-I2272 HydrophobicContact CG2-CD1 3.28Å; I2268-I2272 VanDerWaalsContact CG2-CD1 3.45Å; I2268-I2272 HydrophobicContact CG2-CG1 3.68Å; I2268-I2272 VanDerWaalsContact CG2-CG1 3.45Å; I2268-I2272 WeakPolarHBondContact O-CA 3.32Å; I2268-I2272 WeakPolarHBondContact O-CB 3.31Å; I2268-I2272 WeakPolarHBondContact O-CD1 3.38Å; I2268-I2272 WeakPolarHBondContact O-CG1 3.29Å; I2268-I2272 PolarHBondContact O-N 2.96Å; I2272-S2274 PolarHBondContact O-N 3.11Å; I2272-K2275 CarbonylContact O-C 3.57Å; I2272-K2275 PolarHBondContact O-N 2.72Å; I2272-S2276 VanDerWaalsContact CG2-CB 3.47Å; I2272-S2276 WeakPolarHBondContact O-CA 3.47Å; I2272-S2276 WeakPolarHBondContact O-CB 3.18Å; I2272-S2276 PolarHBondContact O-N 3.29Å; I2272-S2276 PolarHBondContact O-OG 3.22Å; I2272-I2279 HydrophobicContact CG2-CD1 4.24Å; I2272-I2279 HydrophobicContact CG2-CG1 4.19Å; I2272-L2282 HydrophobicContact CD1-CB 4.43Å; I2272-L2282 HydrophobicContact CD1-CD1 4.36Å; I2272-L2282 HydrophobicContact CG1-CD1 4.25Å; I2272-L2282 HydrophobicContact CG2-CB 4.49Å; I2272-T2286 HydrophobicContact CD1-CG2 4.43Å; I2272-T2286 HydrophobicContact CG2-CG2 4.19Å
2273K47.3Very low52.3Low177.333 Ų177.33382 Ų8277%0.77142%0.416SS*.THydrogen-bonded Turntrans-64.9-5.7-174.8-153.4-179.7-179.5-172.90114.6K2269 L2271 K2275 S2276 D2277K2269-K2273 WeakPolarHBondContact O-CB 3.33Å; K2269-K2273 PolarHBondContact O-N 2.94Å; L2271-K2273 VanDerWaalsContact C-N 3.33Å; L2271-K2273 PolarHBondContact O-N 3.49Å; K2273-K2275 PolarHBondContact O-N 3.41Å; K2273-S2276 VanDerWaalsContact CA-OG 3.28Å; K2273-S2276 WeakPolarHBondContact CA-OG 3.42Å; K2273-D2277 VanDerWaalsContact O-CG 3.26Å
2274S45.2Very low54.3Low90.3333 Ų90.333380.7 Ų80.763%0.63241%0.407SS*.THydrogen-bonded Turntrans-105.1-9.6-17474.60000117.6R2270 L2271 I2272R2270-S2274 PolarHBondContact O-N 3.31Å; L2271-S2274 PolarHBondContact O-N 3.43Å; L2271-S2274 PolarHBondContact O-OG 2.76Å; I2272-S2274 PolarHBondContact O-N 3.11Å
2275K48.6Very low56.4Low141 Ų14176.1 Ų76.161%0.61338%0.382SS*.  trans-148.4101.7170.6-95.5157.4-176.1-175.60112.7L2271 I2272 K2273 D2277 N2278L2271-K2275 PolarHBondContact O-N 3.34Å; I2272-K2275 CarbonylContact O-C 3.57Å; I2272-K2275 PolarHBondContact O-N 2.72Å; K2273-K2275 PolarHBondContact O-N 3.41Å; K2275-D2277 VanDerWaalsContact C-N 3.31Å; K2275-D2277 PolarHBondContact O-N 2.99Å; K2275-N2278 WeakPolarHBondContact CB-ND2 3.09Å; K2275-N2278 PolarHBondContact O-N 3.04Å
2276S52.3Low58Low63.3333 Ų63.333375.2 Ų75.244%0.44338%0.379SS..THydrogen-bonded Turntrans-67.3-25.9-171.254.40000114.9I2272 K2273 N2278 I2279 Q2283I2272-S2276 VanDerWaalsContact CG2-CB 3.47Å; I2272-S2276 WeakPolarHBondContact O-CA 3.47Å; I2272-S2276 WeakPolarHBondContact O-CB 3.18Å; I2272-S2276 PolarHBondContact O-N 3.29Å; I2272-S2276 PolarHBondContact O-OG 3.22Å; K2273-S2276 VanDerWaalsContact CA-OG 3.28Å; K2273-S2276 WeakPolarHBondContact CA-OG 3.42Å; S2276-N2278 PolarHBondContact O-N 3.2Å; S2276-I2279 VanDerWaalsContact O-CD1 3.31Å; S2276-I2279 WeakPolarHBondContact O-CD1 3.48Å; S2276-I2279 VanDerWaalsContact O-CG1 3.27Å; S2276-I2279 WeakPolarHBondContact O-CG1 3.38Å; S2276-I2279 PolarHBondContact O-N 3.34Å; S2276-Q2283 PolarHBondContact O-NE2 3.38Å
2277D51.3Low59.4Low129.667 Ų129.66778.3 Ų78.369%0.69339%0.391SS*.THydrogen-bonded Turntrans-84.2-14.6-174.7-56.7-10.3000111.9K2273 K2275 I2279K2273-D2277 VanDerWaalsContact O-CG 3.26Å; K2275-D2277 VanDerWaalsContact C-N 3.31Å; K2275-D2277 PolarHBondContact O-N 2.99Å; D2277-I2279 PolarHBondContact O-N 3.46Å; D2277-I2279 VanDerWaalsContact O-N 3.12Å
2278N54.2Low61.2Low81.3333 Ų81.333376.3 Ų76.344%0.43538%0.381SS..SBendtrans-87.84.6178-65.4-30.1000114R2165 K2275 S2276R2165-N2278 PolarHBondContact NH1-OD1 3.12Å; R2165-N2278 VanDerWaalsContact NH1-OD1 3.15Å; K2275-N2278 WeakPolarHBondContact CB-ND2 3.09Å; K2275-N2278 PolarHBondContact O-N 3.04Å; S2276-N2278 PolarHBondContact O-N 3.2Å
2279I63.3Low62.9Low45 Ų4575.5 Ų75.523%0.23138%0.378CS..Hα-helixtrans-102.8-12.1-165.8-61.8-180000111.8I2161 I2272 S2276 D2277 S2281 L2282 Q2283I2161-I2279 HydrophobicContact CG2-CD1 4.5Å; I2272-I2279 HydrophobicContact CG2-CD1 4.24Å; I2272-I2279 HydrophobicContact CG2-CG1 4.19Å; S2276-I2279 VanDerWaalsContact O-CD1 3.31Å; S2276-I2279 WeakPolarHBondContact O-CD1 3.48Å; S2276-I2279 VanDerWaalsContact O-CG1 3.27Å; S2276-I2279 WeakPolarHBondContact O-CG1 3.38Å; S2276-I2279 PolarHBondContact O-N 3.34Å; D2277-I2279 PolarHBondContact O-N 3.46Å; D2277-I2279 VanDerWaalsContact O-N 3.12Å; I2279-S2281 VanDerWaalsContact C-N 3.27Å; I2279-S2281 VanDerWaalsContact CG2-OG 3.26Å; I2279-S2281 WeakPolarHBondContact CG2-OG 3.35Å; I2279-S2281 PolarHBondContact O-N 3Å; I2279-L2282 HydrophobicContact CB-CD1 4.23Å; I2279-L2282 HydrophobicContact CB-CG 4.46Å; I2279-L2282 HydrophobicContact CD1-CD1 4.13Å; I2279-L2282 HydrophobicContact CG2-CB 4.37Å; I2279-L2282 HydrophobicContact CG2-CD1 4.17Å; I2279-L2282 HydrophobicContact CG2-CG 4Å; I2279-L2282 PolarHBondContact O-N 3.37Å; I2279-Q2283 HydrophobicContact CG2-CG 3.82Å; I2279-Q2283 VanDerWaalsContact CG2-NE2 3.3Å; I2279-Q2283 VanDerWaalsContact O-CB 3.24Å; I2279-Q2283 WeakPolarHBondContact O-CB 3.45Å; I2279-Q2283 WeakPolarHBondContact O-CG 3.34Å; I2279-Q2283 PolarHBondContact O-N 3.34Å
2280L70.2Confident64.8Low120.667 Ų120.66770.7 Ų70.763%0.63236%0.359SS*.Hα-helixtrans-60.6-44.1-174.7-67.6172000113.3L2282 Q2283 H2284L2280-L2282 VanDerWaalsContact C-N 3.35Å; L2280-L2282 PolarHBondContact O-N 3.2Å; L2280-Q2283 WeakPolarHBondContact O-CB 3.49Å; L2280-Q2283 PolarHBondContact O-N 2.95Å; L2280-H2284 WeakPolarHBondContact O-CB 3.39Å; L2280-H2284 PolarHBondContact O-N 3.05Å
2281S72Confident66.7Low8 Ų865.4 Ų65.46%0.05634%0.34CS..Hα-helixtrans-63.3-40.5-17963.20000112.7H2168 I2279 H2284 Y2285H2168-S2281 VanDerWaalsContact CB-CB 3.5Å; H2168-S2281 VanDerWaalsContact CD2-CA 3.49Å; H2168-S2281 WeakPolarHBondContact CD2-CA 3.22Å; H2168-S2281 WeakPolarHBondContact CD2-CB 3.37Å; H2168-S2281 VanDerWaalsContact CG-CB 3.48Å; I2279-S2281 VanDerWaalsContact C-N 3.27Å; I2279-S2281 VanDerWaalsContact CG2-OG 3.26Å; I2279-S2281 WeakPolarHBondContact CG2-OG 3.35Å; I2279-S2281 PolarHBondContact O-N 3Å; S2281-H2284 PolarHBondContact O-N 3.28Å; S2281-Y2285 WeakPolarHBondContact O-CD2 3.36Å; S2281-Y2285 PolarHBondContact O-N 3.35Å
2282L72.3Confident68.7Low15.6667 Ų15.666764.4 Ų64.48%0.08234%0.335CS..Hα-helixtrans-71.3-38.2177.8-69.4175.6000111.2I2161 I2164 F2193 I2272 I2279 L2280 H2284 Y2285 T2286I2161-L2282 HydrophobicContact CG2-CD1 4.29Å; I2164-L2282 HydrophobicContact CD1-CD2 4.48Å; I2164-L2282 HydrophobicContact CG2-CD2 4.23Å; F2193-L2282 HydrophobicContact CD2-CD2 4.16Å; F2193-L2282 HydrophobicContact CE2-CD2 4.22Å; I2272-L2282 HydrophobicContact CD1-CB 4.43Å; I2272-L2282 HydrophobicContact CD1-CD1 4.36Å; I2272-L2282 HydrophobicContact CG1-CD1 4.25Å; I2272-L2282 HydrophobicContact CG2-CB 4.49Å; I2279-L2282 HydrophobicContact CB-CD1 4.23Å; I2279-L2282 HydrophobicContact CB-CG 4.46Å; I2279-L2282 HydrophobicContact CD1-CD1 4.13Å; I2279-L2282 HydrophobicContact CG2-CB 4.37Å; I2279-L2282 HydrophobicContact CG2-CD1 4.17Å; I2279-L2282 HydrophobicContact CG2-CG 4Å; I2279-L2282 PolarHBondContact O-N 3.37Å; L2280-L2282 VanDerWaalsContact C-N 3.35Å; L2280-L2282 PolarHBondContact O-N 3.2Å; L2282-H2284 VanDerWaalsContact C-N 3.35Å; L2282-H2284 PolarHBondContact O-N 2.87Å; L2282-Y2285 PolarHBondContact O-N 3.42Å; L2282-T2286 VanDerWaalsContact O-CB 3.25Å; L2282-T2286 WeakPolarHBondContact O-CB 3.34Å; L2282-T2286 WeakPolarHBondContact O-CG2 3.17Å; L2282-T2286 PolarHBondContact O-N 3.28Å; L2282-T2286 PolarHBondContact O-OG1 3.19Å
2283Q72Confident70.5Confident81.6667 Ų81.666764.5 Ų64.538%0.38233%0.334SS..Hα-helixtrans-60.8-45.5173.5-74.6-179.8-1800111.3S2276 I2279 L2280 Y2285 T2286 M2287S2276-Q2283 PolarHBondContact O-NE2 3.38Å; I2279-Q2283 HydrophobicContact CG2-CG 3.82Å; I2279-Q2283 VanDerWaalsContact CG2-NE2 3.3Å; I2279-Q2283 VanDerWaalsContact O-CB 3.24Å; I2279-Q2283 WeakPolarHBondContact O-CB 3.45Å; I2279-Q2283 WeakPolarHBondContact O-CG 3.34Å; I2279-Q2283 PolarHBondContact O-N 3.34Å; L2280-Q2283 WeakPolarHBondContact O-CB 3.49Å; L2280-Q2283 PolarHBondContact O-N 2.95Å; Q2283-Y2285 PolarHBondContact O-N 2.96Å; Q2283-T2286 WeakPolarHBondContact CA-OG1 3.45Å; Q2283-T2286 PolarHBondContact O-N 3.12Å; Q2283-T2286 PolarHBondContact O-OG1 3.26Å; Q2283-M2287 VanDerWaalsContact O-CG 3.31Å; Q2283-M2287 WeakPolarHBondContact O-CG 3.39Å; Q2283-M2287 PolarHBondContact O-N 3.11Å
2284H77Confident72.4Confident70.6667 Ų70.666757.5 Ų57.533%0.32731%0.305SS..Hα-helixtrans-57.8-49.9177.9-17761.8000112.5H2168 H2186 L2280 S2281 L2282 M2287 N2288H2168-H2284 AromaticContact CD2-CD2 3.74Å; H2168-H2284 AromaticContact CE1-CD2 3.63Å; H2168-H2284 AromaticContact CE1-CG 3.94Å; H2168-H2284 AromaticContact ND1-CD2 3.91Å; H2168-H2284 AromaticContact NE2-CD2 3.4Å; H2168-H2284 PolarHBondContact NE2-CD2 3.15Å; H2168-H2284 AromaticContact NE2-CG 3.73Å; H2186-H2284 AromaticContact CD2-NE2 3.84Å; H2186-H2284 AromaticContact NE2-CD2 3.74Å; H2186-H2284 AromaticContact NE2-NE2 3.21Å; H2186-H2284 PolarHBondContact NE2-NE2 3.27Å; H2186-H2284 VanDerWaalsContact NE2-NE2 3.19Å; L2280-H2284 WeakPolarHBondContact O-CB 3.39Å; L2280-H2284 PolarHBondContact O-N 3.05Å; S2281-H2284 PolarHBondContact O-N 3.28Å; L2282-H2284 VanDerWaalsContact C-N 3.35Å; L2282-H2284 PolarHBondContact O-N 2.87Å; H2284-M2287 PolarHBondContact O-N 2.95Å; H2284-N2288 PolarHBondContact CE1-ND2 3.39Å; H2284-N2288 VanDerWaalsContact CE1-ND2 3.28Å; H2284-N2288 PolarHBondContact ND1-ND2 3.16Å; H2284-N2288 VanDerWaalsContact ND1-ND2 3.19Å; H2284-N2288 WeakPolarHBondContact O-CB 3.46Å; H2284-N2288 VanDerWaalsContact O-CG 3.26Å; H2284-N2288 PolarHBondContact O-N 3.14Å; H2284-N2288 PolarHBondContact O-ND2 3.38Å
2285Y82.8Confident74.3Confident0 Ų056.3 Ų56.30%029%0.294CS..Hα-helixtrans-69-34.6177.9-64.6-54.9000112.4I2164 H2168 H2186 H2190 F2193 S2281 L2282 Q2283 M2287 N2288 T2289I2164-Y2285 HydrophobicContact CG2-CD2 3.58Å; I2164-Y2285 HydrophobicContact CG2-CE2 3.58Å; H2168-Y2285 HydrophobicContact CB-CE2 4.06Å; H2168-Y2285 AromaticContact CD2-CE2 3.87Å; H2168-Y2285 AromaticContact CD2-CZ 3.9Å; H2186-Y2285 AromaticContact CD2-CE1 3.97Å; H2186-Y2285 AromaticContact NE2-CE1 3.76Å; H2190-Y2285 HydrophobicContact CB-CD1 3.82Å; H2190-Y2285 HydrophobicContact CB-CE1 3.82Å; H2190-Y2285 AromaticContact CD2-CD1 3.88Å; H2190-Y2285 AromaticContact CG-CD1 3.83Å; H2190-Y2285 AromaticContact ND1-CD1 3.56Å; F2193-Y2285 HydrophobicContact CB-CD2 4.5Å; F2193-Y2285 HydrophobicContact CB-CG 4.34Å; F2193-Y2285 HydrophobicContact CG-CG 4.44Å; S2281-Y2285 WeakPolarHBondContact O-CD2 3.36Å; S2281-Y2285 PolarHBondContact O-N 3.35Å; L2282-Y2285 PolarHBondContact O-N 3.42Å; Q2283-Y2285 PolarHBondContact O-N 2.96Å; Y2285-M2287 PolarHBondContact O-N 3.23Å; Y2285-N2288 PolarHBondContact O-N 3.14Å; Y2285-T2289 WeakPolarHBondContact O-CB 3.39Å; Y2285-T2289 WeakPolarHBondContact O-CG2 3.23Å; Y2285-T2289 PolarHBondContact O-N 3.15Å; Y2285-T2289 VanDerWaalsContact O-N 3.13Å; Y2285-T2289 PolarHBondContact O-OG1 3.24Å
2286T77.9Confident75.9Confident47 Ų4751.5 Ų51.529%0.28827%0.272SS..Hα-helixtrans-64-43.3176.6-27.30000112.2F2193 I2268 I2272 L2282 Q2283 N2288 T2289F2193-T2286 HydrophobicContact CE1-CG2 4.3Å; F2193-T2286 HydrophobicContact CE2-CG2 4.02Å; F2193-T2286 HydrophobicContact CZ-CG2 3.43Å; F2193-T2286 VanDerWaalsContact CZ-CG2 3.43Å; F2193-T2286 WeakPolarHBondContact CZ-OG1 3.41Å; I2268-T2286 HydrophobicContact CD1-CG2 4.08Å; I2268-T2286 WeakPolarHBondContact CD1-OG1 3.25Å; I2272-T2286 HydrophobicContact CD1-CG2 4.43Å; I2272-T2286 HydrophobicContact CG2-CG2 4.19Å; L2282-T2286 VanDerWaalsContact O-CB 3.25Å; L2282-T2286 WeakPolarHBondContact O-CB 3.34Å; L2282-T2286 WeakPolarHBondContact O-CG2 3.17Å; L2282-T2286 PolarHBondContact O-N 3.28Å; L2282-T2286 PolarHBondContact O-OG1 3.19Å; Q2283-T2286 WeakPolarHBondContact CA-OG1 3.45Å; Q2283-T2286 PolarHBondContact O-N 3.12Å; Q2283-T2286 PolarHBondContact O-OG1 3.26Å; T2286-N2288 VanDerWaalsContact C-N 3.3Å; T2286-N2288 PolarHBondContact O-N 2.92Å; T2286-T2289 PolarHBondContact O-N 3.14Å; T2286-T2289 PolarHBondContact O-OG1 2.95Å; T2286-T2289 VanDerWaalsContact O-OG1 3.13Å
2287M77.9Confident77.2Confident121.333 Ų121.33352.5 Ų52.560%0.59828%0.284SS*.Hα-helixtrans-67.5-28.1179-68.5-88.6177.600112.7L2261 Q2283 H2284 Y2285L2261-M2287 HydrophobicContact CD1-CE 3.59Å; L2261-M2287 HydrophobicContact CD2-CE 4.15Å; Q2283-M2287 VanDerWaalsContact O-CG 3.31Å; Q2283-M2287 WeakPolarHBondContact O-CG 3.39Å; Q2283-M2287 PolarHBondContact O-N 3.11Å; H2284-M2287 PolarHBondContact O-N 2.95Å; Y2285-M2287 PolarHBondContact O-N 3.23Å
2288N83Confident78.5Confident27 Ų2750.7 Ų50.714%0.14427%0.274CS..THydrogen-bonded Turntrans-98.47.4-177.4-62-24.4000113.3H2190 H2284 Y2285 T2286 I2308 H2313H2190-N2288 PolarHBondContact CE1-O 3.17Å; H2190-N2288 VanDerWaalsContact CE1-O 3.28Å; H2190-N2288 PolarHBondContact NE2-O 3.07Å; H2284-N2288 PolarHBondContact CE1-ND2 3.39Å; H2284-N2288 VanDerWaalsContact CE1-ND2 3.28Å; H2284-N2288 PolarHBondContact ND1-ND2 3.16Å; H2284-N2288 VanDerWaalsContact ND1-ND2 3.19Å; H2284-N2288 WeakPolarHBondContact O-CB 3.46Å; H2284-N2288 VanDerWaalsContact O-CG 3.26Å; H2284-N2288 PolarHBondContact O-N 3.14Å; H2284-N2288 PolarHBondContact O-ND2 3.38Å; Y2285-N2288 PolarHBondContact O-N 3.14Å; T2286-N2288 VanDerWaalsContact C-N 3.3Å; T2286-N2288 PolarHBondContact O-N 2.92Å; N2288-I2308 WeakPolarHBondContact O-CB 3.3Å; N2288-I2308 WeakPolarHBondContact O-CG1 3.04Å; N2288-I2308 PolarHBondContact O-N 3.13Å; N2288-H2313 PolarHBondContact OD1-CE1 3.02Å; N2288-H2313 VanDerWaalsContact OD1-CE1 3.3Å; N2288-H2313 PolarHBondContact OD1-NE2 3Å
2289T84Confident79.7Confident17.3333 Ų17.333353.2 Ų53.211%0.10629%0.287CS..EExtended strand (participates in β ladder)trans-110.5129.3176.4-26.60000110.6H2190 F2193 I2194 Y2285 T2286 V2305H2190-T2289 PolarHBondContact CD2-OG1 3.09Å; H2190-T2289 VanDerWaalsContact CE1-CG2 3.46Å; H2190-T2289 WeakPolarHBondContact CE1-CG2 3.39Å; H2190-T2289 WeakPolarHBondContact NE2-CG2 3.32Å; H2190-T2289 PolarHBondContact NE2-OG1 3.26Å; F2193-T2289 HydrophobicContact CD1-CG2 3.6Å; F2193-T2289 HydrophobicContact CE1-CG2 4.06Å; F2193-T2289 WeakPolarHBondContact CE1-OG1 3.25Å; I2194-T2289 HydrophobicContact CG1-CG2 4.29Å; Y2285-T2289 WeakPolarHBondContact O-CB 3.39Å; Y2285-T2289 WeakPolarHBondContact O-CG2 3.23Å; Y2285-T2289 PolarHBondContact O-N 3.15Å; Y2285-T2289 VanDerWaalsContact O-N 3.13Å; Y2285-T2289 PolarHBondContact O-OG1 3.24Å; T2286-T2289 PolarHBondContact O-N 3.14Å; T2286-T2289 PolarHBondContact O-OG1 2.95Å; T2286-T2289 VanDerWaalsContact O-OG1 3.13Å; T2289-V2305 HydrophobicContact CG2-CG1 3.68Å; T2289-V2305 VanDerWaalsContact CG2-CG1 3.4Å
2290A86.1Confident80.6Confident8 Ų858.6 Ų58.67%0.06631%0.305CS..EExtended strand (participates in β ladder)trans-113.1160.9170.300000110.3V2305 Y2306 I2308 H2772A2290-V2305 WeakPolarHBondContact O-CA 3.42Å; A2290-V2305 WeakPolarHBondContact O-CG1 3.34Å; A2290-Y2306 HydrophobicContact CB-CD1 4.42Å; A2290-Y2306 HydrophobicContact CB-CE1 3.71Å; A2290-Y2306 HydrophobicContact CB-CE2 4.04Å; A2290-Y2306 VanDerWaalsContact CB-CZ 3.47Å; A2290-Y2306 WeakPolarHBondContact CB-OH 3.36Å; A2290-Y2306 PolarHBondContact N-O 2.98Å; A2290-Y2306 PolarHBondContact O-N 3.01Å; A2290-I2308 HydrophobicContact CB-CD1 3.89Å; A2290-I2308 HydrophobicContact CB-CG1 3.6Å; A2290-H2772 HydrophobicContact CB-CB 4.07Å
2291Q87Confident81.2Confident38.6667 Ų38.666756.3 Ų56.318%0.18129%0.293CS..EExtended strand (participates in β ladder)trans-135.3144.5173.857.1159.942.800110.4R2303 I2304 V2305 V2766 D2767 H2772Q2291-R2303 VanDerWaalsContact NE2-NH1 3.13Å; Q2291-I2304 CarbonylContact C-O 3.58Å; Q2291-I2304 VanDerWaalsContact CA-O 3.3Å; Q2291-I2304 WeakPolarHBondContact CA-O 3.36Å; Q2291-V2305 HydrophobicContact CB-CB 4.49Å; Q2291-V2305 HydrophobicContact CB-CG1 4.5Å; Q2291-V2305 HydrophobicContact CB-CG2 4.16Å; Q2291-V2766 VanDerWaalsContact NE2-C 3.28Å; Q2291-V2766 VanDerWaalsContact NE2-CG1 3.34Å; Q2291-V2766 PolarHBondContact NE2-O 3.02Å; Q2291-D2767 PolarHBondContact NE2-OD1 2.97Å; Q2291-H2772 WeakPolarHBondContact O-CB 3.46Å; Q2291-H2772 PolarHBondContact O-ND1 3.49Å
2292I88.3Confident81.7Confident26.3333 Ų26.333356.6 Ų56.614%0.13529%0.293CS..EExtended strand (participates in β ladder)trans-133.5158.1176.154.9167.7000110.2I2294 R2303 I2304 Y2306 H2772 Y2773 F2776 W2806I2292-I2294 HydrophobicContact CD1-CD1 4.18Å; I2292-I2294 HydrophobicContact CD1-CG1 4.3Å; I2292-I2294 HydrophobicContact CD1-CG2 3.91Å; I2292-I2294 HydrophobicContact CG1-CG2 4.25Å; I2292-R2303 CarbonylContact O-C 3.56Å; I2292-R2303 VanDerWaalsContact O-CA 3.27Å; I2292-R2303 WeakPolarHBondContact O-CA 3.37Å; I2292-I2304 HydrophobicContact CD1-CB 4.42Å; I2292-I2304 HydrophobicContact CG1-CB 4.02Å; I2292-I2304 PolarHBondContact N-O 3.15Å; I2292-I2304 PolarHBondContact O-N 3.21Å; I2292-Y2306 HydrophobicContact CB-CE1 4.27Å; I2292-Y2306 HydrophobicContact CG1-CD1 4.08Å; I2292-Y2306 HydrophobicContact CG1-CE1 4.21Å; I2292-Y2306 HydrophobicContact CG2-CE1 4.05Å; I2292-H2772 HydrophobicContact CG2-CB 3.61Å; I2292-H2772 WeakPolarHBondContact CG2-O 3.35Å; I2292-Y2773 HydrophobicContact CB-CD1 4.47Å; I2292-Y2773 HydrophobicContact CB-CE1 4.02Å; I2292-Y2773 HydrophobicContact CB-CE2 4.19Å; I2292-Y2773 HydrophobicContact CG2-CD1 4.2Å; I2292-Y2773 HydrophobicContact CG2-CD2 3.9Å; I2292-Y2773 HydrophobicContact CG2-CE1 4.18Å; I2292-Y2773 HydrophobicContact CG2-CE2 3.85Å; I2292-Y2773 HydrophobicContact CG2-CG 4.06Å; I2292-F2776 HydrophobicContact CD1-CB 3.93Å; I2292-F2776 HydrophobicContact CD1-CD1 3.45Å; I2292-F2776 VanDerWaalsContact CD1-CD1 3.45Å; I2292-F2776 HydrophobicContact CD1-CD2 3.87Å; I2292-F2776 HydrophobicContact CD1-CE1 3.84Å; I2292-F2776 HydrophobicContact CD1-CE2 4.23Å; I2292-F2776 HydrophobicContact CD1-CG 3.46Å; I2292-F2776 VanDerWaalsContact CD1-CG 3.46Å; I2292-F2776 HydrophobicContact CD1-CZ 4.21Å; I2292-W2806 HydrophobicContact CD1-CZ3 4.33Å
2293E87.3Confident82.2Confident44 Ų4458.6 Ų58.621%0.20630%0.3CS..EExtended strand (participates in β ladder)trans-108.3130.6171.4-62.6-170.4162.900109.8I2301 E2302 R2303 H2768 Y2773 P2808 M2813E2293-I2301 HydrophobicContact CB-CG2 3.98Å; E2293-I2301 HydrophobicContact CG-CG2 4.18Å; E2293-E2302 CarbonylContact C-O 3.59Å; E2293-E2302 WeakPolarHBondContact CA-O 3.48Å; E2293-R2303 HydrophobicContact CG-CG 3.82Å; E2293-R2303 IonicContact OE1-CZ 3.4Å; E2293-R2303 IonicContact OE1-NE 2.95Å; E2293-R2303 PolarHBondContact OE1-NE 3.21Å; E2293-R2303 IonicContact OE1-NH2 3.43Å; E2293-R2303 PolarHBondContact OE1-NH2 3.31Å; E2293-H2768 IonicContact OE2-CD2 2.89Å; E2293-H2768 IonicContact OE2-CE1 3.35Å; E2293-H2768 IonicContact OE2-NE2 2.96Å; E2293-H2768 PolarHBondContact OE2-NE2 3.23Å; E2293-Y2773 PolarHBondContact N-OH 3.49Å; E2293-Y2773 VanDerWaalsContact N-OH 3.12Å; E2293-Y2773 WeakPolarHBondContact O-CE1 3.23Å; E2293-Y2773 PolarHBondContact O-OH 3.07Å; E2293-P2808 HydrophobicContact CB-CG 4.23Å; E2293-P2808 VanDerWaalsContact O-CD 3.22Å; E2293-P2808 WeakPolarHBondContact O-CD 3.34Å; E2293-M2813 WeakPolarHBondContact OE1-CB 3.4Å; E2293-M2813 PolarHBondContact OE2-N 3.23Å
2294I87.7Confident82.8Confident30 Ų3056 Ų5615%0.15429%0.288CS..EExtended strand (participates in β ladder)trans-120.7146.4178.632.6161.4000109.9I2292 R2296 I2301 E2302 I2304 L2791 I2795 W2806I2292-I2294 HydrophobicContact CD1-CD1 4.18Å; I2292-I2294 HydrophobicContact CD1-CG1 4.3Å; I2292-I2294 HydrophobicContact CD1-CG2 3.91Å; I2292-I2294 HydrophobicContact CG1-CG2 4.25Å; I2294-R2296 HydrophobicContact CD1-CG 4.35Å; I2294-I2301 CarbonylContact O-C 3.49Å; I2294-I2301 VanDerWaalsContact O-CA 3.29Å; I2294-I2301 WeakPolarHBondContact O-CA 3.36Å; I2294-E2302 HydrophobicContact CD1-CB 4.43Å; I2294-E2302 HydrophobicContact CG1-CB 4.18Å; I2294-E2302 WeakPolarHBondContact CG1-O 3.4Å; I2294-E2302 PolarHBondContact N-O 3.13Å; I2294-E2302 PolarHBondContact O-N 3.34Å; I2294-I2304 HydrophobicContact CD1-CD1 3.56Å; I2294-I2304 HydrophobicContact CD1-CG1 4.24Å; I2294-I2304 HydrophobicContact CG1-CD1 3.99Å; I2294-I2304 HydrophobicContact CG1-CG1 4.26Å; I2294-I2304 HydrophobicContact CG2-CD1 4.21Å; I2294-L2791 HydrophobicContact CD1-CB 4.5Å; I2294-L2791 HydrophobicContact CD1-CD1 4.43Å; I2294-L2791 HydrophobicContact CD1-CD2 4.26Å; I2294-I2795 HydrophobicContact CB-CD1 4.37Å; I2294-I2795 HydrophobicContact CD1-CD1 4.1Å; I2294-I2795 HydrophobicContact CG2-CD1 3.89Å; I2294-W2806 CarbonylContact C-O 3.6Å; I2294-W2806 WeakPolarHBondContact CA-O 3.32Å; I2294-W2806 HydrophobicContact CB-CE3 4.35Å; I2294-W2806 HydrophobicContact CG2-CE3 3.82Å; I2294-W2806 HydrophobicContact CG2-CZ3 3.92Å
2295V85.2Confident83.3Confident65.3333 Ų65.333353.3 Ų53.340%0.39628%0.276SS..EExtended strand (participates in β ladder)trans-97.4120.4171.3-177.10000108I2301 Y2794 K2805 W2806 P2808 R2811V2295-I2301 HydrophobicContact CG2-CG1 4.39Å; V2295-Y2794 WeakPolarHBondContact O-CE1 3.32Å; V2295-K2805 WeakPolarHBondContact CB-O 3.43Å; V2295-W2806 PolarHBondContact N-O 3.42Å; V2295-P2808 HydrophobicContact CG2-CB 4.26Å; V2295-R2811 VanDerWaalsContact CG1-NH2 3.25Å; V2295-R2811 VanDerWaalsContact CG2-NH2 3.28Å
2296R82Confident83.5Confident41 Ų4154.9 Ų54.916%0.15528%0.282CS..  trans-80.9168.6175.4-77.8-178.276.5-170.8-6.9111.9P2082 I2294 D2298 N2299 R2300 E2302 L2791P2082-R2296 VanDerWaalsContact CG-NH1 3.25Å; I2294-R2296 HydrophobicContact CD1-CG 4.35Å; R2296-D2298 WeakPolarHBondContact CB-OD1 3.36Å; R2296-D2298 IonicContact CZ-OD2 2.93Å; R2296-D2298 IonicContact NE-OD2 2.84Å; R2296-D2298 PolarHBondContact NE-OD2 3.15Å; R2296-D2298 IonicContact NH2-OD2 3.31Å; R2296-D2298 PolarHBondContact NH2-OD2 3.26Å; R2296-D2298 PolarHBondContact O-N 2.98Å; R2296-D2298 VanDerWaalsContact O-N 3.12Å; R2296-N2299 WeakPolarHBondContact O-CA 3.31Å; R2296-N2299 PolarHBondContact O-N 2.86Å; R2296-R2300 PolarHBondContact N-O 3.19Å; R2296-E2302 WeakPolarHBondContact CD-OE2 3.39Å; R2296-E2302 HydrophobicContact CG-CB 4.47Å; R2296-E2302 IonicContact CZ-OE1 2.7Å; R2296-E2302 IonicContact CZ-OE2 3.43Å; R2296-E2302 IonicContact NE-OE2 3.06Å; R2296-E2302 PolarHBondContact NE-OE2 3.43Å; R2296-E2302 IonicContact NH1-OE2 3.8Å; R2296-E2302 PolarHBondContact NH1-OE2 3.3Å; R2296-E2302 VanDerWaalsContact NH2-CD 3.3Å; R2296-E2302 IonicContact NH2-OE1 2.81Å; R2296-E2302 PolarHBondContact NH2-OE1 2.94Å; R2296-E2302 IonicContact NH2-OE2 3.19Å; R2296-E2302 PolarHBondContact NH2-OE2 3.35Å; R2296-L2791 HydrophobicContact CG-CD2 3.76Å
2297A78.8Confident84Confident84 Ų8454.9 Ų54.969%0.69428%0.284SS*.THydrogen-bonded Turntrans-55.6-27.5175.900000113.5N2299 Y2794A2297-N2299 PolarHBondContact O-N 3.06Å; A2297-Y2794 HydrophobicContact CB-CE2 3.93Å; A2297-Y2794 PolarHBondContact N-OH 3.2Å
2298D79.4Confident84.4Confident92.6667 Ų92.666750.6 Ų50.650%0.49626%0.262SS..THydrogen-bonded Turntrans-82.912.8176.9-11.4-37.3000113.3R2296 R2300R2296-D2298 WeakPolarHBondContact CB-OD1 3.36Å; R2296-D2298 IonicContact CZ-OD2 2.93Å; R2296-D2298 IonicContact NE-OD2 2.84Å; R2296-D2298 PolarHBondContact NE-OD2 3.15Å; R2296-D2298 IonicContact NH2-OD2 3.31Å; R2296-D2298 PolarHBondContact NH2-OD2 3.26Å; R2296-D2298 PolarHBondContact O-N 2.98Å; R2296-D2298 VanDerWaalsContact O-N 3.12Å; D2298-R2300 HydrophobicContact CB-CG 4.49Å; D2298-R2300 PolarHBondContact O-N 3.13Å; D2298-R2300 VanDerWaalsContact O-N 3.14Å; D2298-R2300 PolarHBondContact OD1-N 3Å; D2298-R2300 WeakPolarHBondContact OD2-CD 3.28Å; D2298-R2300 WeakPolarHBondContact OD2-CG 3.4Å; D2298-R2300 IonicContact OD2-NE 2.92Å; D2298-R2300 IonicContact OD2-NH1 2.7Å
2299N80.5Confident84.5Confident132 Ų13251 Ų5171%0.70627%0.267SS*.SBendtrans57.513.6-174-65.9-30.5000115.3R2296 A2297 R2811R2296-N2299 WeakPolarHBondContact O-CA 3.31Å; R2296-N2299 PolarHBondContact O-N 2.86Å; A2297-N2299 PolarHBondContact O-N 3.06Å; N2299-R2811 PolarHBondContact O-NH1 3.41Å; N2299-R2811 PolarHBondContact O-NH2 3.42Å
2300R81Confident84.3Confident160 Ų16057.9 Ų57.960%0.60430%0.295SS*.  trans-84.1143.2173.7-65.2-175.3179174.4-2.6110.8R2296 D2298 R2811R2296-R2300 PolarHBondContact N-O 3.19Å; D2298-R2300 HydrophobicContact CB-CG 4.49Å; D2298-R2300 PolarHBondContact O-N 3.13Å; D2298-R2300 VanDerWaalsContact O-N 3.14Å; D2298-R2300 PolarHBondContact OD1-N 3Å; D2298-R2300 WeakPolarHBondContact OD2-CD 3.28Å; D2298-R2300 WeakPolarHBondContact OD2-CG 3.4Å; D2298-R2300 IonicContact OD2-NE 2.92Å; D2298-R2300 IonicContact OD2-NH1 2.7Å; R2300-R2811 PolarHBondContact O-NH2 2.75Å
2301I83.2Confident83.9Confident72.6667 Ų72.666758.9 Ų58.937%0.37330%0.299SS..EExtended strand (participates in β ladder)trans-87.7122.5175.3-55.4173.7000108.5H2143 E2293 I2294 V2295 R2811 M2813 D2816H2143-I2301 PolarHBondContact CE1-O 3.39Å; E2293-I2301 HydrophobicContact CB-CG2 3.98Å; E2293-I2301 HydrophobicContact CG-CG2 4.18Å; I2294-I2301 CarbonylContact O-C 3.49Å; I2294-I2301 VanDerWaalsContact O-CA 3.29Å; I2294-I2301 WeakPolarHBondContact O-CA 3.36Å; V2295-I2301 HydrophobicContact CG2-CG1 4.39Å; I2301-R2811 HydrophobicContact CD1-CB 4.17Å; I2301-R2811 HydrophobicContact CD1-CG 3.74Å; I2301-R2811 HydrophobicContact CG1-CG 4.45Å; I2301-R2811 VanDerWaalsContact CG1-NH2 3.26Å; I2301-M2813 HydrophobicContact CB-CE 4.38Å; I2301-M2813 HydrophobicContact CG2-CB 4.3Å; I2301-M2813 HydrophobicContact CG2-CE 3.98Å; I2301-M2813 WeakPolarHBondContact O-CE 3.39Å; I2301-D2816 WeakPolarHBondContact CD1-OD2 3.12Å
2302E81.4Confident83.7Confident12.3333 Ų12.333357.9 Ų57.96%0.05830%0.296CS..EExtended strand (participates in β ladder)trans-115.1139.1173.9-173.9169.2-171.900110.1G2141 E2293 I2294 R2296 I2304 L2791G2141-E2302 VanDerWaalsContact CA-OE1 3.25Å; G2141-E2302 WeakPolarHBondContact CA-OE1 3.3Å; G2141-E2302 VanDerWaalsContact CA-OE2 3.27Å; G2141-E2302 WeakPolarHBondContact CA-OE2 3.24Å; G2141-E2302 PolarHBondContact N-OE1 3.06Å; E2293-E2302 CarbonylContact C-O 3.59Å; E2293-E2302 WeakPolarHBondContact CA-O 3.48Å; I2294-E2302 HydrophobicContact CD1-CB 4.43Å; I2294-E2302 HydrophobicContact CG1-CB 4.18Å; I2294-E2302 WeakPolarHBondContact CG1-O 3.4Å; I2294-E2302 PolarHBondContact N-O 3.13Å; I2294-E2302 PolarHBondContact O-N 3.34Å; R2296-E2302 WeakPolarHBondContact CD-OE2 3.39Å; R2296-E2302 HydrophobicContact CG-CB 4.47Å; R2296-E2302 IonicContact CZ-OE1 2.7Å; R2296-E2302 IonicContact CZ-OE2 3.43Å; R2296-E2302 IonicContact NE-OE2 3.06Å; R2296-E2302 PolarHBondContact NE-OE2 3.43Å; R2296-E2302 IonicContact NH1-OE2 3.8Å; R2296-E2302 PolarHBondContact NH1-OE2 3.3Å; R2296-E2302 VanDerWaalsContact NH2-CD 3.3Å; R2296-E2302 IonicContact NH2-OE1 2.81Å; R2296-E2302 PolarHBondContact NH2-OE1 2.94Å; R2296-E2302 IonicContact NH2-OE2 3.19Å; R2296-E2302 PolarHBondContact NH2-OE2 3.35Å; E2302-I2304 HydrophobicContact CG-CG1 4.28Å; E2302-L2791 HydrophobicContact CG-CD1 4.49Å; E2302-L2791 WeakPolarHBondContact OE1-CD1 3.45Å
2303R83.4Confident83.4Confident59.3333 Ų59.333361.4 Ų61.422%0.22431%0.312CS..EExtended strand (participates in β ladder)trans-98.7121.2176.6-93.1178.7-160.4173.5-4.7110.3Y2198 R2201 Q2291 I2292 E2293 V2305 D2767 M2813Y2198-R2303 PolarHBondContact OH-O 3.2Å; R2201-R2303 VanDerWaalsContact CZ-CZ 3.48Å; R2201-R2303 PolarHBondContact NH1-O 3.33Å; R2201-R2303 VanDerWaalsContact NH1-O 3.15Å; Q2291-R2303 VanDerWaalsContact NE2-NH1 3.13Å; I2292-R2303 CarbonylContact O-C 3.56Å; I2292-R2303 VanDerWaalsContact O-CA 3.27Å; I2292-R2303 WeakPolarHBondContact O-CA 3.37Å; E2293-R2303 HydrophobicContact CG-CG 3.82Å; E2293-R2303 IonicContact OE1-CZ 3.4Å; E2293-R2303 IonicContact OE1-NE 2.95Å; E2293-R2303 PolarHBondContact OE1-NE 3.21Å; E2293-R2303 IonicContact OE1-NH2 3.43Å; E2293-R2303 PolarHBondContact OE1-NH2 3.31Å; R2303-V2305 HydrophobicContact CG-CG2 4.41Å; R2303-D2767 IonicContact CZ-OD1 2.84Å; R2303-D2767 VanDerWaalsContact CZ-OD1 3.3Å; R2303-D2767 IonicContact CZ-OD2 3.78Å; R2303-D2767 IonicContact NH1-OD1 2.82Å; R2303-D2767 PolarHBondContact NH1-OD1 2.95Å; R2303-D2767 IonicContact NH1-OD2 2.63Å; R2303-D2767 IonicContact NH2-OD1 3.81Å; R2303-D2767 PolarHBondContact NH2-OD1 2.99Å; R2303-D2767 VanDerWaalsContact NH2-OD1 3.14Å; R2303-D2767 IonicContact NH2-OD2 3.61Å; R2303-D2767 PolarHBondContact NH2-OD2 2.92Å; R2303-M2813 HydrophobicContact CB-CE 4.12Å
2304I85.8Confident83Confident26.6667 Ų26.666763.3 Ų63.314%0.13732%0.318CS..EExtended strand (participates in β ladder)trans-103.2123.3175.5-60.1-177.9000108.7Y2198 Q2291 I2292 I2294 E2302 Y2306 F2776 L2791 I2795Y2198-I2304 WeakPolarHBondContact OH-CA 3.09Å; Q2291-I2304 CarbonylContact C-O 3.58Å; Q2291-I2304 VanDerWaalsContact CA-O 3.3Å; Q2291-I2304 WeakPolarHBondContact CA-O 3.36Å; I2292-I2304 HydrophobicContact CD1-CB 4.42Å; I2292-I2304 HydrophobicContact CG1-CB 4.02Å; I2292-I2304 PolarHBondContact N-O 3.15Å; I2292-I2304 PolarHBondContact O-N 3.21Å; I2294-I2304 HydrophobicContact CD1-CD1 3.56Å; I2294-I2304 HydrophobicContact CD1-CG1 4.24Å; I2294-I2304 HydrophobicContact CG1-CD1 3.99Å; I2294-I2304 HydrophobicContact CG1-CG1 4.26Å; I2294-I2304 HydrophobicContact CG2-CD1 4.21Å; E2302-I2304 HydrophobicContact CG-CG1 4.28Å; I2304-Y2306 HydrophobicContact CG2-CD1 4.37Å; I2304-F2776 HydrophobicContact CD1-CZ 4.16Å; I2304-F2776 HydrophobicContact CG2-CE2 3.99Å; I2304-L2791 HydrophobicContact CD1-CB 4.17Å; I2304-L2791 HydrophobicContact CD1-CD1 4.4Å; I2304-I2795 HydrophobicContact CD1-CD1 4.28Å
2305V86.3Confident82.6Confident14 Ų1462.7 Ų62.79%0.08532%0.315CS..EExtended strand (participates in β ladder)trans-103.7128.4172.1-174.20000108.1I2194 Q2197 Y2198 T2289 A2290 Q2291 R2303I2194-V2305 HydrophobicContact CB-CG1 4.46Å; I2194-V2305 HydrophobicContact CG1-CB 4.49Å; I2194-V2305 HydrophobicContact CG1-CG1 4.06Å; I2194-V2305 HydrophobicContact CG2-CB 4.09Å; I2194-V2305 HydrophobicContact CG2-CG1 4.04Å; Q2197-V2305 VanDerWaalsContact OE1-CG1 3.25Å; Y2198-V2305 HydrophobicContact CD2-CG2 4.47Å; Y2198-V2305 HydrophobicContact CE1-CG2 4.2Å; Y2198-V2305 HydrophobicContact CE2-CB 3.86Å; Y2198-V2305 HydrophobicContact CE2-CG2 3.96Å; Y2198-V2305 PolarHBondContact OH-N 3.17Å; T2289-V2305 HydrophobicContact CG2-CG1 3.68Å; T2289-V2305 VanDerWaalsContact CG2-CG1 3.4Å; A2290-V2305 WeakPolarHBondContact O-CA 3.42Å; A2290-V2305 WeakPolarHBondContact O-CG1 3.34Å; Q2291-V2305 HydrophobicContact CB-CB 4.49Å; Q2291-V2305 HydrophobicContact CB-CG1 4.5Å; Q2291-V2305 HydrophobicContact CB-CG2 4.16Å; R2303-V2305 HydrophobicContact CG-CG2 4.41Å
2306Y88.1Confident82.1Confident32.3333 Ų32.333363.3 Ų63.313%0.12732%0.319CS..EExtended strand (participates in β ladder)trans-143.6155.9-17371.2-84.9000112A2290 I2292 I2304 H2772 Y2775 F2776 Y2779A2290-Y2306 HydrophobicContact CB-CD1 4.42Å; A2290-Y2306 HydrophobicContact CB-CE1 3.71Å; A2290-Y2306 HydrophobicContact CB-CE2 4.04Å; A2290-Y2306 VanDerWaalsContact CB-CZ 3.47Å; A2290-Y2306 WeakPolarHBondContact CB-OH 3.36Å; A2290-Y2306 PolarHBondContact N-O 2.98Å; A2290-Y2306 PolarHBondContact O-N 3.01Å; I2292-Y2306 HydrophobicContact CB-CE1 4.27Å; I2292-Y2306 HydrophobicContact CG1-CD1 4.08Å; I2292-Y2306 HydrophobicContact CG1-CE1 4.21Å; I2292-Y2306 HydrophobicContact CG2-CE1 4.05Å; I2304-Y2306 HydrophobicContact CG2-CD1 4.37Å; Y2306-H2772 PolarHBondContact OH-O 2.67Å; Y2306-Y2775 WeakPolarHBondContact OH-CB 3.45Å; Y2306-F2776 AromaticContact CD1-CD2 3.63Å; Y2306-F2776 HydrophobicContact CD1-CD2 3.63Å; Y2306-F2776 HydrophobicContact CD1-CE2 4.3Å; Y2306-F2776 HydrophobicContact CD1-CG 4.49Å; Y2306-F2776 HydrophobicContact CD2-CD2 4.1Å; Y2306-F2776 HydrophobicContact CE1-CB 3.8Å; Y2306-F2776 AromaticContact CE1-CD2 3.71Å; Y2306-F2776 HydrophobicContact CE1-CD2 3.71Å; Y2306-F2776 HydrophobicContact CE1-CG 4.15Å; Y2306-F2776 HydrophobicContact CE2-CB 4.27Å; Y2306-F2776 HydrophobicContact CE2-CD2 4.21Å; Y2306-F2776 AromaticContact CG-CD2 3.85Å; Y2306-F2776 HydrophobicContact CG-CD2 3.85Å; Y2306-F2776 HydrophobicContact CG-CE2 4.39Å; Y2306-F2776 PolarHBondContact OH-N 3.05Å; Y2306-Y2779 HydrophobicContact CD2-CD1 4.05Å; Y2306-Y2779 HydrophobicContact CD2-CD2 4.33Å; Y2306-Y2779 HydrophobicContact CD2-CE1 4.48Å; Y2306-Y2779 AromaticContact CD2-CG 3.97Å; Y2306-Y2779 HydrophobicContact CD2-CG 3.97Å; Y2306-Y2779 HydrophobicContact CE2-CG 4.39Å
2307P88.1Confident81.9Confident48 Ų4866.1 Ų66.131%0.31234%0.337SS..EExtended strand (participates in β ladder)trans-74.6132.3176.430.1-34.4000111.5H2190 P2309 Y2779H2190-P2307 VanDerWaalsContact CE1-CA 3.49Å; H2190-P2307 WeakPolarHBondContact CE1-CA 3.48Å; H2190-P2307 WeakPolarHBondContact CE1-CB 3.33Å; H2190-P2307 WeakPolarHBondContact ND1-CB 3.33Å; H2190-P2307 VanDerWaalsContact NE2-CA 3.3Å; H2190-P2307 WeakPolarHBondContact NE2-CA 3.46Å; H2190-P2307 WeakPolarHBondContact NE2-CB 3.35Å; P2307-P2309 WeakPolarHBondContact O-CD 3.39Å; P2307-Y2779 HydrophobicContact CG-CE2 4.05Å
2308I86.7Confident81.5Confident30 Ų3065.6 Ų65.615%0.15433%0.328CS..PPolyproline II helixtrans-71.6125.6174.2-59.1173.8000108.9N2288 A2290 C2312 Y2775N2288-I2308 WeakPolarHBondContact O-CB 3.3Å; N2288-I2308 WeakPolarHBondContact O-CG1 3.04Å; N2288-I2308 PolarHBondContact O-N 3.13Å; A2290-I2308 HydrophobicContact CB-CD1 3.89Å; A2290-I2308 HydrophobicContact CB-CG1 3.6Å; I2308-C2312 HydrophobicContact CG2-CB 3.77Å; I2308-Y2775 HydrophobicContact CD1-CD2 4.22Å; I2308-Y2775 HydrophobicContact CD1-CE2 4.47Å; I2308-Y2775 HydrophobicContact CG1-CD2 4.37Å; I2308-Y2775 HydrophobicContact CG2-CD2 3.93Å; I2308-Y2775 HydrophobicContact CG2-CE2 4.34Å; I2308-Y2775 HydrophobicContact CG2-CG 4.36Å
2309P83.2Confident81.2Confident37.3333 Ų37.333363.6 Ų63.624%0.24232%0.315CS..PPolyproline II helixtrans-60141.3173.9-23.833.8000112P2307 I2311 C2312 Y2779P2307-P2309 WeakPolarHBondContact O-CD 3.39Å; P2309-I2311 HydrophobicContact CB-CG2 4.08Å; P2309-I2311 PolarHBondContact O-N 2.97Å; P2309-I2311 VanDerWaalsContact O-N 3.09Å; P2309-C2312 VanDerWaalsContact O-CB 3.28Å; P2309-C2312 WeakPolarHBondContact O-CB 3.39Å; P2309-C2312 PolarHBondContact O-N 3.34Å; P2309-Y2779 HydrophobicContact CG-CD2 4.3Å; P2309-Y2779 HydrophobicContact CG-CG 4.45Å
2310K79.9Confident81.2Confident161.667 Ų161.66759.7 Ų59.770%0.70329%0.292SS*.G310 helixtrans-54.6-35.5-179-66.5-178.3-178.9176.80113.1C2312 H2313K2310-C2312 PolarHBondContact O-N 3.14Å; K2310-H2313 WeakPolarHBondContact O-CB 3.46Å; K2310-H2313 PolarHBondContact O-CD2 2.79Å; K2310-H2313 PolarHBondContact O-N 3.27Å; K2310-H2313 VanDerWaalsContact O-N 3.11Å; K2310-H2313 PolarHBondContact O-ND1 3.09Å
2311I79.3Confident80.9Confident27.6667 Ų27.666760.3 Ų60.314%0.14230%0.296CS..G310 helixtrans-60.6-29.4-179.7-132.9166.8000112.9P2309 H2313 Y2314 Y2347 M2350 L2351 E2354 I2778P2309-I2311 HydrophobicContact CB-CG2 4.08Å; P2309-I2311 PolarHBondContact O-N 2.97Å; P2309-I2311 VanDerWaalsContact O-N 3.09Å; I2311-H2313 PolarHBondContact O-N 3.36Å; I2311-Y2314 HydrophobicContact CB-CD2 4.45Å; I2311-Y2314 HydrophobicContact CG1-CD2 4.06Å; I2311-Y2314 HydrophobicContact CG1-CE2 4.36Å; I2311-Y2314 WeakPolarHBondContact O-CB 3.41Å; I2311-Y2314 WeakPolarHBondContact O-CD2 3.4Å; I2311-Y2314 PolarHBondContact O-N 3.02Å; I2311-Y2314 VanDerWaalsContact O-N 3.12Å; I2311-Y2347 HydrophobicContact CD1-CE2 4.12Å; I2311-Y2347 HydrophobicContact CG2-CE2 4.45Å; I2311-M2350 HydrophobicContact CG1-CB 4.12Å; I2311-M2350 HydrophobicContact CG2-CB 3.72Å; I2311-M2350 HydrophobicContact CG2-CE 4.1Å; I2311-M2350 HydrophobicContact CG2-SD 4.24Å; I2311-L2351 HydrophobicContact CD1-CD2 3.49Å; I2311-L2351 VanDerWaalsContact CD1-CD2 3.47Å; I2311-L2351 HydrophobicContact CD1-CG 3.9Å; I2311-E2354 WeakPolarHBondContact CD1-OE2 3.49Å; I2311-I2778 HydrophobicContact CG2-CG2 4.13Å
2312C82.4Confident80.5Confident18.3333 Ų18.333361.6 Ų61.612%0.12430%0.3CS..G310 helixtrans-68.4-21-179-63.20000113.3I2308 P2309 K2310 Y2314 L2315 M2350 Y2775I2308-C2312 HydrophobicContact CG2-CB 3.77Å; P2309-C2312 VanDerWaalsContact O-CB 3.28Å; P2309-C2312 WeakPolarHBondContact O-CB 3.39Å; P2309-C2312 PolarHBondContact O-N 3.34Å; K2310-C2312 PolarHBondContact O-N 3.14Å; C2312-Y2314 VanDerWaalsContact C-N 3.32Å; C2312-Y2314 PolarHBondContact O-N 3.25Å; C2312-L2315 WeakPolarHBondContact O-CB 3.33Å; C2312-L2315 PolarHBondContact O-N 3.07Å; C2312-M2350 HydrophobicContact CB-CE 4.42Å; C2312-Y2775 HydrophobicContact CB-CD1 3.61Å; C2312-Y2775 HydrophobicContact CB-CD2 4.42Å; C2312-Y2775 HydrophobicContact CB-CE1 3.64Å; C2312-Y2775 HydrophobicContact CB-CE2 4.44Å; C2312-Y2775 HydrophobicContact CB-CG 4.02Å; C2312-Y2775 VanDerWaalsContact SG-CD1 3.52Å
2313H81.4Confident80Confident100 Ų10061.9 Ų61.946%0.46330%0.302SS..G310 helixtrans-74.5-16.3178.1-67-63.8000113.2N2288 K2310 I2311 L2315N2288-H2313 PolarHBondContact OD1-CE1 3.02Å; N2288-H2313 VanDerWaalsContact OD1-CE1 3.3Å; N2288-H2313 PolarHBondContact OD1-NE2 3Å; K2310-H2313 WeakPolarHBondContact O-CB 3.46Å; K2310-H2313 PolarHBondContact O-CD2 2.79Å; K2310-H2313 PolarHBondContact O-N 3.27Å; K2310-H2313 VanDerWaalsContact O-N 3.11Å; K2310-H2313 PolarHBondContact O-ND1 3.09Å; I2311-H2313 PolarHBondContact O-N 3.36Å; H2313-L2315 VanDerWaalsContact C-N 3.3Å; H2313-L2315 PolarHBondContact O-N 3.28Å
2314Y79.1Confident79.5Confident83.3333 Ų83.333362.4 Ų62.433%0.32731%0.309SS..G310 helixtrans-77.5-7.1178.1-58.6-55.3000113.7I2311 C2312 T2316 E2354 L2357I2311-Y2314 HydrophobicContact CB-CD2 4.45Å; I2311-Y2314 HydrophobicContact CG1-CD2 4.06Å; I2311-Y2314 HydrophobicContact CG1-CE2 4.36Å; I2311-Y2314 WeakPolarHBondContact O-CB 3.41Å; I2311-Y2314 WeakPolarHBondContact O-CD2 3.4Å; I2311-Y2314 PolarHBondContact O-N 3.02Å; I2311-Y2314 VanDerWaalsContact O-N 3.12Å; C2312-Y2314 VanDerWaalsContact C-N 3.32Å; C2312-Y2314 PolarHBondContact O-N 3.25Å; Y2314-T2316 PolarHBondContact O-N 2.89Å; Y2314-E2354 HydrophobicContact CD2-CB 3.74Å; Y2314-E2354 HydrophobicContact CD2-CG 4.23Å; Y2314-E2354 HydrophobicContact CE2-CB 3.62Å; Y2314-E2354 VanDerWaalsContact CE2-CD 3.41Å; Y2314-E2354 HydrophobicContact CE2-CG 3.58Å; Y2314-E2354 VanDerWaalsContact CE2-OE1 3.24Å; Y2314-E2354 WeakPolarHBondContact CE2-OE1 3.21Å; Y2314-E2354 HydrophobicContact CG-CB 4.45Å; Y2314-E2354 PolarHBondContact OH-OE1 2.88Å; Y2314-L2357 HydrophobicContact CD1-CD1 3.22Å; Y2314-L2357 HydrophobicContact CE1-CD1 3.37Å; Y2314-L2357 VanDerWaalsContact CE1-CD1 3.47Å; Y2314-L2357 HydrophobicContact CG-CD1 4.17Å
2315L79.3Confident78.8Confident18.6667 Ų18.666765 Ų6510%0.09833%0.334CS..SBendtrans-84.7114.1176.2-171.768000110.9C2312 H2313 K2319 K2320 L2323 I2346 E2349 M2350 W2771C2312-L2315 WeakPolarHBondContact O-CB 3.33Å; C2312-L2315 PolarHBondContact O-N 3.07Å; H2313-L2315 VanDerWaalsContact C-N 3.3Å; H2313-L2315 PolarHBondContact O-N 3.28Å; L2315-K2319 HydrophobicContact CD1-CB 3.9Å; L2315-K2319 HydrophobicContact CD1-CG 4.27Å; L2315-K2319 HydrophobicContact CG-CB 4.35Å; L2315-K2320 HydrophobicContact CD2-CD 4.47Å; L2315-K2320 HydrophobicContact CD2-CG 3.66Å; L2315-K2320 HydrophobicContact CG-CG 3.96Å; L2315-K2320 VanDerWaalsContact O-CE 3.22Å; L2315-K2320 WeakPolarHBondContact O-CE 3.44Å; L2315-L2323 HydrophobicContact CD1-CD1 4.16Å; L2315-L2323 HydrophobicContact CD2-CD1 4.14Å; L2315-I2346 HydrophobicContact CD1-CG2 3.72Å; L2315-I2346 HydrophobicContact CD2-CG2 4.23Å; L2315-E2349 HydrophobicContact CD1-CG 4.13Å; L2315-M2350 HydrophobicContact CB-CE 4.05Å; L2315-M2350 HydrophobicContact CB-CG 4.3Å; L2315-M2350 HydrophobicContact CB-SD 4.05Å; L2315-M2350 HydrophobicContact CD2-CE 3.88Å; L2315-M2350 HydrophobicContact CG-CE 4.36Å; L2315-W2771 HydrophobicContact CD2-CE3 4.14Å; L2315-W2771 HydrophobicContact CD2-CH2 3.99Å; L2315-W2771 HydrophobicContact CD2-CZ3 3.47Å; L2315-W2771 VanDerWaalsContact CD2-CZ3 3.47Å
2316T75.6Confident77.9Confident78.3333 Ų78.333368.5 Ų68.548%0.48135%0.352SS..  trans-66.4147.6177.561.20000112.3Y2314 S2318 K2319 K2320Y2314-T2316 PolarHBondContact O-N 2.89Å; T2316-S2318 VanDerWaalsContact C-N 3.29Å; T2316-S2318 PolarHBondContact O-N 3.09Å; T2316-S2318 PolarHBondContact OG1-OG 3.17Å; T2316-K2319 WeakPolarHBondContact O-CA 3.17Å; T2316-K2319 WeakPolarHBondContact O-CB 3.38Å; T2316-K2319 PolarHBondContact O-N 3.2Å; T2316-K2319 VanDerWaalsContact O-N 3.08Å; T2316-K2319 WeakPolarHBondContact OG1-CB 3.41Å; T2316-K2319 WeakPolarHBondContact OG1-CG 3.42Å; T2316-K2319 PolarHBondContact OG1-N 3.09Å; T2316-K2320 PolarHBondContact O-N 3.36Å
2317D76.1Confident76.7Confident99 Ų9968.1 Ų68.153%0.52935%0.351SS..Hα-helixtrans-63.5-33.5-179.8-63-38.3000112.8K2319 K2320 Y2321D2317-K2319 VanDerWaalsContact C-N 3.28Å; D2317-K2319 PolarHBondContact O-N 3.06Å; D2317-K2320 WeakPolarHBondContact O-CA 3.21Å; D2317-K2320 VanDerWaalsContact O-CB 3.28Å; D2317-K2320 WeakPolarHBondContact O-CB 3.22Å; D2317-K2320 PolarHBondContact O-N 3.2Å; D2317-K2320 VanDerWaalsContact O-N 3.13Å; D2317-K2320 WeakPolarHBondContact OD1-CD 3.34Å; D2317-K2320 WeakPolarHBondContact OD1-CE 3.46Å; D2317-K2320 IonicContact OD1-NZ 3.38Å; D2317-K2320 PolarHBondContact OD1-NZ 3.18Å; D2317-Y2321 HydrophobicContact CB-CE2 4.41Å; D2317-Y2321 WeakPolarHBondContact O-CD2 3.31Å; D2317-Y2321 PolarHBondContact O-N 3.21Å
2318S71.5Confident75.4Confident73.6667 Ų73.666771.2 Ų71.252%0.51537%0.365SS..Hα-helixtrans-58-41.4172.462.10000112.3T2316 K2320 Y2321 Q2322T2316-S2318 VanDerWaalsContact C-N 3.29Å; T2316-S2318 PolarHBondContact O-N 3.09Å; T2316-S2318 PolarHBondContact OG1-OG 3.17Å; S2318-K2320 VanDerWaalsContact C-N 3.34Å; S2318-Y2321 PolarHBondContact O-N 3.21Å; S2318-Q2322 WeakPolarHBondContact O-CG 3.42Å; S2318-Q2322 PolarHBondContact O-N 3.22Å
2319K72.6Confident74Confident51 Ų5171.8 Ų71.822%0.22237%0.368CS..Hα-helixtrans-68.5-38.2174.6-101.4-58.7-173.71710111.7L2315 T2316 D2317 Y2321 Q2322 L2323 E2349 Q2473L2315-K2319 HydrophobicContact CD1-CB 3.9Å; L2315-K2319 HydrophobicContact CD1-CG 4.27Å; L2315-K2319 HydrophobicContact CG-CB 4.35Å; T2316-K2319 WeakPolarHBondContact O-CA 3.17Å; T2316-K2319 WeakPolarHBondContact O-CB 3.38Å; T2316-K2319 PolarHBondContact O-N 3.2Å; T2316-K2319 VanDerWaalsContact O-N 3.08Å; T2316-K2319 WeakPolarHBondContact OG1-CB 3.41Å; T2316-K2319 WeakPolarHBondContact OG1-CG 3.42Å; T2316-K2319 PolarHBondContact OG1-N 3.09Å; D2317-K2319 VanDerWaalsContact C-N 3.28Å; D2317-K2319 PolarHBondContact O-N 3.06Å; K2319-Y2321 VanDerWaalsContact C-N 3.31Å; K2319-Y2321 PolarHBondContact O-N 2.89Å; K2319-Q2322 PolarHBondContact O-N 3.25Å; K2319-L2323 HydrophobicContact CB-CD1 4.49Å; K2319-L2323 HydrophobicContact CG-CD1 4.19Å; K2319-L2323 HydrophobicContact CG-CG 4.29Å; K2319-L2323 WeakPolarHBondContact O-CB 3.31Å; K2319-L2323 WeakPolarHBondContact O-CD1 3.4Å; K2319-L2323 VanDerWaalsContact O-CG 3.23Å; K2319-L2323 WeakPolarHBondContact O-CG 3.44Å; K2319-L2323 PolarHBondContact O-N 3.2Å; K2319-E2349 WeakPolarHBondContact CE-OE1 3.45Å; K2319-E2349 WeakPolarHBondContact CE-OE2 3.47Å; K2319-E2349 VanDerWaalsContact NZ-CD 3.29Å; K2319-E2349 IonicContact NZ-OE1 3.44Å; K2319-E2349 PolarHBondContact NZ-OE1 3.16Å; K2319-E2349 IonicContact NZ-OE2 2.91Å; K2319-E2349 PolarHBondContact NZ-OE2 3.08Å; K2319-Q2473 VanDerWaalsContact NZ-NE2 3.17Å
2320K80.4Confident73.1Confident49.6667 Ų49.666774.7 Ų74.722%0.21638%0.382CS..Hα-helixtrans-55.8-50173.6-68.4179.4-163.3160.30111.3L2315 T2316 D2317 S2318 Q2322 L2323 L2324 W2771 Y2775L2315-K2320 HydrophobicContact CD2-CD 4.47Å; L2315-K2320 HydrophobicContact CD2-CG 3.66Å; L2315-K2320 HydrophobicContact CG-CG 3.96Å; L2315-K2320 VanDerWaalsContact O-CE 3.22Å; L2315-K2320 WeakPolarHBondContact O-CE 3.44Å; T2316-K2320 PolarHBondContact O-N 3.36Å; D2317-K2320 WeakPolarHBondContact O-CA 3.21Å; D2317-K2320 VanDerWaalsContact O-CB 3.28Å; D2317-K2320 WeakPolarHBondContact O-CB 3.22Å; D2317-K2320 PolarHBondContact O-N 3.2Å; D2317-K2320 VanDerWaalsContact O-N 3.13Å; D2317-K2320 WeakPolarHBondContact OD1-CD 3.34Å; D2317-K2320 WeakPolarHBondContact OD1-CE 3.46Å; D2317-K2320 IonicContact OD1-NZ 3.38Å; D2317-K2320 PolarHBondContact OD1-NZ 3.18Å; S2318-K2320 VanDerWaalsContact C-N 3.34Å; K2320-Q2322 VanDerWaalsContact C-N 3.34Å; K2320-Q2322 PolarHBondContact O-N 3.21Å; K2320-L2323 PolarHBondContact O-N 3.21Å; K2320-L2324 VanDerWaalsContact O-CG 3.3Å; K2320-L2324 WeakPolarHBondContact O-CG 3.44Å; K2320-L2324 PolarHBondContact O-N 3.19Å; K2320-L2324 VanDerWaalsContact O-N 3.07Å; K2320-W2771 HydrophobicContact CB-CD2 4.37Å; K2320-W2771 HydrophobicContact CB-CH2 3.86Å; K2320-W2771 HydrophobicContact CB-CZ2 3.27Å; K2320-W2771 HydrophobicContact CD-CD2 3.95Å; K2320-W2771 HydrophobicContact CD-CE3 4.35Å; K2320-W2771 HydrophobicContact CD-CG 4.33Å; K2320-W2771 HydrophobicContact CD-CZ2 4.36Å; K2320-W2771 HydrophobicContact CG-CD2 3.99Å; K2320-W2771 HydrophobicContact CG-CE3 4.14Å; K2320-W2771 HydrophobicContact CG-CH2 3.79Å; K2320-W2771 HydrophobicContact CG-CZ2 3.59Å; K2320-W2771 HydrophobicContact CG-CZ3 4.04Å; K2320-W2771 WeakPolarHBondContact O-CZ2 3.31Å; K2320-Y2775 VanDerWaalsContact CE-OH 3.24Å; K2320-Y2775 WeakPolarHBondContact CE-OH 3.28Å; K2320-Y2775 PolarHBondContact NZ-OH 2.72Å
2321Y75.9Confident72.4Confident173 Ų17372 Ų7268%0.67838%0.375SS*.Hα-helixtrans-62.1-42.2176.9-69.4-67.8000112.5D2317 S2318 K2319 L2323 L2324 A2325D2317-Y2321 HydrophobicContact CB-CE2 4.41Å; D2317-Y2321 WeakPolarHBondContact O-CD2 3.31Å; D2317-Y2321 PolarHBondContact O-N 3.21Å; S2318-Y2321 PolarHBondContact O-N 3.21Å; K2319-Y2321 VanDerWaalsContact C-N 3.31Å; K2319-Y2321 PolarHBondContact O-N 2.89Å; Y2321-L2323 PolarHBondContact O-N 3.08Å; Y2321-L2324 PolarHBondContact O-N 3.19Å; Y2321-A2325 VanDerWaalsContact O-CB 3.29Å; Y2321-A2325 WeakPolarHBondContact O-CB 3.38Å; Y2321-A2325 PolarHBondContact O-N 3.14Å
2322Q72.9Confident71.8Confident98.6667 Ų98.666774.4 Ų74.446%0.46139%0.388SS..Hα-helixtrans-61.7-43176-73174.96.600112.4S2318 K2319 K2320 L2324 A2325 I2326S2318-Q2322 WeakPolarHBondContact O-CG 3.42Å; S2318-Q2322 PolarHBondContact O-N 3.22Å; K2319-Q2322 PolarHBondContact O-N 3.25Å; K2320-Q2322 VanDerWaalsContact C-N 3.34Å; K2320-Q2322 PolarHBondContact O-N 3.21Å; Q2322-L2324 VanDerWaalsContact C-N 3.31Å; Q2322-L2324 PolarHBondContact O-N 2.96Å; Q2322-A2325 PolarHBondContact O-N 2.95Å; Q2322-A2325 VanDerWaalsContact O-N 3.15Å; Q2322-I2326 HydrophobicContact CB-CD1 4.45Å; Q2322-I2326 WeakPolarHBondContact O-CB 3.15Å; Q2322-I2326 WeakPolarHBondContact O-CD1 3.44Å; Q2322-I2326 VanDerWaalsContact O-CG1 3.28Å; Q2322-I2326 WeakPolarHBondContact O-CG1 3.29Å; Q2322-I2326 PolarHBondContact O-N 2.9Å; Q2322-I2326 VanDerWaalsContact O-N 3.1Å
2323L71.5Confident71.1Confident19 Ų1983 Ų8310%0.09942%0.419CS..Hα-helixtrans-67.5-35179.8-71.3166.9000112.4L2315 K2319 K2320 Y2321 A2325 I2326 N2327 I2342 I2346 E2349 W2771L2315-L2323 HydrophobicContact CD1-CD1 4.16Å; L2315-L2323 HydrophobicContact CD2-CD1 4.14Å; K2319-L2323 HydrophobicContact CB-CD1 4.49Å; K2319-L2323 HydrophobicContact CG-CD1 4.19Å; K2319-L2323 HydrophobicContact CG-CG 4.29Å; K2319-L2323 WeakPolarHBondContact O-CB 3.31Å; K2319-L2323 WeakPolarHBondContact O-CD1 3.4Å; K2319-L2323 VanDerWaalsContact O-CG 3.23Å; K2319-L2323 WeakPolarHBondContact O-CG 3.44Å; K2319-L2323 PolarHBondContact O-N 3.2Å; K2320-L2323 PolarHBondContact O-N 3.21Å; Y2321-L2323 PolarHBondContact O-N 3.08Å; L2323-A2325 VanDerWaalsContact C-N 3.33Å; L2323-I2326 HydrophobicContact CD2-CD1 4.15Å; L2323-N2327 WeakPolarHBondContact O-CB 3.34Å; L2323-N2327 PolarHBondContact O-N 2.96Å; L2323-N2327 VanDerWaalsContact O-N 3.12Å; L2323-N2327 PolarHBondContact O-ND2 3.19Å; L2323-I2342 HydrophobicContact CD2-CG2 3.75Å; L2323-I2342 VanDerWaalsContact CD2-CG2 3.48Å; L2323-I2346 HydrophobicContact CB-CG1 4.26Å; L2323-I2346 HydrophobicContact CD1-CD1 3.73Å; L2323-I2346 VanDerWaalsContact CD1-CD1 3.42Å; L2323-I2346 HydrophobicContact CD1-CG1 3.89Å; L2323-I2346 HydrophobicContact CD2-CD1 4.03Å; L2323-I2346 HydrophobicContact CD2-CG1 3.98Å; L2323-I2346 HydrophobicContact CG-CD1 4.18Å; L2323-I2346 HydrophobicContact CG-CG1 4.4Å; L2323-E2349 HydrophobicContact CD1-CG 4.38Å; L2323-W2771 HydrophobicContact CB-CH2 4.24Å; L2323-W2771 HydrophobicContact CD1-CH2 4.25Å
2324L73.6Confident70.6Confident69.6667 Ų69.666780.4 Ų80.437%0.36541%0.412SS..Hα-helixtrans-69.8-36.4172.6-72.3170.3000112K2320 Y2321 Q2322 I2326 N2327 L2339 V2770 W2771K2320-L2324 VanDerWaalsContact O-CG 3.3Å; K2320-L2324 WeakPolarHBondContact O-CG 3.44Å; K2320-L2324 PolarHBondContact O-N 3.19Å; K2320-L2324 VanDerWaalsContact O-N 3.07Å; Y2321-L2324 PolarHBondContact O-N 3.19Å; Q2322-L2324 VanDerWaalsContact C-N 3.31Å; Q2322-L2324 PolarHBondContact O-N 2.96Å; L2324-I2326 VanDerWaalsContact C-N 3.27Å; L2324-I2326 PolarHBondContact O-N 3.33Å; L2324-N2327 PolarHBondContact O-N 3.32Å; L2324-N2327 VanDerWaalsContact O-N 3.16Å; L2324-L2339 HydrophobicContact CD2-CD1 4.07Å; L2324-V2770 HydrophobicContact CD2-CB 4.37Å; L2324-V2770 HydrophobicContact CD2-CG1 3.93Å; L2324-W2771 HydrophobicContact CD1-CZ2 3.85Å; L2324-W2771 HydrophobicContact CD2-CZ2 4.39Å; L2324-W2771 HydrophobicContact CG-CZ2 3.78Å
2325A71.6Confident70.2Confident80.6667 Ų80.666777.6 Ų77.667%0.66740%0.402SS*.Hα-helixtrans-72.7-24179.100000114Y2321 Q2322 L2323 N2327Y2321-A2325 VanDerWaalsContact O-CB 3.29Å; Y2321-A2325 WeakPolarHBondContact O-CB 3.38Å; Y2321-A2325 PolarHBondContact O-N 3.14Å; Q2322-A2325 PolarHBondContact O-N 2.95Å; Q2322-A2325 VanDerWaalsContact O-N 3.15Å; L2323-A2325 VanDerWaalsContact C-N 3.33Å; A2325-N2327 VanDerWaalsContact C-N 3.32Å; A2325-N2327 PolarHBondContact O-N 3.44Å
2326I67.1Low69.9Low89.3333 Ų89.333379.8 Ų79.846%0.45841%0.413SS..THydrogen-bonded Turntrans-72.6-28.7178.2-70.4163.9000111.8Q2322 L2323 L2324 N2328 I2342Q2322-I2326 HydrophobicContact CB-CD1 4.45Å; Q2322-I2326 WeakPolarHBondContact O-CB 3.15Å; Q2322-I2326 WeakPolarHBondContact O-CD1 3.44Å; Q2322-I2326 VanDerWaalsContact O-CG1 3.28Å; Q2322-I2326 WeakPolarHBondContact O-CG1 3.29Å; Q2322-I2326 PolarHBondContact O-N 2.9Å; Q2322-I2326 VanDerWaalsContact O-N 3.1Å; L2323-I2326 HydrophobicContact CD2-CD1 4.15Å; L2324-I2326 VanDerWaalsContact C-N 3.27Å; L2324-I2326 PolarHBondContact O-N 3.33Å; I2326-N2328 PolarHBondContact O-N 3.41Å; I2326-I2342 HydrophobicContact CG2-CD1 4.17Å
2327N62.1Low70Confident23 Ų2378.9 Ų78.912%0.12341%0.408CS..SBendtrans-83.7123.4178.7-82-38.9000111.3L2323 L2324 A2325 M2329 S2338 I2342L2323-N2327 WeakPolarHBondContact O-CB 3.34Å; L2323-N2327 PolarHBondContact O-N 2.96Å; L2323-N2327 VanDerWaalsContact O-N 3.12Å; L2323-N2327 PolarHBondContact O-ND2 3.19Å; L2324-N2327 PolarHBondContact O-N 3.32Å; L2324-N2327 VanDerWaalsContact O-N 3.16Å; A2325-N2327 VanDerWaalsContact C-N 3.32Å; A2325-N2327 PolarHBondContact O-N 3.44Å; N2327-M2329 VanDerWaalsContact C-N 3.29Å; N2327-M2329 HydrophobicContact CB-CG 4.3Å; N2327-M2329 HydrophobicContact CB-SD 4.02Å; N2327-M2329 WeakPolarHBondContact O-CG 3.23Å; N2327-M2329 PolarHBondContact O-N 3.08Å; N2327-M2329 VanDerWaalsContact O-N 3.14Å; N2327-S2338 WeakPolarHBondContact ND2-CB 3.34Å; N2327-S2338 PolarHBondContact ND2-O 3.39Å; N2327-S2338 PolarHBondContact ND2-OG 3.16Å; N2327-S2338 VanDerWaalsContact ND2-OG 3.15Å; N2327-S2338 WeakPolarHBondContact OD1-CB 3.45Å; N2327-S2338 PolarHBondContact OD1-OG 3.39Å; N2327-I2342 HydrophobicContact CB-CD1 3.63Å; N2327-I2342 WeakPolarHBondContact ND2-CD1 3.42Å; N2327-I2342 VanDerWaalsContact ND2-CG1 3.26Å; N2327-I2342 WeakPolarHBondContact ND2-CG1 3.35Å; N2327-I2342 WeakPolarHBondContact OD1-CD1 3.32Å
2328N60.1Low69.8Low112.333 Ų112.33375.5 Ų75.560%0.60139%0.392SS*.  trans-66.9103.9166.6-73.29.7000109.2I2326 D2330 S2334I2326-N2328 PolarHBondContact O-N 3.41Å; N2328-D2330 VanDerWaalsContact C-N 3.26Å; N2328-D2330 PolarHBondContact ND2-OD2 3.47Å; N2328-D2330 PolarHBondContact O-N 3.05Å; N2328-S2334 PolarHBondContact O-OG 3.28Å
2329M59Low70Confident42.6667 Ų42.666773.9 Ų73.921%0.2138%0.378CS..  trans-86.625.2-177.2-66.8-63.8-81.800112.4N2327 N2331 K2335 S2338 N2739 C2744N2327-M2329 VanDerWaalsContact C-N 3.29Å; N2327-M2329 HydrophobicContact CB-CG 4.3Å; N2327-M2329 HydrophobicContact CB-SD 4.02Å; N2327-M2329 WeakPolarHBondContact O-CG 3.23Å; N2327-M2329 PolarHBondContact O-N 3.08Å; N2327-M2329 VanDerWaalsContact O-N 3.14Å; M2329-N2331 PolarHBondContact O-N 3.16Å; M2329-K2335 HydrophobicContact CB-CD 4.37Å; M2329-K2335 HydrophobicContact CB-CG 3.94Å; M2329-K2335 HydrophobicContact CE-CB 3.4Å; M2329-K2335 HydrophobicContact CE-CD 4.06Å; M2329-K2335 HydrophobicContact CE-CG 4.05Å; M2329-K2335 HydrophobicContact CG-CG 4.42Å; M2329-K2335 WeakPolarHBondContact O-CE 3.28Å; M2329-K2335 PolarHBondContact O-NZ 3.41Å; M2329-K2335 HydrophobicContact SD-CB 4.25Å; M2329-K2335 HydrophobicContact SD-CD 3.87Å; M2329-K2335 HydrophobicContact SD-CG 3.89Å; M2329-S2338 PolarHBondContact SD-OG 3.4Å; M2329-N2739 WeakPolarHBondContact CG-OD1 3.39Å; M2329-C2744 HydrophobicContact CE-CB 3.9Å
2330D62.8Low70.2Confident99.3333 Ų99.333375.4 Ų75.453%0.53138%0.384SS..THydrogen-bonded Turntrans-72.5-32.3-166.4-55.7-22.4000113.3N2328N2328-D2330 VanDerWaalsContact C-N 3.26Å; N2328-D2330 PolarHBondContact ND2-OD2 3.47Å; N2328-D2330 PolarHBondContact O-N 3.05Å
2331N66.4Low70Confident105.333 Ų105.33380.8 Ų80.856%0.56341%0.408SS*.  trans-128.8134.7-177-68.6-39.8000112.1M2329 Y2333 S2334 K2335M2329-N2331 PolarHBondContact O-N 3.16Å; N2331-Y2333 VanDerWaalsContact C-N 3.26Å; N2331-Y2333 PolarHBondContact O-N 3.41Å; N2331-S2334 PolarHBondContact O-N 3.2Å; N2331-S2334 PolarHBondContact O-OG 3.01Å; N2331-S2334 VanDerWaalsContact O-OG 3.04Å; N2331-K2335 WeakPolarHBondContact O-CG 3.35Å; N2331-K2335 PolarHBondContact O-N 3.27Å
2332D66.7Low70.1Confident78 Ų7873.5 Ų73.542%0.41738%0.38SS..Hα-helixtrans-56.4-33.4179.8-64.4-30.5000113.4S2334 K2335D2332-S2334 VanDerWaalsContact C-N 3.34Å; D2332-S2334 PolarHBondContact O-N 3.44Å; D2332-K2335 IonicContact OD1-NZ 3.09Å; D2332-K2335 PolarHBondContact OD1-NZ 3.18Å
2333Y67.7Low70.4Confident197.667 Ų197.66770 Ų7078%0.77537%0.365SS*.Hα-helixtrans-73.8-24.4177.9-61.2-76.8000114.3N2331 P2337N2331-Y2333 VanDerWaalsContact C-N 3.26Å; N2331-Y2333 PolarHBondContact O-N 3.41Å; Y2333-P2337 VanDerWaalsContact O-CD 3.32Å; Y2333-P2337 WeakPolarHBondContact O-CD 3.34Å; Y2333-P2337 WeakPolarHBondContact O-CG 3.31Å
2334S69.9Low70.7Confident46 Ų4672.2 Ų72.232%0.32237%0.374SS..Hα-helixtrans-93-24.3-178.8620000113.5N2328 N2331 D2332 I2336 P2337 S2338N2328-S2334 PolarHBondContact O-OG 3.28Å; N2331-S2334 PolarHBondContact O-N 3.2Å; N2331-S2334 PolarHBondContact O-OG 3.01Å; N2331-S2334 VanDerWaalsContact O-OG 3.04Å; D2332-S2334 VanDerWaalsContact C-N 3.34Å; D2332-S2334 PolarHBondContact O-N 3.44Å; S2334-I2336 VanDerWaalsContact C-N 3.32Å; S2334-I2336 PolarHBondContact O-N 3.31Å; S2334-P2337 WeakPolarHBondContact O-CD 3.37Å; S2334-S2338 VanDerWaalsContact O-CB 3.3Å; S2334-S2338 WeakPolarHBondContact O-CB 3.46Å; S2334-S2338 PolarHBondContact O-N 3.27Å; S2334-S2338 PolarHBondContact O-OG 3.21Å
2335K70.6Confident70.8Confident25.3333 Ų25.333372.5 Ų72.511%0.1137%0.374CS..Hα-helixtrans-54.1-50.4-178.6-71.6173.4-171.2165.40112.6M2329 N2331 D2332 S2338 L2339M2329-K2335 HydrophobicContact CB-CD 4.37Å; M2329-K2335 HydrophobicContact CB-CG 3.94Å; M2329-K2335 HydrophobicContact CE-CB 3.4Å; M2329-K2335 HydrophobicContact CE-CD 4.06Å; M2329-K2335 HydrophobicContact CE-CG 4.05Å; M2329-K2335 HydrophobicContact CG-CG 4.42Å; M2329-K2335 WeakPolarHBondContact O-CE 3.28Å; M2329-K2335 PolarHBondContact O-NZ 3.41Å; M2329-K2335 HydrophobicContact SD-CB 4.25Å; M2329-K2335 HydrophobicContact SD-CD 3.87Å; M2329-K2335 HydrophobicContact SD-CG 3.89Å; N2331-K2335 WeakPolarHBondContact O-CG 3.35Å; N2331-K2335 PolarHBondContact O-N 3.27Å; D2332-K2335 IonicContact OD1-NZ 3.09Å; D2332-K2335 PolarHBondContact OD1-NZ 3.18Å; K2335-S2338 PolarHBondContact O-N 3.2Å; K2335-S2338 PolarHBondContact O-OG 3.25Å; K2335-S2338 VanDerWaalsContact O-OG 3.06Å; K2335-L2339 WeakPolarHBondContact O-CB 3.39Å; K2335-L2339 PolarHBondContact O-N 3.26Å
2336I74.1Confident71.2Confident64.3333 Ų64.333369 Ų6933%0.3334%0.344SS..Hα-helixtrans-68.1-52.1-175.7-62.5169.6000111.3S2334 S2338 L2339 F2340 F2804 I2807S2334-I2336 VanDerWaalsContact C-N 3.32Å; S2334-I2336 PolarHBondContact O-N 3.31Å; I2336-S2338 VanDerWaalsContact C-N 3.31Å; I2336-S2338 PolarHBondContact O-N 3.17Å; I2336-L2339 WeakPolarHBondContact O-CB 3.22Å; I2336-L2339 PolarHBondContact O-N 3.11Å; I2336-L2339 VanDerWaalsContact O-N 3.12Å; I2336-F2340 HydrophobicContact CG2-CD2 3.67Å; I2336-F2340 VanDerWaalsContact CG2-CD2 3.49Å; I2336-F2340 HydrophobicContact CG2-CE2 3.53Å; I2336-F2340 WeakPolarHBondContact O-CD2 3.44Å; I2336-F2340 PolarHBondContact O-N 3.19Å; I2336-F2804 HydrophobicContact CG2-CB 3.85Å; I2336-F2804 HydrophobicContact CG2-CD1 3.72Å; I2336-F2804 HydrophobicContact CG2-CD2 4.31Å; I2336-F2804 HydrophobicContact CG2-CE1 4.4Å; I2336-F2804 HydrophobicContact CG2-CG 3.67Å; I2336-I2807 HydrophobicContact CD1-CB 4.13Å; I2336-I2807 HydrophobicContact CD1-CD1 4.28Å; I2336-I2807 HydrophobicContact CD1-CG2 3.63Å; I2336-I2807 HydrophobicContact CG1-CD1 4.46Å; I2336-I2807 HydrophobicContact CG1-CG2 4.5Å; I2336-I2807 HydrophobicContact CG2-CD1 3.56Å
2337P76.5Confident71.9Confident59.3333 Ų59.333367.2 Ų67.239%0.38533%0.332SS..Hα-helixtrans-58.8-35.8175.6-24.732.6000114.1Y2333 S2334 K2341 F2804Y2333-P2337 VanDerWaalsContact O-CD 3.32Å; Y2333-P2337 WeakPolarHBondContact O-CD 3.34Å; Y2333-P2337 WeakPolarHBondContact O-CG 3.31Å; S2334-P2337 WeakPolarHBondContact O-CD 3.37Å; P2337-K2341 WeakPolarHBondContact O-CG 3.33Å; P2337-K2341 PolarHBondContact O-N 3.03Å; P2337-K2341 VanDerWaalsContact O-N 3.16Å; P2337-F2804 HydrophobicContact CB-CE2 4.01Å; P2337-F2804 HydrophobicContact CG-CD2 3.89Å; P2337-F2804 HydrophobicContact CG-CE2 3.75Å
2338S72.5Confident72.6Confident27.3333 Ų27.333366.2 Ų66.219%0.19133%0.327CS..Hα-helixtrans-69.4-41.417776.10000111.4N2327 M2329 S2334 K2335 I2336 F2340 K2341 I2342N2327-S2338 WeakPolarHBondContact ND2-CB 3.34Å; N2327-S2338 PolarHBondContact ND2-O 3.39Å; N2327-S2338 PolarHBondContact ND2-OG 3.16Å; N2327-S2338 VanDerWaalsContact ND2-OG 3.15Å; N2327-S2338 WeakPolarHBondContact OD1-CB 3.45Å; N2327-S2338 PolarHBondContact OD1-OG 3.39Å; M2329-S2338 PolarHBondContact SD-OG 3.4Å; S2334-S2338 VanDerWaalsContact O-CB 3.3Å; S2334-S2338 WeakPolarHBondContact O-CB 3.46Å; S2334-S2338 PolarHBondContact O-N 3.27Å; S2334-S2338 PolarHBondContact O-OG 3.21Å; K2335-S2338 PolarHBondContact O-N 3.2Å; K2335-S2338 PolarHBondContact O-OG 3.25Å; K2335-S2338 VanDerWaalsContact O-OG 3.06Å; I2336-S2338 VanDerWaalsContact C-N 3.31Å; I2336-S2338 PolarHBondContact O-N 3.17Å; S2338-F2340 VanDerWaalsContact C-N 3.32Å; S2338-F2340 PolarHBondContact O-N 3.39Å; S2338-K2341 PolarHBondContact O-N 3.07Å; S2338-I2342 WeakPolarHBondContact O-CG1 3.28Å; S2338-I2342 PolarHBondContact O-N 3.21Å
2339L76Confident73.5Confident40.3333 Ų40.333362.5 Ų62.521%0.21131%0.306CS..Hα-helixtrans-59.7-47.2175.4-169.176.9000111.2L2324 K2335 I2336 K2341 I2342 I2343 V2770 I2774L2324-L2339 HydrophobicContact CD2-CD1 4.07Å; K2335-L2339 WeakPolarHBondContact O-CB 3.39Å; K2335-L2339 PolarHBondContact O-N 3.26Å; I2336-L2339 WeakPolarHBondContact O-CB 3.22Å; I2336-L2339 PolarHBondContact O-N 3.11Å; I2336-L2339 VanDerWaalsContact O-N 3.12Å; L2339-K2341 VanDerWaalsContact C-N 3.3Å; L2339-K2341 PolarHBondContact O-N 3.15Å; L2339-I2342 CarbonylContact O-C 3.58Å; L2339-I2342 WeakPolarHBondContact O-CA 3.11Å; L2339-I2342 PolarHBondContact O-N 3.19Å; L2339-I2343 HydrophobicContact CD1-CG1 4.49Å; L2339-I2343 HydrophobicContact CD2-CD1 3.88Å; L2339-I2343 HydrophobicContact CG-CD1 3.97Å; L2339-I2343 HydrophobicContact CG-CG1 3.95Å; L2339-I2343 VanDerWaalsContact O-CG1 3.23Å; L2339-I2343 WeakPolarHBondContact O-CG1 3.3Å; L2339-I2343 PolarHBondContact O-N 3.25Å; L2339-I2343 VanDerWaalsContact O-N 3.09Å; L2339-V2770 HydrophobicContact CD1-CG1 3.94Å; L2339-V2770 HydrophobicContact CD2-CG1 4Å; L2339-I2774 HydrophobicContact CD1-CD1 4.18Å; L2339-I2774 HydrophobicContact CD2-CG1 4.1Å; L2339-I2774 HydrophobicContact CG-CD1 4.47Å; L2339-I2774 HydrophobicContact CG-CG1 4.38Å
2340F77.6Confident74.6Confident82 Ų8260.8 Ų60.836%0.3630%0.297SS..Hα-helixtrans-59.5-35.1178.9-87.1-80.1000113.4I2336 S2338 I2342 I2343 I2777 I2799 F2804 W2806 I2807I2336-F2340 HydrophobicContact CG2-CD2 3.67Å; I2336-F2340 VanDerWaalsContact CG2-CD2 3.49Å; I2336-F2340 HydrophobicContact CG2-CE2 3.53Å; I2336-F2340 WeakPolarHBondContact O-CD2 3.44Å; I2336-F2340 PolarHBondContact O-N 3.19Å; S2338-F2340 VanDerWaalsContact C-N 3.32Å; S2338-F2340 PolarHBondContact O-N 3.39Å; F2340-I2342 VanDerWaalsContact C-N 3.31Å; F2340-I2342 PolarHBondContact O-N 2.76Å; F2340-I2343 HydrophobicContact CD1-CD1 4.12Å; F2340-I2343 HydrophobicContact CD2-CD1 4.48Å; F2340-I2343 HydrophobicContact CE1-CD1 4.22Å; F2340-I2343 HydrophobicContact CG-CD1 4.34Å; F2340-I2343 PolarHBondContact O-N 3.33Å; F2340-I2777 HydrophobicContact CD1-CD1 4.34Å; F2340-I2777 HydrophobicContact CE1-CD1 3.58Å; F2340-I2777 HydrophobicContact CE1-CG1 4.24Å; F2340-I2777 HydrophobicContact CE1-CG2 4.48Å; F2340-I2777 HydrophobicContact CE2-CD1 3.84Å; F2340-I2777 HydrophobicContact CZ-CD1 3.31Å; F2340-I2777 HydrophobicContact CZ-CG1 4.2Å; F2340-I2799 HydrophobicContact CE1-CD1 4.42Å; F2340-I2799 HydrophobicContact CE1-CG1 4.07Å; F2340-I2799 HydrophobicContact CE1-CG2 4.28Å; F2340-I2799 HydrophobicContact CZ-CG1 4.45Å; F2340-F2804 HydrophobicContact CB-CE1 4.1Å; F2340-F2804 HydrophobicContact CB-CZ 4.15Å; F2340-F2804 AromaticContact CD1-CE1 3.66Å; F2340-F2804 HydrophobicContact CD1-CE1 3.66Å; F2340-F2804 HydrophobicContact CD1-CZ 4.41Å; F2340-F2804 AromaticContact CD2-CD1 3.81Å; F2340-F2804 HydrophobicContact CD2-CD1 3.81Å; F2340-F2804 AromaticContact CD2-CE1 3.37Å; F2340-F2804 HydrophobicContact CD2-CE1 3.37Å; F2340-F2804 HydrophobicContact CD2-CZ 4.13Å; F2340-F2804 HydrophobicContact CE1-CD1 4.34Å; F2340-F2804 AromaticContact CE1-CE1 3.78Å; F2340-F2804 HydrophobicContact CE1-CE1 3.78Å; F2340-F2804 AromaticContact CE2-CD1 3.52Å; F2340-F2804 HydrophobicContact CE2-CD1 3.52Å; F2340-F2804 AromaticContact CE2-CE1 3.49Å; F2340-F2804 HydrophobicContact CE2-CE1 3.49Å; F2340-F2804 VanDerWaalsContact CE2-CE1 3.49Å; F2340-F2804 HydrophobicContact CG-CD1 4.31Å; F2340-F2804 AromaticContact CG-CE1 3.43Å; F2340-F2804 HydrophobicContact CG-CE1 3.43Å; F2340-F2804 VanDerWaalsContact CG-CE1 3.43Å; F2340-F2804 AromaticContact CG-CZ 3.99Å; F2340-F2804 HydrophobicContact CG-CZ 3.99Å; F2340-F2804 AromaticContact CZ-CD1 3.79Å; F2340-F2804 HydrophobicContact CZ-CD1 3.79Å; F2340-F2804 AromaticContact CZ-CE1 3.67Å; F2340-F2804 HydrophobicContact CZ-CE1 3.67Å; F2340-W2806 AromaticContact CZ-CZ2 4Å; F2340-W2806 HydrophobicContact CZ-CZ2 4Å; F2340-I2807 HydrophobicContact CE2-CD1 3.92Å; F2340-I2807 HydrophobicContact CZ-CD1 4.43Å
2341K75.6Confident75.4Confident162.667 Ų162.66757.4 Ų57.471%0.70728%0.279SS*.Hα-helixtrans-66.2-33.2174-71177.6-178.8-177.90112.9P2337 S2338 L2339P2337-K2341 WeakPolarHBondContact O-CG 3.33Å; P2337-K2341 PolarHBondContact O-N 3.03Å; P2337-K2341 VanDerWaalsContact O-N 3.16Å; S2338-K2341 PolarHBondContact O-N 3.07Å; L2339-K2341 VanDerWaalsContact C-N 3.3Å; L2339-K2341 PolarHBondContact O-N 3.15Å
2342I77.3Confident76Confident19.6667 Ų19.666752.5 Ų52.510%0.10125%0.253CS..Hα-helixtrans-85.9-25.9-178-58.1169.7000111.7L2323 I2326 N2327 S2338 L2339 F2340 E2344 E2345 I2346L2323-I2342 HydrophobicContact CD2-CG2 3.75Å; L2323-I2342 VanDerWaalsContact CD2-CG2 3.48Å; I2326-I2342 HydrophobicContact CG2-CD1 4.17Å; N2327-I2342 HydrophobicContact CB-CD1 3.63Å; N2327-I2342 WeakPolarHBondContact ND2-CD1 3.42Å; N2327-I2342 VanDerWaalsContact ND2-CG1 3.26Å; N2327-I2342 WeakPolarHBondContact ND2-CG1 3.35Å; N2327-I2342 WeakPolarHBondContact OD1-CD1 3.32Å; S2338-I2342 WeakPolarHBondContact O-CG1 3.28Å; S2338-I2342 PolarHBondContact O-N 3.21Å; L2339-I2342 CarbonylContact O-C 3.58Å; L2339-I2342 WeakPolarHBondContact O-CA 3.11Å; L2339-I2342 PolarHBondContact O-N 3.19Å; F2340-I2342 VanDerWaalsContact C-N 3.31Å; F2340-I2342 PolarHBondContact O-N 2.76Å; I2342-E2344 PolarHBondContact O-N 3.21Å; I2342-E2344 VanDerWaalsContact O-N 3.1Å; I2342-E2345 CarbonylContact O-C 3.47Å; I2342-E2345 WeakPolarHBondContact O-CA 3.39Å; I2342-E2345 WeakPolarHBondContact O-CB 3.36Å; I2342-E2345 PolarHBondContact O-N 3.23Å; I2342-I2346 HydrophobicContact CB-CD1 4.44Å; I2342-I2346 HydrophobicContact CG2-CD1 3.76Å; I2342-I2346 HydrophobicContact CG2-CG1 3.85Å; I2342-I2346 WeakPolarHBondContact O-CG1 3.32Å; I2342-I2346 PolarHBondContact O-N 3.24Å
2343I80.4Confident76.6Confident25.3333 Ų25.333349.9 Ų49.913%0.1324%0.242CC..Hα-helixtrans-53.1-38.1-179.4-75.7166.7000111.9L2339 F2340 E2345 I2346 Y2347 I2774 I2777 I2778L2339-I2343 HydrophobicContact CD1-CG1 4.49Å; L2339-I2343 HydrophobicContact CD2-CD1 3.88Å; L2339-I2343 HydrophobicContact CG-CD1 3.97Å; L2339-I2343 HydrophobicContact CG-CG1 3.95Å; L2339-I2343 VanDerWaalsContact O-CG1 3.23Å; L2339-I2343 WeakPolarHBondContact O-CG1 3.3Å; L2339-I2343 PolarHBondContact O-N 3.25Å; L2339-I2343 VanDerWaalsContact O-N 3.09Å; F2340-I2343 HydrophobicContact CD1-CD1 4.12Å; F2340-I2343 HydrophobicContact CD2-CD1 4.48Å; F2340-I2343 HydrophobicContact CE1-CD1 4.22Å; F2340-I2343 HydrophobicContact CG-CD1 4.34Å; F2340-I2343 PolarHBondContact O-N 3.33Å; I2343-E2345 PolarHBondContact O-N 3.36Å; I2343-I2346 PolarHBondContact O-N 3.27Å; I2343-Y2347 VanDerWaalsContact O-CB 3.31Å; I2343-Y2347 WeakPolarHBondContact O-CB 3.39Å; I2343-Y2347 PolarHBondContact O-N 3.2Å; I2343-I2774 HydrophobicContact CG1-CG1 4.37Å; I2343-I2774 HydrophobicContact CG1-CG2 4.4Å; I2343-I2777 HydrophobicContact CD1-CB 4.19Å; I2343-I2777 HydrophobicContact CD1-CD1 3.38Å; I2343-I2777 HydrophobicContact CD1-CG1 4.37Å; I2343-I2777 HydrophobicContact CD1-CG2 4.04Å; I2343-I2777 HydrophobicContact CG2-CG2 4.09Å; I2343-I2778 HydrophobicContact CG2-CG1 4.46Å
2344E76.6Confident77.1Confident65.3333 Ų65.333343.2 Ų43.231%0.30522%0.218SC..Hα-helixtrans-69-36.3179-56.3-166.9151.600112.4I2342 Y2347 A2348 F2485 K2781I2342-E2344 PolarHBondContact O-N 3.21Å; I2342-E2344 VanDerWaalsContact O-N 3.1Å; E2344-Y2347 PolarHBondContact O-N 3.09Å; E2344-A2348 WeakPolarHBondContact O-CB 3.36Å; E2344-A2348 PolarHBondContact O-N 3.36Å; E2344-A2348 VanDerWaalsContact O-N 3.15Å; E2344-F2485 HydrophobicContact CB-CE2 4.24Å; E2344-F2485 HydrophobicContact CB-CZ 4.26Å; E2344-F2485 WeakPolarHBondContact OE2-CE1 3.49Å; E2344-F2485 WeakPolarHBondContact OE2-CE2 3.43Å; E2344-F2485 WeakPolarHBondContact OE2-CZ 3.46Å; E2344-K2781 IonicContact OE1-NZ 3.46Å; E2344-K2781 PolarHBondContact OE1-NZ 3.19Å
2345E76.4Confident77.4Confident77 Ų7742 Ų4236%0.3621%0.207SC..Hα-helixtrans-69.8-40.3173.7-55.8-162.4150.400111.2I2342 I2343 Y2347 A2348 E2349 K2481I2342-E2345 CarbonylContact O-C 3.47Å; I2342-E2345 WeakPolarHBondContact O-CA 3.39Å; I2342-E2345 WeakPolarHBondContact O-CB 3.36Å; I2342-E2345 PolarHBondContact O-N 3.23Å; I2343-E2345 PolarHBondContact O-N 3.36Å; E2345-Y2347 VanDerWaalsContact C-N 3.34Å; E2345-Y2347 PolarHBondContact O-N 3.35Å; E2345-A2348 PolarHBondContact O-N 3.16Å; E2345-E2349 WeakPolarHBondContact O-CB 3.49Å; E2345-E2349 WeakPolarHBondContact O-CG 3.44Å; E2345-E2349 PolarHBondContact O-N 3.12Å; E2345-K2481 IonicContact OE1-NZ 3.42Å; E2345-K2481 PolarHBondContact OE1-NZ 3.43Å
2346I79.8Confident77.6Confident6.66667 Ų6.6666741.4 Ų41.43%0.03421%0.205CC..Hα-helixtrans-62.3-44.6174.8-66.5167.6000110.6L2315 L2323 I2342 I2343 A2348 E2349 M2350 W2771 I2774L2315-I2346 HydrophobicContact CD1-CG2 3.72Å; L2315-I2346 HydrophobicContact CD2-CG2 4.23Å; L2323-I2346 HydrophobicContact CB-CG1 4.26Å; L2323-I2346 HydrophobicContact CD1-CD1 3.73Å; L2323-I2346 VanDerWaalsContact CD1-CD1 3.42Å; L2323-I2346 HydrophobicContact CD1-CG1 3.89Å; L2323-I2346 HydrophobicContact CD2-CD1 4.03Å; L2323-I2346 HydrophobicContact CD2-CG1 3.98Å; L2323-I2346 HydrophobicContact CG-CD1 4.18Å; L2323-I2346 HydrophobicContact CG-CG1 4.4Å; I2342-I2346 HydrophobicContact CB-CD1 4.44Å; I2342-I2346 HydrophobicContact CG2-CD1 3.76Å; I2342-I2346 HydrophobicContact CG2-CG1 3.85Å; I2342-I2346 WeakPolarHBondContact O-CG1 3.32Å; I2342-I2346 PolarHBondContact O-N 3.24Å; I2343-I2346 PolarHBondContact O-N 3.27Å; I2346-A2348 PolarHBondContact O-N 2.94Å; I2346-E2349 CarbonylContact O-C 3.5Å; I2346-E2349 WeakPolarHBondContact O-CB 3.35Å; I2346-E2349 PolarHBondContact O-N 3.25Å; I2346-E2349 VanDerWaalsContact O-N 3.14Å; I2346-M2350 HydrophobicContact CG2-CE 3.72Å; I2346-M2350 VanDerWaalsContact CG2-CE 3.5Å; I2346-M2350 HydrophobicContact CG2-CG 4.41Å; I2346-M2350 HydrophobicContact CG2-SD 4.22Å; I2346-M2350 VanDerWaalsContact O-CG 3.32Å; I2346-M2350 WeakPolarHBondContact O-CG 3.34Å; I2346-M2350 PolarHBondContact O-N 3.1Å; I2346-W2771 HydrophobicContact CD1-CH2 4.43Å; I2346-W2771 HydrophobicContact CD1-CZ3 4.29Å; I2346-I2774 HydrophobicContact CD1-CD1 4.27Å; I2346-I2774 HydrophobicContact CG2-CG2 4.49Å
2347Y81.8Confident77.7Confident51.6667 Ų51.666741.8 Ų41.820%0.20321%0.207CC..Hα-helixtrans-65.3-41.7-180-172.9-117.8000111.7I2311 I2343 E2344 E2345 E2349 M2350 L2351 L2484 I2778 T2782I2311-Y2347 HydrophobicContact CD1-CE2 4.12Å; I2311-Y2347 HydrophobicContact CG2-CE2 4.45Å; I2343-Y2347 VanDerWaalsContact O-CB 3.31Å; I2343-Y2347 WeakPolarHBondContact O-CB 3.39Å; I2343-Y2347 PolarHBondContact O-N 3.2Å; E2344-Y2347 PolarHBondContact O-N 3.09Å; E2345-Y2347 VanDerWaalsContact C-N 3.34Å; E2345-Y2347 PolarHBondContact O-N 3.35Å; Y2347-E2349 VanDerWaalsContact C-N 3.34Å; Y2347-E2349 PolarHBondContact O-N 3.15Å; Y2347-M2350 HydrophobicContact CD2-CE 4.07Å; Y2347-M2350 PolarHBondContact O-N 3.13Å; Y2347-L2351 HydrophobicContact CD1-CD1 3.97Å; Y2347-L2351 HydrophobicContact CD1-CG 4.49Å; Y2347-L2351 HydrophobicContact CE1-CD1 3.61Å; Y2347-L2351 VanDerWaalsContact CE1-CD1 3.43Å; Y2347-L2351 HydrophobicContact CE1-CG 4.27Å; Y2347-L2351 HydrophobicContact CE2-CD1 4.29Å; Y2347-L2351 HydrophobicContact CE2-CG 4.28Å; Y2347-L2351 HydrophobicContact CG-CD1 4.5Å; Y2347-L2351 WeakPolarHBondContact O-CG 3.13Å; Y2347-L2351 PolarHBondContact O-N 3.32Å; Y2347-L2484 HydrophobicContact CD1-CD1 3.88Å; Y2347-L2484 HydrophobicContact CD1-CD2 3.71Å; Y2347-L2484 HydrophobicContact CD1-CG 4.45Å; Y2347-L2484 HydrophobicContact CE1-CD2 3.79Å; Y2347-I2778 HydrophobicContact CD2-CD1 4.28Å; Y2347-I2778 HydrophobicContact CD2-CG1 4.22Å; Y2347-I2778 HydrophobicContact CD2-CG2 3.81Å; Y2347-I2778 HydrophobicContact CE2-CG2 3.77Å; Y2347-T2782 HydrophobicContact CE2-CG2 4.43Å
2348A77.4Confident77.5Confident1.33333 Ų1.3333342.3 Ų42.31%0.01121%0.206CC..Hα-helixtrans-62.9-37.8172.500000112.6E2344 E2345 I2346 C2352 I2477 L2484E2344-A2348 WeakPolarHBondContact O-CB 3.36Å; E2344-A2348 PolarHBondContact O-N 3.36Å; E2344-A2348 VanDerWaalsContact O-N 3.15Å; E2345-A2348 PolarHBondContact O-N 3.16Å; I2346-A2348 PolarHBondContact O-N 2.94Å; A2348-C2352 VanDerWaalsContact O-CB 3.29Å; A2348-C2352 WeakPolarHBondContact O-CB 3.34Å; A2348-C2352 PolarHBondContact O-N 3.29Å; A2348-I2477 HydrophobicContact CB-CG2 4.44Å; A2348-L2484 HydrophobicContact CB-CD1 4.13Å
2349E78.7Confident77.6Confident34.6667 Ų34.666742.3 Ų42.316%0.16220%0.203CC..Hα-helixtrans-66.6-40.7174.5-146.9143-165.700112L2315 K2319 L2323 E2345 I2346 Y2347 C2352 A2353 Q2473 I2477L2315-E2349 HydrophobicContact CD1-CG 4.13Å; K2319-E2349 WeakPolarHBondContact CE-OE1 3.45Å; K2319-E2349 WeakPolarHBondContact CE-OE2 3.47Å; K2319-E2349 VanDerWaalsContact NZ-CD 3.29Å; K2319-E2349 IonicContact NZ-OE1 3.44Å; K2319-E2349 PolarHBondContact NZ-OE1 3.16Å; K2319-E2349 IonicContact NZ-OE2 2.91Å; K2319-E2349 PolarHBondContact NZ-OE2 3.08Å; L2323-E2349 HydrophobicContact CD1-CG 4.38Å; E2345-E2349 WeakPolarHBondContact O-CB 3.49Å; E2345-E2349 WeakPolarHBondContact O-CG 3.44Å; E2345-E2349 PolarHBondContact O-N 3.12Å; I2346-E2349 CarbonylContact O-C 3.5Å; I2346-E2349 WeakPolarHBondContact O-CB 3.35Å; I2346-E2349 PolarHBondContact O-N 3.25Å; I2346-E2349 VanDerWaalsContact O-N 3.14Å; Y2347-E2349 VanDerWaalsContact C-N 3.34Å; Y2347-E2349 PolarHBondContact O-N 3.15Å; E2349-C2352 WeakPolarHBondContact O-CB 3.32Å; E2349-C2352 PolarHBondContact O-N 2.85Å; E2349-A2353 WeakPolarHBondContact O-CB 3.31Å; E2349-A2353 PolarHBondContact O-N 3.17Å; E2349-Q2473 PolarHBondContact OE1-NE2 2.68Å; E2349-I2477 WeakPolarHBondContact OE2-CD1 3.46Å
2350M82.4Confident77.5Confident7 Ų744.9 Ų44.93%0.03422%0.223CC..Hα-helixtrans-65-44.7176.4-71.1178.4-152.100112.2I2311 C2312 L2315 I2346 Y2347 C2352 A2353 E2354 Y2775 I2778I2311-M2350 HydrophobicContact CG1-CB 4.12Å; I2311-M2350 HydrophobicContact CG2-CB 3.72Å; I2311-M2350 HydrophobicContact CG2-CE 4.1Å; I2311-M2350 HydrophobicContact CG2-SD 4.24Å; C2312-M2350 HydrophobicContact CB-CE 4.42Å; L2315-M2350 HydrophobicContact CB-CE 4.05Å; L2315-M2350 HydrophobicContact CB-CG 4.3Å; L2315-M2350 HydrophobicContact CB-SD 4.05Å; L2315-M2350 HydrophobicContact CD2-CE 3.88Å; L2315-M2350 HydrophobicContact CG-CE 4.36Å; I2346-M2350 HydrophobicContact CG2-CE 3.72Å; I2346-M2350 VanDerWaalsContact CG2-CE 3.5Å; I2346-M2350 HydrophobicContact CG2-CG 4.41Å; I2346-M2350 HydrophobicContact CG2-SD 4.22Å; I2346-M2350 VanDerWaalsContact O-CG 3.32Å; I2346-M2350 WeakPolarHBondContact O-CG 3.34Å; I2346-M2350 PolarHBondContact O-N 3.1Å; Y2347-M2350 HydrophobicContact CD2-CE 4.07Å; Y2347-M2350 PolarHBondContact O-N 3.13Å; M2350-C2352 VanDerWaalsContact C-N 3.29Å; M2350-C2352 PolarHBondContact O-N 2.96Å; M2350-A2353 PolarHBondContact O-N 3.2Å; M2350-A2353 VanDerWaalsContact O-N 3.14Å; M2350-E2354 PolarHBondContact O-N 3.06Å; M2350-Y2775 HydrophobicContact CE-CD1 4.39Å; M2350-Y2775 HydrophobicContact CE-CE1 3.95Å; M2350-I2778 HydrophobicContact CE-CD1 3.89Å; M2350-I2778 HydrophobicContact SD-CD1 3.65Å
2351L79.5Confident77.3Confident28 Ų2848.6 Ų48.615%0.14723%0.234CC..Hα-helixtrans-61.9-38.4173.7-73.8170.4000111.7I2311 Y2347 A2353 E2354 H2355 Y2480I2311-L2351 HydrophobicContact CD1-CD2 3.49Å; I2311-L2351 VanDerWaalsContact CD1-CD2 3.47Å; I2311-L2351 HydrophobicContact CD1-CG 3.9Å; Y2347-L2351 HydrophobicContact CD1-CD1 3.97Å; Y2347-L2351 HydrophobicContact CD1-CG 4.49Å; Y2347-L2351 HydrophobicContact CE1-CD1 3.61Å; Y2347-L2351 VanDerWaalsContact CE1-CD1 3.43Å; Y2347-L2351 HydrophobicContact CE1-CG 4.27Å; Y2347-L2351 HydrophobicContact CE2-CD1 4.29Å; Y2347-L2351 HydrophobicContact CE2-CG 4.28Å; Y2347-L2351 HydrophobicContact CG-CD1 4.5Å; Y2347-L2351 WeakPolarHBondContact O-CG 3.13Å; Y2347-L2351 PolarHBondContact O-N 3.32Å; L2351-A2353 VanDerWaalsContact C-N 3.34Å; L2351-E2354 PolarHBondContact O-N 3.23Å; L2351-H2355 WeakPolarHBondContact O-CB 3.37Å; L2351-H2355 PolarHBondContact O-N 3.14Å; L2351-Y2480 HydrophobicContact CB-CD1 4.21Å; L2351-Y2480 HydrophobicContact CB-CD2 4.13Å; L2351-Y2480 HydrophobicContact CB-CE1 4.18Å; L2351-Y2480 HydrophobicContact CB-CE2 4.11Å; L2351-Y2480 HydrophobicContact CB-CG 4.2Å; L2351-Y2480 HydrophobicContact CD1-CD1 4.11Å; L2351-Y2480 HydrophobicContact CD1-CE1 4.42Å; L2351-Y2480 HydrophobicContact CD1-CG 4.39Å
2352C77.6Confident77.3Confident2.33333 Ų2.3333341.2 Ų41.22%0.01620%0.202CC..Hα-helixtrans-63.5-44.2173.6-176.70000111.6A2348 E2349 M2350 H2355 M2356 L2476 I2477 Y2480A2348-C2352 VanDerWaalsContact O-CB 3.29Å; A2348-C2352 WeakPolarHBondContact O-CB 3.34Å; A2348-C2352 PolarHBondContact O-N 3.29Å; E2349-C2352 WeakPolarHBondContact O-CB 3.32Å; E2349-C2352 PolarHBondContact O-N 2.85Å; M2350-C2352 VanDerWaalsContact C-N 3.29Å; M2350-C2352 PolarHBondContact O-N 2.96Å; C2352-H2355 PolarHBondContact O-N 3.11Å; C2352-M2356 WeakPolarHBondContact O-CB 3.33Å; C2352-M2356 VanDerWaalsContact O-CG 3.29Å; C2352-M2356 WeakPolarHBondContact O-CG 3.41Å; C2352-M2356 PolarHBondContact O-N 3.04Å; C2352-L2476 HydrophobicContact CB-CB 4.5Å; C2352-L2476 HydrophobicContact CB-CD2 4.16Å; C2352-I2477 HydrophobicContact CB-CG1 4Å; C2352-Y2480 HydrophobicContact CB-CD2 4.42Å; C2352-Y2480 HydrophobicContact CB-CE2 4.43Å
2353A79.2Confident77.1Confident23.3333 Ų23.333343.2 Ų43.219%0.19321%0.211CC..Hα-helixtrans-62-46.1176.700000111.7E2349 M2350 L2351 H2355 M2356 L2357E2349-A2353 WeakPolarHBondContact O-CB 3.31Å; E2349-A2353 PolarHBondContact O-N 3.17Å; M2350-A2353 PolarHBondContact O-N 3.2Å; M2350-A2353 VanDerWaalsContact O-N 3.14Å; L2351-A2353 VanDerWaalsContact C-N 3.34Å; A2353-H2355 VanDerWaalsContact C-N 3.31Å; A2353-H2355 PolarHBondContact O-N 3.12Å; A2353-M2356 PolarHBondContact O-N 3.28Å; A2353-L2357 VanDerWaalsContact O-CG 3.24Å; A2353-L2357 WeakPolarHBondContact O-CG 3.25Å; A2353-L2357 PolarHBondContact O-N 3.31Å
2354E79.9Confident77Confident57.3333 Ų57.333347.2 Ų47.227%0.26823%0.225SC..Hα-helixtrans-56.6-48.9174-176.4172.1-159.200111.4I2311 Y2314 M2350 L2351 M2356 L2357 I2358I2311-E2354 WeakPolarHBondContact CD1-OE2 3.49Å; Y2314-E2354 HydrophobicContact CD2-CB 3.74Å; Y2314-E2354 HydrophobicContact CD2-CG 4.23Å; Y2314-E2354 HydrophobicContact CE2-CB 3.62Å; Y2314-E2354 VanDerWaalsContact CE2-CD 3.41Å; Y2314-E2354 HydrophobicContact CE2-CG 3.58Å; Y2314-E2354 VanDerWaalsContact CE2-OE1 3.24Å; Y2314-E2354 WeakPolarHBondContact CE2-OE1 3.21Å; Y2314-E2354 HydrophobicContact CG-CB 4.45Å; Y2314-E2354 PolarHBondContact OH-OE1 2.88Å; M2350-E2354 PolarHBondContact O-N 3.06Å; L2351-E2354 PolarHBondContact O-N 3.23Å; E2354-M2356 VanDerWaalsContact C-N 3.31Å; E2354-M2356 PolarHBondContact O-N 3.4Å; E2354-L2357 WeakPolarHBondContact O-CB 3.37Å; E2354-L2357 PolarHBondContact O-N 3.09Å; E2354-L2357 VanDerWaalsContact O-N 3.16Å; E2354-I2358 WeakPolarHBondContact O-CG1 3.44Å; E2354-I2358 PolarHBondContact O-N 3.16Å
2355H75.4Confident76.9Confident21 Ų2147.2 Ų47.210%0.09722%0.224CC..Hα-helixtrans-64.1-35179.1-170.7-65.6000112.8L2351 C2352 A2353 L2357 I2358 H2359 L2476 Y2480L2351-H2355 WeakPolarHBondContact O-CB 3.37Å; L2351-H2355 PolarHBondContact O-N 3.14Å; C2352-H2355 PolarHBondContact O-N 3.11Å; A2353-H2355 VanDerWaalsContact C-N 3.31Å; A2353-H2355 PolarHBondContact O-N 3.12Å; H2355-L2357 VanDerWaalsContact C-N 3.33Å; H2355-I2358 PolarHBondContact O-N 3.01Å; H2355-H2359 AromaticContact CE1-CD2 3.67Å; H2355-H2359 AromaticContact CE1-NE2 3.46Å; H2355-H2359 PolarHBondContact CE1-NE2 3.48Å; H2355-H2359 VanDerWaalsContact CE1-NE2 3.34Å; H2355-H2359 AromaticContact ND1-CD2 3.71Å; H2355-H2359 AromaticContact ND1-NE2 3.88Å; H2355-H2359 PolarHBondContact O-CD2 3.04Å; H2355-L2476 HydrophobicContact CB-CD2 3.85Å; H2355-Y2480 PolarHBondContact CD2-OH 3.12Å; H2355-Y2480 VanDerWaalsContact CD2-OH 3.31Å
2356M75.6Confident76.9Confident13.6667 Ų13.666745.2 Ų45.27%0.06722%0.218CC..Hα-helixtrans-69.2-34176.6-72.3-142.2-68.300111.9C2352 A2353 E2354 I2358 H2359 I2362 H2363 L2476C2352-M2356 WeakPolarHBondContact O-CB 3.33Å; C2352-M2356 VanDerWaalsContact O-CG 3.29Å; C2352-M2356 WeakPolarHBondContact O-CG 3.41Å; C2352-M2356 PolarHBondContact O-N 3.04Å; A2353-M2356 PolarHBondContact O-N 3.28Å; E2354-M2356 VanDerWaalsContact C-N 3.31Å; E2354-M2356 PolarHBondContact O-N 3.4Å; M2356-I2358 VanDerWaalsContact C-N 3.32Å; M2356-I2358 PolarHBondContact O-N 3.02Å; M2356-H2359 PolarHBondContact O-N 3Å; M2356-H2359 VanDerWaalsContact O-N 3.16Å; M2356-I2362 HydrophobicContact CB-CG2 4.41Å; M2356-I2362 HydrophobicContact CE-CG2 3.15Å; M2356-I2362 HydrophobicContact CG-CG2 4.07Å; M2356-I2362 HydrophobicContact SD-CG2 4.05Å; M2356-I2362 WeakPolarHBondContact SD-CG2 3.44Å; M2356-H2363 WeakPolarHBondContact O-CB 3.44Å; M2356-L2476 HydrophobicContact CG-CD1 4.36Å
2357L75.2Confident76.6Confident71.3333 Ų71.333350.3 Ų50.337%0.37325%0.245SC..Hα-helixtrans-67.4-29176.9-72166000113.2Y2314 A2353 E2354 H2355 H2359 H2363Y2314-L2357 HydrophobicContact CD1-CD1 3.22Å; Y2314-L2357 HydrophobicContact CE1-CD1 3.37Å; Y2314-L2357 VanDerWaalsContact CE1-CD1 3.47Å; Y2314-L2357 HydrophobicContact CG-CD1 4.17Å; A2353-L2357 VanDerWaalsContact O-CG 3.24Å; A2353-L2357 WeakPolarHBondContact O-CG 3.25Å; A2353-L2357 PolarHBondContact O-N 3.31Å; E2354-L2357 WeakPolarHBondContact O-CB 3.37Å; E2354-L2357 PolarHBondContact O-N 3.09Å; E2354-L2357 VanDerWaalsContact O-N 3.16Å; H2355-L2357 VanDerWaalsContact C-N 3.33Å; L2357-H2359 VanDerWaalsContact C-N 3.25Å; L2357-H2359 PolarHBondContact O-N 3.39Å; L2357-H2359 VanDerWaalsContact O-N 3.17Å; L2357-H2363 WeakPolarHBondContact CD2-CE1 3.34Å; L2357-H2363 WeakPolarHBondContact CD2-ND1 3.45Å
2358I73.6Confident76.4Confident69.6667 Ų69.666752.4 Ų52.436%0.35725%0.252SS..THydrogen-bonded Turntrans-64.1-24.5176.1-64.2169.5000111.8E2354 H2355 M2356 P2360E2354-I2358 WeakPolarHBondContact O-CG1 3.44Å; E2354-I2358 PolarHBondContact O-N 3.16Å; H2355-I2358 PolarHBondContact O-N 3.01Å; M2356-I2358 VanDerWaalsContact C-N 3.32Å; M2356-I2358 PolarHBondContact O-N 3.02Å; I2358-P2360 WeakPolarHBondContact O-CD 3.44Å
2359H74.2Confident76.4Confident28.3333 Ų28.333353.5 Ų53.513%0.13126%0.26CS..SBendtrans-108.5104.6-177.3-70.2-63.5000112.3H2355 M2356 L2357 W2361 I2362 H2363H2355-H2359 AromaticContact CE1-CD2 3.67Å; H2355-H2359 AromaticContact CE1-NE2 3.46Å; H2355-H2359 PolarHBondContact CE1-NE2 3.48Å; H2355-H2359 VanDerWaalsContact CE1-NE2 3.34Å; H2355-H2359 AromaticContact ND1-CD2 3.71Å; H2355-H2359 AromaticContact ND1-NE2 3.88Å; H2355-H2359 PolarHBondContact O-CD2 3.04Å; M2356-H2359 PolarHBondContact O-N 3Å; M2356-H2359 VanDerWaalsContact O-N 3.16Å; L2357-H2359 VanDerWaalsContact C-N 3.25Å; L2357-H2359 PolarHBondContact O-N 3.39Å; L2357-H2359 VanDerWaalsContact O-N 3.17Å; H2359-W2361 VanDerWaalsContact C-N 3.32Å; H2359-W2361 PolarHBondContact O-N 3.12Å; H2359-W2361 VanDerWaalsContact O-N 3.1Å; H2359-I2362 HydrophobicContact CB-CB 4.05Å; H2359-I2362 HydrophobicContact CB-CD1 3.63Å; H2359-I2362 HydrophobicContact CB-CG1 3.93Å; H2359-I2362 PolarHBondContact O-N 3.02Å; H2359-I2362 VanDerWaalsContact O-N 3.13Å; H2359-H2363 WeakPolarHBondContact O-CB 3.38Å; H2359-H2363 PolarHBondContact O-N 3.14Å
2360P74.3Confident76.3Confident95 Ų9558.7 Ų58.762%0.61728%0.284SS*.Hα-helixtrans-57.7-40.4-169.6-13.514.2000115.2I2358 W2364I2358-P2360 WeakPolarHBondContact O-CD 3.44Å; P2360-W2364 VanDerWaalsContact O-CB 3.3Å; P2360-W2364 WeakPolarHBondContact O-CB 3.34Å; P2360-W2364 PolarHBondContact O-N 3.09Å
2361W72.3Confident76.2Confident158.667 Ų158.66763.2 Ų63.260%0.60130%0.301SS*.Hα-helixtrans-70.4-39.218069.4-83.3000112.3H2359 W2364 F2365H2359-W2361 VanDerWaalsContact C-N 3.32Å; H2359-W2361 PolarHBondContact O-N 3.12Å; H2359-W2361 VanDerWaalsContact O-N 3.1Å; W2361-W2364 PolarHBondContact O-N 3.38Å; W2361-F2365 HydrophobicContact CE3-CD2 4.22Å; W2361-F2365 WeakPolarHBondContact O-CB 2.99Å; W2361-F2365 VanDerWaalsContact O-CD2 3.26Å; W2361-F2365 WeakPolarHBondContact O-CD2 3.3Å; W2361-F2365 PolarHBondContact O-N 2.92Å; W2361-F2365 VanDerWaalsContact O-N 3.09Å
2362I75Confident76.3Confident7.66667 Ų7.6666762.2 Ų62.24%0.03930%0.296CS..Hα-helixtrans-67.8-44.3177.1-57.2175.5000109.6M2356 H2359 W2364 F2365 S2366 K2472M2356-I2362 HydrophobicContact CB-CG2 4.41Å; M2356-I2362 HydrophobicContact CE-CG2 3.15Å; M2356-I2362 HydrophobicContact CG-CG2 4.07Å; M2356-I2362 HydrophobicContact SD-CG2 4.05Å; M2356-I2362 WeakPolarHBondContact SD-CG2 3.44Å; H2359-I2362 HydrophobicContact CB-CB 4.05Å; H2359-I2362 HydrophobicContact CB-CD1 3.63Å; H2359-I2362 HydrophobicContact CB-CG1 3.93Å; H2359-I2362 PolarHBondContact O-N 3.02Å; H2359-I2362 VanDerWaalsContact O-N 3.13Å; I2362-W2364 VanDerWaalsContact C-N 3.33Å; I2362-W2364 PolarHBondContact O-N 3.02Å; I2362-F2365 PolarHBondContact O-N 3.09Å; I2362-S2366 VanDerWaalsContact O-CB 3.22Å; I2362-S2366 WeakPolarHBondContact O-CB 3.3Å; I2362-S2366 PolarHBondContact O-N 3.17Å; I2362-K2472 HydrophobicContact CD1-CD 4.02Å; I2362-K2472 VanDerWaalsContact CD1-CE 3.47Å
2363H74.9Confident76.5Confident62.3333 Ų62.333363.4 Ų63.429%0.28931%0.305SS..Hα-helixtrans-56.5-48.7175.1177.850.7000111.6M2356 L2357 H2359 F2365 S2366 L2367M2356-H2363 WeakPolarHBondContact O-CB 3.44Å; L2357-H2363 WeakPolarHBondContact CD2-CE1 3.34Å; L2357-H2363 WeakPolarHBondContact CD2-ND1 3.45Å; H2359-H2363 WeakPolarHBondContact O-CB 3.38Å; H2359-H2363 PolarHBondContact O-N 3.14Å; H2363-F2365 VanDerWaalsContact C-N 3.3Å; H2363-F2365 PolarHBondContact O-N 3.26Å; H2363-S2366 PolarHBondContact O-N 3Å; H2363-L2367 WeakPolarHBondContact CE1-CD1 3.23Å; H2363-L2367 WeakPolarHBondContact NE2-CD1 3.31Å; H2363-L2367 WeakPolarHBondContact O-CB 3.28Å; H2363-L2367 WeakPolarHBondContact O-CG 3.41Å; H2363-L2367 PolarHBondContact O-N 3.32Å
2364W76.8Confident76.7Confident109.667 Ų109.66763 Ų6342%0.41530%0.299SS..Hα-helixtrans-58.3-43.7178.3-175.1100000112.6P2360 W2361 I2362 R2368P2360-W2364 VanDerWaalsContact O-CB 3.3Å; P2360-W2364 WeakPolarHBondContact O-CB 3.34Å; P2360-W2364 PolarHBondContact O-N 3.09Å; W2361-W2364 PolarHBondContact O-N 3.38Å; I2362-W2364 VanDerWaalsContact C-N 3.33Å; I2362-W2364 PolarHBondContact O-N 3.02Å; W2364-R2368 VanDerWaalsContact CE2-CZ 3.49Å; W2364-R2368 VanDerWaalsContact NE1-CZ 3.31Å; W2364-R2368 VanDerWaalsContact NE1-NH1 3.19Å; W2364-R2368 WeakPolarHBondContact O-CG 3.46Å; W2364-R2368 PolarHBondContact O-N 2.9Å; W2364-R2368 PolarHBondContact O-NH1 3.37Å; W2364-R2368 VanDerWaalsContact O-NH1 3.07Å
2365F75.8Confident76.8Confident64.3333 Ų64.333360.4 Ų60.428%0.28229%0.288SS..Hα-helixtrans-71.9-39.8177.6-93.4-69.2000112.5W2361 I2362 H2363 R2368 S2369 I2372 I2469W2361-F2365 HydrophobicContact CE3-CD2 4.22Å; W2361-F2365 WeakPolarHBondContact O-CB 2.99Å; W2361-F2365 VanDerWaalsContact O-CD2 3.26Å; W2361-F2365 WeakPolarHBondContact O-CD2 3.3Å; W2361-F2365 PolarHBondContact O-N 2.92Å; W2361-F2365 VanDerWaalsContact O-N 3.09Å; I2362-F2365 PolarHBondContact O-N 3.09Å; H2363-F2365 VanDerWaalsContact C-N 3.3Å; H2363-F2365 PolarHBondContact O-N 3.26Å; F2365-R2368 CarbonylContact O-C 3.57Å; F2365-R2368 PolarHBondContact O-N 3.36Å; F2365-R2368 VanDerWaalsContact O-N 3.16Å; F2365-S2369 WeakPolarHBondContact O-CA 3.3Å; F2365-S2369 PolarHBondContact O-N 3.13Å; F2365-I2372 HydrophobicContact CD1-CD1 3.68Å; F2365-I2372 HydrophobicContact CE1-CD1 4.07Å; F2365-I2469 HydrophobicContact CB-CD1 3.63Å; F2365-I2469 HydrophobicContact CB-CG1 4Å; F2365-I2469 HydrophobicContact CD1-CD1 3.85Å; F2365-I2469 HydrophobicContact CG-CD1 4.08Å
2366S76.1Confident77.3Confident35.6667 Ų35.666759.5 Ų59.525%0.24928%0.283CS..Hα-helixtrans-65.8-43.9-180-176.60000111.8I2362 H2363 R2368 S2369I2362-S2366 VanDerWaalsContact O-CB 3.22Å; I2362-S2366 WeakPolarHBondContact O-CB 3.3Å; I2362-S2366 PolarHBondContact O-N 3.17Å; H2363-S2366 PolarHBondContact O-N 3Å; S2366-R2368 PolarHBondContact O-N 3.26Å; S2366-R2368 VanDerWaalsContact O-N 3.12Å; S2366-S2369 WeakPolarHBondContact O-CB 3.46Å; S2366-S2369 PolarHBondContact O-N 3.16Å
2367L73.7Confident77.9Confident112.333 Ų112.33359.7 Ų59.759%0.58828%0.284SS*.Hα-helixtrans-58.7-31.3174.2-79.1172.3000112.5H2363H2363-L2367 WeakPolarHBondContact CE1-CD1 3.23Å; H2363-L2367 WeakPolarHBondContact NE2-CD1 3.31Å; H2363-L2367 WeakPolarHBondContact O-CB 3.28Å; H2363-L2367 WeakPolarHBondContact O-CG 3.41Å; H2363-L2367 PolarHBondContact O-N 3.32Å
2368R76.1Confident78.3Confident96.3333 Ų96.333357.9 Ų57.936%0.36427%0.272SS..THydrogen-bonded Turntrans-103.45.2-175.5-63.9178.2-175169.3-4.3113.6W2364 F2365 S2366 Q2370 W2371 I2372W2364-R2368 VanDerWaalsContact CE2-CZ 3.49Å; W2364-R2368 VanDerWaalsContact NE1-CZ 3.31Å; W2364-R2368 VanDerWaalsContact NE1-NH1 3.19Å; W2364-R2368 WeakPolarHBondContact O-CG 3.46Å; W2364-R2368 PolarHBondContact O-N 2.9Å; W2364-R2368 PolarHBondContact O-NH1 3.37Å; W2364-R2368 VanDerWaalsContact O-NH1 3.07Å; F2365-R2368 CarbonylContact O-C 3.57Å; F2365-R2368 PolarHBondContact O-N 3.36Å; F2365-R2368 VanDerWaalsContact O-N 3.16Å; S2366-R2368 PolarHBondContact O-N 3.26Å; S2366-R2368 VanDerWaalsContact O-N 3.12Å; R2368-Q2370 VanDerWaalsContact C-N 3.3Å; R2368-Q2370 PolarHBondContact O-N 3.08Å; R2368-W2371 WeakPolarHBondContact O-CA 3.41Å; R2368-W2371 VanDerWaalsContact O-CB 3.3Å; R2368-W2371 WeakPolarHBondContact O-CB 3.33Å; R2368-W2371 PolarHBondContact O-N 3.12Å; R2368-I2372 HydrophobicContact CB-CD1 4.28Å; R2368-I2372 HydrophobicContact CB-CG1 4.49Å; R2368-I2372 WeakPolarHBondContact O-CG1 3.23Å; R2368-I2372 PolarHBondContact O-N 3.38Å
2369S77.2Confident78.9Confident24 Ų2454.8 Ų54.817%0.16826%0.256CS..Hα-helixtrans-59.2-40-175.2173.50000112.4F2365 S2366 W2371 I2372 S2373 N2466F2365-S2369 WeakPolarHBondContact O-CA 3.3Å; F2365-S2369 PolarHBondContact O-N 3.13Å; S2366-S2369 WeakPolarHBondContact O-CB 3.46Å; S2366-S2369 PolarHBondContact O-N 3.16Å; S2369-W2371 VanDerWaalsContact C-N 3.35Å; S2369-W2371 PolarHBondContact O-N 3.17Å; S2369-I2372 PolarHBondContact O-N 3Å; S2369-S2373 WeakPolarHBondContact O-CB 3.28Å; S2369-S2373 PolarHBondContact O-N 3.24Å; S2369-N2466 PolarHBondContact OG-OD1 3.35Å
2370Q78.2Confident79.6Confident145 Ų14553.6 Ų53.668%0.67825%0.25SS*.Hα-helixtrans-60.9-46174.3-170.3141.3400111.4R2368 I2372 S2373 D2374R2368-Q2370 VanDerWaalsContact C-N 3.3Å; R2368-Q2370 PolarHBondContact O-N 3.08Å; Q2370-I2372 VanDerWaalsContact C-N 3.34Å; Q2370-I2372 PolarHBondContact O-N 3.11Å; Q2370-S2373 WeakPolarHBondContact O-CB 3.37Å; Q2370-S2373 PolarHBondContact O-N 3.21Å; Q2370-D2374 WeakPolarHBondContact O-CB 3.11Å; Q2370-D2374 VanDerWaalsContact O-CG 3.32Å; Q2370-D2374 PolarHBondContact O-N 3.04Å
2371W79Confident80.2Confident100.333 Ų100.33352 Ų5238%0.3824%0.237SC..Hα-helixtrans-62.4-41.2177-149.491.8000112.7R2368 S2369 S2373 D2374 A2375 V2431 F2462R2368-W2371 WeakPolarHBondContact O-CA 3.41Å; R2368-W2371 VanDerWaalsContact O-CB 3.3Å; R2368-W2371 WeakPolarHBondContact O-CB 3.33Å; R2368-W2371 PolarHBondContact O-N 3.12Å; S2369-W2371 VanDerWaalsContact C-N 3.35Å; S2369-W2371 PolarHBondContact O-N 3.17Å; W2371-S2373 VanDerWaalsContact C-N 3.33Å; W2371-D2374 PolarHBondContact O-N 2.99Å; W2371-A2375 HydrophobicContact CH2-CB 4.45Å; W2371-A2375 HydrophobicContact CZ3-CB 4.38Å; W2371-A2375 VanDerWaalsContact O-CB 3.27Å; W2371-A2375 WeakPolarHBondContact O-CB 3.42Å; W2371-A2375 PolarHBondContact O-N 3.13Å; W2371-V2431 VanDerWaalsContact NE1-CG2 3.27Å; W2371-F2462 HydrophobicContact CH2-CE2 4.41Å; W2371-F2462 HydrophobicContact CZ3-CE2 4.16Å
2372I81.4Confident80.8Confident8 Ų845.5 Ų45.54%0.04122%0.215CC..Hα-helixtrans-65.3-40.4176.5-64.4167.6000110.3F2365 R2368 S2369 Q2370 A2375 S2376 F2462 N2466 I2469F2365-I2372 HydrophobicContact CD1-CD1 3.68Å; F2365-I2372 HydrophobicContact CE1-CD1 4.07Å; R2368-I2372 HydrophobicContact CB-CD1 4.28Å; R2368-I2372 HydrophobicContact CB-CG1 4.49Å; R2368-I2372 WeakPolarHBondContact O-CG1 3.23Å; R2368-I2372 PolarHBondContact O-N 3.38Å; S2369-I2372 PolarHBondContact O-N 3Å; Q2370-I2372 VanDerWaalsContact C-N 3.34Å; Q2370-I2372 PolarHBondContact O-N 3.11Å; I2372-A2375 PolarHBondContact O-N 2.9Å; I2372-S2376 WeakPolarHBondContact O-CB 3.42Å; I2372-S2376 PolarHBondContact O-N 3.33Å; I2372-S2376 PolarHBondContact O-OG 3.19Å; I2372-F2462 HydrophobicContact CG2-CB 4.2Å; I2372-F2462 HydrophobicContact CG2-CD2 4.36Å; I2372-F2462 HydrophobicContact CG2-CG 4.46Å; I2372-F2462 WeakPolarHBondContact CG2-O 3.18Å; I2372-N2466 HydrophobicContact CG2-CB 4.16Å; I2372-I2469 HydrophobicContact CD1-CD1 4.33Å
2373S82.4Confident81.4Confident28.3333 Ų28.333345.1 Ų45.120%0.19821%0.213CC..Hα-helixtrans-61.8-48.2174.9-168.70000111S2369 Q2370 W2371 A2375 S2376 F2377S2369-S2373 WeakPolarHBondContact O-CB 3.28Å; S2369-S2373 PolarHBondContact O-N 3.24Å; Q2370-S2373 WeakPolarHBondContact O-CB 3.37Å; Q2370-S2373 PolarHBondContact O-N 3.21Å; W2371-S2373 VanDerWaalsContact C-N 3.33Å; S2373-A2375 PolarHBondContact O-N 3.43Å; S2373-S2376 PolarHBondContact O-N 3.2Å; S2373-S2376 PolarHBondContact O-OG 3.29Å; S2373-F2377 PolarHBondContact O-N 3.05Å; S2373-F2377 VanDerWaalsContact O-N 3.07Å
2374D82.9Confident82.1Confident15 Ų1542.9 Ų42.98%0.0820%0.203CC..Hα-helixtrans-61.2-45.3178-67.7-14000111.5Q2370 W2371 S2376 F2377 Y2378 Q2428 R2596Q2370-D2374 WeakPolarHBondContact O-CB 3.11Å; Q2370-D2374 VanDerWaalsContact O-CG 3.32Å; Q2370-D2374 PolarHBondContact O-N 3.04Å; W2371-D2374 PolarHBondContact O-N 2.99Å; D2374-S2376 VanDerWaalsContact C-N 3.33Å; D2374-S2376 PolarHBondContact O-N 3.04Å; D2374-F2377 WeakPolarHBondContact O-CB 3.41Å; D2374-F2377 PolarHBondContact O-N 3.26Å; D2374-F2377 VanDerWaalsContact O-N 3.15Å; D2374-Y2378 HydrophobicContact CB-CE2 4.23Å; D2374-Y2378 WeakPolarHBondContact O-CD2 3.42Å; D2374-Y2378 PolarHBondContact O-N 3.17Å; D2374-Q2428 PolarHBondContact OD2-NE2 3.23Å; D2374-Q2428 PolarHBondContact OD2-OE1 2.72Å; D2374-R2596 VanDerWaalsContact CG-NH2 3.3Å; D2374-R2596 IonicContact OD1-CZ 3.35Å; D2374-R2596 IonicContact OD1-NE 3.49Å; D2374-R2596 IonicContact OD1-NH2 3.62Å; D2374-R2596 PolarHBondContact OD1-NH2 2.96Å
2375A82Confident82.5Confident2.66667 Ų2.6666741.2 Ų41.22%0.02221%0.207CC..Hα-helixtrans-60.5-41175.700000112.5W2371 I2372 S2373 F2377 Y2378 R2379 V2431 I2435 F2462W2371-A2375 HydrophobicContact CH2-CB 4.45Å; W2371-A2375 HydrophobicContact CZ3-CB 4.38Å; W2371-A2375 VanDerWaalsContact O-CB 3.27Å; W2371-A2375 WeakPolarHBondContact O-CB 3.42Å; W2371-A2375 PolarHBondContact O-N 3.13Å; I2372-A2375 PolarHBondContact O-N 2.9Å; S2373-A2375 PolarHBondContact O-N 3.43Å; A2375-F2377 VanDerWaalsContact C-N 3.31Å; A2375-F2377 PolarHBondContact O-N 3.31Å; A2375-Y2378 PolarHBondContact O-N 3.1Å; A2375-R2379 WeakPolarHBondContact O-CB 3.44Å; A2375-R2379 WeakPolarHBondContact O-CG 3.16Å; A2375-R2379 PolarHBondContact O-N 3.31Å; A2375-V2431 HydrophobicContact CB-CG1 4.07Å; A2375-I2435 HydrophobicContact CB-CD1 4.05Å; A2375-I2435 WeakPolarHBondContact O-CD1 3.46Å; A2375-F2462 HydrophobicContact CB-CD2 4.15Å; A2375-F2462 HydrophobicContact CB-CE2 4.13Å
2376S86.3Confident82.9Confident0.666667 Ų0.66666739.2 Ų39.21%0.00520%0.199CC..Hα-helixtrans-64.9-34.4176.277.80000112.6I2372 S2373 D2374 S2380 N2459I2372-S2376 WeakPolarHBondContact O-CB 3.42Å; I2372-S2376 PolarHBondContact O-N 3.33Å; I2372-S2376 PolarHBondContact O-OG 3.19Å; S2373-S2376 PolarHBondContact O-N 3.2Å; S2373-S2376 PolarHBondContact O-OG 3.29Å; D2374-S2376 VanDerWaalsContact C-N 3.33Å; D2374-S2376 PolarHBondContact O-N 3.04Å; S2376-S2380 WeakPolarHBondContact O-CB 3.18Å; S2376-S2380 PolarHBondContact O-N 3.14Å; S2376-S2380 VanDerWaalsContact O-N 3.16Å; S2376-S2380 PolarHBondContact O-OG 3.07Å; S2376-N2459 WeakPolarHBondContact CB-OD1 3.36Å; S2376-N2459 PolarHBondContact O-OD1 2.93Å
2377F87.6Confident83.4Confident18.3333 Ų18.333338.1 Ų38.18%0.0819%0.19CC..Hα-helixtrans-68.7-49.2175.1176.3-92.9000111.8S2373 D2374 A2375 R2379 S2380 L2381 D2592 V2593 R2596S2373-F2377 PolarHBondContact O-N 3.05Å; S2373-F2377 VanDerWaalsContact O-N 3.07Å; D2374-F2377 WeakPolarHBondContact O-CB 3.41Å; D2374-F2377 PolarHBondContact O-N 3.26Å; D2374-F2377 VanDerWaalsContact O-N 3.15Å; A2375-F2377 VanDerWaalsContact C-N 3.31Å; A2375-F2377 PolarHBondContact O-N 3.31Å; F2377-R2379 VanDerWaalsContact C-N 3.3Å; F2377-R2379 PolarHBondContact O-N 3.2Å; F2377-S2380 CarbonylContact O-C 3.42Å; F2377-S2380 WeakPolarHBondContact O-CA 3.29Å; F2377-S2380 VanDerWaalsContact O-CB 3.28Å; F2377-S2380 WeakPolarHBondContact O-CB 3.31Å; F2377-S2380 PolarHBondContact O-N 3.09Å; F2377-S2380 VanDerWaalsContact O-N 3.09Å; F2377-L2381 HydrophobicContact CE1-CD1 4.37Å; F2377-L2381 PolarHBondContact O-N 3.34Å; F2377-D2592 HydrophobicContact CD2-CB 4.46Å; F2377-V2593 HydrophobicContact CE2-CB 3.92Å; F2377-V2593 HydrophobicContact CE2-CG2 4.32Å; F2377-V2593 HydrophobicContact CZ-CB 4.13Å; F2377-V2593 HydrophobicContact CZ-CG2 4.06Å; F2377-R2596 VanDerWaalsContact CE1-NH1 3.27Å
2378Y85Confident84Confident34 Ų3439.7 Ų39.713%0.13320%0.198CC..Hα-helixtrans-63.7-35.8179-67.6-60.5000112.2D2374 A2375 S2380 L2381 C2382 S2426 Q2428 V2431 Q2432D2374-Y2378 HydrophobicContact CB-CE2 4.23Å; D2374-Y2378 WeakPolarHBondContact O-CD2 3.42Å; D2374-Y2378 PolarHBondContact O-N 3.17Å; A2375-Y2378 PolarHBondContact O-N 3.1Å; Y2378-S2380 VanDerWaalsContact C-N 3.32Å; Y2378-S2380 PolarHBondContact O-N 2.95Å; Y2378-L2381 WeakPolarHBondContact O-CB 3.39Å; Y2378-L2381 PolarHBondContact O-N 3.07Å; Y2378-C2382 PolarHBondContact O-N 3.22Å; Y2378-C2382 PolarHBondContact O-SG 3.43Å; Y2378-C2382 VanDerWaalsContact O-SG 3.35Å; Y2378-S2426 PolarHBondContact OH-OG 3.03Å; Y2378-Q2428 HydrophobicContact CE2-CB 4.36Å; Y2378-Q2428 PolarHBondContact OH-OE1 3.05Å; Y2378-V2431 HydrophobicContact CD2-CG1 4.26Å; Y2378-Q2432 HydrophobicContact CD1-CG 3.92Å; Y2378-Q2432 HydrophobicContact CD2-CG 4.18Å; Y2378-Q2432 HydrophobicContact CE1-CG 3.68Å; Y2378-Q2432 HydrophobicContact CE2-CG 3.96Å; Y2378-Q2432 HydrophobicContact CG-CG 4.18Å; Y2378-Q2432 PolarHBondContact OH-NE2 3.41Å
2379R85.6Confident84.2Confident5 Ų537.8 Ų37.82%0.01921%0.209CC..Hα-helixtrans-62.2-41.1170.3-76.7-178.5-179.8-163-6.3112.5A2375 F2377 L2381 C2382 L2383 I2435 E2438 T2458 N2459 F2462A2375-R2379 WeakPolarHBondContact O-CB 3.44Å; A2375-R2379 WeakPolarHBondContact O-CG 3.16Å; A2375-R2379 PolarHBondContact O-N 3.31Å; F2377-R2379 VanDerWaalsContact C-N 3.3Å; F2377-R2379 PolarHBondContact O-N 3.2Å; R2379-L2381 VanDerWaalsContact C-N 3.29Å; R2379-L2381 PolarHBondContact O-N 3.18Å; R2379-C2382 PolarHBondContact O-N 3.05Å; R2379-L2383 WeakPolarHBondContact O-CB 3.34Å; R2379-L2383 WeakPolarHBondContact O-CG 3.4Å; R2379-L2383 PolarHBondContact O-N 3.25Å; R2379-I2435 HydrophobicContact CG-CD1 4.17Å; R2379-I2435 HydrophobicContact CG-CG1 4.36Å; R2379-I2435 HydrophobicContact CG-CG2 3.84Å; R2379-E2438 IonicContact CZ-OE1 3.14Å; R2379-E2438 IonicContact CZ-OE2 3.66Å; R2379-E2438 IonicContact NE-OE2 3.61Å; R2379-E2438 PolarHBondContact NE-OE2 3.17Å; R2379-E2438 VanDerWaalsContact NH2-CD 3.26Å; R2379-E2438 IonicContact NH2-OE1 3.3Å; R2379-E2438 PolarHBondContact NH2-OE1 3.27Å; R2379-E2438 VanDerWaalsContact NH2-OE1 3.08Å; R2379-E2438 IonicContact NH2-OE2 3.27Å; R2379-E2438 PolarHBondContact NH2-OE2 3.06Å; R2379-T2458 VanDerWaalsContact NH1-CB 3.26Å; R2379-T2458 PolarHBondContact NH1-O 3.28Å; R2379-T2458 PolarHBondContact NH1-OG1 3.01Å; R2379-N2459 HydrophobicContact CB-CB 4.37Å; R2379-F2462 VanDerWaalsContact CZ-CE2 3.44Å; R2379-F2462 VanDerWaalsContact NH1-CD2 3.31Å; R2379-F2462 VanDerWaalsContact NH1-CE1 3.32Å
2380S88.2Confident84.4Confident1.33333 Ų1.3333341 Ų411%0.00922%0.22CC..Hα-helixtrans-61.6-38173.3-61.40000111.9S2376 F2377 Y2378 L2383 N2384 N2459 R2463 V2589S2376-S2380 WeakPolarHBondContact O-CB 3.18Å; S2376-S2380 PolarHBondContact O-N 3.14Å; S2376-S2380 VanDerWaalsContact O-N 3.16Å; S2376-S2380 PolarHBondContact O-OG 3.07Å; F2377-S2380 CarbonylContact O-C 3.42Å; F2377-S2380 WeakPolarHBondContact O-CA 3.29Å; F2377-S2380 VanDerWaalsContact O-CB 3.28Å; F2377-S2380 WeakPolarHBondContact O-CB 3.31Å; F2377-S2380 PolarHBondContact O-N 3.09Å; F2377-S2380 VanDerWaalsContact O-N 3.09Å; Y2378-S2380 VanDerWaalsContact C-N 3.32Å; Y2378-S2380 PolarHBondContact O-N 2.95Å; S2380-L2383 PolarHBondContact O-N 3.4Å; S2380-N2384 PolarHBondContact O-N 3.21Å; S2380-N2384 VanDerWaalsContact O-N 3.12Å; S2380-N2384 PolarHBondContact O-ND2 3.22Å; S2380-N2459 PolarHBondContact OG-ND2 3.38Å; S2380-R2463 PolarHBondContact OG-NH2 3.32Å; S2380-V2589 VanDerWaalsContact OG-CG1 3.27Å; S2380-V2589 WeakPolarHBondContact OG-CG1 3.24Å
2381L87.9Confident84.4Confident63.3333 Ų63.333338.9 Ų38.933%0.33221%0.206SC..Hα-helixtrans-65.8-48.5175.8-169.6149.9000111.1F2377 Y2378 R2379 L2383 N2384 C2385F2377-L2381 HydrophobicContact CE1-CD1 4.37Å; F2377-L2381 PolarHBondContact O-N 3.34Å; Y2378-L2381 WeakPolarHBondContact O-CB 3.39Å; Y2378-L2381 PolarHBondContact O-N 3.07Å; R2379-L2381 VanDerWaalsContact C-N 3.29Å; R2379-L2381 PolarHBondContact O-N 3.18Å; L2381-L2383 VanDerWaalsContact C-N 3.33Å; L2381-L2383 PolarHBondContact O-N 3.07Å; L2381-N2384 PolarHBondContact O-N 3.34Å; L2381-N2384 VanDerWaalsContact O-N 3.1Å; L2381-C2385 PolarHBondContact O-N 2.77Å; L2381-C2385 PolarHBondContact O-SG 3.27Å; L2381-C2385 VanDerWaalsContact O-SG 3.38Å
2382C85.2Confident84.3Confident20.3333 Ų20.333338.2 Ų38.214%0.13721%0.214CC..Hα-helixtrans-59.4-42.5176.1-660000112.5Y2378 R2379 N2384 C2385 L2386 T2439Y2378-C2382 PolarHBondContact O-N 3.22Å; Y2378-C2382 PolarHBondContact O-SG 3.43Å; Y2378-C2382 VanDerWaalsContact O-SG 3.35Å; R2379-C2382 PolarHBondContact O-N 3.05Å; C2382-N2384 VanDerWaalsContact C-N 3.32Å; C2382-N2384 PolarHBondContact O-N 2.97Å; C2382-C2385 PolarHBondContact O-N 2.98Å; C2382-L2386 WeakPolarHBondContact O-CG 3.38Å; C2382-L2386 PolarHBondContact O-N 3.31Å; C2382-T2439 HydrophobicContact CB-CG2 3.85Å
2383L87.6Confident83.8Confident0 Ų040.2 Ų40.20%022%0.223CC..Hα-helixtrans-56.7-44.7174.7-82.9165.5000112.1R2379 S2380 L2381 L2386 L2387 I2452 L2455 N2459 Y2586R2379-L2383 WeakPolarHBondContact O-CB 3.34Å; R2379-L2383 WeakPolarHBondContact O-CG 3.4Å; R2379-L2383 PolarHBondContact O-N 3.25Å; S2380-L2383 PolarHBondContact O-N 3.4Å; L2381-L2383 VanDerWaalsContact C-N 3.33Å; L2381-L2383 PolarHBondContact O-N 3.07Å; L2383-L2386 PolarHBondContact O-N 3.36Å; L2383-L2387 WeakPolarHBondContact O-CG 3.42Å; L2383-L2387 PolarHBondContact O-N 3.14Å; L2383-I2452 HydrophobicContact CD2-CB 4.45Å; L2383-I2452 HydrophobicContact CD2-CG2 4.07Å; L2383-L2455 HydrophobicContact CD1-CB 4.43Å; L2383-L2455 HydrophobicContact CD2-CB 3.63Å; L2383-L2455 HydrophobicContact CD2-CD1 4.46Å; L2383-L2455 HydrophobicContact CG-CB 4.03Å; L2383-N2459 HydrophobicContact CD1-CB 4.47Å; L2383-Y2586 HydrophobicContact CB-CD2 4.47Å; L2383-Y2586 HydrophobicContact CB-CG 4.47Å; L2383-Y2586 HydrophobicContact CD1-CD1 4.09Å; L2383-Y2586 HydrophobicContact CD1-CD2 4.48Å; L2383-Y2586 HydrophobicContact CD1-CE1 4.09Å; L2383-Y2586 HydrophobicContact CD1-CE2 4.49Å; L2383-Y2586 HydrophobicContact CD1-CG 4.31Å; L2383-Y2586 HydrophobicContact CD2-CD2 4.42Å; L2383-Y2586 HydrophobicContact CD2-CE2 4.24Å
2384N88.7Confident82.7Confident17 Ų1749.2 Ų49.29%0.09125%0.252CS..Hα-helixtrans-69.2-37.1177.7-77.6-73000112.5S2380 L2381 C2382 L2386 L2387 I2388 Y2586 S2587S2380-N2384 PolarHBondContact O-N 3.21Å; S2380-N2384 VanDerWaalsContact O-N 3.12Å; S2380-N2384 PolarHBondContact O-ND2 3.22Å; L2381-N2384 PolarHBondContact O-N 3.34Å; L2381-N2384 VanDerWaalsContact O-N 3.1Å; C2382-N2384 VanDerWaalsContact C-N 3.32Å; C2382-N2384 PolarHBondContact O-N 2.97Å; N2384-L2386 VanDerWaalsContact C-N 3.34Å; N2384-L2386 PolarHBondContact O-N 3.24Å; N2384-L2387 PolarHBondContact O-N 3.21Å; N2384-I2388 VanDerWaalsContact O-CG1 3.32Å; N2384-I2388 WeakPolarHBondContact O-CG1 3.4Å; N2384-I2388 PolarHBondContact O-N 3Å; N2384-Y2586 PolarHBondContact ND2-O 3.16Å; N2384-Y2586 PolarHBondContact OD1-O 3.28Å; N2384-S2587 WeakPolarHBondContact OD1-CA 3.4Å; N2384-S2587 PolarHBondContact OD1-N 3.15Å
2385C86.5Confident81.2Confident73.3333 Ų73.333352 Ų5250%0.49529%0.285SS..Hα-helixtrans-62.5-41.9172.6-67.60000112.3L2381 C2382 L2387 I2388 G2389L2381-C2385 PolarHBondContact O-N 2.77Å; L2381-C2385 PolarHBondContact O-SG 3.27Å; L2381-C2385 VanDerWaalsContact O-SG 3.38Å; C2382-C2385 PolarHBondContact O-N 2.98Å; C2385-L2387 VanDerWaalsContact C-N 3.34Å; C2385-L2387 PolarHBondContact O-N 3.3Å; C2385-I2388 PolarHBondContact O-N 3.07Å; C2385-G2389 PolarHBondContact O-N 3.08Å
2386L83.4Confident79.4Confident22 Ų2260.1 Ų60.112%0.11532%0.323CS..Hα-helixtrans-64.2-39.1175.8-70175.2000112C2382 L2383 N2384 I2388 G2389 F2390 L2443 V2451 I2452 L2455C2382-L2386 WeakPolarHBondContact O-CG 3.38Å; C2382-L2386 PolarHBondContact O-N 3.31Å; L2383-L2386 PolarHBondContact O-N 3.36Å; N2384-L2386 VanDerWaalsContact C-N 3.34Å; N2384-L2386 PolarHBondContact O-N 3.24Å; L2386-I2388 VanDerWaalsContact C-N 3.35Å; L2386-G2389 PolarHBondContact O-N 3.05Å; L2386-F2390 HydrophobicContact CD2-CD2 4.06Å; L2386-F2390 HydrophobicContact CD2-CE2 3.83Å; L2386-F2390 WeakPolarHBondContact O-CD2 3.37Å; L2386-F2390 PolarHBondContact O-N 3.4Å; L2386-L2443 HydrophobicContact CD2-CD1 3.47Å; L2386-L2443 VanDerWaalsContact CD2-CD1 3.47Å; L2386-V2451 HydrophobicContact CD1-CG1 4.08Å; L2386-I2452 HydrophobicContact CB-CD1 4.45Å; L2386-I2452 HydrophobicContact CB-CG1 4.37Å; L2386-I2452 HydrophobicContact CD1-CG1 4.41Å; L2386-L2455 HydrophobicContact CD1-CD1 3.58Å
2387L85.9Confident77.2Confident12.3333 Ų12.333365.1 Ų65.17%0.06536%0.358CS..Hα-helixtrans-62.3-42.5174.7-77165.6000112.4L2383 N2384 C2385 G2389 Y2391 F2393 I2452 P2583 Y2586L2383-L2387 WeakPolarHBondContact O-CG 3.42Å; L2383-L2387 PolarHBondContact O-N 3.14Å; N2384-L2387 PolarHBondContact O-N 3.21Å; C2385-L2387 VanDerWaalsContact C-N 3.34Å; C2385-L2387 PolarHBondContact O-N 3.3Å; L2387-G2389 VanDerWaalsContact C-N 3.33Å; L2387-G2389 PolarHBondContact O-N 3.24Å; L2387-Y2391 WeakPolarHBondContact O-CB 3.35Å; L2387-Y2391 PolarHBondContact O-N 3.08Å; L2387-F2393 HydrophobicContact CD2-CE2 4.4Å; L2387-F2393 HydrophobicContact CD2-CZ 3.97Å; L2387-I2452 HydrophobicContact CD2-CD1 4.37Å; L2387-P2583 HydrophobicContact CD1-CB 4.37Å; L2387-P2583 WeakPolarHBondContact CD1-O 3.16Å; L2387-P2583 HydrophobicContact CD2-CB 3.51Å; L2387-P2583 VanDerWaalsContact CD2-CB 3.49Å; L2387-Y2586 HydrophobicContact CD1-CD2 4.1Å
2388I86.4Confident75Confident147.333 Ų147.33370.6 Ų70.676%0.75639%0.387SS*.Hα-helixtrans-65.5-38176.6-67.1165.3000111.1N2384 C2385 L2386N2384-I2388 VanDerWaalsContact O-CG1 3.32Å; N2384-I2388 WeakPolarHBondContact O-CG1 3.4Å; N2384-I2388 PolarHBondContact O-N 3Å; C2385-I2388 PolarHBondContact O-N 3.07Å; L2386-I2388 VanDerWaalsContact C-N 3.35Å
2389G81.1Confident72.7Confident56.3333 Ų56.333373.5 Ų73.558%0.58141%0.413SS*.Hα-helixtrans-78.3-31.9-175.600000115.7C2385 L2386 L2387C2385-G2389 PolarHBondContact O-N 3.08Å; L2386-G2389 PolarHBondContact O-N 3.05Å; L2387-G2389 VanDerWaalsContact C-N 3.33Å; L2387-G2389 PolarHBondContact O-N 3.24Å
2390F80.9Confident70.7Confident89.6667 Ų89.666780.7 Ų80.739%0.39344%0.441SS..Hα-helixtrans-124.90.9-166.4-63.8-75.3000115.6L2386 P2392 F2393 L2443 T2448L2386-F2390 HydrophobicContact CD2-CD2 4.06Å; L2386-F2390 HydrophobicContact CD2-CE2 3.83Å; L2386-F2390 WeakPolarHBondContact O-CD2 3.37Å; L2386-F2390 PolarHBondContact O-N 3.4Å; F2390-P2392 CarbonylContact O-C 3.49Å; F2390-F2393 HydrophobicContact CB-CD1 4.36Å; F2390-F2393 HydrophobicContact CB-CE1 4.03Å; F2390-F2393 WeakPolarHBondContact O-CD1 3.37Å; F2390-F2393 WeakPolarHBondContact O-CE1 3.45Å; F2390-L2443 HydrophobicContact CD2-CD1 4.41Å; F2390-L2443 HydrophobicContact CE2-CD1 3.82Å; F2390-L2443 HydrophobicContact CZ-CD1 4.12Å; F2390-L2443 HydrophobicContact CZ-CD2 4.16Å; F2390-T2448 HydrophobicContact CB-CG2 4.31Å; F2390-T2448 HydrophobicContact CD1-CG2 3.8Å; F2390-T2448 HydrophobicContact CD2-CG2 4.15Å; F2390-T2448 HydrophobicContact CE1-CG2 4.1Å; F2390-T2448 HydrophobicContact CE2-CG2 4.44Å; F2390-T2448 HydrophobicContact CG-CG2 3.83Å; F2390-T2448 HydrophobicContact CZ-CG2 4.41Å
2391Y79.4Confident68.3Low102 Ų10286.6 Ų86.640%0.447%0.472SS..  trans-85.5137177.9-171.5-87.8000111.8L2387 F2393 F2584L2387-Y2391 WeakPolarHBondContact O-CB 3.35Å; L2387-Y2391 PolarHBondContact O-N 3.08Å; Y2391-F2393 HydrophobicContact CD2-CD2 4.24Å; Y2391-F2393 AromaticContact CD2-CE2 3.8Å; Y2391-F2393 HydrophobicContact CD2-CE2 3.8Å; Y2391-F2393 HydrophobicContact CD2-CZ 4.19Å; Y2391-F2393 HydrophobicContact CE2-CE2 4.36Å; Y2391-F2584 HydrophobicContact CD1-CE1 4.1Å; Y2391-F2584 AromaticContact CD1-CZ 3.9Å; Y2391-F2584 HydrophobicContact CD1-CZ 3.97Å; Y2391-F2584 AromaticContact CD2-CE1 3.92Å; Y2391-F2584 HydrophobicContact CD2-CE1 3.92Å; Y2391-F2584 HydrophobicContact CD2-CZ 4.33Å; Y2391-F2584 AromaticContact CE1-CE1 3.95Å; Y2391-F2584 HydrophobicContact CE1-CE1 3.98Å; Y2391-F2584 HydrophobicContact CE1-CE2 4.43Å; Y2391-F2584 AromaticContact CE1-CZ 3.46Å; Y2391-F2584 HydrophobicContact CE1-CZ 3.46Å; Y2391-F2584 AromaticContact CE2-CE1 3.78Å; Y2391-F2584 HydrophobicContact CE2-CE1 3.78Å; Y2391-F2584 AromaticContact CE2-CZ 3.85Å; Y2391-F2584 HydrophobicContact CE2-CZ 3.85Å; Y2391-F2584 HydrophobicContact CG-CE1 4.07Å; Y2391-F2584 HydrophobicContact CG-CZ 4.39Å; Y2391-F2584 AromaticContact CZ-CE1 3.81Å; Y2391-F2584 AromaticContact CZ-CZ 3.37Å
2392P75.8Confident66.3Low84.3333 Ų84.333391.4 Ų91.455%0.54849%0.491SS..SBendcis-81.9145.10.532.9-34.6000112.9F2390 R2394F2390-P2392 CarbonylContact O-C 3.49Å; P2392-R2394 PolarHBondContact O-N 3.37Å
2393F71.7Confident64.6Low50 Ų50100.5 Ų100.522%0.21952%0.524CS..  trans-70.463.8-179.3-48.7-65.7000112.5L2387 F2390 Y2391 G2395 E2449 I2452L2387-F2393 HydrophobicContact CD2-CE2 4.4Å; L2387-F2393 HydrophobicContact CD2-CZ 3.97Å; F2390-F2393 HydrophobicContact CB-CD1 4.36Å; F2390-F2393 HydrophobicContact CB-CE1 4.03Å; F2390-F2393 WeakPolarHBondContact O-CD1 3.37Å; F2390-F2393 WeakPolarHBondContact O-CE1 3.45Å; Y2391-F2393 HydrophobicContact CD2-CD2 4.24Å; Y2391-F2393 AromaticContact CD2-CE2 3.8Å; Y2391-F2393 HydrophobicContact CD2-CE2 3.8Å; Y2391-F2393 HydrophobicContact CD2-CZ 4.19Å; Y2391-F2393 HydrophobicContact CE2-CE2 4.36Å; F2393-G2395 PolarHBondContact O-N 3.03Å; F2393-G2395 VanDerWaalsContact O-N 3.12Å; F2393-E2449 HydrophobicContact CB-CG 3.72Å; F2393-E2449 VanDerWaalsContact CB-OE1 3.27Å; F2393-E2449 WeakPolarHBondContact CB-OE1 3.45Å; F2393-E2449 HydrophobicContact CD1-CG 4.35Å; F2393-E2449 HydrophobicContact CD2-CG 4.34Å; F2393-E2449 HydrophobicContact CG-CG 3.89Å; F2393-I2452 HydrophobicContact CE1-CD1 3.49Å; F2393-I2452 VanDerWaalsContact CE1-CD1 3.45Å; F2393-I2452 HydrophobicContact CE2-CD1 4.23Å; F2393-I2452 HydrophobicContact CZ-CD1 3.25Å
2394R58.4Low62.6Low217.333 Ų217.333105.8 Ų105.882%0.8255%0.552SS**  trans-73.3104.9179.5-81-175.5173.2-180-1.2110.1P2392 E2396P2392-R2394 PolarHBondContact O-N 3.37Å; R2394-E2396 HydrophobicContact CB-CG 4.26Å; R2394-E2396 IonicContact NH1-OE1 3.88Å; R2394-E2396 PolarHBondContact O-N 3.37Å
2395G51.9Low60.6Low74.6667 Ų74.6667111 Ų11177%0.7758%0.579SS**  trans21.447.6147.100000117.4F2393 S2397F2393-G2395 PolarHBondContact O-N 3.03Å; F2393-G2395 VanDerWaalsContact O-N 3.12Å; G2395-S2397 VanDerWaalsContact C-N 3.3Å; G2395-S2397 PolarHBondContact O-N 2.8Å
2396E44.3Very low59.3Low172.667 Ų172.667115.3 Ų115.381%0.80759%0.592SS**  trans-52.787.1161.6-72.7-179.9170.600112.5R2394 L2398R2394-E2396 HydrophobicContact CB-CG 4.26Å; R2394-E2396 IonicContact NH1-OE1 3.88Å; R2394-E2396 PolarHBondContact O-N 3.37Å; E2396-L2398 PolarHBondContact O-N 3.09Å
2397S39.2Very low57.9Low106.333 Ų106.333117.1 Ų117.174%0.74460%0.604SS**  trans-71.367168.161.90000112.8G2395 S2399G2395-S2397 VanDerWaalsContact C-N 3.3Å; G2395-S2397 PolarHBondContact O-N 2.8Å; S2397-S2399 VanDerWaalsContact C-N 3.29Å; S2397-S2399 PolarHBondContact O-N 3.04Å
2398L41.6Very low56.3Low132.667 Ų132.667121.5 Ų121.570%0.69562%0.624SS**  trans-90.176146-110.198.2000107.7E2396 Y2400E2396-L2398 PolarHBondContact O-N 3.09Å; L2398-Y2400 HydrophobicContact CB-CD2 4.31Å; L2398-Y2400 HydrophobicContact CB-CE2 4.44Å; L2398-Y2400 HydrophobicContact CD2-CD1 4.2Å; L2398-Y2400 HydrophobicContact CD2-CD2 3.95Å; L2398-Y2400 HydrophobicContact CD2-CE1 3.76Å; L2398-Y2400 HydrophobicContact CD2-CE2 3.6Å; L2398-Y2400 HydrophobicContact CD2-CG 4.08Å; L2398-Y2400 HydrophobicContact CG-CD2 4.19Å; L2398-Y2400 HydrophobicContact CG-CE2 4.24Å; L2398-Y2400 PolarHBondContact O-N 3.19Å
2399S37.5Very low54.9Low96 Ų96120.2 Ų120.267%0.67162%0.618SS**  trans-60.982.9154.8530000107.8S2397 D2401S2397-S2399 VanDerWaalsContact C-N 3.29Å; S2397-S2399 PolarHBondContact O-N 3.04Å; S2399-D2401 PolarHBondContact O-N 3.05Å
2400Y42.6Very low53.9Low155.333 Ų155.333121.4 Ų121.461%0.60961%0.614SS**  trans-70.4102.6151.9-89.4-76.6000105.7L2398 F2402 T2407L2398-Y2400 HydrophobicContact CB-CD2 4.31Å; L2398-Y2400 HydrophobicContact CB-CE2 4.44Å; L2398-Y2400 HydrophobicContact CD2-CD1 4.2Å; L2398-Y2400 HydrophobicContact CD2-CD2 3.95Å; L2398-Y2400 HydrophobicContact CD2-CE1 3.76Å; L2398-Y2400 HydrophobicContact CD2-CE2 3.6Å; L2398-Y2400 HydrophobicContact CD2-CG 4.08Å; L2398-Y2400 HydrophobicContact CG-CD2 4.19Å; L2398-Y2400 HydrophobicContact CG-CE2 4.24Å; L2398-Y2400 PolarHBondContact O-N 3.19Å; Y2400-F2402 PolarHBondContact O-N 3.08Å; Y2400-T2407 HydrophobicContact CE1-CG2 4.37Å; Y2400-T2407 WeakPolarHBondContact CE1-OG1 3.36Å
2401D38.5Very low52.9Low125.5 Ų125.5120.6 Ų120.667%0.67162%0.616SS**  trans-5790.9166.7-78.7-36.7000108.2S2399 Y2403 N2404S2399-D2401 PolarHBondContact O-N 3.05Å; D2401-Y2403 PolarHBondContact O-N 3.17Å; D2401-N2404 PolarHBondContact O-N 3.15Å
2402F46Very low52.1Low164.5 Ų164.5119.2 Ų119.272%0.72162%0.615SS**THydrogen-bonded Turntrans-69.733173.4-94.4-84.9000112.1Y2400 T2407Y2400-F2402 PolarHBondContact O-N 3.08Å; F2402-T2407 HydrophobicContact CE1-CG2 4.48Å
2403Y48.7Very low51.4Low211 Ų211118.4 Ų118.483%0.82761%0.609SS**THydrogen-bonded Turntrans-93.2-9.3174.8-90.4-77.5000114D2401 L2405D2401-Y2403 PolarHBondContact O-N 3.17Å; Y2403-L2405 PolarHBondContact O-N 3.22Å; Y2403-L2405 VanDerWaalsContact O-N 3.07Å
2404N45.2Very low51.2Low111.5 Ų111.5121.4 Ų121.460%0.59663%0.627SS**  trans-87.492.1176.6-80-7.7000112.1D2401 E2406 T2407D2401-N2404 PolarHBondContact O-N 3.15Å; N2404-E2406 PolarHBondContact O-N 3.03Å; N2404-T2407 PolarHBondContact O-N 3.11Å; N2404-T2407 PolarHBondContact O-OG1 3.12Å
2405L48.5Very low51.4Low127 Ų127112.7 Ų112.767%0.66560%0.601SS**Hα-helixtrans-51.3-23.4174.6-158.476000113.8Y2403 T2407 Q2408Y2403-L2405 PolarHBondContact O-N 3.22Å; Y2403-L2405 VanDerWaalsContact O-N 3.07Å; L2405-T2407 VanDerWaalsContact C-N 3.35Å; L2405-T2407 PolarHBondContact O-N 3.24Å; L2405-Q2408 PolarHBondContact O-N 3.28Å
2406E57.7Low52Low162 Ų162113.6 Ų113.676%0.75759%0.587SS**Hα-helixtrans-68.4-26.6-177.2-72.8-174.3139.500114.6N2404N2404-E2406 PolarHBondContact O-N 3.03Å
2407T54.6Low53.1Low60.5 Ų60.5111.7 Ų111.737%0.37158%0.577SS.*Hα-helixtrans-90.5-18.4-179.852.10000113.8Y2400 F2402 N2404 L2405 I2409 T2410 V2411Y2400-T2407 HydrophobicContact CE1-CG2 4.37Å; Y2400-T2407 WeakPolarHBondContact CE1-OG1 3.36Å; F2402-T2407 HydrophobicContact CE1-CG2 4.48Å; N2404-T2407 PolarHBondContact O-N 3.11Å; N2404-T2407 PolarHBondContact O-OG1 3.12Å; L2405-T2407 VanDerWaalsContact C-N 3.35Å; L2405-T2407 PolarHBondContact O-N 3.24Å; T2407-I2409 VanDerWaalsContact C-N 3.26Å; T2407-I2409 PolarHBondContact O-N 3.22Å; T2407-T2410 PolarHBondContact O-OG1 3.44Å; T2407-V2411 WeakPolarHBondContact O-CG2 3.4Å
2408Q52.3Low54.2Low105.5 Ų105.5108.5 Ų108.549%0.49356%0.557SS.*Hα-helixtrans-71.4-27.8173.3-80.7-173.2-18.700112.7L2405 T2410 V2411 I2412L2405-Q2408 PolarHBondContact O-N 3.28Å; Q2408-T2410 VanDerWaalsContact C-N 3.3Å; Q2408-T2410 PolarHBondContact O-N 3.36Å; Q2408-V2411 PolarHBondContact O-N 3.23Å; Q2408-I2412 HydrophobicContact CB-CD1 3.86Å; Q2408-I2412 HydrophobicContact CG-CD1 4.07Å; Q2408-I2412 WeakPolarHBondContact O-CB 3.32Å; Q2408-I2412 WeakPolarHBondContact O-CD1 3.47Å; Q2408-I2412 WeakPolarHBondContact O-CG1 3.38Å; Q2408-I2412 PolarHBondContact O-N 3.18Å
2409I57.7Low55.2Low119 Ų119104.3 Ų104.361%0.6154%0.537SS*.Hα-helixtrans-69.4-21.7-177.7-65.5171.8000112.4T2407 P2413T2407-I2409 VanDerWaalsContact C-N 3.26Å; T2407-I2409 PolarHBondContact O-N 3.22Å; I2409-P2413 WeakPolarHBondContact O-CD 3.32Å; I2409-P2413 WeakPolarHBondContact O-CG 3.36Å
2410T58.9Low56.5Low82 Ų82103.2 Ų103.250%0.50353%0.526SS..Hα-helixtrans-94.3-35.8178.6560000113.3T2407 Q2408 P2413 I2414T2407-T2410 PolarHBondContact O-OG1 3.44Å; Q2408-T2410 VanDerWaalsContact C-N 3.3Å; Q2408-T2410 PolarHBondContact O-N 3.36Å; T2410-P2413 WeakPolarHBondContact O-CD 3.45Å; T2410-P2413 WeakPolarHBondContact O-CG 3.35Å; T2410-I2414 WeakPolarHBondContact O-CD1 3.42Å; T2410-I2414 VanDerWaalsContact O-CG1 3.3Å; T2410-I2414 WeakPolarHBondContact O-CG1 3.26Å; T2410-I2414 PolarHBondContact O-N 3.03Å
2411V61.2Low57.5Low72.5 Ų72.5100.1 Ų100.144%0.43952%0.52SS..Hα-helixtrans-77-37.5-176.8-179.30000112.4T2407 Q2408 I2414 A2415T2407-V2411 WeakPolarHBondContact O-CG2 3.4Å; Q2408-V2411 PolarHBondContact O-N 3.23Å; V2411-I2414 PolarHBondContact O-N 3.32Å; V2411-A2415 WeakPolarHBondContact O-CB 3.4Å; V2411-A2415 PolarHBondContact O-N 3.47Å
2412I61.9Low58.3Low72 Ų7295.4 Ų95.437%0.36950%0.496SS..Hα-helixtrans-60.9-50.1179.5-65.6170.9000112.3Q2408 I2414 A2415 I2416Q2408-I2412 HydrophobicContact CB-CD1 3.86Å; Q2408-I2412 HydrophobicContact CG-CD1 4.07Å; Q2408-I2412 WeakPolarHBondContact O-CB 3.32Å; Q2408-I2412 WeakPolarHBondContact O-CD1 3.47Å; Q2408-I2412 WeakPolarHBondContact O-CG1 3.38Å; Q2408-I2412 PolarHBondContact O-N 3.18Å; I2412-I2414 VanDerWaalsContact C-N 3.31Å; I2412-I2414 PolarHBondContact O-N 3.11Å; I2412-A2415 PolarHBondContact O-N 3.2Å; I2412-I2416 HydrophobicContact CG2-CD1 3.65Å; I2412-I2416 HydrophobicContact CG2-CG1 4.24Å; I2412-I2416 WeakPolarHBondContact O-CB 3.47Å; I2412-I2416 WeakPolarHBondContact O-CG1 3.35Å; I2412-I2416 PolarHBondContact O-N 3.19Å
2413P61.9Low58.9Low67.5 Ų67.591.8 Ų91.844%0.43848%0.484SS..Hα-helixtrans-67.5-28.9176.522.9-30.2000112.9I2409 T2410 F2417I2409-P2413 WeakPolarHBondContact O-CD 3.32Å; I2409-P2413 WeakPolarHBondContact O-CG 3.36Å; T2410-P2413 WeakPolarHBondContact O-CD 3.45Å; T2410-P2413 WeakPolarHBondContact O-CG 3.35Å; P2413-F2417 WeakPolarHBondContact O-CA 3.48Å; P2413-F2417 WeakPolarHBondContact O-CB 3.32Å; P2413-F2417 PolarHBondContact O-N 3.12Å
2414I65.7Low59.5Low114.5 Ų114.587.5 Ų87.559%0.58748%0.479SS*.Hα-helixtrans-68.1-42.7173.6-66.3168000110.7T2410 V2411 I2412 F2417 A2418T2410-I2414 WeakPolarHBondContact O-CD1 3.42Å; T2410-I2414 VanDerWaalsContact O-CG1 3.3Å; T2410-I2414 WeakPolarHBondContact O-CG1 3.26Å; T2410-I2414 PolarHBondContact O-N 3.03Å; V2411-I2414 PolarHBondContact O-N 3.32Å; I2412-I2414 VanDerWaalsContact C-N 3.31Å; I2412-I2414 PolarHBondContact O-N 3.11Å; I2414-F2417 PolarHBondContact O-N 2.92Å; I2414-A2418 VanDerWaalsContact O-CB 3.31Å; I2414-A2418 WeakPolarHBondContact O-CB 3.32Å; I2414-A2418 PolarHBondContact O-N 2.94Å
2415A62.5Low60.1Low34.5 Ų34.585.1 Ų85.129%0.28547%0.471SS..Hα-helixtrans-64.8-44.3175.200000111.6V2411 I2412 F2417 A2418 V2419V2411-A2415 WeakPolarHBondContact O-CB 3.4Å; V2411-A2415 PolarHBondContact O-N 3.47Å; I2412-A2415 PolarHBondContact O-N 3.2Å; A2415-F2417 VanDerWaalsContact C-N 3.34Å; A2415-F2417 PolarHBondContact O-N 3.22Å; A2415-A2418 PolarHBondContact O-N 2.99Å; A2415-V2419 VanDerWaalsContact O-CG2 3.29Å; A2415-V2419 WeakPolarHBondContact O-CG2 3.2Å; A2415-V2419 PolarHBondContact O-N 3.28Å
2416I66.3Low60.5Low92.5 Ų92.581.1 Ų81.147%0.47445%0.454SS..Hα-helixtrans-63.3-41.5174.6-67169.1000110.6I2412 V2419 V2420I2412-I2416 HydrophobicContact CG2-CD1 3.65Å; I2412-I2416 HydrophobicContact CG2-CG1 4.24Å; I2412-I2416 WeakPolarHBondContact O-CB 3.47Å; I2412-I2416 WeakPolarHBondContact O-CG1 3.35Å; I2412-I2416 PolarHBondContact O-N 3.19Å; I2416-V2419 WeakPolarHBondContact O-CB 3.28Å; I2416-V2419 PolarHBondContact O-N 3.47Å; I2416-V2420 HydrophobicContact CG2-CG2 4.11Å; I2416-V2420 WeakPolarHBondContact O-CB 3.48Å; I2416-V2420 WeakPolarHBondContact O-CG2 3.27Å; I2416-V2420 PolarHBondContact O-N 3.05Å
2417F67.3Low60.6Low133 Ų13378.3 Ų78.358%0.58344%0.444SS*.Hα-helixtrans-66.7-39178-175-108.3000112P2413 I2414 A2415 V2420 L2421P2413-F2417 WeakPolarHBondContact O-CA 3.48Å; P2413-F2417 WeakPolarHBondContact O-CB 3.32Å; P2413-F2417 PolarHBondContact O-N 3.12Å; I2414-F2417 PolarHBondContact O-N 2.92Å; A2415-F2417 VanDerWaalsContact C-N 3.34Å; A2415-F2417 PolarHBondContact O-N 3.22Å; F2417-V2420 PolarHBondContact O-N 3.4Å; F2417-L2421 HydrophobicContact CD1-CD1 3.7Å; F2417-L2421 HydrophobicContact CD1-CG 4.47Å; F2417-L2421 HydrophobicContact CE1-CD1 3.26Å; F2417-L2421 HydrophobicContact CE1-CG 4.25Å; F2417-L2421 HydrophobicContact CE2-CD1 4.45Å; F2417-L2421 HydrophobicContact CG-CD1 4.46Å; F2417-L2421 HydrophobicContact CZ-CD1 3.69Å; F2417-L2421 HydrophobicContact CZ-CG 4.28Å; F2417-L2421 VanDerWaalsContact O-CB 3.31Å; F2417-L2421 WeakPolarHBondContact O-CB 3.42Å; F2417-L2421 PolarHBondContact O-N 3.11Å
2418A62.3Low61.2Low40.5 Ų40.579 Ų7934%0.33544%0.443SS..Hα-helixtrans-64.3-40.6172.600000111.8I2414 A2415 C2422 L2437I2414-A2418 VanDerWaalsContact O-CB 3.31Å; I2414-A2418 WeakPolarHBondContact O-CB 3.32Å; I2414-A2418 PolarHBondContact O-N 2.94Å; A2415-A2418 PolarHBondContact O-N 2.99Å; A2418-C2422 VanDerWaalsContact O-CB 3.28Å; A2418-C2422 WeakPolarHBondContact O-CB 3.42Å; A2418-C2422 PolarHBondContact O-N 3.3Å; A2418-C2422 PolarHBondContact O-SG 2.84Å; A2418-L2437 HydrophobicContact CB-CD1 3.96Å
2419V62Low61.9Low44.5 Ų44.577.8 Ų77.827%0.2744%0.44SS..Hα-helixtrans-62.8-47172.8170.90000110.6A2415 I2416 L2421 C2422 L2423 Y2434A2415-V2419 VanDerWaalsContact O-CG2 3.29Å; A2415-V2419 WeakPolarHBondContact O-CG2 3.2Å; A2415-V2419 PolarHBondContact O-N 3.28Å; I2416-V2419 WeakPolarHBondContact O-CB 3.28Å; I2416-V2419 PolarHBondContact O-N 3.47Å; V2419-L2421 PolarHBondContact O-N 3.02Å; V2419-C2422 CarbonylContact O-C 3.56Å; V2419-C2422 WeakPolarHBondContact O-CA 3.4Å; V2419-C2422 WeakPolarHBondContact O-CB 3.48Å; V2419-C2422 PolarHBondContact O-N 3.32Å; V2419-C2422 VanDerWaalsContact O-N 3.08Å; V2419-L2423 HydrophobicContact CG1-CD1 4.11Å; V2419-L2423 HydrophobicContact CG1-CG 4.33Å; V2419-L2423 VanDerWaalsContact O-CG 3.28Å; V2419-L2423 WeakPolarHBondContact O-CG 3.43Å; V2419-L2423 PolarHBondContact O-N 2.9Å; V2419-Y2434 HydrophobicContact CG2-CD2 4.4Å; V2419-Y2434 HydrophobicContact CG2-CE2 4.05Å
2420V65Low62.2Low72.5 Ų72.575.6 Ų75.644%0.43943%0.429SS..Hα-helixtrans-64-43178.71710000111.7I2416 F2417 C2422 L2423 V2424I2416-V2420 HydrophobicContact CG2-CG2 4.11Å; I2416-V2420 WeakPolarHBondContact O-CB 3.48Å; I2416-V2420 WeakPolarHBondContact O-CG2 3.27Å; I2416-V2420 PolarHBondContact O-N 3.05Å; F2417-V2420 PolarHBondContact O-N 3.4Å; V2420-C2422 VanDerWaalsContact C-N 3.28Å; V2420-C2422 PolarHBondContact O-N 3.5Å; V2420-L2423 CarbonylContact O-C 3.17Å; V2420-L2423 WeakPolarHBondContact O-CB 3.29Å; V2420-L2423 PolarHBondContact O-N 3.15Å; V2420-L2423 VanDerWaalsContact O-N 3.1Å; V2420-V2424 HydrophobicContact CG1-CG2 4.09Å; V2420-V2424 WeakPolarHBondContact O-CB 3.47Å; V2420-V2424 WeakPolarHBondContact O-CG2 3.39Å; V2420-V2424 PolarHBondContact O-N 3.32Å
2421L62.7Low62.7Low90.5 Ų90.572.3 Ų72.347%0.47441%0.408SS..Hα-helixtrans-61.6-41.6173.1-90.9165.6000111.8F2417 V2419 L2423 V2424 S2425F2417-L2421 HydrophobicContact CD1-CD1 3.7Å; F2417-L2421 HydrophobicContact CD1-CG 4.47Å; F2417-L2421 HydrophobicContact CE1-CD1 3.26Å; F2417-L2421 HydrophobicContact CE1-CG 4.25Å; F2417-L2421 HydrophobicContact CE2-CD1 4.45Å; F2417-L2421 HydrophobicContact CG-CD1 4.46Å; F2417-L2421 HydrophobicContact CZ-CD1 3.69Å; F2417-L2421 HydrophobicContact CZ-CG 4.28Å; F2417-L2421 VanDerWaalsContact O-CB 3.31Å; F2417-L2421 WeakPolarHBondContact O-CB 3.42Å; F2417-L2421 PolarHBondContact O-N 3.11Å; V2419-L2421 PolarHBondContact O-N 3.02Å; L2421-L2423 VanDerWaalsContact C-N 3.31Å; L2421-L2423 PolarHBondContact O-N 3.09Å; L2421-V2424 WeakPolarHBondContact O-CB 3.46Å; L2421-V2424 PolarHBondContact O-N 3.16Å; L2421-S2425 WeakPolarHBondContact O-CB 3.37Å; L2421-S2425 PolarHBondContact O-N 2.93Å; L2421-S2425 VanDerWaalsContact O-N 3.09Å; L2421-S2425 PolarHBondContact O-OG 3.04Å
2422C55.9Low63.1Low26.5 Ų26.571 Ų7118%0.17940%0.398CS..Hα-helixtrans-65.6-32.8175.8-113.50000112.6A2418 V2419 V2420 V2424 S2425 Q2432A2418-C2422 VanDerWaalsContact O-CB 3.28Å; A2418-C2422 WeakPolarHBondContact O-CB 3.42Å; A2418-C2422 PolarHBondContact O-N 3.3Å; A2418-C2422 PolarHBondContact O-SG 2.84Å; V2419-C2422 CarbonylContact O-C 3.56Å; V2419-C2422 WeakPolarHBondContact O-CA 3.4Å; V2419-C2422 WeakPolarHBondContact O-CB 3.48Å; V2419-C2422 PolarHBondContact O-N 3.32Å; V2419-C2422 VanDerWaalsContact O-N 3.08Å; V2420-C2422 VanDerWaalsContact C-N 3.28Å; V2420-C2422 PolarHBondContact O-N 3.5Å; C2422-V2424 PolarHBondContact O-N 3.13Å; C2422-S2425 PolarHBondContact O-N 2.89Å; C2422-S2425 PolarHBondContact O-OG 2.84Å; C2422-Q2432 VanDerWaalsContact O-CD 3.3Å; C2422-Q2432 PolarHBondContact O-NE2 3.47Å; C2422-Q2432 PolarHBondContact O-OE1 2.9Å
2423L58.5Low63.5Low89 Ų8971.2 Ų71.247%0.46640%0.399SS..Hα-helixtrans-71.3-29.4174.1-70.9175.5000113.2V2419 V2420 L2421 S2425 L2429 Q2432 I2433V2419-L2423 HydrophobicContact CG1-CD1 4.11Å; V2419-L2423 HydrophobicContact CG1-CG 4.33Å; V2419-L2423 VanDerWaalsContact O-CG 3.28Å; V2419-L2423 WeakPolarHBondContact O-CG 3.43Å; V2419-L2423 PolarHBondContact O-N 2.9Å; V2420-L2423 CarbonylContact O-C 3.17Å; V2420-L2423 WeakPolarHBondContact O-CB 3.29Å; V2420-L2423 PolarHBondContact O-N 3.15Å; V2420-L2423 VanDerWaalsContact O-N 3.1Å; L2421-L2423 VanDerWaalsContact C-N 3.31Å; L2421-L2423 PolarHBondContact O-N 3.09Å; L2423-S2425 VanDerWaalsContact C-N 3.33Å; L2423-L2429 WeakPolarHBondContact O-CD2 3.38Å; L2423-Q2432 HydrophobicContact CD2-CB 3.58Å; L2423-Q2432 PolarHBondContact O-OE1 2.86Å; L2423-I2433 HydrophobicContact CD1-CG1 4.01Å; L2423-I2433 HydrophobicContact CD2-CB 4.19Å; L2423-I2433 HydrophobicContact CD2-CG1 3.55Å; L2423-I2433 VanDerWaalsContact CD2-N 3.26Å; L2423-I2433 HydrophobicContact CG-CG1 4.38Å
2424V60.4Low64Low119 Ų11972.9 Ų72.972%0.72140%0.397SS*.Hα-helixtrans-83.4-24.2-180172.40000112V2420 L2421 C2422 S2426V2420-V2424 HydrophobicContact CG1-CG2 4.09Å; V2420-V2424 WeakPolarHBondContact O-CB 3.47Å; V2420-V2424 WeakPolarHBondContact O-CG2 3.39Å; V2420-V2424 PolarHBondContact O-N 3.32Å; L2421-V2424 WeakPolarHBondContact O-CB 3.46Å; L2421-V2424 PolarHBondContact O-N 3.16Å; C2422-V2424 PolarHBondContact O-N 3.13Å; V2424-S2426 PolarHBondContact O-N 2.54Å
2425S57.8Low64.4Low62 Ų6267.5 Ų67.543%0.43437%0.37SS..THydrogen-bonded Turntrans-101.163-170.754.10000115.3L2421 C2422 L2423 N2427 L2430L2421-S2425 WeakPolarHBondContact O-CB 3.37Å; L2421-S2425 PolarHBondContact O-N 2.93Å; L2421-S2425 VanDerWaalsContact O-N 3.09Å; L2421-S2425 PolarHBondContact O-OG 3.04Å; C2422-S2425 PolarHBondContact O-N 2.89Å; C2422-S2425 PolarHBondContact O-OG 2.84Å; L2423-S2425 VanDerWaalsContact C-N 3.33Å; S2425-N2427 PolarHBondContact O-N 3.07Å; S2425-L2430 WeakPolarHBondContact OG-CD1 3.15Å; S2425-L2430 WeakPolarHBondContact OG-CD2 3.32Å
2426S57.6Low65Low44 Ų4466.8 Ų66.831%0.30837%0.365SS..  trans-119.276.5-177.768.20000117.1N2240 Y2378 V2424 Q2428 Q2432N2240-S2426 VanDerWaalsContact ND2-CB 3.29Å; N2240-S2426 WeakPolarHBondContact ND2-CB 3.48Å; Y2378-S2426 PolarHBondContact OH-OG 3.03Å; V2424-S2426 PolarHBondContact O-N 2.54Å; S2426-Q2428 PolarHBondContact O-N 2.92Å; S2426-Q2428 PolarHBondContact OG-N 2.9Å; S2426-Q2432 PolarHBondContact O-OE1 2.72Å; S2426-Q2432 PolarHBondContact OG-NE2 3.1Å; S2426-Q2432 PolarHBondContact OG-OE1 2.86Å
2427N60.8Low65.3Low103 Ų10366.7 Ų66.755%0.55137%0.365SS*.  trans-76.178.4-172.2-70.1-13.3000114S2425 L2429 L2430S2425-N2427 PolarHBondContact O-N 3.07Å; N2427-L2429 PolarHBondContact O-N 3.44Å; N2427-L2430 HydrophobicContact CB-CD1 4.09Å; N2427-L2430 PolarHBondContact O-N 3.36Å
2428Q66.7Low65.6Low75.5 Ų75.562.3 Ų62.335%0.35335%0.346SS..Hα-helixtrans-85.66.6180-68-176.3-33.900112.6D2374 Y2378 S2426 L2430 V2431 Q2432D2374-Q2428 PolarHBondContact OD2-NE2 3.23Å; D2374-Q2428 PolarHBondContact OD2-OE1 2.72Å; Y2378-Q2428 HydrophobicContact CE2-CB 4.36Å; Y2378-Q2428 PolarHBondContact OH-OE1 3.05Å; S2426-Q2428 PolarHBondContact O-N 2.92Å; S2426-Q2428 PolarHBondContact OG-N 2.9Å; Q2428-L2430 VanDerWaalsContact C-N 3.28Å; Q2428-L2430 PolarHBondContact O-N 3.05Å; Q2428-V2431 WeakPolarHBondContact O-CB 3.5Å; Q2428-V2431 PolarHBondContact O-N 3.31Å; Q2428-V2431 VanDerWaalsContact O-N 3.14Å; Q2428-Q2432 PolarHBondContact O-N 2.95Å
2429L66.2Low66.2Low80 Ų8061 Ų6142%0.41933%0.334SS..Hα-helixtrans-50.7-41.7-178.9-109.7161.6000113.2L2423 N2427 V2431 Q2432 I2433L2423-L2429 WeakPolarHBondContact O-CD2 3.38Å; N2427-L2429 PolarHBondContact O-N 3.44Å; L2429-V2431 PolarHBondContact O-N 3.05Å; L2429-Q2432 WeakPolarHBondContact O-CB 3.39Å; L2429-Q2432 PolarHBondContact O-N 3.21Å; L2429-I2433 HydrophobicContact CB-CD1 4.42Å; L2429-I2433 HydrophobicContact CD2-CD1 3.72Å; L2429-I2433 HydrophobicContact CD2-CG1 4.25Å; L2429-I2433 WeakPolarHBondContact O-CB 3.47Å; L2429-I2433 WeakPolarHBondContact O-CG1 3.43Å; L2429-I2433 PolarHBondContact O-N 3.14Å
2430L65.7Low66.7Low72.5 Ų72.561.9 Ų61.938%0.3834%0.337SS..Hα-helixtrans-69.8-32.4-177.5-119.7126.5000113.4T2235 S2425 N2427 Q2428 I2433 Y2434T2235-L2430 HydrophobicContact CG2-CD1 3.51Å; S2425-L2430 WeakPolarHBondContact OG-CD1 3.15Å; S2425-L2430 WeakPolarHBondContact OG-CD2 3.32Å; N2427-L2430 HydrophobicContact CB-CD1 4.09Å; N2427-L2430 PolarHBondContact O-N 3.36Å; Q2428-L2430 VanDerWaalsContact C-N 3.28Å; Q2428-L2430 PolarHBondContact O-N 3.05Å; L2430-I2433 PolarHBondContact O-N 3.02Å; L2430-Y2434 VanDerWaalsContact O-CB 3.31Å; L2430-Y2434 WeakPolarHBondContact O-CB 3.49Å; L2430-Y2434 PolarHBondContact O-N 3.2Å
2431V68.6Low67.1Low11.5 Ų11.565.4 Ų65.47%0.0734%0.343CS..Hα-helixtrans-69.2-40.7175.2-170.60000110.4W2371 A2375 Y2378 Q2428 L2429 Y2434 I2435W2371-V2431 VanDerWaalsContact NE1-CG2 3.27Å; A2375-V2431 HydrophobicContact CB-CG1 4.07Å; Y2378-V2431 HydrophobicContact CD2-CG1 4.26Å; Q2428-V2431 WeakPolarHBondContact O-CB 3.5Å; Q2428-V2431 PolarHBondContact O-N 3.31Å; Q2428-V2431 VanDerWaalsContact O-N 3.14Å; L2429-V2431 PolarHBondContact O-N 3.05Å; V2431-Y2434 PolarHBondContact O-N 3.07Å; V2431-I2435 HydrophobicContact CG1-CD1 3.89Å; V2431-I2435 WeakPolarHBondContact O-CG1 3.37Å; V2431-I2435 PolarHBondContact O-N 3.01Å
2432Q70.1Confident67.6Low46 Ų4662.7 Ų62.722%0.21533%0.329CS..Hα-helixtrans-66.2-42.3177-60.4176.7-20.200111.4Y2378 C2422 L2423 S2426 Q2428 L2429 I2435 G2436Y2378-Q2432 HydrophobicContact CD1-CG 3.92Å; Y2378-Q2432 HydrophobicContact CD2-CG 4.18Å; Y2378-Q2432 HydrophobicContact CE1-CG 3.68Å; Y2378-Q2432 HydrophobicContact CE2-CG 3.96Å; Y2378-Q2432 HydrophobicContact CG-CG 4.18Å; Y2378-Q2432 PolarHBondContact OH-NE2 3.41Å; C2422-Q2432 VanDerWaalsContact O-CD 3.3Å; C2422-Q2432 PolarHBondContact O-NE2 3.47Å; C2422-Q2432 PolarHBondContact O-OE1 2.9Å; L2423-Q2432 HydrophobicContact CD2-CB 3.58Å; L2423-Q2432 PolarHBondContact O-OE1 2.86Å; S2426-Q2432 PolarHBondContact O-OE1 2.72Å; S2426-Q2432 PolarHBondContact OG-NE2 3.1Å; S2426-Q2432 PolarHBondContact OG-OE1 2.86Å; Q2428-Q2432 PolarHBondContact O-N 2.95Å; L2429-Q2432 WeakPolarHBondContact O-CB 3.39Å; L2429-Q2432 PolarHBondContact O-N 3.21Å; Q2432-I2435 PolarHBondContact O-N 3.38Å; Q2432-G2436 WeakPolarHBondContact O-CA 3.4Å; Q2432-G2436 PolarHBondContact O-N 3.09Å
2433I70.1Confident68.4Low76.5 Ų76.563.9 Ų63.939%0.39233%0.334SS..Hα-helixtrans-62-46.9175.5-68164.8000110.6L2423 L2429 L2430 I2435 G2436 L2437L2423-I2433 HydrophobicContact CD1-CG1 4.01Å; L2423-I2433 HydrophobicContact CD2-CB 4.19Å; L2423-I2433 HydrophobicContact CD2-CG1 3.55Å; L2423-I2433 VanDerWaalsContact CD2-N 3.26Å; L2423-I2433 HydrophobicContact CG-CG1 4.38Å; L2429-I2433 HydrophobicContact CB-CD1 4.42Å; L2429-I2433 HydrophobicContact CD2-CD1 3.72Å; L2429-I2433 HydrophobicContact CD2-CG1 4.25Å; L2429-I2433 WeakPolarHBondContact O-CB 3.47Å; L2429-I2433 WeakPolarHBondContact O-CG1 3.43Å; L2429-I2433 PolarHBondContact O-N 3.14Å; L2430-I2433 PolarHBondContact O-N 3.02Å; I2433-I2435 PolarHBondContact O-N 3.45Å; I2433-G2436 PolarHBondContact O-N 3.22Å; I2433-L2437 HydrophobicContact CG2-CD1 3.72Å; I2433-L2437 HydrophobicContact CG2-CG 4.28Å; I2433-L2437 WeakPolarHBondContact O-CB 3.33Å; I2433-L2437 VanDerWaalsContact O-CG 3.26Å; I2433-L2437 WeakPolarHBondContact O-CG 3.31Å; I2433-L2437 PolarHBondContact O-N 3.31Å
2434Y72.1Confident69Low102.5 Ų102.566.7 Ų66.740%0.40234%0.343SS..Hα-helixtrans-59.4-48.9178.3174.8-91.7000111.7V2419 L2430 V2431 L2437 E2438V2419-Y2434 HydrophobicContact CG2-CD2 4.4Å; V2419-Y2434 HydrophobicContact CG2-CE2 4.05Å; L2430-Y2434 VanDerWaalsContact O-CB 3.31Å; L2430-Y2434 WeakPolarHBondContact O-CB 3.49Å; L2430-Y2434 PolarHBondContact O-N 3.2Å; V2431-Y2434 PolarHBondContact O-N 3.07Å; Y2434-L2437 PolarHBondContact O-N 3.3Å; Y2434-E2438 HydrophobicContact CE1-CB 4.29Å; Y2434-E2438 WeakPolarHBondContact CE1-OE2 3.33Å; Y2434-E2438 VanDerWaalsContact O-CB 3.26Å; Y2434-E2438 WeakPolarHBondContact O-CB 3.47Å; Y2434-E2438 PolarHBondContact O-N 3.41Å; Y2434-E2438 PolarHBondContact OH-OE1 3.34Å
2435I74.5Confident69.4Low2.5 Ų2.564.2 Ų64.21%0.01333%0.334CS..Hα-helixtrans-68.6-37.4-179.3-65.1167.4000110.9A2375 R2379 V2431 Q2432 I2433 E2438 T2439A2375-I2435 HydrophobicContact CB-CD1 4.05Å; A2375-I2435 WeakPolarHBondContact O-CD1 3.46Å; R2379-I2435 HydrophobicContact CG-CD1 4.17Å; R2379-I2435 HydrophobicContact CG-CG1 4.36Å; R2379-I2435 HydrophobicContact CG-CG2 3.84Å; V2431-I2435 HydrophobicContact CG1-CD1 3.89Å; V2431-I2435 WeakPolarHBondContact O-CG1 3.37Å; V2431-I2435 PolarHBondContact O-N 3.01Å; Q2432-I2435 PolarHBondContact O-N 3.38Å; I2433-I2435 PolarHBondContact O-N 3.45Å; I2435-E2438 PolarHBondContact O-N 2.92Å; I2435-T2439 HydrophobicContact CG2-CG2 4.11Å; I2435-T2439 VanDerWaalsContact O-CB 3.31Å; I2435-T2439 WeakPolarHBondContact O-CB 3.25Å; I2435-T2439 WeakPolarHBondContact O-CG2 3.42Å; I2435-T2439 PolarHBondContact O-N 3.09Å; I2435-T2439 PolarHBondContact O-OG1 2.98Å; I2435-T2439 VanDerWaalsContact O-OG1 3.11Å
2436G74.1Confident69.9Low18 Ų1863.6 Ų63.619%0.18633%0.329CS..Hα-helixtrans-63.1-40.8174.100000113Q2432 I2433 T2439 L2440Q2432-G2436 WeakPolarHBondContact O-CA 3.4Å; Q2432-G2436 PolarHBondContact O-N 3.09Å; I2433-G2436 PolarHBondContact O-N 3.22Å; G2436-T2439 WeakPolarHBondContact CA-OG1 3.32Å; G2436-T2439 PolarHBondContact O-OG1 2.87Å; G2436-L2440 WeakPolarHBondContact O-CB 3.25Å; G2436-L2440 PolarHBondContact O-N 2.93Å
2437L73.5Confident70.5Confident91 Ų9163.7 Ų63.748%0.47634%0.337SS..Hα-helixtrans-73.3-38.6175.4-70172.9000112.1A2418 I2433 Y2434 L2440 Y2441A2418-L2437 HydrophobicContact CB-CD1 3.96Å; I2433-L2437 HydrophobicContact CG2-CD1 3.72Å; I2433-L2437 HydrophobicContact CG2-CG 4.28Å; I2433-L2437 WeakPolarHBondContact O-CB 3.33Å; I2433-L2437 VanDerWaalsContact O-CG 3.26Å; I2433-L2437 WeakPolarHBondContact O-CG 3.31Å; I2433-L2437 PolarHBondContact O-N 3.31Å; Y2434-L2437 PolarHBondContact O-N 3.3Å; L2437-L2440 PolarHBondContact O-N 3.24Å; L2437-Y2441 VanDerWaalsContact O-CB 3.23Å; L2437-Y2441 WeakPolarHBondContact O-CB 3.34Å; L2437-Y2441 PolarHBondContact O-N 3.3Å
2438E73.2Confident71.3Confident40 Ų4060.8 Ų60.819%0.18732%0.323CS..Hα-helixtrans-60.5-46.9173.9-177.9-179.6-146.800110.7R2379 Y2434 I2435 L2442R2379-E2438 IonicContact CZ-OE1 3.14Å; R2379-E2438 IonicContact CZ-OE2 3.66Å; R2379-E2438 IonicContact NE-OE2 3.61Å; R2379-E2438 PolarHBondContact NE-OE2 3.17Å; R2379-E2438 VanDerWaalsContact NH2-CD 3.26Å; R2379-E2438 IonicContact NH2-OE1 3.3Å; R2379-E2438 PolarHBondContact NH2-OE1 3.27Å; R2379-E2438 VanDerWaalsContact NH2-OE1 3.08Å; R2379-E2438 IonicContact NH2-OE2 3.27Å; R2379-E2438 PolarHBondContact NH2-OE2 3.06Å; Y2434-E2438 HydrophobicContact CE1-CB 4.29Å; Y2434-E2438 WeakPolarHBondContact CE1-OE2 3.33Å; Y2434-E2438 VanDerWaalsContact O-CB 3.26Å; Y2434-E2438 WeakPolarHBondContact O-CB 3.47Å; Y2434-E2438 PolarHBondContact O-N 3.41Å; Y2434-E2438 PolarHBondContact OH-OE1 3.34Å; I2435-E2438 PolarHBondContact O-N 2.92Å; E2438-L2442 HydrophobicContact CG-CD1 4.25Å; E2438-L2442 WeakPolarHBondContact O-CB 3.36Å; E2438-L2442 VanDerWaalsContact O-CG 3.25Å; E2438-L2442 WeakPolarHBondContact O-CG 3.36Å; E2438-L2442 PolarHBondContact O-N 3.29Å
2439T74.2Confident72Confident14.5 Ų14.562.7 Ų62.79%0.08933%0.332CS..Hα-helixtrans-67.1-42.2178.358.10000111.8C2382 I2435 G2436 L2442 L2443 L2455C2382-T2439 HydrophobicContact CB-CG2 3.85Å; I2435-T2439 HydrophobicContact CG2-CG2 4.11Å; I2435-T2439 VanDerWaalsContact O-CB 3.31Å; I2435-T2439 WeakPolarHBondContact O-CB 3.25Å; I2435-T2439 WeakPolarHBondContact O-CG2 3.42Å; I2435-T2439 PolarHBondContact O-N 3.09Å; I2435-T2439 PolarHBondContact O-OG1 2.98Å; I2435-T2439 VanDerWaalsContact O-OG1 3.11Å; G2436-T2439 WeakPolarHBondContact CA-OG1 3.32Å; G2436-T2439 PolarHBondContact O-OG1 2.87Å; T2439-L2442 PolarHBondContact O-N 3.04Å; T2439-L2443 WeakPolarHBondContact O-CB 3.3Å; T2439-L2443 PolarHBondContact O-N 3.13Å; T2439-L2455 HydrophobicContact CG2-CD1 3.73Å; T2439-L2455 HydrophobicContact CG2-CD2 3.73Å; T2439-L2455 HydrophobicContact CG2-CG 4.4Å
2440L73.1Confident72.8Confident62.5 Ų62.563.1 Ų63.133%0.32734%0.335SS..Hα-helixtrans-63.9-45176.7-174.269000111.9G2436 L2437 L2442 L2443 F2444G2436-L2440 WeakPolarHBondContact O-CB 3.25Å; G2436-L2440 PolarHBondContact O-N 2.93Å; L2437-L2440 PolarHBondContact O-N 3.24Å; L2440-L2442 PolarHBondContact O-N 2.86Å; L2440-L2443 WeakPolarHBondContact O-CB 3.31Å; L2440-L2443 PolarHBondContact O-N 3.34Å; L2440-F2444 HydrophobicContact CD1-CD2 4.2Å; L2440-F2444 HydrophobicContact CD1-CE2 3.58Å; L2440-F2444 HydrophobicContact CD1-CZ 4.38Å; L2440-F2444 HydrophobicContact CD2-CE2 4.34Å; L2440-F2444 HydrophobicContact CG-CD2 4.04Å; L2440-F2444 HydrophobicContact CG-CE2 3.72Å; L2440-F2444 VanDerWaalsContact O-CD2 3.23Å; L2440-F2444 WeakPolarHBondContact O-CD2 3.45Å; L2440-F2444 PolarHBondContact O-N 3.23Å; L2440-F2444 VanDerWaalsContact O-N 3.13Å
2441Y73.4Confident73.6Confident146 Ų14659.7 Ų59.757%0.57332%0.317SS*.Hα-helixtrans-60.4-45.7176173.5-98.7000111.5L2437 L2443 F2444 A2445L2437-Y2441 VanDerWaalsContact O-CB 3.23Å; L2437-Y2441 WeakPolarHBondContact O-CB 3.34Å; L2437-Y2441 PolarHBondContact O-N 3.3Å; Y2441-L2443 VanDerWaalsContact C-N 3.31Å; Y2441-L2443 PolarHBondContact O-N 3.47Å; Y2441-F2444 PolarHBondContact O-N 3.21Å; Y2441-A2445 HydrophobicContact CE1-CB 4.41Å; Y2441-A2445 VanDerWaalsContact O-CB 3.3Å; Y2441-A2445 WeakPolarHBondContact O-CB 3.45Å; Y2441-A2445 PolarHBondContact O-N 3.23Å
2442L73.3Confident74.4Confident33.5 Ų33.559.6 Ų59.618%0.17532%0.316CS..Hα-helixtrans-63.1-37.7176.8-72.9172000111.9E2438 T2439 L2440 F2444 A2445 C2446 V2451 V2454 L2455E2438-L2442 HydrophobicContact CG-CD1 4.25Å; E2438-L2442 WeakPolarHBondContact O-CB 3.36Å; E2438-L2442 VanDerWaalsContact O-CG 3.25Å; E2438-L2442 WeakPolarHBondContact O-CG 3.36Å; E2438-L2442 PolarHBondContact O-N 3.29Å; T2439-L2442 PolarHBondContact O-N 3.04Å; L2440-L2442 PolarHBondContact O-N 2.86Å; L2442-F2444 VanDerWaalsContact C-N 3.32Å; L2442-F2444 PolarHBondContact O-N 3.21Å; L2442-A2445 PolarHBondContact O-N 3.08Å; L2442-C2446 WeakPolarHBondContact O-CB 3.37Å; L2442-C2446 PolarHBondContact O-N 3.33Å; L2442-V2451 VanDerWaalsContact C-CG2 3.48Å; L2442-V2451 HydrophobicContact CB-CG1 3.94Å; L2442-V2451 HydrophobicContact CB-CG2 4.07Å; L2442-V2451 WeakPolarHBondContact O-CG2 3.39Å; L2442-V2454 HydrophobicContact CD1-CG1 4Å; L2442-V2454 HydrophobicContact CD2-CG1 4.41Å; L2442-L2455 HydrophobicContact CD1-CD2 4.07Å; L2442-L2455 HydrophobicContact CD1-CG 4.34Å
2443L73.2Confident75.2Confident53 Ų5361.7 Ų61.728%0.27733%0.328SS..Hα-helixtrans-63.9-33.7177-152.6127.8000113.2L2386 F2390 T2439 L2440 Y2441 T2448L2386-L2443 HydrophobicContact CD2-CD1 3.47Å; L2386-L2443 VanDerWaalsContact CD2-CD1 3.47Å; F2390-L2443 HydrophobicContact CD2-CD1 4.41Å; F2390-L2443 HydrophobicContact CE2-CD1 3.82Å; F2390-L2443 HydrophobicContact CZ-CD1 4.12Å; F2390-L2443 HydrophobicContact CZ-CD2 4.16Å; T2439-L2443 WeakPolarHBondContact O-CB 3.3Å; T2439-L2443 PolarHBondContact O-N 3.13Å; L2440-L2443 WeakPolarHBondContact O-CB 3.31Å; L2440-L2443 PolarHBondContact O-N 3.34Å; Y2441-L2443 VanDerWaalsContact C-N 3.31Å; Y2441-L2443 PolarHBondContact O-N 3.47Å; L2443-T2448 HydrophobicContact CD1-CG2 4.27Å
2444F70.3Confident75.9Confident148 Ų14860.7 Ų60.765%0.64933%0.326SS*.Hα-helixtrans-81.3-33.4174-75-63.8000113.3L2440 Y2441 L2442L2440-F2444 HydrophobicContact CD1-CD2 4.2Å; L2440-F2444 HydrophobicContact CD1-CE2 3.58Å; L2440-F2444 HydrophobicContact CD1-CZ 4.38Å; L2440-F2444 HydrophobicContact CD2-CE2 4.34Å; L2440-F2444 HydrophobicContact CG-CD2 4.04Å; L2440-F2444 HydrophobicContact CG-CE2 3.72Å; L2440-F2444 VanDerWaalsContact O-CD2 3.23Å; L2440-F2444 WeakPolarHBondContact O-CD2 3.45Å; L2440-F2444 PolarHBondContact O-N 3.23Å; L2440-F2444 VanDerWaalsContact O-N 3.13Å; Y2441-F2444 PolarHBondContact O-N 3.21Å; L2442-F2444 VanDerWaalsContact C-N 3.32Å; L2442-F2444 PolarHBondContact O-N 3.21Å
2445A68.4Low76.6Confident65.5 Ų65.555.9 Ų55.954%0.54131%0.307SS..Hα-helixtrans-85.2-23.9-176.100000113.8Y2441 L2442Y2441-A2445 HydrophobicContact CE1-CB 4.41Å; Y2441-A2445 VanDerWaalsContact O-CB 3.3Å; Y2441-A2445 WeakPolarHBondContact O-CB 3.45Å; Y2441-A2445 PolarHBondContact O-N 3.23Å; L2442-A2445 PolarHBondContact O-N 3.08Å
2446C68.1Low77.3Confident49 Ų4955.8 Ų55.833%0.33131%0.306SS..SBendtrans-142.9147.7-172.1-143.60000111.7L2442 N2450 V2451L2442-C2446 WeakPolarHBondContact O-CB 3.37Å; L2442-C2446 PolarHBondContact O-N 3.33Å; C2446-N2450 HydrophobicContact CB-CB 4.35Å; C2446-N2450 WeakPolarHBondContact SG-CB 3.43Å; C2446-N2450 PolarHBondContact SG-ND2 3.3Å; C2446-V2451 HydrophobicContact CB-CG2 3.98Å; C2446-V2451 VanDerWaalsContact O-CG2 3.24Å; C2446-V2451 WeakPolarHBondContact O-CG2 3.46Å
2447G71.9Confident78.1Confident46.5 Ų46.558.6 Ų58.648%0.47932%0.317SS..  trans-58.8149.7175.600000112.6E2449 N2450 V2451G2447-E2449 VanDerWaalsContact C-N 3.28Å; G2447-E2449 PolarHBondContact O-N 3.17Å; G2447-E2449 VanDerWaalsContact O-N 3.15Å; G2447-N2450 WeakPolarHBondContact O-CB 3.35Å; G2447-N2450 PolarHBondContact O-N 3.4Å; G2447-V2451 WeakPolarHBondContact O-CG2 3.42Å; G2447-V2451 PolarHBondContact O-N 2.98Å; G2447-V2451 VanDerWaalsContact O-N 3.09Å
2448T77.6Confident78.7Confident42 Ų4255.9 Ų55.926%0.25830%0.304SS..Hα-helixtrans-53.9-38.1-170.849.70000114.1F2390 L2443 V2451 I2452F2390-T2448 HydrophobicContact CB-CG2 4.31Å; F2390-T2448 HydrophobicContact CD1-CG2 3.8Å; F2390-T2448 HydrophobicContact CD2-CG2 4.15Å; F2390-T2448 HydrophobicContact CE1-CG2 4.1Å; F2390-T2448 HydrophobicContact CE2-CG2 4.44Å; F2390-T2448 HydrophobicContact CG-CG2 3.83Å; F2390-T2448 HydrophobicContact CZ-CG2 4.41Å; L2443-T2448 HydrophobicContact CD1-CG2 4.27Å; T2448-V2451 PolarHBondContact O-N 3.41Å; T2448-I2452 WeakPolarHBondContact O-CG1 3.39Å; T2448-I2452 PolarHBondContact O-N 3.19Å
2449E80.7Confident79.5Confident116 Ų11654 Ų5454%0.54230%0.295SS..Hα-helixtrans-61-46.3175.4-63.7-170.1148.500112.3F2393 G2447 V2451 I2452 L2453F2393-E2449 HydrophobicContact CB-CG 3.72Å; F2393-E2449 VanDerWaalsContact CB-OE1 3.27Å; F2393-E2449 WeakPolarHBondContact CB-OE1 3.45Å; F2393-E2449 HydrophobicContact CD1-CG 4.35Å; F2393-E2449 HydrophobicContact CD2-CG 4.34Å; F2393-E2449 HydrophobicContact CG-CG 3.89Å; G2447-E2449 VanDerWaalsContact C-N 3.28Å; G2447-E2449 PolarHBondContact O-N 3.17Å; G2447-E2449 VanDerWaalsContact O-N 3.15Å; E2449-V2451 VanDerWaalsContact C-N 3.32Å; E2449-V2451 PolarHBondContact O-N 3.41Å; E2449-I2452 PolarHBondContact O-N 3.35Å; E2449-L2453 PolarHBondContact O-N 3.13Å
2450N82.2Confident80.3Confident88 Ų8856.4 Ų56.447%0.47131%0.305SS..Hα-helixtrans-66.5-36.8178.4-67.6-30.6000111.1C2446 G2447 L2453 V2454C2446-N2450 HydrophobicContact CB-CB 4.35Å; C2446-N2450 WeakPolarHBondContact SG-CB 3.43Å; C2446-N2450 PolarHBondContact SG-ND2 3.3Å; G2447-N2450 WeakPolarHBondContact O-CB 3.35Å; G2447-N2450 PolarHBondContact O-N 3.4Å; N2450-L2453 PolarHBondContact O-N 3.48Å; N2450-V2454 WeakPolarHBondContact O-CB 3.27Å; N2450-V2454 VanDerWaalsContact O-CG2 3.29Å; N2450-V2454 WeakPolarHBondContact O-CG2 3.28Å; N2450-V2454 PolarHBondContact O-N 3.17Å
2451V82.8Confident81.1Confident1 Ų158.3 Ų58.31%0.00631%0.314CS..Hα-helixtrans-62.7-44.6176.5177.80000111.1L2386 L2442 C2446 G2447 T2448 E2449 L2453 V2454 L2455L2386-V2451 HydrophobicContact CD1-CG1 4.08Å; L2442-V2451 VanDerWaalsContact C-CG2 3.48Å; L2442-V2451 HydrophobicContact CB-CG1 3.94Å; L2442-V2451 HydrophobicContact CB-CG2 4.07Å; L2442-V2451 WeakPolarHBondContact O-CG2 3.39Å; C2446-V2451 HydrophobicContact CB-CG2 3.98Å; C2446-V2451 VanDerWaalsContact O-CG2 3.24Å; C2446-V2451 WeakPolarHBondContact O-CG2 3.46Å; G2447-V2451 WeakPolarHBondContact O-CG2 3.42Å; G2447-V2451 PolarHBondContact O-N 2.98Å; G2447-V2451 VanDerWaalsContact O-N 3.09Å; T2448-V2451 PolarHBondContact O-N 3.41Å; E2449-V2451 VanDerWaalsContact C-N 3.32Å; E2449-V2451 PolarHBondContact O-N 3.41Å; V2451-L2453 VanDerWaalsContact C-N 3.32Å; V2451-L2453 PolarHBondContact O-N 3.08Å; V2451-V2454 PolarHBondContact O-N 2.87Å; V2451-L2455 HydrophobicContact CG1-CD1 3.71Å; V2451-L2455 HydrophobicContact CG1-CG 4.28Å; V2451-L2455 VanDerWaalsContact O-CB 3.3Å; V2451-L2455 WeakPolarHBondContact O-CB 3.43Å; V2451-L2455 VanDerWaalsContact O-CG 3.25Å; V2451-L2455 WeakPolarHBondContact O-CG 3.47Å; V2451-L2455 PolarHBondContact O-N 3.35Å
2452I85.9Confident81.8Confident9 Ų953.8 Ų53.85%0.04630%0.297CS..Hα-helixtrans-63.3-40.2176.5-69.4169.6000110.9L2383 L2386 L2387 F2393 T2448 E2449 G2456 Y2586L2383-I2452 HydrophobicContact CD2-CB 4.45Å; L2383-I2452 HydrophobicContact CD2-CG2 4.07Å; L2386-I2452 HydrophobicContact CB-CD1 4.45Å; L2386-I2452 HydrophobicContact CB-CG1 4.37Å; L2386-I2452 HydrophobicContact CD1-CG1 4.41Å; L2387-I2452 HydrophobicContact CD2-CD1 4.37Å; F2393-I2452 HydrophobicContact CE1-CD1 3.49Å; F2393-I2452 VanDerWaalsContact CE1-CD1 3.45Å; F2393-I2452 HydrophobicContact CE2-CD1 4.23Å; F2393-I2452 HydrophobicContact CZ-CD1 3.25Å; T2448-I2452 WeakPolarHBondContact O-CG1 3.39Å; T2448-I2452 PolarHBondContact O-N 3.19Å; E2449-I2452 PolarHBondContact O-N 3.35Å; I2452-G2456 WeakPolarHBondContact O-CA 3.44Å; I2452-G2456 PolarHBondContact O-N 3.05Å; I2452-Y2586 HydrophobicContact CG2-CE2 4.04Å
2453L85.7Confident82.6Confident91 Ų9152.3 Ų52.348%0.47629%0.29SS..Hα-helixtrans-64.9-45.5176.6-171.5154000111.8E2449 N2450 V2451 G2456 L2457E2449-L2453 PolarHBondContact O-N 3.13Å; N2450-L2453 PolarHBondContact O-N 3.48Å; V2451-L2453 VanDerWaalsContact C-N 3.32Å; V2451-L2453 PolarHBondContact O-N 3.08Å; L2453-G2456 PolarHBondContact O-N 2.8Å; L2453-L2457 HydrophobicContact CD2-CD1 3.53Å; L2453-L2457 VanDerWaalsContact CD2-CD1 3.48Å; L2453-L2457 HydrophobicContact CD2-CG 4.19Å; L2453-L2457 WeakPolarHBondContact O-CB 3.36Å; L2453-L2457 WeakPolarHBondContact O-CG 3.43Å; L2453-L2457 PolarHBondContact O-N 3.21Å
2454V86.2Confident83.4Confident56 Ų5653.1 Ų53.134%0.33929%0.291SS..Hα-helixtrans-64.9-46.9178.3170.70000111.3L2442 N2450 V2451 G2456 L2457 T2458L2442-V2454 HydrophobicContact CD1-CG1 4Å; L2442-V2454 HydrophobicContact CD2-CG1 4.41Å; N2450-V2454 WeakPolarHBondContact O-CB 3.27Å; N2450-V2454 VanDerWaalsContact O-CG2 3.29Å; N2450-V2454 WeakPolarHBondContact O-CG2 3.28Å; N2450-V2454 PolarHBondContact O-N 3.17Å; V2451-V2454 PolarHBondContact O-N 2.87Å; V2454-G2456 VanDerWaalsContact C-N 3.31Å; V2454-G2456 PolarHBondContact O-N 3.25Å; V2454-L2457 PolarHBondContact O-N 2.94Å; V2454-T2458 HydrophobicContact CG1-CG2 4.36Å; V2454-T2458 WeakPolarHBondContact O-CB 3.38Å; V2454-T2458 WeakPolarHBondContact O-CG2 3.45Å; V2454-T2458 PolarHBondContact O-N 3.24Å; V2454-T2458 PolarHBondContact O-OG1 2.91Å
2455L86.9Confident84.1Confident0.5 Ų0.547.3 Ų47.30%0.00327%0.27CS..Hα-helixtrans-64.2-36.8175.8-70.5172.9000111.9L2383 L2386 T2439 L2442 V2451 T2458 N2459L2383-L2455 HydrophobicContact CD1-CB 4.43Å; L2383-L2455 HydrophobicContact CD2-CB 3.63Å; L2383-L2455 HydrophobicContact CD2-CD1 4.46Å; L2383-L2455 HydrophobicContact CG-CB 4.03Å; L2386-L2455 HydrophobicContact CD1-CD1 3.58Å; T2439-L2455 HydrophobicContact CG2-CD1 3.73Å; T2439-L2455 HydrophobicContact CG2-CD2 3.73Å; T2439-L2455 HydrophobicContact CG2-CG 4.4Å; L2442-L2455 HydrophobicContact CD1-CD2 4.07Å; L2442-L2455 HydrophobicContact CD1-CG 4.34Å; V2451-L2455 HydrophobicContact CG1-CD1 3.71Å; V2451-L2455 HydrophobicContact CG1-CG 4.28Å; V2451-L2455 VanDerWaalsContact O-CB 3.3Å; V2451-L2455 WeakPolarHBondContact O-CB 3.43Å; V2451-L2455 VanDerWaalsContact O-CG 3.25Å; V2451-L2455 WeakPolarHBondContact O-CG 3.47Å; V2451-L2455 PolarHBondContact O-N 3.35Å; L2455-T2458 WeakPolarHBondContact CA-OG1 3.33Å; L2455-T2458 PolarHBondContact O-OG1 3.27Å; L2455-T2458 VanDerWaalsContact O-OG1 3.08Å; L2455-N2459 VanDerWaalsContact O-CB 3.23Å; L2455-N2459 WeakPolarHBondContact O-CB 3.38Å; L2455-N2459 PolarHBondContact O-N 2.98Å
2456G89.1Confident84.9Confident0 Ų044.3 Ų44.30%025%0.245CC..Hα-helixtrans-61-53173.100000112.7I2452 L2453 V2454 T2458 N2459 F2460 Y2586I2452-G2456 WeakPolarHBondContact O-CA 3.44Å; I2452-G2456 PolarHBondContact O-N 3.05Å; L2453-G2456 PolarHBondContact O-N 2.8Å; V2454-G2456 VanDerWaalsContact C-N 3.31Å; V2454-G2456 PolarHBondContact O-N 3.25Å; G2456-T2458 PolarHBondContact O-N 3.08Å; G2456-N2459 PolarHBondContact O-N 2.89Å; G2456-F2460 WeakPolarHBondContact O-CB 3.29Å; G2456-F2460 PolarHBondContact O-N 3.23Å; G2456-Y2586 VanDerWaalsContact CA-OH 3.31Å; G2456-Y2586 WeakPolarHBondContact CA-OH 3.37Å
2457L89.8Confident85.8Confident77 Ų7742.5 Ų42.540%0.40323%0.232SC..Hα-helixtrans-61.2-44.9178.1-75.7176.2000112.2L2453 V2454 N2459 F2460 I2461 I2579L2453-L2457 HydrophobicContact CD2-CD1 3.53Å; L2453-L2457 VanDerWaalsContact CD2-CD1 3.48Å; L2453-L2457 HydrophobicContact CD2-CG 4.19Å; L2453-L2457 WeakPolarHBondContact O-CB 3.36Å; L2453-L2457 WeakPolarHBondContact O-CG 3.43Å; L2453-L2457 PolarHBondContact O-N 3.21Å; V2454-L2457 PolarHBondContact O-N 2.94Å; L2457-N2459 VanDerWaalsContact C-N 3.34Å; L2457-N2459 PolarHBondContact O-N 3.02Å; L2457-F2460 WeakPolarHBondContact O-CB 3.17Å; L2457-F2460 PolarHBondContact O-N 3.12Å; L2457-I2461 VanDerWaalsContact O-CG1 3.3Å; L2457-I2461 WeakPolarHBondContact O-CG1 3.34Å; L2457-I2461 PolarHBondContact O-N 2.98Å; L2457-I2579 HydrophobicContact CD2-CD1 4.25Å; L2457-I2579 HydrophobicContact CD2-CG2 4.41Å
2458T87.1Confident86.5Confident35 Ų3543.8 Ų43.822%0.21523%0.227CC..Hα-helixtrans-66.6-35.9179.256.30000112.2R2379 V2454 L2455 G2456 F2462R2379-T2458 VanDerWaalsContact NH1-CB 3.26Å; R2379-T2458 PolarHBondContact NH1-O 3.28Å; R2379-T2458 PolarHBondContact NH1-OG1 3.01Å; V2454-T2458 HydrophobicContact CG1-CG2 4.36Å; V2454-T2458 WeakPolarHBondContact O-CB 3.38Å; V2454-T2458 WeakPolarHBondContact O-CG2 3.45Å; V2454-T2458 PolarHBondContact O-N 3.24Å; V2454-T2458 PolarHBondContact O-OG1 2.91Å; L2455-T2458 WeakPolarHBondContact CA-OG1 3.33Å; L2455-T2458 PolarHBondContact O-OG1 3.27Å; L2455-T2458 VanDerWaalsContact O-OG1 3.08Å; G2456-T2458 PolarHBondContact O-N 3.08Å; T2458-F2462 WeakPolarHBondContact O-CB 3.22Å; T2458-F2462 VanDerWaalsContact O-CD1 3.32Å; T2458-F2462 WeakPolarHBondContact O-CD1 3.45Å; T2458-F2462 PolarHBondContact O-N 3.05Å
2459N89.9Confident86.7Confident0 Ų042.6 Ų42.60%022%0.22CC..Hα-helixtrans-64.9-44.2171.6-170.814000111.5S2376 R2379 S2380 L2383 L2455 G2456 L2457 I2461 F2462 R2463S2376-N2459 WeakPolarHBondContact CB-OD1 3.36Å; S2376-N2459 PolarHBondContact O-OD1 2.93Å; R2379-N2459 HydrophobicContact CB-CB 4.37Å; S2380-N2459 PolarHBondContact OG-ND2 3.38Å; L2383-N2459 HydrophobicContact CD1-CB 4.47Å; L2455-N2459 VanDerWaalsContact O-CB 3.23Å; L2455-N2459 WeakPolarHBondContact O-CB 3.38Å; L2455-N2459 PolarHBondContact O-N 2.98Å; G2456-N2459 PolarHBondContact O-N 2.89Å; L2457-N2459 VanDerWaalsContact C-N 3.34Å; L2457-N2459 PolarHBondContact O-N 3.02Å; N2459-I2461 VanDerWaalsContact C-N 3.35Å; N2459-I2461 PolarHBondContact O-N 3.22Å; N2459-F2462 PolarHBondContact O-N 3.47Å; N2459-R2463 WeakPolarHBondContact O-CG 3.5Å; N2459-R2463 PolarHBondContact O-N 3.45Å; N2459-R2463 PolarHBondContact OD1-NE 3.16Å
2460F91.2Very high86.8Confident64.5 Ų64.537.9 Ų37.928%0.28320%0.198SC..Hα-helixtrans-59.1-44.9175.6-176.3-89.6000111.9G2456 L2457 F2462 R2463 F2464 I2572 I2579G2456-F2460 WeakPolarHBondContact O-CB 3.29Å; G2456-F2460 PolarHBondContact O-N 3.23Å; L2457-F2460 WeakPolarHBondContact O-CB 3.17Å; L2457-F2460 PolarHBondContact O-N 3.12Å; F2460-F2462 PolarHBondContact O-N 3.29Å; F2460-R2463 PolarHBondContact O-N 2.92Å; F2460-F2464 VanDerWaalsContact O-CB 3.28Å; F2460-F2464 WeakPolarHBondContact O-CB 3.33Å; F2460-F2464 PolarHBondContact O-N 3.12Å; F2460-I2572 HydrophobicContact CD2-CG2 4.31Å; F2460-I2572 HydrophobicContact CE2-CG2 3.65Å; F2460-I2572 HydrophobicContact CZ-CG2 4.13Å; F2460-I2579 HydrophobicContact CB-CD1 3.79Å; F2460-I2579 HydrophobicContact CD2-CD1 4.27Å; F2460-I2579 HydrophobicContact CG-CD1 4.17Å
2461I89.3Confident86.9Confident103 Ų10337 Ų3753%0.52819%0.189SC..Hα-helixtrans-60.8-44.8175.8-68.2164.7000111.1L2457 N2459 F2464 A2465L2457-I2461 VanDerWaalsContact O-CG1 3.3Å; L2457-I2461 WeakPolarHBondContact O-CG1 3.34Å; L2457-I2461 PolarHBondContact O-N 2.98Å; N2459-I2461 VanDerWaalsContact C-N 3.35Å; N2459-I2461 PolarHBondContact O-N 3.22Å; I2461-F2464 PolarHBondContact O-N 3.04Å; I2461-A2465 WeakPolarHBondContact O-CB 3.43Å; I2461-A2465 PolarHBondContact O-N 3.28Å
2462F88.7Confident86.8Confident51 Ų5140.3 Ų40.322%0.22420%0.203CC..Hα-helixtrans-64.8-44.2180-83.526.2000111.7W2371 I2372 A2375 R2379 T2458 N2459 F2460 A2465 N2466W2371-F2462 HydrophobicContact CH2-CE2 4.41Å; W2371-F2462 HydrophobicContact CZ3-CE2 4.16Å; I2372-F2462 HydrophobicContact CG2-CB 4.2Å; I2372-F2462 HydrophobicContact CG2-CD2 4.36Å; I2372-F2462 HydrophobicContact CG2-CG 4.46Å; I2372-F2462 WeakPolarHBondContact CG2-O 3.18Å; A2375-F2462 HydrophobicContact CB-CD2 4.15Å; A2375-F2462 HydrophobicContact CB-CE2 4.13Å; R2379-F2462 VanDerWaalsContact CZ-CE2 3.44Å; R2379-F2462 VanDerWaalsContact NH1-CD2 3.31Å; R2379-F2462 VanDerWaalsContact NH1-CE1 3.32Å; T2458-F2462 WeakPolarHBondContact O-CB 3.22Å; T2458-F2462 VanDerWaalsContact O-CD1 3.32Å; T2458-F2462 WeakPolarHBondContact O-CD1 3.45Å; T2458-F2462 PolarHBondContact O-N 3.05Å; N2459-F2462 PolarHBondContact O-N 3.47Å; F2460-F2462 PolarHBondContact O-N 3.29Å; F2462-A2465 PolarHBondContact O-N 2.87Å; F2462-N2466 PolarHBondContact O-N 3.3Å
2463R89.5Confident86.6Confident2 Ų241.3 Ų41.31%0.00821%0.207CC..Hα-helixtrans-65.7-40.8176.1-69-169.7177.9-92.97.8111.8S2380 N2459 F2460 N2466 L2467 L2571 I2572 D2592S2380-R2463 PolarHBondContact OG-NH2 3.32Å; N2459-R2463 WeakPolarHBondContact O-CG 3.5Å; N2459-R2463 PolarHBondContact O-N 3.45Å; N2459-R2463 PolarHBondContact OD1-NE 3.16Å; F2460-R2463 PolarHBondContact O-N 2.92Å; R2463-N2466 PolarHBondContact O-N 2.9Å; R2463-L2467 PolarHBondContact O-N 3.37Å; R2463-L2571 VanDerWaalsContact NH1-CD1 3.33Å; R2463-I2572 HydrophobicContact CB-CD1 4.32Å; R2463-I2572 HydrophobicContact CB-CG1 3.7Å; R2463-D2592 IonicContact CZ-OD2 2.71Å; R2463-D2592 IonicContact NH1-OD2 2.71Å; R2463-D2592 PolarHBondContact NH1-OD2 3.17Å; R2463-D2592 IonicContact NH2-OD2 3.84Å; R2463-D2592 PolarHBondContact NH2-OD2 3.45Å
2464F89.3Confident86.4Confident70 Ų7038.7 Ų38.731%0.30719%0.191SC..Hα-helixtrans-63-43.5175.6-175.5-102.7000112.3F2460 I2461 N2466 L2467 L2468 V2539F2460-F2464 VanDerWaalsContact O-CB 3.28Å; F2460-F2464 WeakPolarHBondContact O-CB 3.33Å; F2460-F2464 PolarHBondContact O-N 3.12Å; I2461-F2464 PolarHBondContact O-N 3.04Å; F2464-N2466 VanDerWaalsContact C-N 3.35Å; F2464-N2466 PolarHBondContact O-N 2.88Å; F2464-L2467 PolarHBondContact O-N 3.05Å; F2464-L2468 HydrophobicContact CD1-CD1 4.04Å; F2464-L2468 HydrophobicContact CD1-CG 4.4Å; F2464-L2468 HydrophobicContact CE1-CD1 3.55Å; F2464-L2468 HydrophobicContact CE1-CD2 4.45Å; F2464-L2468 HydrophobicContact CE1-CG 4.05Å; F2464-L2468 HydrophobicContact CZ-CD1 4.1Å; F2464-L2468 HydrophobicContact CZ-CD2 4.22Å; F2464-L2468 HydrophobicContact CZ-CG 4.22Å; F2464-L2468 WeakPolarHBondContact O-CG 3.43Å; F2464-L2468 PolarHBondContact O-N 3.32Å; F2464-V2539 HydrophobicContact CZ-CG2 4.22Å
2465A85.8Confident86Confident25.5 Ų25.539.3 Ų39.321%0.21119%0.192CC..Hα-helixtrans-60-44.2174.300000111.6I2461 F2462 L2467 L2468 I2469I2461-A2465 WeakPolarHBondContact O-CB 3.43Å; I2461-A2465 PolarHBondContact O-N 3.28Å; F2462-A2465 PolarHBondContact O-N 2.87Å; A2465-L2467 PolarHBondContact O-N 2.9Å; A2465-L2468 PolarHBondContact O-N 3.02Å; A2465-I2469 WeakPolarHBondContact O-CD1 3.47Å; A2465-I2469 VanDerWaalsContact O-CG1 3.31Å; A2465-I2469 WeakPolarHBondContact O-CG1 3.36Å; A2465-I2469 PolarHBondContact O-N 3.26Å
2466N85.6Confident85.5Confident3 Ų340.4 Ų40.42%0.01620%0.198CC..Hα-helixtrans-62-42.5176.1-160.832.9000112.1S2369 I2372 F2462 R2463 F2464 L2468 I2469 I2470S2369-N2466 PolarHBondContact OG-OD1 3.35Å; I2372-N2466 HydrophobicContact CG2-CB 4.16Å; F2462-N2466 PolarHBondContact O-N 3.3Å; R2463-N2466 PolarHBondContact O-N 2.9Å; F2464-N2466 VanDerWaalsContact C-N 3.35Å; F2464-N2466 PolarHBondContact O-N 2.88Å; N2466-L2468 PolarHBondContact O-N 3.34Å; N2466-I2469 PolarHBondContact O-N 3.38Å; N2466-I2470 VanDerWaalsContact O-CG1 3.3Å; N2466-I2470 WeakPolarHBondContact O-CG1 3.37Å; N2466-I2470 PolarHBondContact O-N 3.02Å
2467L87.3Confident85Confident11.5 Ų11.541.7 Ų41.76%0.0621%0.205CC..Hα-helixtrans-59.8-43.9175.8-177.275.5000112R2463 F2464 A2465 I2469 I2470 Y2471 L2565 N2568 F2569 I2572R2463-L2467 PolarHBondContact O-N 3.37Å; F2464-L2467 PolarHBondContact O-N 3.05Å; A2465-L2467 PolarHBondContact O-N 2.9Å; L2467-I2469 VanDerWaalsContact C-N 3.31Å; L2467-I2469 PolarHBondContact O-N 3.2Å; L2467-I2470 PolarHBondContact O-N 3.04Å; L2467-Y2471 WeakPolarHBondContact O-CB 3.47Å; L2467-Y2471 PolarHBondContact O-N 3.04Å; L2467-L2565 HydrophobicContact CD1-CD2 4.22Å; L2467-N2568 HydrophobicContact CD1-CB 4.04Å; L2467-F2569 HydrophobicContact CD1-CB 4.46Å; L2467-F2569 HydrophobicContact CD2-CD2 4.35Å; L2467-I2572 HydrophobicContact CB-CD1 3.63Å; L2467-I2572 HydrophobicContact CD1-CD1 4.42Å; L2467-I2572 HydrophobicContact CD2-CD1 3.65Å; L2467-I2572 HydrophobicContact CG-CD1 4.1Å
2468L84.9Confident84.3Confident73 Ų7341.5 Ų41.538%0.38220%0.2SC..Hα-helixtrans-61.7-38.7179.2-72.3179.9000112.4F2464 A2465 N2466 K2472 L2542F2464-L2468 HydrophobicContact CD1-CD1 4.04Å; F2464-L2468 HydrophobicContact CD1-CG 4.4Å; F2464-L2468 HydrophobicContact CE1-CD1 3.55Å; F2464-L2468 HydrophobicContact CE1-CD2 4.45Å; F2464-L2468 HydrophobicContact CE1-CG 4.05Å; F2464-L2468 HydrophobicContact CZ-CD1 4.1Å; F2464-L2468 HydrophobicContact CZ-CD2 4.22Å; F2464-L2468 HydrophobicContact CZ-CG 4.22Å; F2464-L2468 WeakPolarHBondContact O-CG 3.43Å; F2464-L2468 PolarHBondContact O-N 3.32Å; A2465-L2468 PolarHBondContact O-N 3.02Å; N2466-L2468 PolarHBondContact O-N 3.34Å; L2468-K2472 WeakPolarHBondContact O-CB 3.28Å; L2468-K2472 PolarHBondContact O-N 3.17Å; L2468-L2542 HydrophobicContact CD2-CD1 4.42Å
2469I83.1Confident83.7Confident18.5 Ų18.543.4 Ų43.410%0.09521%0.209CC..Hα-helixtrans-66.3-50.9177.6-60.9156.7000110F2365 I2372 A2465 N2466 L2467 Y2471 K2472 Q2473F2365-I2469 HydrophobicContact CB-CD1 3.63Å; F2365-I2469 HydrophobicContact CB-CG1 4Å; F2365-I2469 HydrophobicContact CD1-CD1 3.85Å; F2365-I2469 HydrophobicContact CG-CD1 4.08Å; I2372-I2469 HydrophobicContact CD1-CD1 4.33Å; A2465-I2469 WeakPolarHBondContact O-CD1 3.47Å; A2465-I2469 VanDerWaalsContact O-CG1 3.31Å; A2465-I2469 WeakPolarHBondContact O-CG1 3.36Å; A2465-I2469 PolarHBondContact O-N 3.26Å; N2466-I2469 PolarHBondContact O-N 3.38Å; L2467-I2469 VanDerWaalsContact C-N 3.31Å; L2467-I2469 PolarHBondContact O-N 3.2Å; I2469-Y2471 VanDerWaalsContact C-N 3.32Å; I2469-Y2471 PolarHBondContact O-N 3.14Å; I2469-K2472 PolarHBondContact O-N 3.34Å; I2469-Q2473 PolarHBondContact O-N 3.14Å
2470I82.4Confident82.9Confident16 Ų1644.4 Ų44.48%0.08221%0.213CC..Hα-helixtrans-62.8-40.2179.8-63.3167.9000110.7N2466 L2467 Q2473 Y2474 L2561 L2565 N2568N2466-I2470 VanDerWaalsContact O-CG1 3.3Å; N2466-I2470 WeakPolarHBondContact O-CG1 3.37Å; N2466-I2470 PolarHBondContact O-N 3.02Å; L2467-I2470 PolarHBondContact O-N 3.04Å; I2470-Q2473 PolarHBondContact O-N 3.24Å; I2470-Y2474 WeakPolarHBondContact O-CB 3.32Å; I2470-Y2474 PolarHBondContact O-N 2.96Å; I2470-L2561 HydrophobicContact CG2-CD1 4.27Å; I2470-L2565 HydrophobicContact CB-CD2 4.08Å; I2470-L2565 HydrophobicContact CG2-CB 4.34Å; I2470-L2565 HydrophobicContact CG2-CD2 3.56Å; I2470-L2565 HydrophobicContact CG2-CG 3.89Å; I2470-N2568 WeakPolarHBondContact CD1-ND2 3.38Å
2471Y83.6Confident82Confident70 Ų7044 Ų4428%0.27521%0.211SC..Hα-helixtrans-63.4-43.8175.8177.5-100000111.7L2467 I2469 Y2474 L2475 L2542 L2565L2467-Y2471 WeakPolarHBondContact O-CB 3.47Å; L2467-Y2471 PolarHBondContact O-N 3.04Å; I2469-Y2471 VanDerWaalsContact C-N 3.32Å; I2469-Y2471 PolarHBondContact O-N 3.14Å; Y2471-Y2474 PolarHBondContact O-N 2.93Å; Y2471-L2475 HydrophobicContact CE1-CD2 4.38Å; Y2471-L2475 WeakPolarHBondContact O-CB 3.45Å; Y2471-L2475 PolarHBondContact O-N 3.15Å; Y2471-L2542 HydrophobicContact CD1-CD2 4.06Å; Y2471-L2542 HydrophobicContact CD2-CD2 3.72Å; Y2471-L2542 HydrophobicContact CE1-CD2 4.2Å; Y2471-L2542 HydrophobicContact CE2-CD2 3.49Å; Y2471-L2542 VanDerWaalsContact CE2-CD2 3.42Å; Y2471-L2542 HydrophobicContact CG-CD2 3.83Å; Y2471-L2565 HydrophobicContact CD2-CD1 4.2Å
2472K82.1Confident81Confident70.5 Ų70.543.6 Ų43.631%0.30721%0.21SC..Hα-helixtrans-64.3-42.4176.8-173.5162.9-174.2163.30111.7I2362 L2468 I2469 L2475 L2476I2362-K2472 HydrophobicContact CD1-CD 4.02Å; I2362-K2472 VanDerWaalsContact CD1-CE 3.47Å; L2468-K2472 WeakPolarHBondContact O-CB 3.28Å; L2468-K2472 PolarHBondContact O-N 3.17Å; I2469-K2472 PolarHBondContact O-N 3.34Å; K2472-L2475 PolarHBondContact O-N 3.14Å; K2472-L2476 HydrophobicContact CG-CD1 4.16Å; K2472-L2476 WeakPolarHBondContact O-CB 3.42Å; K2472-L2476 WeakPolarHBondContact O-CG 3.46Å; K2472-L2476 PolarHBondContact O-N 3.17Å
2473Q80.5Confident79.8Confident29 Ų2944.1 Ų44.114%0.13622%0.219CC..Hα-helixtrans-60.7-46.5174.5-177.4172.615.700111.5K2319 E2349 I2469 I2470 L2475 L2476 I2477K2319-Q2473 VanDerWaalsContact NZ-NE2 3.17Å; E2349-Q2473 PolarHBondContact OE1-NE2 2.68Å; I2469-Q2473 PolarHBondContact O-N 3.14Å; I2470-Q2473 PolarHBondContact O-N 3.24Å; Q2473-L2475 PolarHBondContact O-N 2.97Å; Q2473-L2476 PolarHBondContact O-N 3.31Å; Q2473-I2477 HydrophobicContact CG-CD1 3.73Å; Q2473-I2477 HydrophobicContact CG-CG1 4.48Å; Q2473-I2477 WeakPolarHBondContact O-CD1 3.25Å; Q2473-I2477 VanDerWaalsContact O-CG1 3.24Å; Q2473-I2477 WeakPolarHBondContact O-CG1 3.38Å; Q2473-I2477 PolarHBondContact O-N 3.26Å
2474Y81.7Confident78.5Confident36.5 Ų36.545.9 Ų45.914%0.14323%0.229CC..Hα-helixtrans-59.2-46175.8170.9-95.1000112.6I2470 Y2471 L2476 I2477 K2478 Y2545 L2561 Y2562 L2565I2470-Y2474 WeakPolarHBondContact O-CB 3.32Å; I2470-Y2474 PolarHBondContact O-N 2.96Å; Y2471-Y2474 PolarHBondContact O-N 2.93Å; Y2474-L2476 PolarHBondContact O-N 2.91Å; Y2474-I2477 PolarHBondContact O-N 3.04Å; Y2474-K2478 HydrophobicContact CE1-CD 4.06Å; Y2474-K2478 VanDerWaalsContact O-CB 3.27Å; Y2474-K2478 WeakPolarHBondContact O-CB 3.44Å; Y2474-K2478 PolarHBondContact O-N 3.06Å; Y2474-Y2545 PolarHBondContact OH-OH 3.31Å; Y2474-L2561 VanDerWaalsContact CA-CD2 3.48Å; Y2474-L2561 HydrophobicContact CD2-CB 4.36Å; Y2474-L2561 HydrophobicContact CD2-CD2 3.89Å; Y2474-L2561 HydrophobicContact CD2-CG 4.08Å; Y2474-L2561 HydrophobicContact CG-CD2 4.33Å; Y2474-Y2562 HydrophobicContact CE2-CD2 4.46Å; Y2474-L2565 HydrophobicContact CD1-CD1 3.94Å; Y2474-L2565 HydrophobicContact CD2-CD1 3.78Å; Y2474-L2565 HydrophobicContact CE1-CD1 4.45Å; Y2474-L2565 HydrophobicContact CE2-CD1 4.44Å; Y2474-L2565 HydrophobicContact CG-CD1 3.69Å; Y2474-L2565 VanDerWaalsContact CG-CD1 3.44Å
2475L78.1Confident77.1Confident68 Ų6847.5 Ų47.536%0.35624%0.236SC..Hα-helixtrans-63.5-43.3179.7-176.665.6000111.6Y2471 K2472 Q2473 K2478 N2479Y2471-L2475 HydrophobicContact CE1-CD2 4.38Å; Y2471-L2475 WeakPolarHBondContact O-CB 3.45Å; Y2471-L2475 PolarHBondContact O-N 3.15Å; K2472-L2475 PolarHBondContact O-N 3.14Å; Q2473-L2475 PolarHBondContact O-N 2.97Å; L2475-K2478 PolarHBondContact O-N 3.35Å; L2475-N2479 WeakPolarHBondContact O-CB 3.42Å; L2475-N2479 PolarHBondContact O-N 3.03Å; L2475-N2479 PolarHBondContact O-ND2 3.02Å; L2475-N2479 PolarHBondContact O-OD1 3.22Å
2476L77.4Confident75.5Confident23.5 Ų23.548.2 Ų48.212%0.12324%0.239CC..Hα-helixtrans-63.3-49178.3-105.5125000111.3C2352 H2355 M2356 K2472 Q2473 Y2474 K2478 N2479 Y2480C2352-L2476 HydrophobicContact CB-CB 4.5Å; C2352-L2476 HydrophobicContact CB-CD2 4.16Å; H2355-L2476 HydrophobicContact CB-CD2 3.85Å; M2356-L2476 HydrophobicContact CG-CD1 4.36Å; K2472-L2476 HydrophobicContact CG-CD1 4.16Å; K2472-L2476 WeakPolarHBondContact O-CB 3.42Å; K2472-L2476 WeakPolarHBondContact O-CG 3.46Å; K2472-L2476 PolarHBondContact O-N 3.17Å; Q2473-L2476 PolarHBondContact O-N 3.31Å; Y2474-L2476 PolarHBondContact O-N 2.91Å; L2476-K2478 VanDerWaalsContact C-N 3.31Å; L2476-K2478 PolarHBondContact O-N 3.37Å; L2476-N2479 PolarHBondContact O-N 2.98Å; L2476-Y2480 HydrophobicContact CB-CD2 4.38Å; L2476-Y2480 HydrophobicContact CB-CE2 4.2Å; L2476-Y2480 HydrophobicContact CD2-CE2 3.96Å; L2476-Y2480 HydrophobicContact CG-CD2 4.33Å; L2476-Y2480 HydrophobicContact CG-CE2 3.86Å; L2476-Y2480 WeakPolarHBondContact O-CD2 3.37Å; L2476-Y2480 PolarHBondContact O-N 3.31Å
2477I77.7Confident73.6Confident28.5 Ų28.554.4 Ų54.415%0.14627%0.272CS..Hα-helixtrans-60.3-42.5177.5-67164.8000110.6A2348 E2349 C2352 Q2473 Y2474 Y2480 K2481 L2561A2348-I2477 HydrophobicContact CB-CG2 4.44Å; E2349-I2477 WeakPolarHBondContact OE2-CD1 3.46Å; C2352-I2477 HydrophobicContact CB-CG1 4Å; Q2473-I2477 HydrophobicContact CG-CD1 3.73Å; Q2473-I2477 HydrophobicContact CG-CG1 4.48Å; Q2473-I2477 WeakPolarHBondContact O-CD1 3.25Å; Q2473-I2477 VanDerWaalsContact O-CG1 3.24Å; Q2473-I2477 WeakPolarHBondContact O-CG1 3.38Å; Q2473-I2477 PolarHBondContact O-N 3.26Å; Y2474-I2477 PolarHBondContact O-N 3.04Å; I2477-Y2480 PolarHBondContact O-N 3.18Å; I2477-K2481 VanDerWaalsContact O-CB 3.28Å; I2477-K2481 WeakPolarHBondContact O-CB 3.48Å; I2477-K2481 PolarHBondContact O-N 3.39Å; I2477-L2561 HydrophobicContact CD1-CD2 3.88Å
2478K75.4Confident71.7Confident72.5 Ų72.562.8 Ų62.832%0.31531%0.311SS..Hα-helixtrans-63.1-42176.8-174.8176.3-176.8174.80112.1Y2474 L2475 L2476 K2481 N2482Y2474-K2478 HydrophobicContact CE1-CD 4.06Å; Y2474-K2478 VanDerWaalsContact O-CB 3.27Å; Y2474-K2478 WeakPolarHBondContact O-CB 3.44Å; Y2474-K2478 PolarHBondContact O-N 3.06Å; L2475-K2478 PolarHBondContact O-N 3.35Å; L2476-K2478 VanDerWaalsContact C-N 3.31Å; L2476-K2478 PolarHBondContact O-N 3.37Å; K2478-K2481 PolarHBondContact O-N 3.19Å; K2478-N2482 WeakPolarHBondContact O-CB 3.47Å; K2478-N2482 PolarHBondContact O-N 2.9Å; K2478-N2482 PolarHBondContact O-OD1 2.88Å
2479N73.9Confident69.5Low75 Ų7565.7 Ų65.740%0.40133%0.326SS..Hα-helixtrans-65.2-47177.2-70.7-10.3000111.1L2475 L2476 K2481 N2482 C2483L2475-N2479 WeakPolarHBondContact O-CB 3.42Å; L2475-N2479 PolarHBondContact O-N 3.03Å; L2475-N2479 PolarHBondContact O-ND2 3.02Å; L2475-N2479 PolarHBondContact O-OD1 3.22Å; L2476-N2479 PolarHBondContact O-N 2.98Å; N2479-K2481 PolarHBondContact O-N 3.28Å; N2479-N2482 PolarHBondContact O-N 3.09Å; N2479-C2483 PolarHBondContact O-N 3.28Å; N2479-C2483 PolarHBondContact O-SG 3.27Å; N2479-C2483 VanDerWaalsContact O-SG 3.34Å
2480Y74Confident67.2Low21 Ų2170.9 Ų70.98%0.08235%0.354CS..Hα-helixtrans-62.9-41.9176.2-72.9-56.5000112.2L2351 C2352 H2355 L2476 I2477 C2483 L2484 F2499L2351-Y2480 HydrophobicContact CB-CD1 4.21Å; L2351-Y2480 HydrophobicContact CB-CD2 4.13Å; L2351-Y2480 HydrophobicContact CB-CE1 4.18Å; L2351-Y2480 HydrophobicContact CB-CE2 4.11Å; L2351-Y2480 HydrophobicContact CB-CG 4.2Å; L2351-Y2480 HydrophobicContact CD1-CD1 4.11Å; L2351-Y2480 HydrophobicContact CD1-CE1 4.42Å; L2351-Y2480 HydrophobicContact CD1-CG 4.39Å; C2352-Y2480 HydrophobicContact CB-CD2 4.42Å; C2352-Y2480 HydrophobicContact CB-CE2 4.43Å; H2355-Y2480 PolarHBondContact CD2-OH 3.12Å; H2355-Y2480 VanDerWaalsContact CD2-OH 3.31Å; L2476-Y2480 HydrophobicContact CB-CD2 4.38Å; L2476-Y2480 HydrophobicContact CB-CE2 4.2Å; L2476-Y2480 HydrophobicContact CD2-CE2 3.96Å; L2476-Y2480 HydrophobicContact CG-CD2 4.33Å; L2476-Y2480 HydrophobicContact CG-CE2 3.86Å; L2476-Y2480 WeakPolarHBondContact O-CD2 3.37Å; L2476-Y2480 PolarHBondContact O-N 3.31Å; I2477-Y2480 PolarHBondContact O-N 3.18Å; Y2480-C2483 PolarHBondContact O-N 3.32Å; Y2480-L2484 WeakPolarHBondContact O-CB 3.23Å; Y2480-L2484 VanDerWaalsContact O-CG 3.28Å; Y2480-L2484 WeakPolarHBondContact O-CG 3.35Å; Y2480-L2484 PolarHBondContact O-N 2.94Å; Y2480-F2499 HydrophobicContact CD1-CE2 4.4Å; Y2480-F2499 HydrophobicContact CD1-CZ 4.49Å; Y2480-F2499 HydrophobicContact CE1-CE1 4.34Å; Y2480-F2499 AromaticContact CE1-CE2 3.59Å; Y2480-F2499 HydrophobicContact CE1-CE2 3.83Å; Y2480-F2499 AromaticContact CE1-CZ 3.67Å; Y2480-F2499 HydrophobicContact CE1-CZ 3.67Å; Y2480-F2499 AromaticContact CZ-CZ 3.91Å
2481K71.7Confident64.9Low56 Ų5676.5 Ų76.524%0.24338%0.383CS..Hα-helixtrans-58.6-50.6173.7-169.7169.1-175.2170.80110.4E2345 I2477 K2478 N2479 C2483 L2484 F2485E2345-K2481 IonicContact OE1-NZ 3.42Å; E2345-K2481 PolarHBondContact OE1-NZ 3.43Å; I2477-K2481 VanDerWaalsContact O-CB 3.28Å; I2477-K2481 WeakPolarHBondContact O-CB 3.48Å; I2477-K2481 PolarHBondContact O-N 3.39Å; K2478-K2481 PolarHBondContact O-N 3.19Å; N2479-K2481 PolarHBondContact O-N 3.28Å; K2481-C2483 VanDerWaalsContact C-N 3.3Å; K2481-C2483 PolarHBondContact O-N 3.02Å; K2481-L2484 PolarHBondContact O-N 2.98Å; K2481-L2484 VanDerWaalsContact O-N 3.13Å; K2481-F2485 HydrophobicContact CB-CD2 4.5Å; K2481-F2485 HydrophobicContact CD-CD2 4.38Å; K2481-F2485 HydrophobicContact CD-CE2 4.18Å; K2481-F2485 VanDerWaalsContact CE-CE2 3.46Å; K2481-F2485 HydrophobicContact CG-CD2 3.54Å; K2481-F2485 VanDerWaalsContact CG-CD2 3.43Å; K2481-F2485 HydrophobicContact CG-CE2 3.61Å; K2481-F2485 VanDerWaalsContact CG-CE2 3.49Å; K2481-F2485 VanDerWaalsContact O-CD2 3.25Å; K2481-F2485 WeakPolarHBondContact O-CD2 3.32Å; K2481-F2485 PolarHBondContact O-N 2.88Å
2482N67.7Low62.5Low94 Ų9477.1 Ų77.150%0.50339%0.39SS..Hα-helixtrans-59-39.7177.5-72.4-2.1000112.6K2478 N2479 S2486K2478-N2482 WeakPolarHBondContact O-CB 3.47Å; K2478-N2482 PolarHBondContact O-N 2.9Å; K2478-N2482 PolarHBondContact O-OD1 2.88Å; N2479-N2482 PolarHBondContact O-N 3.09Å; N2482-S2486 VanDerWaalsContact O-CB 3.27Å; N2482-S2486 WeakPolarHBondContact O-CB 3.4Å; N2482-S2486 PolarHBondContact O-N 3.06Å; N2482-S2486 PolarHBondContact O-OG 3.26Å
2483C65Low60.6Low62 Ų6279.1 Ų79.142%0.41940%0.401SS..Hα-helixtrans-65.2-43.2175-69.70000112.3N2479 Y2480 K2481 S2486N2479-C2483 PolarHBondContact O-N 3.28Å; N2479-C2483 PolarHBondContact O-SG 3.27Å; N2479-C2483 VanDerWaalsContact O-SG 3.34Å; Y2480-C2483 PolarHBondContact O-N 3.32Å; K2481-C2483 VanDerWaalsContact C-N 3.3Å; K2481-C2483 PolarHBondContact O-N 3.02Å; C2483-S2486 WeakPolarHBondContact CA-OG 3.38Å; C2483-S2486 PolarHBondContact O-N 2.92Å; C2483-S2486 PolarHBondContact O-OG 2.96Å
2484L62.3Low58.9Low39 Ų3981 Ų8120%0.20442%0.415CS..Hα-helixtrans-64.2-45.2178.5-72.1165.7000112.1Y2347 A2348 Y2480 K2481 S2486 N2487Y2347-L2484 HydrophobicContact CD1-CD1 3.88Å; Y2347-L2484 HydrophobicContact CD1-CD2 3.71Å; Y2347-L2484 HydrophobicContact CD1-CG 4.45Å; Y2347-L2484 HydrophobicContact CE1-CD2 3.79Å; A2348-L2484 HydrophobicContact CB-CD1 4.13Å; Y2480-L2484 WeakPolarHBondContact O-CB 3.23Å; Y2480-L2484 VanDerWaalsContact O-CG 3.28Å; Y2480-L2484 WeakPolarHBondContact O-CG 3.35Å; Y2480-L2484 PolarHBondContact O-N 2.94Å; K2481-L2484 PolarHBondContact O-N 2.98Å; K2481-L2484 VanDerWaalsContact O-N 3.13Å; L2484-S2486 VanDerWaalsContact C-N 3.31Å; L2484-S2486 PolarHBondContact O-N 2.95Å; L2484-N2487 PolarHBondContact O-N 3.22Å
2485F58.9Low56.7Low105.5 Ų105.583.7 Ų83.746%0.46343%0.432SS..Hα-helixtrans-75.7-18179-79.1-84.1000113.4E2344 K2481 N2487E2344-F2485 HydrophobicContact CB-CE2 4.24Å; E2344-F2485 HydrophobicContact CB-CZ 4.26Å; E2344-F2485 WeakPolarHBondContact OE2-CE1 3.49Å; E2344-F2485 WeakPolarHBondContact OE2-CE2 3.43Å; E2344-F2485 WeakPolarHBondContact OE2-CZ 3.46Å; K2481-F2485 HydrophobicContact CB-CD2 4.5Å; K2481-F2485 HydrophobicContact CD-CD2 4.38Å; K2481-F2485 HydrophobicContact CD-CE2 4.18Å; K2481-F2485 VanDerWaalsContact CE-CE2 3.46Å; K2481-F2485 HydrophobicContact CG-CD2 3.54Å; K2481-F2485 VanDerWaalsContact CG-CD2 3.43Å; K2481-F2485 HydrophobicContact CG-CE2 3.61Å; K2481-F2485 VanDerWaalsContact CG-CE2 3.49Å; K2481-F2485 VanDerWaalsContact O-CD2 3.25Å; K2481-F2485 WeakPolarHBondContact O-CD2 3.32Å; K2481-F2485 PolarHBondContact O-N 2.88Å; F2485-N2487 PolarHBondContact O-N 3.11Å; F2485-N2487 VanDerWaalsContact O-N 3.08Å
2486S52.2Low55.1Low38.5 Ų38.587.4 Ų87.427%0.26944%0.441SS..G310 helixtrans-68.6-7.7177.566.80000114.5N2482 C2483 L2484 E2488 I2489N2482-S2486 VanDerWaalsContact O-CB 3.27Å; N2482-S2486 WeakPolarHBondContact O-CB 3.4Å; N2482-S2486 PolarHBondContact O-N 3.06Å; N2482-S2486 PolarHBondContact O-OG 3.26Å; C2483-S2486 WeakPolarHBondContact CA-OG 3.38Å; C2483-S2486 PolarHBondContact O-N 2.92Å; C2483-S2486 PolarHBondContact O-OG 2.96Å; L2484-S2486 VanDerWaalsContact C-N 3.31Å; L2484-S2486 PolarHBondContact O-N 2.95Å; S2486-E2488 VanDerWaalsContact C-N 3.26Å; S2486-E2488 PolarHBondContact O-N 2.93Å; S2486-I2489 CarbonylContact O-C 3.59Å; S2486-I2489 PolarHBondContact O-N 3.19Å
2487N46.3Very low53.4Low134 Ų13491.6 Ų91.672%0.71746%0.458SS*.G310 helixtrans-69.1-11.1-180-76.4-13.2000114.9L2484 F2485L2484-N2487 PolarHBondContact O-N 3.22Å; F2485-N2487 PolarHBondContact O-N 3.11Å; F2485-N2487 VanDerWaalsContact O-N 3.08Å
2488E45.8Very low51.8Low188 Ų18897 Ų9788%0.87948%0.478SS*.G310 helixtrans-95.6-4.5171.8-71.5-171.7157.300114S2486S2486-E2488 VanDerWaalsContact C-N 3.26Å; S2486-E2488 PolarHBondContact O-N 2.93Å
2489I39.8Very low50.5Low133 Ų13396.5 Ų96.568%0.68248%0.475SS*.SBendtrans-126.991-178.8-54.1178.5000109.9S2486S2486-I2489 CarbonylContact O-C 3.59Å; S2486-I2489 PolarHBondContact O-N 3.19Å
2490N34.2Very low49.4Very low128.5 Ų128.596.4 Ų96.469%0.68747%0.473SS*.  trans61.2104.7171.5-66.9-24.5000116.1N2492N2490-N2492 VanDerWaalsContact C-N 3.33Å; N2490-N2492 PolarHBondContact O-N 3.24Å
2491I33.8Very low48.2Very low134 Ų134101.5 Ų101.569%0.68749%0.493SS*.  trans-54.888.7160.5-57.6165.2000109
2492N33.7Very low47.2Very low82 Ų82102 Ų10244%0.43950%0.497SS..  trans-113.5110.7158.6-80.2-15.8000106.2N2490 T2494 N2495N2490-N2492 VanDerWaalsContact C-N 3.33Å; N2490-N2492 PolarHBondContact O-N 3.24Å; N2492-T2494 HydrophobicContact CB-CG2 4.49Å; N2492-T2494 WeakPolarHBondContact CB-OG1 3.29Å; N2492-T2494 PolarHBondContact O-N 2.97Å; N2492-N2495 PolarHBondContact O-N 2.97Å; N2492-N2495 VanDerWaalsContact O-N 3.15Å
2493E43Very low46.3Very low112.5 Ų112.599.3 Ų99.353%0.52648%0.483SS..THydrogen-bonded Turntrans-51.1-15.1172.6-67.7-171.1152.500113.5N2495 W2496 K2497E2493-N2495 VanDerWaalsContact C-N 3.26Å; E2493-N2495 PolarHBondContact O-N 3.15Å; E2493-W2496 PolarHBondContact O-N 3.16Å; E2493-K2497 HydrophobicContact CB-CD 4.35Å; E2493-K2497 WeakPolarHBondContact O-CB 3.49Å; E2493-K2497 PolarHBondContact O-N 3.19Å; E2493-K2497 VanDerWaalsContact O-N 3.11Å; E2493-K2497 IonicContact OE2-NZ 3.69Å; E2493-K2497 PolarHBondContact OE2-NZ 3.17Å
2494T43.5Very low45.5Very low69.5 Ų69.598.7 Ų98.743%0.42648%0.476SS..Hα-helixtrans-57.6-32.8176.962.30000112.9N2492 K2497 Y2498N2492-T2494 HydrophobicContact CB-CG2 4.49Å; N2492-T2494 WeakPolarHBondContact CB-OG1 3.29Å; N2492-T2494 PolarHBondContact O-N 2.97Å; T2494-K2497 CarbonylContact O-C 3.59Å; T2494-Y2498 WeakPolarHBondContact O-CA 3.24Å; T2494-Y2498 WeakPolarHBondContact O-CB 3.38Å; T2494-Y2498 PolarHBondContact O-N 3.25Å
2495N37.4Very low44.7Very low92.5 Ų92.5101.3 Ų101.350%0.49549%0.485SS..Hα-helixtrans-72.6-39.1-178.8-79.2-15.2000112.9N2492 E2493 Y2498 F2499N2492-N2495 PolarHBondContact O-N 2.97Å; N2492-N2495 VanDerWaalsContact O-N 3.15Å; E2493-N2495 VanDerWaalsContact C-N 3.26Å; E2493-N2495 PolarHBondContact O-N 3.15Å; N2495-Y2498 PolarHBondContact O-N 3.36Å; N2495-F2499 PolarHBondContact O-N 3.11Å
2496W43.9Very low44.3Very low146 Ų146100.4 Ų100.455%0.55348%0.482SS*.Hα-helixtrans-70.1-44.8173.6161.1-105.8000110.8E2026 E2493 Y2498 F2499 E2500E2026-W2496 WeakPolarHBondContact OE1-CH2 3.36Å; E2026-W2496 WeakPolarHBondContact OE1-CZ3 3.27Å; E2026-W2496 WeakPolarHBondContact OE2-CH2 3.41Å; E2026-W2496 WeakPolarHBondContact OE2-CZ3 3.45Å; E2493-W2496 PolarHBondContact O-N 3.16Å; W2496-Y2498 PolarHBondContact O-N 3.42Å; W2496-F2499 CarbonylContact O-C 3.46Å; W2496-F2499 WeakPolarHBondContact O-CA 3.48Å; W2496-F2499 WeakPolarHBondContact O-CB 3.26Å; W2496-F2499 PolarHBondContact O-N 3.41Å; W2496-F2499 VanDerWaalsContact O-N 3.12Å; W2496-E2500 HydrophobicContact CE3-CB 4.35Å; W2496-E2500 HydrophobicContact CH2-CB 3.56Å; W2496-E2500 HydrophobicContact CH2-CG 3.46Å; W2496-E2500 VanDerWaalsContact CH2-CG 3.46Å; W2496-E2500 HydrophobicContact CZ2-CB 4.22Å; W2496-E2500 HydrophobicContact CZ2-CG 4.24Å; W2496-E2500 WeakPolarHBondContact CZ2-OE2 3.49Å; W2496-E2500 HydrophobicContact CZ3-CB 3.65Å; W2496-E2500 HydrophobicContact CZ3-CG 3.94Å; W2496-E2500 PolarHBondContact O-N 3.34Å
2497K41.7Very low44.2Very low111 Ų111102.3 Ų102.348%0.48349%0.486SS..Hα-helixtrans-61.1-29.3172.2-76.5168.2176.5158.70112.5E2493 T2494 Y2501E2493-K2497 HydrophobicContact CB-CD 4.35Å; E2493-K2497 WeakPolarHBondContact O-CB 3.49Å; E2493-K2497 PolarHBondContact O-N 3.19Å; E2493-K2497 VanDerWaalsContact O-N 3.11Å; E2493-K2497 IonicContact OE2-NZ 3.69Å; E2493-K2497 PolarHBondContact OE2-NZ 3.17Å; T2494-K2497 CarbonylContact O-C 3.59Å; K2497-Y2501 WeakPolarHBondContact O-CB 3.36Å; K2497-Y2501 PolarHBondContact O-N 3.31Å
2498Y43.5Very low44.3Very low143 Ų143103.8 Ų103.856%0.56148%0.481SS*.Hα-helixtrans-72.6-36.8173.2-171.4-106.7000111.7T2494 N2495 W2496 Y2501 I2502T2494-Y2498 WeakPolarHBondContact O-CA 3.24Å; T2494-Y2498 WeakPolarHBondContact O-CB 3.38Å; T2494-Y2498 PolarHBondContact O-N 3.25Å; N2495-Y2498 PolarHBondContact O-N 3.36Å; W2496-Y2498 PolarHBondContact O-N 3.42Å; Y2498-Y2501 HydrophobicContact CD2-CD1 4.42Å; Y2498-Y2501 PolarHBondContact O-N 3.06Å; Y2498-I2502 HydrophobicContact CD1-CD1 3.67Å; Y2498-I2502 HydrophobicContact CD1-CG1 4.41Å; Y2498-I2502 HydrophobicContact CE1-CD1 3.3Å; Y2498-I2502 HydrophobicContact CE1-CG1 4.19Å; Y2498-I2502 HydrophobicContact CG-CD1 4.46Å; Y2498-I2502 WeakPolarHBondContact O-CB 3.2Å; Y2498-I2502 VanDerWaalsContact O-CG1 3.32Å; Y2498-I2502 WeakPolarHBondContact O-CG1 3.36Å; Y2498-I2502 PolarHBondContact O-N 2.75Å
2499F47.3Very low44.4Very low61 Ų61101 Ų10127%0.26847%0.466SS..Hα-helixtrans-64.9-45.7170.7-162.5-93.6000111.4Y2480 N2495 W2496 Y2501 I2502 N2503Y2480-F2499 HydrophobicContact CD1-CE2 4.4Å; Y2480-F2499 HydrophobicContact CD1-CZ 4.49Å; Y2480-F2499 HydrophobicContact CE1-CE1 4.34Å; Y2480-F2499 AromaticContact CE1-CE2 3.59Å; Y2480-F2499 HydrophobicContact CE1-CE2 3.83Å; Y2480-F2499 AromaticContact CE1-CZ 3.67Å; Y2480-F2499 HydrophobicContact CE1-CZ 3.67Å; Y2480-F2499 AromaticContact CZ-CZ 3.91Å; N2495-F2499 PolarHBondContact O-N 3.11Å; W2496-F2499 CarbonylContact O-C 3.46Å; W2496-F2499 WeakPolarHBondContact O-CA 3.48Å; W2496-F2499 WeakPolarHBondContact O-CB 3.26Å; W2496-F2499 PolarHBondContact O-N 3.41Å; W2496-F2499 VanDerWaalsContact O-N 3.12Å; F2499-Y2501 VanDerWaalsContact C-N 3.33Å; F2499-Y2501 PolarHBondContact O-N 3.18Å; F2499-I2502 PolarHBondContact O-N 3.15Å; F2499-N2503 VanDerWaalsContact O-CB 3.31Å; F2499-N2503 WeakPolarHBondContact O-CB 3.09Å; F2499-N2503 PolarHBondContact O-N 3.38Å
2500E51.3Low44.7Very low74 Ų7499.2 Ų99.235%0.34646%0.458SS..Hα-helixtrans-62-40.4173.7-160.5-170.7169.400111.4W2496 N2503 N2504W2496-E2500 HydrophobicContact CE3-CB 4.35Å; W2496-E2500 HydrophobicContact CH2-CB 3.56Å; W2496-E2500 HydrophobicContact CH2-CG 3.46Å; W2496-E2500 VanDerWaalsContact CH2-CG 3.46Å; W2496-E2500 HydrophobicContact CZ2-CB 4.22Å; W2496-E2500 HydrophobicContact CZ2-CG 4.24Å; W2496-E2500 WeakPolarHBondContact CZ2-OE2 3.49Å; W2496-E2500 HydrophobicContact CZ3-CB 3.65Å; W2496-E2500 HydrophobicContact CZ3-CG 3.94Å; W2496-E2500 PolarHBondContact O-N 3.34Å; E2500-N2503 PolarHBondContact O-N 3.48Å; E2500-N2504 WeakPolarHBondContact O-CB 3.36Å; E2500-N2504 PolarHBondContact O-N 3.4Å; E2500-N2504 PolarHBondContact O-ND2 3.17Å; E2500-N2504 PolarHBondContact OE1-ND2 3.4Å; E2500-N2504 VanDerWaalsContact OE1-ND2 3.09Å
2501Y50.2Low45.6Very low127.5 Ų127.596.6 Ų96.650%0.545%0.446SS..Hα-helixtrans-64.5-42.3174.3175.7-96.6000112.2K2497 Y2498 F2499 K2505K2497-Y2501 WeakPolarHBondContact O-CB 3.36Å; K2497-Y2501 PolarHBondContact O-N 3.31Å; Y2498-Y2501 HydrophobicContact CD2-CD1 4.42Å; Y2498-Y2501 PolarHBondContact O-N 3.06Å; F2499-Y2501 VanDerWaalsContact C-N 3.33Å; F2499-Y2501 PolarHBondContact O-N 3.18Å; Y2501-K2505 HydrophobicContact CD1-CD 4.42Å; Y2501-K2505 HydrophobicContact CE1-CD 3.66Å; Y2501-K2505 WeakPolarHBondContact O-CA 3.34Å; Y2501-K2505 WeakPolarHBondContact O-CB 3.45Å; Y2501-K2505 PolarHBondContact O-N 2.9Å; Y2501-K2505 PolarHBondContact OH-NZ 3.28Å
2502I49.9Very low46.1Very low66 Ų6694.7 Ų94.734%0.33844%0.438SS..Hα-helixtrans-64.1-48.8174.9-74171.7000110.1Y2498 F2499 N2504 K2505 E2506Y2498-I2502 HydrophobicContact CD1-CD1 3.67Å; Y2498-I2502 HydrophobicContact CD1-CG1 4.41Å; Y2498-I2502 HydrophobicContact CE1-CD1 3.3Å; Y2498-I2502 HydrophobicContact CE1-CG1 4.19Å; Y2498-I2502 HydrophobicContact CG-CD1 4.46Å; Y2498-I2502 WeakPolarHBondContact O-CB 3.2Å; Y2498-I2502 VanDerWaalsContact O-CG1 3.32Å; Y2498-I2502 WeakPolarHBondContact O-CG1 3.36Å; Y2498-I2502 PolarHBondContact O-N 2.75Å; F2499-I2502 PolarHBondContact O-N 3.15Å; I2502-N2504 PolarHBondContact O-N 2.91Å; I2502-K2505 CarbonylContact O-C 3.6Å; I2502-K2505 PolarHBondContact O-N 3.37Å; I2502-K2505 VanDerWaalsContact O-N 3.12Å; I2502-E2506 HydrophobicContact CG2-CG 4.43Å; I2502-E2506 WeakPolarHBondContact O-CG 3.41Å; I2502-E2506 PolarHBondContact O-N 3.02Å
2503N48.8Very low46.8Very low37 Ų3792.9 Ų92.920%0.19843%0.434CS..Hα-helixtrans-64.5-41.5-177.8-145.3-7.2000110.9F2499 E2500 E2506 K2507F2499-N2503 VanDerWaalsContact O-CB 3.31Å; F2499-N2503 WeakPolarHBondContact O-CB 3.09Å; F2499-N2503 PolarHBondContact O-N 3.38Å; E2500-N2503 PolarHBondContact O-N 3.48Å; N2503-E2506 PolarHBondContact O-N 3.08Å; N2503-K2507 VanDerWaalsContact O-CB 3.31Å; N2503-K2507 WeakPolarHBondContact O-CB 3.33Å; N2503-K2507 VanDerWaalsContact O-CG 3.3Å; N2503-K2507 WeakPolarHBondContact O-CG 3.39Å; N2503-K2507 PolarHBondContact O-N 3.39Å
2504N49.1Very low46.9Very low50.5 Ų50.595 Ų9527%0.2744%0.441SS..Hα-helixtrans-70.6-32.7173.7-74.7-26.2000112.8E2500 I2502 R2508E2500-N2504 WeakPolarHBondContact O-CB 3.36Å; E2500-N2504 PolarHBondContact O-N 3.4Å; E2500-N2504 PolarHBondContact O-ND2 3.17Å; E2500-N2504 PolarHBondContact OE1-ND2 3.4Å; E2500-N2504 VanDerWaalsContact OE1-ND2 3.09Å; I2502-N2504 PolarHBondContact O-N 2.91Å; N2504-R2508 VanDerWaalsContact O-CB 3.25Å; N2504-R2508 WeakPolarHBondContact O-CB 3.31Å; N2504-R2508 VanDerWaalsContact O-CG 3.28Å; N2504-R2508 WeakPolarHBondContact O-CG 3.44Å; N2504-R2508 PolarHBondContact O-N 3.24Å
2505K45.7Very low47Very low94 Ų9494.9 Ų94.941%0.40944%0.438SS..Hα-helixtrans-71.1-37175.2-174.2173-171.4168.70111.5Y2501 I2502 K2509Y2501-K2505 HydrophobicContact CD1-CD 4.42Å; Y2501-K2505 HydrophobicContact CE1-CD 3.66Å; Y2501-K2505 WeakPolarHBondContact O-CA 3.34Å; Y2501-K2505 WeakPolarHBondContact O-CB 3.45Å; Y2501-K2505 PolarHBondContact O-N 2.9Å; Y2501-K2505 PolarHBondContact OH-NZ 3.28Å; I2502-K2505 CarbonylContact O-C 3.6Å; I2502-K2505 PolarHBondContact O-N 3.37Å; I2502-K2505 VanDerWaalsContact O-N 3.12Å; K2505-K2509 WeakPolarHBondContact O-CB 3.12Å; K2505-K2509 VanDerWaalsContact O-CG 3.28Å; K2505-K2509 WeakPolarHBondContact O-CG 3.29Å; K2505-K2509 PolarHBondContact O-N 2.71Å
2506E50.3Low47.2Very low85.5 Ų85.599.4 Ų99.440%0.445%0.448SS..Hα-helixtrans-73.6-42.4173.1-67.9-148.7147.500111.9I2502 N2503 R2508 K2509 L2510I2502-E2506 HydrophobicContact CG2-CG 4.43Å; I2502-E2506 WeakPolarHBondContact O-CG 3.41Å; I2502-E2506 PolarHBondContact O-N 3.02Å; N2503-E2506 PolarHBondContact O-N 3.08Å; E2506-R2508 PolarHBondContact O-N 3.05Å; E2506-K2509 CarbonylContact O-C 3.59Å; E2506-K2509 WeakPolarHBondContact O-CB 3.15Å; E2506-K2509 PolarHBondContact O-N 3.25Å; E2506-K2509 VanDerWaalsContact O-N 3.17Å; E2506-L2510 WeakPolarHBondContact O-CB 3.48Å; E2506-L2510 PolarHBondContact O-N 3.26Å
2507K48.4Very low47.4Very low79 Ų7998.5 Ų98.534%0.34345%0.453SS..Hα-helixtrans-57.8-45.2170.4-77.4-179.8179.3-177.20111.8M2022 N2503 K2509 L2510 V2511M2022-K2507 PolarHBondContact O-NZ 3.31Å; N2503-K2507 VanDerWaalsContact O-CB 3.31Å; N2503-K2507 WeakPolarHBondContact O-CB 3.33Å; N2503-K2507 VanDerWaalsContact O-CG 3.3Å; N2503-K2507 WeakPolarHBondContact O-CG 3.39Å; N2503-K2507 PolarHBondContact O-N 3.39Å; K2507-K2509 PolarHBondContact O-N 3.23Å; K2507-L2510 WeakPolarHBondContact O-CB 3.34Å; K2507-L2510 PolarHBondContact O-N 3.26Å; K2507-L2510 VanDerWaalsContact O-N 3.16Å; K2507-V2511 WeakPolarHBondContact O-CG2 3.38Å; K2507-V2511 PolarHBondContact O-N 3.23Å
2508R48.6Very low47.7Very low164.5 Ų164.596.9 Ų96.962%0.62146%0.456SS*.Hα-helixtrans-64-38174.6-77.5177.7-174.9-175.73.7112.6E2026 N2504 E2506 L2510 N2512E2026-R2508 IonicContact OE1-CZ 2.7Å; E2026-R2508 IonicContact OE1-NE 3.93Å; E2026-R2508 PolarHBondContact OE1-NE 3.42Å; E2026-R2508 IonicContact OE1-NH2 2.72Å; E2026-R2508 PolarHBondContact OE1-NH2 3.46Å; E2026-R2508 IonicContact OE2-NH2 2.79Å; N2504-R2508 VanDerWaalsContact O-CB 3.25Å; N2504-R2508 WeakPolarHBondContact O-CB 3.31Å; N2504-R2508 VanDerWaalsContact O-CG 3.28Å; N2504-R2508 WeakPolarHBondContact O-CG 3.44Å; N2504-R2508 PolarHBondContact O-N 3.24Å; E2506-R2508 PolarHBondContact O-N 3.05Å; R2508-L2510 VanDerWaalsContact C-N 3.33Å; R2508-N2512 VanDerWaalsContact O-CB 3.26Å; R2508-N2512 WeakPolarHBondContact O-CB 3.31Å; R2508-N2512 PolarHBondContact O-N 3.19Å; R2508-N2512 PolarHBondContact O-ND2 2.95Å
2509K49.6Very low47.8Very low129 Ų12999 Ų9956%0.56146%0.464SS*.Hα-helixtrans-63.1-39.3171.8-79.7175.4179.8-178.80111.7K2505 E2506 K2507 N2512 A2513K2505-K2509 WeakPolarHBondContact O-CB 3.12Å; K2505-K2509 VanDerWaalsContact O-CG 3.28Å; K2505-K2509 WeakPolarHBondContact O-CG 3.29Å; K2505-K2509 PolarHBondContact O-N 2.71Å; E2506-K2509 CarbonylContact O-C 3.59Å; E2506-K2509 WeakPolarHBondContact O-CB 3.15Å; E2506-K2509 PolarHBondContact O-N 3.25Å; E2506-K2509 VanDerWaalsContact O-N 3.17Å; K2507-K2509 PolarHBondContact O-N 3.23Å; K2509-N2512 PolarHBondContact O-N 3.14Å; K2509-A2513 WeakPolarHBondContact O-CB 3.38Å; K2509-A2513 PolarHBondContact O-N 2.89Å
2510L44.6Very low47.4Very low97 Ų97102.6 Ų102.651%0.50849%0.485SS..Hα-helixtrans-69.6-41.6179.2-157.3107.1000111.8E2506 K2507 R2508 A2513 K2514E2506-L2510 WeakPolarHBondContact O-CB 3.48Å; E2506-L2510 PolarHBondContact O-N 3.26Å; K2507-L2510 WeakPolarHBondContact O-CB 3.34Å; K2507-L2510 PolarHBondContact O-N 3.26Å; K2507-L2510 VanDerWaalsContact O-N 3.16Å; R2508-L2510 VanDerWaalsContact C-N 3.33Å; L2510-A2513 PolarHBondContact O-N 3.45Å; L2510-K2514 WeakPolarHBondContact O-CB 3.42Å; L2510-K2514 PolarHBondContact O-N 3.3Å
2511V52.5Low46.9Very low72.5 Ų72.5108.1 Ų108.144%0.43951%0.51SS..Hα-helixtrans-63.5-44.4173.2173.60000110.8I2024 K2507 A2513 K2514 N2515I2024-V2511 HydrophobicContact CG2-CG1 4.17Å; K2507-V2511 WeakPolarHBondContact O-CG2 3.38Å; K2507-V2511 PolarHBondContact O-N 3.23Å; V2511-A2513 VanDerWaalsContact C-N 3.34Å; V2511-A2513 PolarHBondContact O-N 3.29Å; V2511-K2514 PolarHBondContact O-N 3.21Å; V2511-N2515 WeakPolarHBondContact O-CB 3.33Å; V2511-N2515 PolarHBondContact O-N 3.06Å
2512N45Very low46.3Very low95 Ų95106.3 Ų106.351%0.50852%0.516SS..Hα-helixtrans-69.2-30176.7-70.8-13.8000113R2508 K2509 R2516R2508-N2512 VanDerWaalsContact O-CB 3.26Å; R2508-N2512 WeakPolarHBondContact O-CB 3.31Å; R2508-N2512 PolarHBondContact O-N 3.19Å; R2508-N2512 PolarHBondContact O-ND2 2.95Å; K2509-N2512 PolarHBondContact O-N 3.14Å; N2512-R2516 WeakPolarHBondContact O-CB 3.43Å; N2512-R2516 WeakPolarHBondContact O-CG 3.27Å; N2512-R2516 PolarHBondContact O-N 3.19Å
2513A47.7Very low45.9Very low44 Ų44108.6 Ų108.636%0.36454%0.538SS..Hα-helixtrans-72.1-42.7173.300000111.3K2509 L2510 V2511 N2515 R2516 I2517K2509-A2513 WeakPolarHBondContact O-CB 3.38Å; K2509-A2513 PolarHBondContact O-N 2.89Å; L2510-A2513 PolarHBondContact O-N 3.45Å; V2511-A2513 VanDerWaalsContact C-N 3.34Å; V2511-A2513 PolarHBondContact O-N 3.29Å; A2513-N2515 VanDerWaalsContact C-N 3.29Å; A2513-N2515 PolarHBondContact O-N 3.36Å; A2513-R2516 PolarHBondContact O-N 3.46Å; A2513-R2516 VanDerWaalsContact O-N 3.14Å; A2513-I2517 WeakPolarHBondContact O-CD1 3.43Å; A2513-I2517 VanDerWaalsContact O-CG1 3.29Å; A2513-I2517 WeakPolarHBondContact O-CG1 3.26Å; A2513-I2517 PolarHBondContact O-N 3.27Å
2514K45.3Very low45.4Very low156.5 Ų156.5112.2 Ų112.268%0.6857%0.567SS**Hα-helixtrans-61.6-38.7175.1-149.7175.1-174.1-177.20111.1L2510 V2511 I2517 S2518L2510-K2514 WeakPolarHBondContact O-CB 3.42Å; L2510-K2514 PolarHBondContact O-N 3.3Å; V2511-K2514 PolarHBondContact O-N 3.21Å; K2514-I2517 PolarHBondContact O-N 2.98Å; K2514-S2518 PolarHBondContact O-N 3.39Å
2515N45.6Very low44.9Very low66.5 Ų66.5116.5 Ų116.536%0.35660%0.595SS.*Hα-helixtrans-74.2-24.8173.3-71.8-3.8000114V2511 A2513 S2518 Y2519V2511-N2515 WeakPolarHBondContact O-CB 3.33Å; V2511-N2515 PolarHBondContact O-N 3.06Å; A2513-N2515 VanDerWaalsContact C-N 3.29Å; A2513-N2515 PolarHBondContact O-N 3.36Å; N2515-S2518 PolarHBondContact O-OG 3.27Å; N2515-Y2519 WeakPolarHBondContact O-CD2 3.36Å; N2515-Y2519 VanDerWaalsContact O-CE2 3.29Å; N2515-Y2519 WeakPolarHBondContact O-CE2 3.39Å
2516R42.3Very low44.4Very low188.5 Ų188.5120.3 Ų120.371%0.71162%0.619SS**Hα-helixtrans-77.3-34.1172.3-83.1-175-163-167.43112.7N2512 A2513 S2518 Y2519 L2520N2512-R2516 WeakPolarHBondContact O-CB 3.43Å; N2512-R2516 WeakPolarHBondContact O-CG 3.27Å; N2512-R2516 PolarHBondContact O-N 3.19Å; A2513-R2516 PolarHBondContact O-N 3.46Å; A2513-R2516 VanDerWaalsContact O-N 3.14Å; R2516-S2518 PolarHBondContact O-N 3.14Å; R2516-Y2519 PolarHBondContact O-N 3.19Å; R2516-Y2519 VanDerWaalsContact O-N 3.12Å; R2516-L2520 PolarHBondContact O-N 3.25Å
2517I47.1Very low43.7Very low126 Ų126121.1 Ų121.165%0.64663%0.634SS**Hα-helixtrans-66.7-27.2-180-69.8164.2000111.3A2513 K2514 Y2519 L2520A2513-I2517 WeakPolarHBondContact O-CD1 3.43Å; A2513-I2517 VanDerWaalsContact O-CG1 3.29Å; A2513-I2517 WeakPolarHBondContact O-CG1 3.26Å; A2513-I2517 PolarHBondContact O-N 3.27Å; K2514-I2517 PolarHBondContact O-N 2.98Å; I2517-Y2519 VanDerWaalsContact C-N 3.27Å; I2517-Y2519 PolarHBondContact O-N 3.5Å; I2517-L2520 PolarHBondContact O-N 2.83Å
2518S48.1Very low43.3Very low78 Ų78121.3 Ų121.355%0.54565%0.645SS.*THydrogen-bonded Turntrans-74.8-12.3175.454.90000115.7K2514 N2515 R2516K2514-S2518 PolarHBondContact O-N 3.39Å; N2515-S2518 PolarHBondContact O-OG 3.27Å; R2516-S2518 PolarHBondContact O-N 3.14Å
2519Y47.5Very low43.3Very low187.5 Ų187.5117.1 Ų117.174%0.73564%0.641SS**THydrogen-bonded Turntrans-109.8-3.9178.6-62.8-71.4000114.1N2515 R2516 I2517 H2521N2515-Y2519 WeakPolarHBondContact O-CD2 3.36Å; N2515-Y2519 VanDerWaalsContact O-CE2 3.29Å; N2515-Y2519 WeakPolarHBondContact O-CE2 3.39Å; R2516-Y2519 PolarHBondContact O-N 3.19Å; R2516-Y2519 VanDerWaalsContact O-N 3.12Å; I2517-Y2519 VanDerWaalsContact C-N 3.27Å; I2517-Y2519 PolarHBondContact O-N 3.5Å; Y2519-H2521 VanDerWaalsContact C-N 3.26Å; Y2519-H2521 PolarHBondContact O-N 3.42Å; Y2519-H2521 VanDerWaalsContact O-N 3.16Å
2520L36.9Very low43.3Very low135.5 Ų135.5114.8 Ų114.871%0.70964%0.641SS**  trans-86.624.1-174.1-95.7160.7000114.5R2516 I2517 S2522R2516-L2520 PolarHBondContact O-N 3.25Å; I2517-L2520 PolarHBondContact O-N 2.83Å; L2520-S2522 VanDerWaalsContact C-N 3.34Å
2521H41Very low43.3Very low189.5 Ų189.5119 Ų11988%0.87765%0.65SS**SBendtrans-93.410.7179-120.6-66.2000114.6Y2519Y2519-H2521 VanDerWaalsContact C-N 3.26Å; Y2519-H2521 PolarHBondContact O-N 3.42Å; Y2519-H2521 VanDerWaalsContact O-N 3.16Å
2522S38.8Very low42.7Very low89.5 Ų89.5123.7 Ų123.763%0.62666%0.66SS**SBendtrans-145.5143174.562.90000112.5L2520L2520-S2522 VanDerWaalsContact C-N 3.34Å
2523S40.3Very low42.8Very low114.5 Ų114.5123.5 Ų123.580%0.80166%0.659SS**  trans72.4103.2169.2-1.40000117.6
2524S39.5Very low42.8Very low112.5 Ų112.5126.3 Ų126.379%0.78767%0.668SS**  trans-57.1122.916349.60000113.9
2525T37.8Very low43.2Very low142 Ų142121.8 Ų121.887%0.87165%0.651SS**  trans-173.793.8135.644.30000108.6S2527T2525-S2527 PolarHBondContact O-N 3.46Å
2526L35.7Very low43.3Very low174 Ų174124.9 Ų124.991%0.91166%0.661SS**  trans-81103.7174.5-98.8137.5000110.1S2528L2526-S2528 PolarHBondContact O-N 2.92Å; L2526-S2528 VanDerWaalsContact O-N 3.12Å
2527S35.3Very low43.8Very low101 Ų101122.5 Ų122.571%0.70666%0.656SS**  trans-64.6104.3161.4173.40000109.1T2525 S2529T2525-S2527 PolarHBondContact O-N 3.46Å; S2527-S2529 VanDerWaalsContact C-N 3.33Å; S2527-S2529 PolarHBondContact O-N 3.43Å
2528S40.6Very low44.2Very low83.5 Ų83.5120.6 Ų120.658%0.58465%0.65SS**THydrogen-bonded Turntrans-76.6-4.2-165.3137.80000115.5L2526 S2530L2526-S2528 PolarHBondContact O-N 2.92Å; L2526-S2528 VanDerWaalsContact O-N 3.12Å; S2528-S2530 PolarHBondContact O-N 3.34Å
2529S48.1Very low44.6Very low77.5 Ų77.5119.5 Ų119.554%0.54264%0.641SS.*Hα-helixtrans-80-21.2-166.861.30000115.7S2527 N2533S2527-S2529 VanDerWaalsContact C-N 3.33Å; S2527-S2529 PolarHBondContact O-N 3.43Å; S2529-N2533 PolarHBondContact O-ND2 3.44Å
2530S50.4Low45Very low79 Ų79113.9 Ų113.955%0.55262%0.621SS**Hα-helixtrans-78.4-33.2-173.4166.30000114.5S2528 N2534S2528-S2530 PolarHBondContact O-N 3.34Å; S2530-N2534 PolarHBondContact O-N 3.48Å
2531W43.3Very low46Very low187 Ų187109.1 Ų109.171%0.70860%0.604SS**Hα-helixtrans-78.6-40.6-171.7-161.954.1000112.1N2533 N2534 I2535W2531-N2533 VanDerWaalsContact C-N 3.33Å; W2531-N2533 PolarHBondContact O-N 3.07Å; W2531-N2534 PolarHBondContact O-N 3.37Å; W2531-I2535 HydrophobicContact CD2-CD1 3.99Å; W2531-I2535 HydrophobicContact CE3-CD1 4.15Å; W2531-I2535 HydrophobicContact CH2-CD1 4.33Å; W2531-I2535 HydrophobicContact CZ2-CD1 4.17Å; W2531-I2535 HydrophobicContact CZ3-CD1 4.32Å; W2531-I2535 PolarHBondContact O-N 2.98Å; W2531-I2535 VanDerWaalsContact O-N 3.14Å
2532W40.4Very low46.9Very low170.5 Ų170.5101.1 Ų101.165%0.64657%0.568SS**Hα-helixtrans-60.3-40.3173.7-72.5104000112.4N2534 I2535 F2536W2532-N2534 PolarHBondContact O-N 2.8Å; W2532-I2535 PolarHBondContact O-N 3.31Å; W2532-F2536 VanDerWaalsContact O-CB 3.23Å; W2532-F2536 WeakPolarHBondContact O-CB 3.25Å; W2532-F2536 PolarHBondContact O-N 3.11Å
2533N46.7Very low47.8Very low91.5 Ų91.5101 Ų10149%0.48956%0.56SS.*Hα-helixtrans-61.6-43.1177-78-11.7000111.9S2529 W2531 F2536 F2537S2529-N2533 PolarHBondContact O-ND2 3.44Å; W2531-N2533 VanDerWaalsContact C-N 3.33Å; W2531-N2533 PolarHBondContact O-N 3.07Å; N2533-F2536 PolarHBondContact O-N 2.84Å; N2533-F2537 HydrophobicContact CB-CD2 4.37Å; N2533-F2537 HydrophobicContact CB-CE2 4.32Å; N2533-F2537 WeakPolarHBondContact O-CB 3.42Å; N2533-F2537 WeakPolarHBondContact O-CD2 3.39Å; N2533-F2537 WeakPolarHBondContact O-CG 3.05Å; N2533-F2537 PolarHBondContact O-N 3.13Å
2534N49.4Very low48.6Very low101.5 Ų101.5103.7 Ų103.754%0.54355%0.553SS.*Hα-helixtrans-66.8-42.1178.8-76.6-24.8000112.6S2530 W2531 W2532 F2537 T2538S2530-N2534 PolarHBondContact O-N 3.48Å; W2531-N2534 PolarHBondContact O-N 3.37Å; W2532-N2534 PolarHBondContact O-N 2.8Å; N2534-F2537 PolarHBondContact O-N 3.02Å; N2534-T2538 WeakPolarHBondContact O-CG2 3.46Å; N2534-T2538 PolarHBondContact O-N 3.16Å; N2534-T2538 PolarHBondContact O-OG1 3.12Å
2535I52Low49.4Very low61.5 Ų61.5103.1 Ų103.132%0.31553%0.534SS..Hα-helixtrans-64.1-46.7175.2-66.6169.2000109.8W2531 W2532 F2537 T2538 V2539W2531-I2535 HydrophobicContact CD2-CD1 3.99Å; W2531-I2535 HydrophobicContact CE3-CD1 4.15Å; W2531-I2535 HydrophobicContact CH2-CD1 4.33Å; W2531-I2535 HydrophobicContact CZ2-CD1 4.17Å; W2531-I2535 HydrophobicContact CZ3-CD1 4.32Å; W2531-I2535 PolarHBondContact O-N 2.98Å; W2531-I2535 VanDerWaalsContact O-N 3.14Å; W2532-I2535 PolarHBondContact O-N 3.31Å; I2535-F2537 VanDerWaalsContact C-N 3.33Å; I2535-F2537 PolarHBondContact O-N 3.2Å; I2535-T2538 WeakPolarHBondContact CA-OG1 3.43Å; I2535-T2538 PolarHBondContact O-N 3.33Å; I2535-T2538 VanDerWaalsContact O-N 3.1Å; I2535-T2538 PolarHBondContact O-OG1 3.05Å; I2535-V2539 HydrophobicContact CG2-CG2 4.2Å; I2535-V2539 WeakPolarHBondContact O-CB 3.3Å; I2535-V2539 WeakPolarHBondContact O-CG2 3.35Å; I2535-V2539 PolarHBondContact O-N 3.14Å
2536F48Very low50.3Low132 Ų13297.1 Ų97.158%0.57950%0.496SS*.Hα-helixtrans-59.3-42.3177-171.4-95.2000111.8W2532 N2533 T2538 V2539 H2540W2532-F2536 VanDerWaalsContact O-CB 3.23Å; W2532-F2536 WeakPolarHBondContact O-CB 3.25Å; W2532-F2536 PolarHBondContact O-N 3.11Å; N2533-F2536 PolarHBondContact O-N 2.84Å; F2536-T2538 PolarHBondContact O-N 2.75Å; F2536-V2539 PolarHBondContact O-N 2.87Å; F2536-H2540 HydrophobicContact CD1-CB 4.48Å; F2536-H2540 HydrophobicContact CE1-CB 4.38Å; F2536-H2540 WeakPolarHBondContact O-CA 3.42Å; F2536-H2540 WeakPolarHBondContact O-CB 3.46Å; F2536-H2540 PolarHBondContact O-N 3.04Å
2537F52.4Low51.2Low139 Ų13995.5 Ų95.561%0.6148%0.484SS*.Hα-helixtrans-64.3-37.7174.3-83.2-63.1000112.8N2533 N2534 I2535 G2541N2533-F2537 HydrophobicContact CB-CD2 4.37Å; N2533-F2537 HydrophobicContact CB-CE2 4.32Å; N2533-F2537 WeakPolarHBondContact O-CB 3.42Å; N2533-F2537 WeakPolarHBondContact O-CD2 3.39Å; N2533-F2537 WeakPolarHBondContact O-CG 3.05Å; N2533-F2537 PolarHBondContact O-N 3.13Å; N2534-F2537 PolarHBondContact O-N 3.02Å; I2535-F2537 VanDerWaalsContact C-N 3.33Å; I2535-F2537 PolarHBondContact O-N 3.2Å; F2537-G2541 WeakPolarHBondContact O-CA 3.36Å; F2537-G2541 PolarHBondContact O-N 2.93Å
2538T56.4Low52.1Low85 Ų8593 Ų9352%0.52147%0.474SS..Hα-helixtrans-69.4-41.817557.60000112.7N2534 I2535 F2536 G2541 L2542N2534-T2538 WeakPolarHBondContact O-CG2 3.46Å; N2534-T2538 PolarHBondContact O-N 3.16Å; N2534-T2538 PolarHBondContact O-OG1 3.12Å; I2535-T2538 WeakPolarHBondContact CA-OG1 3.43Å; I2535-T2538 PolarHBondContact O-N 3.33Å; I2535-T2538 VanDerWaalsContact O-N 3.1Å; I2535-T2538 PolarHBondContact O-OG1 3.05Å; F2536-T2538 PolarHBondContact O-N 2.75Å; T2538-G2541 PolarHBondContact O-N 3.1Å; T2538-L2542 WeakPolarHBondContact O-CG 3.37Å; T2538-L2542 PolarHBondContact O-N 2.89Å
2539V57Low52.8Low56.5 Ų56.590 Ų9034%0.34245%0.453SS..Hα-helixtrans-70.5-42.7178.5174.40000111F2464 I2535 F2536 G2541 L2542 L2543F2464-V2539 HydrophobicContact CZ-CG2 4.22Å; I2535-V2539 HydrophobicContact CG2-CG2 4.2Å; I2535-V2539 WeakPolarHBondContact O-CB 3.3Å; I2535-V2539 WeakPolarHBondContact O-CG2 3.35Å; I2535-V2539 PolarHBondContact O-N 3.14Å; F2536-V2539 PolarHBondContact O-N 2.87Å; V2539-G2541 VanDerWaalsContact C-N 3.33Å; V2539-L2542 WeakPolarHBondContact O-CB 3.3Å; V2539-L2542 PolarHBondContact O-N 2.85Å; V2539-L2543 WeakPolarHBondContact O-CB 3.47Å; V2539-L2543 PolarHBondContact O-N 3.39Å
2540H55.5Low52.9Low68 Ų6892.7 Ų92.732%0.31546%0.46SS..Hα-helixtrans-68-32.9174.4-177-88.5000111.8F2536 L2543 R2544F2536-H2540 HydrophobicContact CD1-CB 4.48Å; F2536-H2540 HydrophobicContact CE1-CB 4.38Å; F2536-H2540 WeakPolarHBondContact O-CA 3.42Å; F2536-H2540 WeakPolarHBondContact O-CB 3.46Å; F2536-H2540 PolarHBondContact O-N 3.04Å; H2540-L2543 PolarHBondContact O-N 3.37Å; H2540-R2544 PolarHBondContact CE1-NE 3.38Å; H2540-R2544 VanDerWaalsContact CE1-NE 3.29Å; H2540-R2544 WeakPolarHBondContact O-CB 3.46Å; H2540-R2544 PolarHBondContact O-N 3.33Å
2541G58.6Low52.8Low35.5 Ų35.597.8 Ų97.837%0.36647%0.473SS..Hα-helixtrans-62.3-45.7170.200000112.1F2537 T2538 V2539 Y2545F2537-G2541 WeakPolarHBondContact O-CA 3.36Å; F2537-G2541 PolarHBondContact O-N 2.93Å; T2538-G2541 PolarHBondContact O-N 3.1Å; V2539-G2541 VanDerWaalsContact C-N 3.33Å; G2541-Y2545 VanDerWaalsContact O-CB 3.26Å; G2541-Y2545 WeakPolarHBondContact O-CB 3.38Å; G2541-Y2545 PolarHBondContact O-N 3.04Å
2542L58Low52.6Low21.5 Ų21.595.1 Ų95.111%0.11347%0.472CS..Hα-helixtrans-60.6-47.5171.2-72.5165.2000110.9L2468 Y2471 T2538 V2539 R2544 Y2545 F2546L2468-L2542 HydrophobicContact CD2-CD1 4.42Å; Y2471-L2542 HydrophobicContact CD1-CD2 4.06Å; Y2471-L2542 HydrophobicContact CD2-CD2 3.72Å; Y2471-L2542 HydrophobicContact CE1-CD2 4.2Å; Y2471-L2542 HydrophobicContact CE2-CD2 3.49Å; Y2471-L2542 VanDerWaalsContact CE2-CD2 3.42Å; Y2471-L2542 HydrophobicContact CG-CD2 3.83Å; T2538-L2542 WeakPolarHBondContact O-CG 3.37Å; T2538-L2542 PolarHBondContact O-N 2.89Å; V2539-L2542 WeakPolarHBondContact O-CB 3.3Å; V2539-L2542 PolarHBondContact O-N 2.85Å; L2542-R2544 PolarHBondContact O-N 3.12Å; L2542-Y2545 PolarHBondContact O-N 2.96Å; L2542-Y2545 VanDerWaalsContact O-N 3.15Å; L2542-F2546 HydrophobicContact CD2-CE2 4.28Å; L2542-F2546 VanDerWaalsContact O-CD2 3.27Å; L2542-F2546 WeakPolarHBondContact O-CD2 3.31Å; L2542-F2546 PolarHBondContact O-N 2.96Å
2543L58.5Low52.6Low87 Ų8791.6 Ų91.646%0.45547%0.466SS..Hα-helixtrans-61.6-43.8-178.9-138.688.1000112.4V2539 H2540 F2546 Q2547V2539-L2543 WeakPolarHBondContact O-CB 3.47Å; V2539-L2543 PolarHBondContact O-N 3.39Å; H2540-L2543 PolarHBondContact O-N 3.37Å; L2543-F2546 PolarHBondContact O-N 2.9Å; L2543-Q2547 VanDerWaalsContact O-CB 3.31Å; L2543-Q2547 WeakPolarHBondContact O-CB 3.42Å; L2543-Q2547 WeakPolarHBondContact O-CG 3.36Å; L2543-Q2547 PolarHBondContact O-N 3.38Å
2544R58.1Low52Low171.5 Ų171.597 Ų9765%0.64749%0.485SS*.Hα-helixtrans-63.7-41.7173.9-94.2-169.3-176.8167.64.7112.2H2540 L2542 F2546 Q2547 G2548H2540-R2544 PolarHBondContact CE1-NE 3.38Å; H2540-R2544 VanDerWaalsContact CE1-NE 3.29Å; H2540-R2544 WeakPolarHBondContact O-CB 3.46Å; H2540-R2544 PolarHBondContact O-N 3.33Å; L2542-R2544 PolarHBondContact O-N 3.12Å; R2544-F2546 VanDerWaalsContact C-N 3.32Å; R2544-F2546 PolarHBondContact O-N 2.84Å; R2544-Q2547 PolarHBondContact O-N 3.09Å; R2544-G2548 PolarHBondContact O-N 3.09Å
2545Y55.1Low51.5Low99.5 Ų99.597.6 Ų97.639%0.3949%0.487SS..Hα-helixtrans-63.1-41.4178.7-170.3-99.4000111.1Y2474 G2541 L2542 S2549Y2474-Y2545 PolarHBondContact OH-OH 3.31Å; G2541-Y2545 VanDerWaalsContact O-CB 3.26Å; G2541-Y2545 WeakPolarHBondContact O-CB 3.38Å; G2541-Y2545 PolarHBondContact O-N 3.04Å; L2542-Y2545 PolarHBondContact O-N 2.96Å; L2542-Y2545 VanDerWaalsContact O-N 3.15Å; Y2545-S2549 WeakPolarHBondContact O-CB 3.39Å; Y2545-S2549 PolarHBondContact O-N 3.01Å; Y2545-S2549 VanDerWaalsContact O-N 3.11Å
2546F56.2Low50.7Low17 Ų17100.3 Ų100.38%0.07551%0.509CS..Hα-helixtrans-73-39.2176-79.9-70.9000113.3L2542 L2543 R2544 G2548 S2549 L2550 L2565 I2566 F2569L2542-F2546 HydrophobicContact CD2-CE2 4.28Å; L2542-F2546 VanDerWaalsContact O-CD2 3.27Å; L2542-F2546 WeakPolarHBondContact O-CD2 3.31Å; L2542-F2546 PolarHBondContact O-N 2.96Å; L2543-F2546 PolarHBondContact O-N 2.9Å; R2544-F2546 VanDerWaalsContact C-N 3.32Å; R2544-F2546 PolarHBondContact O-N 2.84Å; F2546-G2548 VanDerWaalsContact C-N 3.33Å; F2546-G2548 PolarHBondContact O-N 3.42Å; F2546-S2549 PolarHBondContact O-N 3.19Å; F2546-S2549 VanDerWaalsContact O-N 3.15Å; F2546-L2550 HydrophobicContact CD1-CD1 4.49Å; F2546-L2550 PolarHBondContact O-N 3.11Å; F2546-L2565 HydrophobicContact CE1-CD2 4.33Å; F2546-L2565 HydrophobicContact CZ-CD2 3.65Å; F2546-I2566 HydrophobicContact CE1-CG1 4.25Å; F2546-F2569 HydrophobicContact CB-CE1 4.47Å; F2546-F2569 HydrophobicContact CB-CZ 4.41Å; F2546-F2569 HydrophobicContact CD1-CD1 4.26Å; F2546-F2569 HydrophobicContact CD1-CE1 4.24Å; F2546-F2569 HydrophobicContact CD2-CD2 4.32Å; F2546-F2569 HydrophobicContact CD2-CE1 4.29Å; F2546-F2569 AromaticContact CD2-CE2 3.99Å; F2546-F2569 HydrophobicContact CD2-CE2 4.04Å; F2546-F2569 AromaticContact CD2-CZ 3.92Å; F2546-F2569 HydrophobicContact CD2-CZ 4.09Å; F2546-F2569 HydrophobicContact CE1-CD1 4.23Å; F2546-F2569 HydrophobicContact CE1-CE1 4.41Å; F2546-F2569 HydrophobicContact CE1-CG 4.33Å; F2546-F2569 AromaticContact CE2-CD2 3.98Å; F2546-F2569 HydrophobicContact CE2-CD2 4.02Å; F2546-F2569 HydrophobicContact CE2-CE2 4.18Å; F2546-F2569 HydrophobicContact CE2-CG 4.29Å; F2546-F2569 HydrophobicContact CE2-CZ 4.31Å; F2546-F2569 HydrophobicContact CG-CD1 4.49Å; F2546-F2569 HydrophobicContact CG-CE1 4.13Å; F2546-F2569 HydrophobicContact CG-CZ 4.15Å; F2546-F2569 HydrophobicContact CZ-CB 4.33Å; F2546-F2569 HydrophobicContact CZ-CD1 4.27Å; F2546-F2569 HydrophobicContact CZ-CD2 4.29Å; F2546-F2569 HydrophobicContact CZ-CG 4.11Å
2547Q55.8Low50.1Low140.5 Ų140.5101 Ų10166%0.65752%0.518SS*.Hα-helixtrans-62-37.9173.9-82.4-177.2-40.700112.4L2543 R2544L2543-Q2547 VanDerWaalsContact O-CB 3.31Å; L2543-Q2547 WeakPolarHBondContact O-CB 3.42Å; L2543-Q2547 WeakPolarHBondContact O-CG 3.36Å; L2543-Q2547 PolarHBondContact O-N 3.38Å; R2544-Q2547 PolarHBondContact O-N 3.09Å
2548G53.9Low49.9Very low48.5 Ų48.598.7 Ų98.750%0.551%0.511SS..Hα-helixtrans-74.5-23.6174.600000114.3R2544 F2546R2544-G2548 PolarHBondContact O-N 3.09Å; F2546-G2548 VanDerWaalsContact C-N 3.33Å; F2546-G2548 PolarHBondContact O-N 3.42Å
2549S54.7Low50Low20.5 Ų20.598.7 Ų98.714%0.14351%0.508CS..Hα-helixtrans-92.9-33-174178.80000114Y2545 F2546 F2551 N2552 Y2562Y2545-S2549 WeakPolarHBondContact O-CB 3.39Å; Y2545-S2549 PolarHBondContact O-N 3.01Å; Y2545-S2549 VanDerWaalsContact O-N 3.11Å; F2546-S2549 PolarHBondContact O-N 3.19Å; F2546-S2549 VanDerWaalsContact O-N 3.15Å; S2549-F2551 VanDerWaalsContact C-N 3.32Å; S2549-F2551 PolarHBondContact O-N 3.01Å; S2549-N2552 PolarHBondContact O-N 3.35Å; S2549-Y2562 PolarHBondContact OG-OH 3.14Å; S2549-Y2562 VanDerWaalsContact OG-OH 3.06Å
2550L51.6Low50.3Low133 Ų133101.3 Ų101.370%0.69652%0.517SS*.Hα-helixtrans-66.2-25.6179.1-111108.2000113.4F2546F2546-L2550 HydrophobicContact CD1-CD1 4.49Å; F2546-L2550 PolarHBondContact O-N 3.11Å
2551F47.8Very low50.8Low187.5 Ų187.5100 Ų10082%0.82251%0.512SS*.THydrogen-bonded Turntrans-95.3-8-173-136.3-95.8000114.7S2549S2549-F2551 VanDerWaalsContact C-N 3.32Å; S2549-F2551 PolarHBondContact O-N 3.01Å
2552N38.8Very low51.3Low130 Ų13099.8 Ų99.870%0.69550%0.5SS*.  trans-130.232.1-172.8-79.9-38.2000114.3S2549 K2554S2549-N2552 PolarHBondContact O-N 3.35Å; N2552-K2554 VanDerWaalsContact C-N 3.28Å; N2552-K2554 PolarHBondContact O-N 3.16Å
2553L40.2Very low52.2Low97 Ų97104.8 Ų104.851%0.50852%0.518SS..  trans-8967.4-175.2-134.194.8000113.9I2555 Y2562L2553-I2555 VanDerWaalsContact C-N 3.3Å; L2553-I2555 HydrophobicContact CD1-CD1 3.64Å; L2553-I2555 HydrophobicContact CD1-CG1 4.24Å; L2553-I2555 HydrophobicContact CG-CB 4.28Å; L2553-I2555 HydrophobicContact CG-CD1 3.91Å; L2553-I2555 HydrophobicContact CG-CG1 3.99Å; L2553-I2555 PolarHBondContact O-N 2.97Å; L2553-Y2562 HydrophobicContact CD2-CE1 3.69Å
2554K34.3Very low53.1Low204.5 Ų204.5104.9 Ų104.989%0.88952%0.515SS*.  trans-108.965.9159.9-98.2-170.9177.2179.90110N2552N2552-K2554 VanDerWaalsContact C-N 3.28Å; N2552-K2554 PolarHBondContact O-N 3.16Å
2555I39.4Very low54.3Low115 Ų11597.1 Ų97.159%0.5949%0.486SS*.  trans-122.8104.8175-55.3177.4000109L2553 N2557L2553-I2555 VanDerWaalsContact C-N 3.3Å; L2553-I2555 HydrophobicContact CD1-CD1 3.64Å; L2553-I2555 HydrophobicContact CD1-CG1 4.24Å; L2553-I2555 HydrophobicContact CG-CB 4.28Å; L2553-I2555 HydrophobicContact CG-CD1 3.91Å; L2553-I2555 HydrophobicContact CG-CG1 3.99Å; L2553-I2555 PolarHBondContact O-N 2.97Å; I2555-N2557 PolarHBondContact O-N 3.43Å
2556P33.5Very low55.7Low118 Ų11894.6 Ų94.677%0.76648%0.479SS*.SBendtrans-81.1101.6176.232.8-29.4000109.2
2557N37.1Very low57.1Low146 Ų14695.4 Ų95.478%0.78148%0.483SS*.  trans137.669.1168.9-75.4-15.7000110.9I2555 N2559I2555-N2557 PolarHBondContact O-N 3.43Å; N2557-N2559 PolarHBondContact O-N 3.05Å
2558I47.3Very low58.5Low91.5 Ų91.589.4 Ų89.447%0.46946%0.456SS..  trans-72.8106.9171.5-75.4167.4000108.4Q2560 Y2562I2558-Q2560 PolarHBondContact O-N 3.16Å; I2558-Y2562 HydrophobicContact CB-CD1 4.31Å; I2558-Y2562 HydrophobicContact CD1-CD1 4.37Å; I2558-Y2562 HydrophobicContact CD1-CE1 4.24Å; I2558-Y2562 HydrophobicContact CG1-CD1 4.15Å; I2558-Y2562 HydrophobicContact CG1-CE1 4.17Å; I2558-Y2562 HydrophobicContact CG2-CD1 3.68Å; I2558-Y2562 HydrophobicContact CG2-CE1 4.41Å; I2558-Y2562 HydrophobicContact CG2-CG 4.26Å
2559N58Low60.1Low83.5 Ų83.589.1 Ų89.145%0.44744%0.44SS..  trans-51.1136.8170.5-69.87.5000109.8N2557 L2561 Y2562 Y2563N2557-N2559 PolarHBondContact O-N 3.05Å; N2559-L2561 PolarHBondContact O-N 3.12Å; N2559-Y2562 WeakPolarHBondContact O-CA 3.09Å; N2559-Y2562 WeakPolarHBondContact O-CB 3.46Å; N2559-Y2562 PolarHBondContact O-N 3.17Å; N2559-Y2563 PolarHBondContact O-N 3.37Å
2560Q64.3Low61.7Low112 Ų11291.5 Ų91.552%0.52345%0.451SS..Hα-helixtrans-49.3-34.4-177.9-167.8-172.621.900113.2I2558 Y2563 K2564I2558-Q2560 PolarHBondContact O-N 3.16Å; Q2560-Y2563 PolarHBondContact O-N 3.25Å; Q2560-K2564 WeakPolarHBondContact O-CG 3.38Å; Q2560-K2564 PolarHBondContact O-N 2.89Å; Q2560-K2564 VanDerWaalsContact O-N 3.1Å
2561L65.3Low63.6Low40 Ų4085.5 Ų85.521%0.20942%0.419CS..Hα-helixtrans-67-34.2177.7-166.562.8000113.2I2470 Y2474 I2477 N2559 K2564 L2565I2470-L2561 HydrophobicContact CG2-CD1 4.27Å; Y2474-L2561 VanDerWaalsContact CA-CD2 3.48Å; Y2474-L2561 HydrophobicContact CD2-CB 4.36Å; Y2474-L2561 HydrophobicContact CD2-CD2 3.89Å; Y2474-L2561 HydrophobicContact CD2-CG 4.08Å; Y2474-L2561 HydrophobicContact CG-CD2 4.33Å; I2477-L2561 HydrophobicContact CD1-CD2 3.88Å; N2559-L2561 PolarHBondContact O-N 3.12Å; L2561-K2564 PolarHBondContact O-N 3.33Å; L2561-L2565 WeakPolarHBondContact O-CB 3.2Å; L2561-L2565 WeakPolarHBondContact O-CG 3.26Å; L2561-L2565 PolarHBondContact O-N 3.22Å
2562Y70.5Confident65.6Low32.5 Ų32.577.2 Ų77.213%0.12738%0.384CS..Hα-helixtrans-71.7-38.6176.8-177.5-99.3000111.6Y2474 S2549 L2553 I2558 N2559 L2565 I2566Y2474-Y2562 HydrophobicContact CE2-CD2 4.46Å; S2549-Y2562 PolarHBondContact OG-OH 3.14Å; S2549-Y2562 VanDerWaalsContact OG-OH 3.06Å; L2553-Y2562 HydrophobicContact CD2-CE1 3.69Å; I2558-Y2562 HydrophobicContact CB-CD1 4.31Å; I2558-Y2562 HydrophobicContact CD1-CD1 4.37Å; I2558-Y2562 HydrophobicContact CD1-CE1 4.24Å; I2558-Y2562 HydrophobicContact CG1-CD1 4.15Å; I2558-Y2562 HydrophobicContact CG1-CE1 4.17Å; I2558-Y2562 HydrophobicContact CG2-CD1 3.68Å; I2558-Y2562 HydrophobicContact CG2-CE1 4.41Å; I2558-Y2562 HydrophobicContact CG2-CG 4.26Å; N2559-Y2562 WeakPolarHBondContact O-CA 3.09Å; N2559-Y2562 WeakPolarHBondContact O-CB 3.46Å; N2559-Y2562 PolarHBondContact O-N 3.17Å; Y2562-L2565 PolarHBondContact O-N 3.25Å; Y2562-I2566 HydrophobicContact CD1-CD1 3.71Å; Y2562-I2566 HydrophobicContact CD1-CG1 4.31Å; Y2562-I2566 HydrophobicContact CE1-CD1 3.2Å; Y2562-I2566 HydrophobicContact CE1-CG1 4.18Å; Y2562-I2566 HydrophobicContact CE2-CD1 4.44Å; Y2562-I2566 WeakPolarHBondContact O-CG1 3.14Å; Y2562-I2566 PolarHBondContact O-N 2.95Å
2563Y75.8Confident68.1Low125 Ų12574 Ų7449%0.4937%0.366SS..Hα-helixtrans-60.3-47.1170.3176.2-95.6000111.4N2559 Q2560 L2565 I2566 H2567N2559-Y2563 PolarHBondContact O-N 3.37Å; Q2560-Y2563 PolarHBondContact O-N 3.25Å; Y2563-L2565 VanDerWaalsContact C-N 3.3Å; Y2563-L2565 PolarHBondContact O-N 3.02Å; Y2563-I2566 PolarHBondContact O-N 3.29Å; Y2563-H2567 VanDerWaalsContact O-CB 3.28Å; Y2563-H2567 WeakPolarHBondContact O-CB 3.3Å; Y2563-H2567 PolarHBondContact O-N 3.06Å
2564K78.4Confident70.5Confident90.5 Ų90.572.1 Ų72.139%0.39335%0.354SS..Hα-helixtrans-58-38.4175.5-74.4-179.5177.1-178.40112.4Q2560 L2561 N2568Q2560-K2564 WeakPolarHBondContact O-CG 3.38Å; Q2560-K2564 PolarHBondContact O-N 2.89Å; Q2560-K2564 VanDerWaalsContact O-N 3.1Å; L2561-K2564 PolarHBondContact O-N 3.33Å; K2564-N2568 PolarHBondContact O-N 2.86Å; K2564-N2568 VanDerWaalsContact O-N 3.09Å; K2564-N2568 PolarHBondContact O-ND2 3.03Å
2565L82.9Confident73.2Confident7 Ų762.4 Ų62.44%0.03731%0.311CS..Hα-helixtrans-68.2-46.9177.8-124.3162.9000112.3L2467 I2470 Y2471 Y2474 F2546 L2561 Y2562 Y2563 H2567 N2568 F2569L2467-L2565 HydrophobicContact CD1-CD2 4.22Å; I2470-L2565 HydrophobicContact CB-CD2 4.08Å; I2470-L2565 HydrophobicContact CG2-CB 4.34Å; I2470-L2565 HydrophobicContact CG2-CD2 3.56Å; I2470-L2565 HydrophobicContact CG2-CG 3.89Å; Y2471-L2565 HydrophobicContact CD2-CD1 4.2Å; Y2474-L2565 HydrophobicContact CD1-CD1 3.94Å; Y2474-L2565 HydrophobicContact CD2-CD1 3.78Å; Y2474-L2565 HydrophobicContact CE1-CD1 4.45Å; Y2474-L2565 HydrophobicContact CE2-CD1 4.44Å; Y2474-L2565 HydrophobicContact CG-CD1 3.69Å; Y2474-L2565 VanDerWaalsContact CG-CD1 3.44Å; F2546-L2565 HydrophobicContact CE1-CD2 4.33Å; F2546-L2565 HydrophobicContact CZ-CD2 3.65Å; L2561-L2565 WeakPolarHBondContact O-CB 3.2Å; L2561-L2565 WeakPolarHBondContact O-CG 3.26Å; L2561-L2565 PolarHBondContact O-N 3.22Å; Y2562-L2565 PolarHBondContact O-N 3.25Å; Y2563-L2565 VanDerWaalsContact C-N 3.3Å; Y2563-L2565 PolarHBondContact O-N 3.02Å; L2565-H2567 VanDerWaalsContact C-N 3.33Å; L2565-H2567 PolarHBondContact O-N 2.98Å; L2565-N2568 PolarHBondContact O-N 3.36Å; L2565-F2569 WeakPolarHBondContact O-CB 3.23Å; L2565-F2569 PolarHBondContact O-N 3.48Å; L2565-F2569 VanDerWaalsContact O-N 3.12Å
2566I84.2Confident75.7Confident46.5 Ų46.557.2 Ų57.224%0.23829%0.287CS..Hα-helixtrans-61.1-45.2175.2-72.4176.8000110.8F2546 Y2562 Y2563 F2569 I2570F2546-I2566 HydrophobicContact CE1-CG1 4.25Å; Y2562-I2566 HydrophobicContact CD1-CD1 3.71Å; Y2562-I2566 HydrophobicContact CD1-CG1 4.31Å; Y2562-I2566 HydrophobicContact CE1-CD1 3.2Å; Y2562-I2566 HydrophobicContact CE1-CG1 4.18Å; Y2562-I2566 HydrophobicContact CE2-CD1 4.44Å; Y2562-I2566 WeakPolarHBondContact O-CG1 3.14Å; Y2562-I2566 PolarHBondContact O-N 2.95Å; Y2563-I2566 PolarHBondContact O-N 3.29Å; I2566-F2569 WeakPolarHBondContact O-CB 3.34Å; I2566-F2569 PolarHBondContact O-N 3.3Å; I2566-F2569 VanDerWaalsContact O-N 3.17Å; I2566-I2570 HydrophobicContact CG2-CD1 3.72Å; I2566-I2570 HydrophobicContact CG2-CG1 4.33Å; I2566-I2570 WeakPolarHBondContact O-CG1 3.3Å; I2566-I2570 PolarHBondContact O-N 2.98Å
2567H85.3Confident78.6Confident33.5 Ų33.555.4 Ų55.416%0.15527%0.267CS..Hα-helixtrans-59.2-50.2-179.5-178.4-111.5000111.8Y2563 L2565 F2569 I2570 L2571 D2592 T2595Y2563-H2567 VanDerWaalsContact O-CB 3.28Å; Y2563-H2567 WeakPolarHBondContact O-CB 3.3Å; Y2563-H2567 PolarHBondContact O-N 3.06Å; L2565-H2567 VanDerWaalsContact C-N 3.33Å; L2565-H2567 PolarHBondContact O-N 2.98Å; H2567-F2569 VanDerWaalsContact C-N 3.27Å; H2567-F2569 PolarHBondContact O-N 2.93Å; H2567-I2570 PolarHBondContact O-N 3.44Å; H2567-L2571 VanDerWaalsContact CE1-CD1 3.43Å; H2567-L2571 WeakPolarHBondContact CE1-CD1 3.38Å; H2567-L2571 WeakPolarHBondContact O-CG 3.4Å; H2567-L2571 PolarHBondContact O-N 3.14Å; H2567-L2571 VanDerWaalsContact O-N 3.11Å; H2567-D2592 IonicContact CE1-OD1 3.36Å; H2567-D2592 PolarHBondContact CE1-OD1 3.38Å; H2567-D2592 VanDerWaalsContact CE1-OD1 3.31Å; H2567-T2595 PolarHBondContact CE1-OG1 3.11Å; H2567-T2595 WeakPolarHBondContact NE2-CG2 3.39Å
2568N85Confident81.1Confident16 Ų1648.7 Ų48.79%0.08623%0.232CC..Hα-helixtrans-61.3-35.9176.1-80.9-76.7000112.5L2467 I2470 K2564 L2565 L2571 I2572L2467-N2568 HydrophobicContact CD1-CB 4.04Å; I2470-N2568 WeakPolarHBondContact CD1-ND2 3.38Å; K2564-N2568 PolarHBondContact O-N 2.86Å; K2564-N2568 VanDerWaalsContact O-N 3.09Å; K2564-N2568 PolarHBondContact O-ND2 3.03Å; L2565-N2568 PolarHBondContact O-N 3.36Å; N2568-L2571 PolarHBondContact O-N 3.14Å; N2568-I2572 WeakPolarHBondContact O-CD1 3.16Å; N2568-I2572 WeakPolarHBondContact O-CG1 3.46Å; N2568-I2572 PolarHBondContact O-N 2.99Å
2569F87.7Confident83.2Confident41 Ų4146.4 Ų46.418%0.1822%0.22CC..Hα-helixtrans-66.1-43.9176.7-177.5-104.8000112.6L2467 F2546 L2565 I2566 H2567 L2571 I2572 I2573L2467-F2569 HydrophobicContact CD1-CB 4.46Å; L2467-F2569 HydrophobicContact CD2-CD2 4.35Å; F2546-F2569 HydrophobicContact CB-CE1 4.47Å; F2546-F2569 HydrophobicContact CB-CZ 4.41Å; F2546-F2569 HydrophobicContact CD1-CD1 4.26Å; F2546-F2569 HydrophobicContact CD1-CE1 4.24Å; F2546-F2569 HydrophobicContact CD2-CD2 4.32Å; F2546-F2569 HydrophobicContact CD2-CE1 4.29Å; F2546-F2569 AromaticContact CD2-CE2 3.99Å; F2546-F2569 HydrophobicContact CD2-CE2 4.04Å; F2546-F2569 AromaticContact CD2-CZ 3.92Å; F2546-F2569 HydrophobicContact CD2-CZ 4.09Å; F2546-F2569 HydrophobicContact CE1-CD1 4.23Å; F2546-F2569 HydrophobicContact CE1-CE1 4.41Å; F2546-F2569 HydrophobicContact CE1-CG 4.33Å; F2546-F2569 AromaticContact CE2-CD2 3.98Å; F2546-F2569 HydrophobicContact CE2-CD2 4.02Å; F2546-F2569 HydrophobicContact CE2-CE2 4.18Å; F2546-F2569 HydrophobicContact CE2-CG 4.29Å; F2546-F2569 HydrophobicContact CE2-CZ 4.31Å; F2546-F2569 HydrophobicContact CG-CD1 4.49Å; F2546-F2569 HydrophobicContact CG-CE1 4.13Å; F2546-F2569 HydrophobicContact CG-CZ 4.15Å; F2546-F2569 HydrophobicContact CZ-CB 4.33Å; F2546-F2569 HydrophobicContact CZ-CD1 4.27Å; F2546-F2569 HydrophobicContact CZ-CD2 4.29Å; F2546-F2569 HydrophobicContact CZ-CG 4.11Å; L2565-F2569 WeakPolarHBondContact O-CB 3.23Å; L2565-F2569 PolarHBondContact O-N 3.48Å; L2565-F2569 VanDerWaalsContact O-N 3.12Å; I2566-F2569 WeakPolarHBondContact O-CB 3.34Å; I2566-F2569 PolarHBondContact O-N 3.3Å; I2566-F2569 VanDerWaalsContact O-N 3.17Å; H2567-F2569 VanDerWaalsContact C-N 3.27Å; H2567-F2569 PolarHBondContact O-N 2.93Å; F2569-L2571 VanDerWaalsContact C-N 3.32Å; F2569-L2571 PolarHBondContact O-N 3.3Å; F2569-I2572 PolarHBondContact O-N 3.07Å; F2569-I2573 HydrophobicContact CD1-CD1 3.85Å; F2569-I2573 HydrophobicContact CE1-CD1 3.46Å; F2569-I2573 HydrophobicContact CE1-CG1 4.4Å; F2569-I2573 HydrophobicContact CZ-CD1 3.95Å; F2569-I2573 HydrophobicContact CZ-CG1 4.45Å; F2569-I2573 WeakPolarHBondContact O-CG1 3.28Å; F2569-I2573 PolarHBondContact O-N 3.13Å; F2569-I2573 VanDerWaalsContact O-N 3.08Å
2570I89.3Confident84.7Confident71.5 Ų71.550.4 Ų50.437%0.36723%0.234SC..Hα-helixtrans-60.3-42.7175.2-69168.7000110.8I2566 H2567 I2572 I2573 F2574I2566-I2570 HydrophobicContact CG2-CD1 3.72Å; I2566-I2570 HydrophobicContact CG2-CG1 4.33Å; I2566-I2570 WeakPolarHBondContact O-CG1 3.3Å; I2566-I2570 PolarHBondContact O-N 2.98Å; H2567-I2570 PolarHBondContact O-N 3.44Å; I2570-I2572 VanDerWaalsContact C-N 3.34Å; I2570-I2572 PolarHBondContact O-N 2.9Å; I2570-I2573 WeakPolarHBondContact O-CB 3.42Å; I2570-I2573 PolarHBondContact O-N 3.36Å; I2570-F2574 HydrophobicContact CG2-CD2 3.83Å; I2570-F2574 HydrophobicContact CG2-CE2 3.37Å; I2570-F2574 HydrophobicContact CG2-CZ 3.96Å; I2570-F2574 PolarHBondContact O-N 3.2Å
2571L89.6Confident85.9Confident6 Ų650.1 Ų50.13%0.03124%0.235CC..Hα-helixtrans-65.7-35.1177.8-66173.5000112.6R2463 H2567 N2568 F2569 I2573 F2574 T2575 V2589 D2592R2463-L2571 VanDerWaalsContact NH1-CD1 3.33Å; H2567-L2571 VanDerWaalsContact CE1-CD1 3.43Å; H2567-L2571 WeakPolarHBondContact CE1-CD1 3.38Å; H2567-L2571 WeakPolarHBondContact O-CG 3.4Å; H2567-L2571 PolarHBondContact O-N 3.14Å; H2567-L2571 VanDerWaalsContact O-N 3.11Å; N2568-L2571 PolarHBondContact O-N 3.14Å; F2569-L2571 VanDerWaalsContact C-N 3.32Å; F2569-L2571 PolarHBondContact O-N 3.3Å; L2571-I2573 VanDerWaalsContact C-N 3.34Å; L2571-F2574 PolarHBondContact O-N 2.87Å; L2571-T2575 WeakPolarHBondContact O-CG2 3.34Å; L2571-T2575 PolarHBondContact O-N 3.11Å; L2571-T2575 PolarHBondContact O-OG1 3.17Å; L2571-V2589 HydrophobicContact CD2-CG1 4.4Å; L2571-D2592 HydrophobicContact CD1-CB 4Å; L2571-D2592 VanDerWaalsContact CD1-CG 3.49Å; L2571-D2592 WeakPolarHBondContact CD1-OD2 3.37Å; L2571-D2592 HydrophobicContact CD2-CB 4.13Å
2572I90.6Very high87.1Confident14.5 Ų14.551.2 Ų51.27%0.07424%0.239CC..Hα-helixtrans-64.1-41.4172.5-72.3162.9000110.9F2460 R2463 L2467 N2568 F2569 I2570 F2574 T2575 G2576F2460-I2572 HydrophobicContact CD2-CG2 4.31Å; F2460-I2572 HydrophobicContact CE2-CG2 3.65Å; F2460-I2572 HydrophobicContact CZ-CG2 4.13Å; R2463-I2572 HydrophobicContact CB-CD1 4.32Å; R2463-I2572 HydrophobicContact CB-CG1 3.7Å; L2467-I2572 HydrophobicContact CB-CD1 3.63Å; L2467-I2572 HydrophobicContact CD1-CD1 4.42Å; L2467-I2572 HydrophobicContact CD2-CD1 3.65Å; L2467-I2572 HydrophobicContact CG-CD1 4.1Å; N2568-I2572 WeakPolarHBondContact O-CD1 3.16Å; N2568-I2572 WeakPolarHBondContact O-CG1 3.46Å; N2568-I2572 PolarHBondContact O-N 2.99Å; F2569-I2572 PolarHBondContact O-N 3.07Å; I2570-I2572 VanDerWaalsContact C-N 3.34Å; I2570-I2572 PolarHBondContact O-N 2.9Å; I2572-F2574 PolarHBondContact O-N 3.45Å; I2572-T2575 VanDerWaalsContact CA-OG1 3.3Å; I2572-T2575 WeakPolarHBondContact CA-OG1 3.29Å; I2572-T2575 PolarHBondContact O-N 3.49Å; I2572-T2575 PolarHBondContact O-OG1 2.89Å; I2572-G2576 PolarHBondContact O-N 3.16Å
2573I90.7Very high88Confident63 Ų6351.2 Ų51.232%0.32324%0.242SC..Hα-helixtrans-60.5-48.3175.3-68.3167.7000110.7F2569 I2570 L2571 T2575 G2576 F2577F2569-I2573 HydrophobicContact CD1-CD1 3.85Å; F2569-I2573 HydrophobicContact CE1-CD1 3.46Å; F2569-I2573 HydrophobicContact CE1-CG1 4.4Å; F2569-I2573 HydrophobicContact CZ-CD1 3.95Å; F2569-I2573 HydrophobicContact CZ-CG1 4.45Å; F2569-I2573 WeakPolarHBondContact O-CG1 3.28Å; F2569-I2573 PolarHBondContact O-N 3.13Å; F2569-I2573 VanDerWaalsContact O-N 3.08Å; I2570-I2573 WeakPolarHBondContact O-CB 3.42Å; I2570-I2573 PolarHBondContact O-N 3.36Å; L2571-I2573 VanDerWaalsContact C-N 3.34Å; I2573-T2575 PolarHBondContact O-N 3.18Å; I2573-G2576 WeakPolarHBondContact O-CA 3.39Å; I2573-G2576 PolarHBondContact O-N 3.1Å; I2573-G2576 VanDerWaalsContact O-N 3.13Å; I2573-F2577 HydrophobicContact CG2-CD2 4.03Å; I2573-F2577 HydrophobicContact CG2-CE1 4.16Å; I2573-F2577 HydrophobicContact CG2-CE2 3.54Å; I2573-F2577 HydrophobicContact CG2-CZ 3.62Å; I2573-F2577 WeakPolarHBondContact O-CG 3.48Å; I2573-F2577 PolarHBondContact O-N 3.29Å
2574F92.4Very high88.7Confident56.5 Ų56.550 Ų5025%0.24824%0.24CC..Hα-helixtrans-65.3-38.1178.9-66.8-37.3000113.1I2570 L2571 I2572 G2576 F2577 G2578 L2588 V2589I2570-F2574 HydrophobicContact CG2-CD2 3.83Å; I2570-F2574 HydrophobicContact CG2-CE2 3.37Å; I2570-F2574 HydrophobicContact CG2-CZ 3.96Å; I2570-F2574 PolarHBondContact O-N 3.2Å; L2571-F2574 PolarHBondContact O-N 2.87Å; I2572-F2574 PolarHBondContact O-N 3.45Å; F2574-G2576 VanDerWaalsContact C-N 3.31Å; F2574-G2576 PolarHBondContact O-N 3.31Å; F2574-F2577 HydrophobicContact CD1-CD2 4.28Å; F2574-F2577 PolarHBondContact O-N 3.24Å; F2574-G2578 PolarHBondContact O-N 3.2Å; F2574-L2588 HydrophobicContact CD1-CD1 4.33Å; F2574-L2588 HydrophobicContact CD2-CB 4.27Å; F2574-L2588 HydrophobicContact CE1-CD1 4.2Å; F2574-L2588 HydrophobicContact CG-CB 4.33Å; F2574-V2589 HydrophobicContact CB-CG2 3.67Å
2575T91.1Very high89.4Confident0 Ų048.4 Ų48.40%023%0.233CC..Hα-helixtrans-65.1-36.7171.451.50000112.3L2571 I2572 I2573 G2578 I2579 V2589L2571-T2575 WeakPolarHBondContact O-CG2 3.34Å; L2571-T2575 PolarHBondContact O-N 3.11Å; L2571-T2575 PolarHBondContact O-OG1 3.17Å; I2572-T2575 VanDerWaalsContact CA-OG1 3.3Å; I2572-T2575 WeakPolarHBondContact CA-OG1 3.29Å; I2572-T2575 PolarHBondContact O-N 3.49Å; I2572-T2575 PolarHBondContact O-OG1 2.89Å; I2573-T2575 PolarHBondContact O-N 3.18Å; T2575-G2578 WeakPolarHBondContact O-CA 3.11Å; T2575-G2578 PolarHBondContact O-N 2.86Å; T2575-G2578 VanDerWaalsContact O-N 3.17Å; T2575-I2579 WeakPolarHBondContact O-CG1 3.38Å; T2575-I2579 PolarHBondContact O-N 3.11Å; T2575-V2589 HydrophobicContact CG2-CB 4.45Å; T2575-V2589 HydrophobicContact CG2-CG1 3.95Å; T2575-V2589 HydrophobicContact CG2-CG2 3.69Å
2576G91.4Very high89.8Confident7.5 Ų7.548.2 Ų48.28%0.07723%0.232CC..Hα-helixtrans-61.9-44.6172.400000112.4I2572 I2573 F2574 G2578 I2579 F2580I2572-G2576 PolarHBondContact O-N 3.16Å; I2573-G2576 WeakPolarHBondContact O-CA 3.39Å; I2573-G2576 PolarHBondContact O-N 3.1Å; I2573-G2576 VanDerWaalsContact O-N 3.13Å; F2574-G2576 VanDerWaalsContact C-N 3.31Å; F2574-G2576 PolarHBondContact O-N 3.31Å; G2576-G2578 VanDerWaalsContact C-N 3.26Å; G2576-G2578 PolarHBondContact O-N 3.07Å; G2576-I2579 PolarHBondContact O-N 3.19Å; G2576-I2579 VanDerWaalsContact O-N 3.11Å; G2576-F2580 WeakPolarHBondContact O-CD2 3.4Å; G2576-F2580 PolarHBondContact O-N 2.94Å
2577F92.9Very high90.2Very high80 Ų8049 Ų4935%0.35124%0.242SC..Hα-helixtrans-64.4-30.1173.7-65.8-18000112.8I2573 F2574 I2579 I2581 H2582 F2585I2573-F2577 HydrophobicContact CG2-CD2 4.03Å; I2573-F2577 HydrophobicContact CG2-CE1 4.16Å; I2573-F2577 HydrophobicContact CG2-CE2 3.54Å; I2573-F2577 HydrophobicContact CG2-CZ 3.62Å; I2573-F2577 WeakPolarHBondContact O-CG 3.48Å; I2573-F2577 PolarHBondContact O-N 3.29Å; F2574-F2577 HydrophobicContact CD1-CD2 4.28Å; F2574-F2577 PolarHBondContact O-N 3.24Å; F2577-I2579 VanDerWaalsContact C-N 3.29Å; F2577-I2579 PolarHBondContact O-N 3.3Å; F2577-I2581 HydrophobicContact CB-CD1 4Å; F2577-I2581 HydrophobicContact CB-CG1 4.38Å; F2577-I2581 HydrophobicContact CD1-CD1 3.44Å; F2577-I2581 VanDerWaalsContact CD1-CD1 3.44Å; F2577-I2581 HydrophobicContact CD1-CG1 4.2Å; F2577-I2581 HydrophobicContact CD2-CD1 4.43Å; F2577-I2581 HydrophobicContact CE1-CD1 3.96Å; F2577-I2581 HydrophobicContact CG-CD1 3.72Å; F2577-I2581 WeakPolarHBondContact O-CA 3.42Å; F2577-I2581 WeakPolarHBondContact O-CB 3.31Å; F2577-I2581 PolarHBondContact O-N 3.15Å; F2577-H2582 PolarHBondContact O-N 2.97Å; F2577-H2582 VanDerWaalsContact O-N 3.1Å; F2577-F2585 HydrophobicContact CB-CB 3.94Å; F2577-F2585 HydrophobicContact CB-CD1 3.73Å; F2577-F2585 HydrophobicContact CB-CD2 3.76Å; F2577-F2585 HydrophobicContact CB-CE1 4.14Å; F2577-F2585 HydrophobicContact CB-CE2 4.18Å; F2577-F2585 HydrophobicContact CB-CG 3.53Å; F2577-F2585 HydrophobicContact CB-CZ 4.36Å; F2577-F2585 HydrophobicContact CD2-CD1 4.04Å; F2577-F2585 AromaticContact CD2-CE1 3.89Å; F2577-F2585 HydrophobicContact CD2-CE1 3.89Å; F2577-F2585 HydrophobicContact CD2-CZ 4.42Å; F2577-F2585 HydrophobicContact CG-CD1 4.39Å; F2577-F2585 HydrophobicContact CG-CE1 4.44Å
2578G90.9Very high90.5Very high4 Ų450.6 Ų50.64%0.04125%0.251CS..Hα-helixtrans-62.3-34.1170.900000113.8F2574 T2575 G2576 H2582F2574-G2578 PolarHBondContact O-N 3.2Å; T2575-G2578 WeakPolarHBondContact O-CA 3.11Å; T2575-G2578 PolarHBondContact O-N 2.86Å; T2575-G2578 VanDerWaalsContact O-N 3.17Å; G2576-G2578 VanDerWaalsContact C-N 3.26Å; G2576-G2578 PolarHBondContact O-N 3.07Å; G2578-H2582 WeakPolarHBondContact CA-O 3.43Å; G2578-H2582 CarbonylContact O-C 3.6Å
2579I90.2Very high90.8Very high44.5 Ų44.549.9 Ų49.923%0.22825%0.247CC..Hα-helixtrans-84.9-44.4179-61.5162.4000111.4L2457 F2460 T2575 G2576 F2577 Y2586L2457-I2579 HydrophobicContact CD2-CD1 4.25Å; L2457-I2579 HydrophobicContact CD2-CG2 4.41Å; F2460-I2579 HydrophobicContact CB-CD1 3.79Å; F2460-I2579 HydrophobicContact CD2-CD1 4.27Å; F2460-I2579 HydrophobicContact CG-CD1 4.17Å; T2575-I2579 WeakPolarHBondContact O-CG1 3.38Å; T2575-I2579 PolarHBondContact O-N 3.11Å; G2576-I2579 PolarHBondContact O-N 3.19Å; G2576-I2579 VanDerWaalsContact O-N 3.11Å; F2577-I2579 VanDerWaalsContact C-N 3.29Å; F2577-I2579 PolarHBondContact O-N 3.3Å; I2579-Y2586 VanDerWaalsContact CG1-OH 3.22Å; I2579-Y2586 WeakPolarHBondContact CG1-OH 3.3Å
2580F90Very high90.9Very high167 Ų16751 Ų5173%0.73226%0.255SS*.Hα-helixtrans-97.5-23.2-168.5-66.5-64000115.5G2576G2576-F2580 WeakPolarHBondContact O-CD2 3.4Å; G2576-F2580 PolarHBondContact O-N 2.94Å
2581I90.2Very high90.9Very high105.5 Ų105.552.7 Ų52.754%0.54126%0.264SS..THydrogen-bonded Turntrans-112.9-64.8-174.9-53.3179.5000110.8F2577 F2585F2577-I2581 HydrophobicContact CB-CD1 4Å; F2577-I2581 HydrophobicContact CB-CG1 4.38Å; F2577-I2581 HydrophobicContact CD1-CD1 3.44Å; F2577-I2581 VanDerWaalsContact CD1-CD1 3.44Å; F2577-I2581 HydrophobicContact CD1-CG1 4.2Å; F2577-I2581 HydrophobicContact CD2-CD1 4.43Å; F2577-I2581 HydrophobicContact CE1-CD1 3.96Å; F2577-I2581 HydrophobicContact CG-CD1 3.72Å; F2577-I2581 WeakPolarHBondContact O-CA 3.42Å; F2577-I2581 WeakPolarHBondContact O-CB 3.31Å; F2577-I2581 PolarHBondContact O-N 3.15Å; I2581-F2585 HydrophobicContact CB-CD2 4.28Å; I2581-F2585 HydrophobicContact CB-CE2 3.95Å; I2581-F2585 HydrophobicContact CD1-CE2 4.41Å; I2581-F2585 HydrophobicContact CG2-CD2 4.5Å; I2581-F2585 HydrophobicContact CG2-CE2 3.78Å
2582H90.9Very high90.8Very high63.5 Ų63.552.7 Ų52.729%0.29426%0.264SS..  trans-159137.2-178.6-162.4-95.6000111.3F2577 G2578 F2584 F2585F2577-H2582 PolarHBondContact O-N 2.97Å; F2577-H2582 VanDerWaalsContact O-N 3.1Å; G2578-H2582 WeakPolarHBondContact CA-O 3.43Å; G2578-H2582 CarbonylContact O-C 3.6Å; H2582-F2584 AromaticContact CE1-CD1 3.62Å; H2582-F2584 AromaticContact CE1-CD2 3.28Å; H2582-F2584 WeakPolarHBondContact CE1-CD2 3.48Å; H2582-F2584 AromaticContact CE1-CE1 3.81Å; H2582-F2584 AromaticContact CE1-CE2 3.48Å; H2582-F2584 VanDerWaalsContact CE1-CE2 3.45Å; H2582-F2584 WeakPolarHBondContact CE1-CE2 3.3Å; H2582-F2584 AromaticContact CE1-CG 3.36Å; H2582-F2584 VanDerWaalsContact CE1-CG 3.43Å; H2582-F2584 WeakPolarHBondContact CE1-CG 3.2Å; H2582-F2584 AromaticContact CE1-CZ 3.76Å; H2582-F2584 VanDerWaalsContact ND1-CB 3.31Å; H2582-F2584 WeakPolarHBondContact ND1-CB 3.42Å; H2582-F2584 AromaticContact ND1-CD1 3.74Å; H2582-F2584 AromaticContact ND1-CD2 3.3Å; H2582-F2584 VanDerWaalsContact ND1-CD2 3.3Å; H2582-F2584 WeakPolarHBondContact ND1-CD2 3.31Å; H2582-F2584 AromaticContact ND1-CE2 3.97Å; H2582-F2584 AromaticContact ND1-CG 3.15Å; H2582-F2584 WeakPolarHBondContact ND1-CG 3.21Å; H2582-F2584 PolarHBondContact ND1-N 2.97Å; H2582-F2584 VanDerWaalsContact ND1-N 3.17Å; H2582-F2584 PolarHBondContact O-N 2.94Å; H2582-F2585 HydrophobicContact CB-CD2 4.28Å; H2582-F2585 HydrophobicContact CB-CE2 4.44Å; H2582-F2585 WeakPolarHBondContact O-CD2 3.19Å; H2582-F2585 PolarHBondContact O-N 3.06Å; H2582-F2585 VanDerWaalsContact O-N 3.09Å
2583P87.9Confident90.8Very high31.5 Ų31.554.6 Ų54.621%0.20528%0.276CS..THydrogen-bonded Turntrans-56.4-24180-2836000114.8L2387 F2585 Y2586L2387-P2583 HydrophobicContact CD1-CB 4.37Å; L2387-P2583 WeakPolarHBondContact CD1-O 3.16Å; L2387-P2583 HydrophobicContact CD2-CB 3.51Å; L2387-P2583 VanDerWaalsContact CD2-CB 3.49Å; P2583-F2585 PolarHBondContact O-N 3Å; P2583-F2585 VanDerWaalsContact O-N 3.1Å; P2583-Y2586 HydrophobicContact CB-CD2 4.29Å; P2583-Y2586 HydrophobicContact CB-CE2 4.32Å; P2583-Y2586 WeakPolarHBondContact O-CB 3.38Å; P2583-Y2586 WeakPolarHBondContact O-CD2 3.26Å; P2583-Y2586 PolarHBondContact O-N 2.92Å
2584F91.3Very high90.7Very high100.5 Ų100.553.3 Ų53.344%0.44127%0.271SS..THydrogen-bonded Turntrans-59.1-20.9176.4-67.7-12.5000114.5Y2391 H2582 Y2586 S2587Y2391-F2584 HydrophobicContact CD1-CE1 4.1Å; Y2391-F2584 AromaticContact CD1-CZ 3.9Å; Y2391-F2584 HydrophobicContact CD1-CZ 3.97Å; Y2391-F2584 AromaticContact CD2-CE1 3.92Å; Y2391-F2584 HydrophobicContact CD2-CE1 3.92Å; Y2391-F2584 HydrophobicContact CD2-CZ 4.33Å; Y2391-F2584 AromaticContact CE1-CE1 3.95Å; Y2391-F2584 HydrophobicContact CE1-CE1 3.98Å; Y2391-F2584 HydrophobicContact CE1-CE2 4.43Å; Y2391-F2584 AromaticContact CE1-CZ 3.46Å; Y2391-F2584 HydrophobicContact CE1-CZ 3.46Å; Y2391-F2584 AromaticContact CE2-CE1 3.78Å; Y2391-F2584 HydrophobicContact CE2-CE1 3.78Å; Y2391-F2584 AromaticContact CE2-CZ 3.85Å; Y2391-F2584 HydrophobicContact CE2-CZ 3.85Å; Y2391-F2584 HydrophobicContact CG-CE1 4.07Å; Y2391-F2584 HydrophobicContact CG-CZ 4.39Å; Y2391-F2584 AromaticContact CZ-CE1 3.81Å; Y2391-F2584 AromaticContact CZ-CZ 3.37Å; H2582-F2584 AromaticContact CE1-CD1 3.62Å; H2582-F2584 AromaticContact CE1-CD2 3.28Å; H2582-F2584 WeakPolarHBondContact CE1-CD2 3.48Å; H2582-F2584 AromaticContact CE1-CE1 3.81Å; H2582-F2584 AromaticContact CE1-CE2 3.48Å; H2582-F2584 VanDerWaalsContact CE1-CE2 3.45Å; H2582-F2584 WeakPolarHBondContact CE1-CE2 3.3Å; H2582-F2584 AromaticContact CE1-CG 3.36Å; H2582-F2584 VanDerWaalsContact CE1-CG 3.43Å; H2582-F2584 WeakPolarHBondContact CE1-CG 3.2Å; H2582-F2584 AromaticContact CE1-CZ 3.76Å; H2582-F2584 VanDerWaalsContact ND1-CB 3.31Å; H2582-F2584 WeakPolarHBondContact ND1-CB 3.42Å; H2582-F2584 AromaticContact ND1-CD1 3.74Å; H2582-F2584 AromaticContact ND1-CD2 3.3Å; H2582-F2584 VanDerWaalsContact ND1-CD2 3.3Å; H2582-F2584 WeakPolarHBondContact ND1-CD2 3.31Å; H2582-F2584 AromaticContact ND1-CE2 3.97Å; H2582-F2584 AromaticContact ND1-CG 3.15Å; H2582-F2584 WeakPolarHBondContact ND1-CG 3.21Å; H2582-F2584 PolarHBondContact ND1-N 2.97Å; H2582-F2584 VanDerWaalsContact ND1-N 3.17Å; H2582-F2584 PolarHBondContact O-N 2.94Å; F2584-Y2586 PolarHBondContact O-N 3.41Å; F2584-S2587 WeakPolarHBondContact O-CB 3.42Å; F2584-S2587 PolarHBondContact O-N 3Å; F2584-S2587 PolarHBondContact O-OG 3.01Å
2585F93Very high90.3Very high57 Ų5752.9 Ų52.925%0.2527%0.273CS..Hα-helixtrans-63.9-19.3173.4-78.5-82.7000113F2577 I2581 H2582 P2583 S2587 L2588 V2589F2577-F2585 HydrophobicContact CB-CB 3.94Å; F2577-F2585 HydrophobicContact CB-CD1 3.73Å; F2577-F2585 HydrophobicContact CB-CD2 3.76Å; F2577-F2585 HydrophobicContact CB-CE1 4.14Å; F2577-F2585 HydrophobicContact CB-CE2 4.18Å; F2577-F2585 HydrophobicContact CB-CG 3.53Å; F2577-F2585 HydrophobicContact CB-CZ 4.36Å; F2577-F2585 HydrophobicContact CD2-CD1 4.04Å; F2577-F2585 AromaticContact CD2-CE1 3.89Å; F2577-F2585 HydrophobicContact CD2-CE1 3.89Å; F2577-F2585 HydrophobicContact CD2-CZ 4.42Å; F2577-F2585 HydrophobicContact CG-CD1 4.39Å; F2577-F2585 HydrophobicContact CG-CE1 4.44Å; I2581-F2585 HydrophobicContact CB-CD2 4.28Å; I2581-F2585 HydrophobicContact CB-CE2 3.95Å; I2581-F2585 HydrophobicContact CD1-CE2 4.41Å; I2581-F2585 HydrophobicContact CG2-CD2 4.5Å; I2581-F2585 HydrophobicContact CG2-CE2 3.78Å; H2582-F2585 HydrophobicContact CB-CD2 4.28Å; H2582-F2585 HydrophobicContact CB-CE2 4.44Å; H2582-F2585 WeakPolarHBondContact O-CD2 3.19Å; H2582-F2585 PolarHBondContact O-N 3.06Å; H2582-F2585 VanDerWaalsContact O-N 3.09Å; P2583-F2585 PolarHBondContact O-N 3Å; P2583-F2585 VanDerWaalsContact O-N 3.1Å; F2585-S2587 PolarHBondContact O-N 3.23Å; F2585-L2588 HydrophobicContact CD1-CD1 4.02Å; F2585-L2588 HydrophobicContact CE1-CD1 4.38Å; F2585-L2588 PolarHBondContact O-N 3.18Å; F2585-V2589 PolarHBondContact O-N 3.06Å
2586Y90.9Very high90Very high3 Ų356.8 Ų56.81%0.01229%0.288CS..Hα-helixtrans-62.4-22170.5-62.1-50.8000113.1L2383 N2384 L2387 I2452 G2456 I2579 P2583 F2584 V2589L2383-Y2586 HydrophobicContact CB-CD2 4.47Å; L2383-Y2586 HydrophobicContact CB-CG 4.47Å; L2383-Y2586 HydrophobicContact CD1-CD1 4.09Å; L2383-Y2586 HydrophobicContact CD1-CD2 4.48Å; L2383-Y2586 HydrophobicContact CD1-CE1 4.09Å; L2383-Y2586 HydrophobicContact CD1-CE2 4.49Å; L2383-Y2586 HydrophobicContact CD1-CG 4.31Å; L2383-Y2586 HydrophobicContact CD2-CD2 4.42Å; L2383-Y2586 HydrophobicContact CD2-CE2 4.24Å; N2384-Y2586 PolarHBondContact ND2-O 3.16Å; N2384-Y2586 PolarHBondContact OD1-O 3.28Å; L2387-Y2586 HydrophobicContact CD1-CD2 4.1Å; I2452-Y2586 HydrophobicContact CG2-CE2 4.04Å; G2456-Y2586 VanDerWaalsContact CA-OH 3.31Å; G2456-Y2586 WeakPolarHBondContact CA-OH 3.37Å; I2579-Y2586 VanDerWaalsContact CG1-OH 3.22Å; I2579-Y2586 WeakPolarHBondContact CG1-OH 3.3Å; P2583-Y2586 HydrophobicContact CB-CD2 4.29Å; P2583-Y2586 HydrophobicContact CB-CE2 4.32Å; P2583-Y2586 WeakPolarHBondContact O-CB 3.38Å; P2583-Y2586 WeakPolarHBondContact O-CD2 3.26Å; P2583-Y2586 PolarHBondContact O-N 2.92Å; F2584-Y2586 PolarHBondContact O-N 3.41Å; Y2586-V2589 WeakPolarHBondContact O-CB 3.21Å; Y2586-V2589 PolarHBondContact O-N 3.31Å
2587S92Very high89.7Confident63 Ų6360.7 Ų60.744%0.44130%0.304SS..Hα-helixtrans-68-36.5174.268.30000112.6N2384 F2584 F2585 V2589 L2590N2384-S2587 WeakPolarHBondContact OD1-CA 3.4Å; N2384-S2587 PolarHBondContact OD1-N 3.15Å; F2584-S2587 WeakPolarHBondContact O-CB 3.42Å; F2584-S2587 PolarHBondContact O-N 3Å; F2584-S2587 PolarHBondContact O-OG 3.01Å; F2585-S2587 PolarHBondContact O-N 3.23Å; S2587-V2589 VanDerWaalsContact C-N 3.29Å; S2587-V2589 PolarHBondContact O-N 3.1Å; S2587-L2590 VanDerWaalsContact O-CB 3.25Å; S2587-L2590 WeakPolarHBondContact O-CB 3.42Å; S2587-L2590 PolarHBondContact O-N 3.14Å; S2587-L2590 VanDerWaalsContact O-N 3.14Å
2588L91.7Very high89.1Confident67.5 Ų67.563.7 Ų63.735%0.35332%0.32SS..Hα-helixtrans-69.5-28.9175.9-65.1179.5000112.1F2574 F2585 L2590 L2591F2574-L2588 HydrophobicContact CD1-CD1 4.33Å; F2574-L2588 HydrophobicContact CD2-CB 4.27Å; F2574-L2588 HydrophobicContact CE1-CD1 4.2Å; F2574-L2588 HydrophobicContact CG-CB 4.33Å; F2585-L2588 HydrophobicContact CD1-CD1 4.02Å; F2585-L2588 HydrophobicContact CE1-CD1 4.38Å; F2585-L2588 PolarHBondContact O-N 3.18Å; L2588-L2590 PolarHBondContact O-N 3.29Å; L2588-L2591 HydrophobicContact CD2-CD1 4.25Å; L2588-L2591 WeakPolarHBondContact O-CB 3.31Å; L2588-L2591 WeakPolarHBondContact O-CG 3.12Å; L2588-L2591 PolarHBondContact O-N 3.1Å
2589V91.3Very high88.9Confident0 Ų067.9 Ų67.90%035%0.345CS..Hα-helixtrans-65.1-23.4173.9-176.40000111.2S2380 L2571 F2574 T2575 F2585 Y2586 S2587 L2591 D2592S2380-V2589 VanDerWaalsContact OG-CG1 3.27Å; S2380-V2589 WeakPolarHBondContact OG-CG1 3.24Å; L2571-V2589 HydrophobicContact CD2-CG1 4.4Å; F2574-V2589 HydrophobicContact CB-CG2 3.67Å; T2575-V2589 HydrophobicContact CG2-CB 4.45Å; T2575-V2589 HydrophobicContact CG2-CG1 3.95Å; T2575-V2589 HydrophobicContact CG2-CG2 3.69Å; F2585-V2589 PolarHBondContact O-N 3.06Å; Y2586-V2589 WeakPolarHBondContact O-CB 3.21Å; Y2586-V2589 PolarHBondContact O-N 3.31Å; S2587-V2589 VanDerWaalsContact C-N 3.29Å; S2587-V2589 PolarHBondContact O-N 3.1Å; V2589-L2591 PolarHBondContact O-N 3.18Å; V2589-D2592 WeakPolarHBondContact O-CB 3.27Å; V2589-D2592 PolarHBondContact O-N 3.16Å
2590L89.9Confident88.8Confident64.5 Ų64.568.9 Ų68.934%0.33835%0.35SS..G310 helixtrans-68.3-21.6177.1-163.967.1000112.9S2587 L2588 D2592 V2593S2587-L2590 VanDerWaalsContact O-CB 3.25Å; S2587-L2590 WeakPolarHBondContact O-CB 3.42Å; S2587-L2590 PolarHBondContact O-N 3.14Å; S2587-L2590 VanDerWaalsContact O-N 3.14Å; L2588-L2590 PolarHBondContact O-N 3.29Å; L2590-D2592 PolarHBondContact O-N 3.12Å; L2590-V2593 WeakPolarHBondContact O-CB 3.39Å; L2590-V2593 VanDerWaalsContact O-CG1 3.24Å; L2590-V2593 WeakPolarHBondContact O-CG1 3.4Å; L2590-V2593 PolarHBondContact O-N 3.3Å
2591L89.3Confident88.5Confident108 Ų10864.6 Ų64.657%0.56533%0.334SS*.G310 helixtrans-59.6-18.1175.5-65.8173000113.1L2588 V2589 V2593 V2594L2588-L2591 HydrophobicContact CD2-CD1 4.25Å; L2588-L2591 WeakPolarHBondContact O-CB 3.31Å; L2588-L2591 WeakPolarHBondContact O-CG 3.12Å; L2588-L2591 PolarHBondContact O-N 3.1Å; V2589-L2591 PolarHBondContact O-N 3.18Å; L2591-V2593 PolarHBondContact O-N 3.06Å; L2591-V2593 VanDerWaalsContact O-N 3.09Å; L2591-V2594 WeakPolarHBondContact O-CB 3.27Å; L2591-V2594 PolarHBondContact O-N 2.96Å; L2591-V2594 VanDerWaalsContact O-N 3.08Å
2592D89.2Confident88.2Confident6 Ų662.3 Ų62.33%0.03232%0.323CS..G310 helixtrans-48.8-30.7168.2-166.82.8000112F2377 R2463 H2567 L2571 V2589 L2590 V2594 T2595 R2596F2377-D2592 HydrophobicContact CD2-CB 4.46Å; R2463-D2592 IonicContact CZ-OD2 2.71Å; R2463-D2592 IonicContact NH1-OD2 2.71Å; R2463-D2592 PolarHBondContact NH1-OD2 3.17Å; R2463-D2592 IonicContact NH2-OD2 3.84Å; R2463-D2592 PolarHBondContact NH2-OD2 3.45Å; H2567-D2592 IonicContact CE1-OD1 3.36Å; H2567-D2592 PolarHBondContact CE1-OD1 3.38Å; H2567-D2592 VanDerWaalsContact CE1-OD1 3.31Å; L2571-D2592 HydrophobicContact CD1-CB 4Å; L2571-D2592 VanDerWaalsContact CD1-CG 3.49Å; L2571-D2592 WeakPolarHBondContact CD1-OD2 3.37Å; L2571-D2592 HydrophobicContact CD2-CB 4.13Å; V2589-D2592 WeakPolarHBondContact O-CB 3.27Å; V2589-D2592 PolarHBondContact O-N 3.16Å; L2590-D2592 PolarHBondContact O-N 3.12Å; D2592-V2594 PolarHBondContact O-N 3.36Å; D2592-T2595 PolarHBondContact O-N 3.2Å; D2592-T2595 PolarHBondContact O-OG1 3.32Å; D2592-T2595 PolarHBondContact OD1-OG1 3.36Å; D2592-R2596 PolarHBondContact O-N 3.02Å; D2592-R2596 VanDerWaalsContact O-N 3.15Å
2593V90.4Very high88.1Confident54 Ų5462.9 Ų62.933%0.32733%0.331SS..Hα-helixtrans-54.4-35.9176.474.50000113.3F2377 L2590 L2591 T2595 R2596 E2597 L2600F2377-V2593 HydrophobicContact CE2-CB 3.92Å; F2377-V2593 HydrophobicContact CE2-CG2 4.32Å; F2377-V2593 HydrophobicContact CZ-CB 4.13Å; F2377-V2593 HydrophobicContact CZ-CG2 4.06Å; L2590-V2593 WeakPolarHBondContact O-CB 3.39Å; L2590-V2593 VanDerWaalsContact O-CG1 3.24Å; L2590-V2593 WeakPolarHBondContact O-CG1 3.4Å; L2590-V2593 PolarHBondContact O-N 3.3Å; L2591-V2593 PolarHBondContact O-N 3.06Å; L2591-V2593 VanDerWaalsContact O-N 3.09Å; V2593-T2595 PolarHBondContact O-N 3Å; V2593-R2596 PolarHBondContact O-N 2.88Å; V2593-E2597 WeakPolarHBondContact O-CB 3.39Å; V2593-E2597 PolarHBondContact O-N 2.96Å; V2593-E2597 VanDerWaalsContact O-N 3.1Å; V2593-L2600 HydrophobicContact CG1-CD2 4.13Å
2594V88.4Confident88.1Confident36.5 Ų36.564.5 Ų64.522%0.22134%0.34CS..Hα-helixtrans-63.7-30.6179179.50000111.3L2591 D2592 L2600 L2601 V2604L2591-V2594 WeakPolarHBondContact O-CB 3.27Å; L2591-V2594 PolarHBondContact O-N 2.96Å; L2591-V2594 VanDerWaalsContact O-N 3.08Å; D2592-V2594 PolarHBondContact O-N 3.36Å; V2594-L2600 HydrophobicContact CB-CD2 4.34Å; V2594-L2600 HydrophobicContact CB-CG 4.46Å; V2594-L2600 HydrophobicContact CG1-CG 4.41Å; V2594-L2600 HydrophobicContact CG2-CD2 3.88Å; V2594-L2600 HydrophobicContact CG2-CG 4.21Å; V2594-L2601 WeakPolarHBondContact O-CB 3.46Å; V2594-V2604 HydrophobicContact CG1-CB 4.48Å; V2594-V2604 HydrophobicContact CG1-CG2 3.83Å
2595T84Confident87.9Confident47.5 Ų47.565.7 Ų65.729%0.29134%0.341SS..Hα-helixtrans-91.3-21.6-17973.30000113.5H2567 D2592 V2593H2567-T2595 PolarHBondContact CE1-OG1 3.11Å; H2567-T2595 WeakPolarHBondContact NE2-CG2 3.39Å; D2592-T2595 PolarHBondContact O-N 3.2Å; D2592-T2595 PolarHBondContact O-OG1 3.32Å; D2592-T2595 PolarHBondContact OD1-OG1 3.36Å; V2593-T2595 PolarHBondContact O-N 3Å
2596R84.3Confident87.6Confident81.5 Ų81.563.2 Ų63.231%0.30833%0.331SS..Hα-helixtrans-82.1-31.1176.6-66.6-177.174.3-1261.2112.3D2374 F2377 D2592 V2593D2374-R2596 VanDerWaalsContact CG-NH2 3.3Å; D2374-R2596 IonicContact OD1-CZ 3.35Å; D2374-R2596 IonicContact OD1-NE 3.49Å; D2374-R2596 IonicContact OD1-NH2 3.62Å; D2374-R2596 PolarHBondContact OD1-NH2 2.96Å; F2377-R2596 VanDerWaalsContact CE1-NH1 3.27Å; D2592-R2596 PolarHBondContact O-N 3.02Å; D2592-R2596 VanDerWaalsContact O-N 3.15Å; V2593-R2596 PolarHBondContact O-N 2.88Å
2597E85.3Confident87.6Confident90 Ų9066 Ų6642%0.42135%0.348SS..  trans-102.4110.3-177-177.652.1-137.900111.7V2593 T2599 L2600 L2601V2593-E2597 WeakPolarHBondContact O-CB 3.39Å; V2593-E2597 PolarHBondContact O-N 2.96Å; V2593-E2597 VanDerWaalsContact O-N 3.1Å; E2597-T2599 VanDerWaalsContact C-N 3.27Å; E2597-T2599 VanDerWaalsContact CG-OG1 3.25Å; E2597-T2599 WeakPolarHBondContact CG-OG1 3.31Å; E2597-T2599 PolarHBondContact O-N 3.21Å; E2597-T2599 WeakPolarHBondContact OE1-CB 3.48Å; E2597-T2599 WeakPolarHBondContact OE1-CG2 3.48Å; E2597-T2599 PolarHBondContact OE1-N 2.86Å; E2597-T2599 PolarHBondContact OE1-OG1 3.2Å; E2597-L2600 HydrophobicContact CB-CB 4.1Å; E2597-L2600 HydrophobicContact CG-CB 4.01Å; E2597-L2600 PolarHBondContact O-N 3.12Å; E2597-L2601 PolarHBondContact O-N 3.38Å
2598E81Confident87.6Confident143.5 Ų143.567.3 Ų67.367%0.67135%0.354SS*.Hα-helixtrans-60.8-35.2-176.5-67.9-171.4177.800112.8L2601 N2602E2598-L2601 PolarHBondContact O-N 3.3Å; E2598-N2602 WeakPolarHBondContact O-CB 3.5Å; E2598-N2602 VanDerWaalsContact O-CG 3.29Å; E2598-N2602 PolarHBondContact O-N 3.27Å; E2598-N2602 PolarHBondContact O-ND2 3.34Å
2599T84.8Confident87.4Confident92 Ų9268.9 Ų68.956%0.56436%0.358SS*.Hα-helixtrans-64.5-44.7179.560.20000111.2E2597 N2602 V2603E2597-T2599 VanDerWaalsContact C-N 3.27Å; E2597-T2599 VanDerWaalsContact CG-OG1 3.25Å; E2597-T2599 WeakPolarHBondContact CG-OG1 3.31Å; E2597-T2599 PolarHBondContact O-N 3.21Å; E2597-T2599 WeakPolarHBondContact OE1-CB 3.48Å; E2597-T2599 WeakPolarHBondContact OE1-CG2 3.48Å; E2597-T2599 PolarHBondContact OE1-N 2.86Å; E2597-T2599 PolarHBondContact OE1-OG1 3.2Å; T2599-N2602 PolarHBondContact O-N 3.04Å; T2599-V2603 PolarHBondContact O-N 3.17Å; T2599-V2603 VanDerWaalsContact O-N 3.16Å
2600L88Confident87.3Confident64 Ų6471.9 Ų71.934%0.33537%0.374SS..Hα-helixtrans-68-40.3177.9-172.556.1000111.6V2593 V2594 E2597 N2602 V2603 V2604V2593-L2600 HydrophobicContact CG1-CD2 4.13Å; V2594-L2600 HydrophobicContact CB-CD2 4.34Å; V2594-L2600 HydrophobicContact CB-CG 4.46Å; V2594-L2600 HydrophobicContact CG1-CG 4.41Å; V2594-L2600 HydrophobicContact CG2-CD2 3.88Å; V2594-L2600 HydrophobicContact CG2-CG 4.21Å; E2597-L2600 HydrophobicContact CB-CB 4.1Å; E2597-L2600 HydrophobicContact CG-CB 4.01Å; E2597-L2600 PolarHBondContact O-N 3.12Å; L2600-N2602 VanDerWaalsContact C-N 3.29Å; L2600-N2602 PolarHBondContact O-N 3.28Å; L2600-V2603 PolarHBondContact O-N 3.12Å; L2600-V2604 PolarHBondContact O-N 3.08Å
2601L85.2Confident87.2Confident77 Ų7770 Ų7040%0.40337%0.37SS..Hα-helixtrans-58.7-41172.9-17467.7000111.8V2594 E2597 E2598 V2604 R2605V2594-L2601 WeakPolarHBondContact O-CB 3.46Å; E2597-L2601 PolarHBondContact O-N 3.38Å; E2598-L2601 PolarHBondContact O-N 3.3Å; L2601-V2604 PolarHBondContact O-N 3.47Å; L2601-R2605 VanDerWaalsContact O-CB 3.29Å; L2601-R2605 WeakPolarHBondContact O-CB 3.45Å; L2601-R2605 PolarHBondContact O-N 3.44Å
2602N83.4Confident87.3Confident58 Ų5874.8 Ų74.831%0.3138%0.38SS..Hα-helixtrans-68.4-32.3178.7-75.5-48.8000113E2598 T2599 L2600 R2605 S2606E2598-N2602 WeakPolarHBondContact O-CB 3.5Å; E2598-N2602 VanDerWaalsContact O-CG 3.29Å; E2598-N2602 PolarHBondContact O-N 3.27Å; E2598-N2602 PolarHBondContact O-ND2 3.34Å; T2599-N2602 PolarHBondContact O-N 3.04Å; L2600-N2602 VanDerWaalsContact C-N 3.29Å; L2600-N2602 PolarHBondContact O-N 3.28Å; N2602-R2605 PolarHBondContact O-N 2.93Å; N2602-S2606 PolarHBondContact O-N 3.48Å
2603V88.5Confident87.4Confident76 Ų7676.5 Ų76.546%0.46139%0.393SS..Hα-helixtrans-67.8-42.1171.9173.60000111.3T2599 L2600 R2605 S2606T2599-V2603 PolarHBondContact O-N 3.17Å; T2599-V2603 VanDerWaalsContact O-N 3.16Å; L2600-V2603 PolarHBondContact O-N 3.12Å; V2603-R2605 VanDerWaalsContact C-N 3.3Å; V2603-R2605 PolarHBondContact O-N 3.27Å; V2603-S2606 PolarHBondContact O-N 3.47Å; V2603-S2606 PolarHBondContact O-OG 3.11Å
2604V89.2Confident87.4Confident64 Ų6475.3 Ų75.339%0.38839%0.385SS..Hα-helixtrans-65.2-38.3173176.90000110.6V2594 L2600 L2601 S2606 V2607 T2608V2594-V2604 HydrophobicContact CG1-CB 4.48Å; V2594-V2604 HydrophobicContact CG1-CG2 3.83Å; L2600-V2604 PolarHBondContact O-N 3.08Å; L2601-V2604 PolarHBondContact O-N 3.47Å; V2604-S2606 VanDerWaalsContact C-N 3.35Å; V2604-S2606 PolarHBondContact O-N 3.29Å; V2604-V2607 PolarHBondContact O-N 3.46Å; V2604-T2608 HydrophobicContact CG1-CG2 4.28Å; V2604-T2608 WeakPolarHBondContact O-CG2 3.43Å; V2604-T2608 PolarHBondContact O-N 2.95Å; V2604-T2608 PolarHBondContact O-OG1 3.28Å
2605R86.3Confident87.6Confident127 Ų12780.3 Ų80.348%0.47940%0.403SS..Hα-helixtrans-62.9-35.5179-168.8174.3-179.6-173.1-2.7113L2601 N2602 V2603 T2608 K2609 L2728L2601-R2605 VanDerWaalsContact O-CB 3.29Å; L2601-R2605 WeakPolarHBondContact O-CB 3.45Å; L2601-R2605 PolarHBondContact O-N 3.44Å; N2602-R2605 PolarHBondContact O-N 2.93Å; V2603-R2605 VanDerWaalsContact C-N 3.3Å; V2603-R2605 PolarHBondContact O-N 3.27Å; R2605-T2608 WeakPolarHBondContact CA-OG1 3.42Å; R2605-T2608 PolarHBondContact O-N 2.99Å; R2605-T2608 PolarHBondContact O-OG1 3.46Å; R2605-K2609 VanDerWaalsContact O-CB 3.27Å; R2605-K2609 WeakPolarHBondContact O-CB 3.33Å; R2605-K2609 PolarHBondContact O-N 3.04Å; R2605-L2728 HydrophobicContact CG-CD1 4.47Å
2606S87.4Confident87.9Confident4 Ų482.5 Ų82.53%0.02841%0.413CS..Hα-helixtrans-64.1-43.4178.670.80000111.9N2602 V2603 V2604 T2724N2602-S2606 PolarHBondContact O-N 3.48Å; V2603-S2606 PolarHBondContact O-N 3.47Å; V2603-S2606 PolarHBondContact O-OG 3.11Å; V2604-S2606 VanDerWaalsContact C-N 3.35Å; V2604-S2606 PolarHBondContact O-N 3.29Å; S2606-T2724 VanDerWaalsContact O-CB 3.31Å; S2606-T2724 WeakPolarHBondContact O-CB 3.49Å; S2606-T2724 PolarHBondContact O-OG1 3.42Å
2607V90.8Very high88.2Confident62 Ų6279.6 Ų79.638%0.37641%0.405SS..Hα-helixtrans-67.7-41.2175.8-175.40000110.9V2604 G2611 I2614 I2721V2604-V2607 PolarHBondContact O-N 3.46Å; V2607-G2611 WeakPolarHBondContact O-CA 3.48Å; V2607-G2611 PolarHBondContact O-N 3.36Å; V2607-I2614 HydrophobicContact CG1-CD1 4.12Å; V2607-I2721 HydrophobicContact CG2-CG2 4.16Å
2608T90.2Very high88.5Confident91 Ų9176.9 Ų76.956%0.55840%0.4SS*.Hα-helixtrans-77.6-30.3-176.958.30000114.6V2604 R2605 N2610 G2611V2604-T2608 HydrophobicContact CG1-CG2 4.28Å; V2604-T2608 WeakPolarHBondContact O-CG2 3.43Å; V2604-T2608 PolarHBondContact O-N 2.95Å; V2604-T2608 PolarHBondContact O-OG1 3.28Å; R2605-T2608 WeakPolarHBondContact CA-OG1 3.42Å; R2605-T2608 PolarHBondContact O-N 2.99Å; R2605-T2608 PolarHBondContact O-OG1 3.46Å; T2608-N2610 PolarHBondContact O-N 2.99Å; T2608-G2611 PolarHBondContact O-N 2.82Å
2609K87.8Confident89.1Confident101 Ų10173.3 Ų73.344%0.43939%0.385SS..Hα-helixtrans-60.4-43.5-175.7-173.4174.3-179.1-174.70111.8R2605 L2728 E2731R2605-K2609 VanDerWaalsContact O-CB 3.27Å; R2605-K2609 WeakPolarHBondContact O-CB 3.33Å; R2605-K2609 PolarHBondContact O-N 3.04Å; K2609-L2728 HydrophobicContact CD-CD2 3.89Å; K2609-L2728 HydrophobicContact CD-CG 4.25Å; K2609-E2731 IonicContact NZ-OE1 3.37Å; K2609-E2731 IonicContact NZ-OE2 3.55Å; K2609-E2731 PolarHBondContact NZ-OE2 3.3Å
2610N89.2Confident89.4Confident62 Ų6273.1 Ų73.133%0.33238%0.38SS..THydrogen-bonded Turntrans-103.827.8171.9-66.12.3000112.5T2608 R2612 S2613 I2614 V2720 T2724T2608-N2610 PolarHBondContact O-N 2.99Å; N2610-R2612 PolarHBondContact O-N 3.38Å; N2610-S2613 PolarHBondContact O-N 3.04Å; N2610-S2613 PolarHBondContact O-OG 3.24Å; N2610-I2614 PolarHBondContact O-N 3.18Å; N2610-V2720 HydrophobicContact CB-CG1 4.47Å; N2610-T2724 HydrophobicContact CB-CG2 3.51Å; N2610-T2724 WeakPolarHBondContact ND2-CG2 3.37Å
2611G89.1Confident89.6Confident25 Ų2570.7 Ų70.726%0.25837%0.369SS..Hα-helixtrans-55.2-27-178.100000113.9V2607 T2608 F2615V2607-G2611 WeakPolarHBondContact O-CA 3.48Å; V2607-G2611 PolarHBondContact O-N 3.36Å; T2608-G2611 PolarHBondContact O-N 2.82Å; G2611-F2615 WeakPolarHBondContact O-CB 3.33Å; G2611-F2615 PolarHBondContact O-N 3.41Å
2612R90.9Very high89.9Confident208 Ų20871.9 Ų71.979%0.78538%0.376SS*.Hα-helixtrans-64.1-41.8173.9-178.7175.9175.6170.4-0.8113.3N2610 L2616N2610-R2612 PolarHBondContact O-N 3.38Å; R2612-L2616 HydrophobicContact CG-CD1 4.11Å; R2612-L2616 WeakPolarHBondContact O-CB 3.37Å; R2612-L2616 VanDerWaalsContact O-CG 3.28Å; R2612-L2616 WeakPolarHBondContact O-CG 3.43Å; R2612-L2616 PolarHBondContact O-N 3.23Å; R2612-L2616 VanDerWaalsContact O-N 3.09Å
2613S90.4Very high90.4Very high42 Ų4273.1 Ų73.129%0.29438%0.381SS..Hα-helixtrans-72.7-41.6179.156.70000110.7N2610 F2615 L2616 T2617 V2720N2610-S2613 PolarHBondContact O-N 3.04Å; N2610-S2613 PolarHBondContact O-OG 3.24Å; S2613-F2615 VanDerWaalsContact C-N 3.31Å; S2613-F2615 PolarHBondContact O-N 3.13Å; S2613-L2616 PolarHBondContact O-N 3.03Å; S2613-T2617 WeakPolarHBondContact O-CG2 3.33Å; S2613-T2617 PolarHBondContact O-N 3.16Å; S2613-T2617 PolarHBondContact O-OG1 2.97Å; S2613-V2720 WeakPolarHBondContact OG-CG1 3.38Å
2614I91.5Very high90.6Very high30 Ų3071.2 Ų71.215%0.15437%0.368CS..Hα-helixtrans-59.5-40.7174.5-61.2172000111.4V2607 N2610 T2617 G2618 I2717 V2720 I2721V2607-I2614 HydrophobicContact CG1-CD1 4.12Å; N2610-I2614 PolarHBondContact O-N 3.18Å; I2614-T2617 WeakPolarHBondContact CA-OG1 3.38Å; I2614-T2617 PolarHBondContact O-OG1 3.44Å; I2614-G2618 PolarHBondContact O-N 3.36Å; I2614-I2717 HydrophobicContact CG2-CG2 4.38Å; I2614-V2720 HydrophobicContact CD1-CG1 4.38Å; I2614-V2720 HydrophobicContact CG1-CG1 3.8Å; I2614-I2721 HydrophobicContact CD1-CD1 4.23Å; I2614-I2721 HydrophobicContact CD1-CG1 3.6Å; I2614-I2721 HydrophobicContact CG1-CG1 4.44Å
2615F91.3Very high90.7Very high140 Ų14068.3 Ų68.361%0.61435%0.35SS*.Hα-helixtrans-66.7-41.6176.1-178.2-108.9000112.3G2611 S2613 G2618 I2619G2611-F2615 WeakPolarHBondContact O-CB 3.33Å; G2611-F2615 PolarHBondContact O-N 3.41Å; S2613-F2615 VanDerWaalsContact C-N 3.31Å; S2613-F2615 PolarHBondContact O-N 3.13Å; F2615-G2618 PolarHBondContact O-N 3.09Å; F2615-I2619 HydrophobicContact CD1-CD1 3.88Å; F2615-I2619 HydrophobicContact CE1-CD1 3.41Å; F2615-I2619 VanDerWaalsContact CE1-CD1 3.41Å; F2615-I2619 HydrophobicContact CE1-CG1 4.42Å; F2615-I2619 HydrophobicContact CE2-CD1 4.42Å; F2615-I2619 HydrophobicContact CZ-CD1 3.72Å; F2615-I2619 HydrophobicContact CZ-CG1 4.41Å; F2615-I2619 WeakPolarHBondContact O-CG1 3.5Å; F2615-I2619 PolarHBondContact O-N 3.24Å
2616L91.9Very high91.1Very high94 Ų9467.2 Ų67.249%0.49235%0.347SS..Hα-helixtrans-67.5-37.5176.8-73.1169000112.5R2612 S2613 I2619 L2620R2612-L2616 HydrophobicContact CG-CD1 4.11Å; R2612-L2616 WeakPolarHBondContact O-CB 3.37Å; R2612-L2616 VanDerWaalsContact O-CG 3.28Å; R2612-L2616 WeakPolarHBondContact O-CG 3.43Å; R2612-L2616 PolarHBondContact O-N 3.23Å; R2612-L2616 VanDerWaalsContact O-N 3.09Å; S2613-L2616 PolarHBondContact O-N 3.03Å; L2616-I2619 PolarHBondContact O-N 3.02Å; L2616-L2620 PolarHBondContact O-N 2.91Å
2617T91.1Very high91.4Very high22 Ų2271.4 Ų71.414%0.13537%0.369CS..Hα-helixtrans-71.4-33.4174.655.90000111.7S2613 I2614 L2620 A2621 L2716S2613-T2617 WeakPolarHBondContact O-CG2 3.33Å; S2613-T2617 PolarHBondContact O-N 3.16Å; S2613-T2617 PolarHBondContact O-OG1 2.97Å; I2614-T2617 WeakPolarHBondContact CA-OG1 3.38Å; I2614-T2617 PolarHBondContact O-OG1 3.44Å; T2617-L2620 PolarHBondContact O-N 3.24Å; T2617-A2621 WeakPolarHBondContact O-CB 3.14Å; T2617-A2621 PolarHBondContact O-N 3.25Å; T2617-L2716 HydrophobicContact CG2-CD2 3.46Å; T2617-L2716 VanDerWaalsContact CG2-CD2 3.46Å
2618G90.9Very high91.5Very high32 Ų3269.7 Ų69.733%0.3336%0.355SS..Hα-helixtrans-63.6-39.4168.900000113.4I2614 F2615 A2621 L2622I2614-G2618 PolarHBondContact O-N 3.36Å; F2615-G2618 PolarHBondContact O-N 3.09Å; G2618-A2621 WeakPolarHBondContact O-CB 3.3Å; G2618-A2621 PolarHBondContact O-N 3.28Å; G2618-L2622 PolarHBondContact O-N 2.79Å
2619I92.9Very high91.6Very high68 Ų6865.3 Ų65.335%0.34933%0.329SS..Hα-helixtrans-64.2-44.4171.6-73.7170.6000110.8F2615 L2616 A2621 L2622 I2623F2615-I2619 HydrophobicContact CD1-CD1 3.88Å; F2615-I2619 HydrophobicContact CE1-CD1 3.41Å; F2615-I2619 VanDerWaalsContact CE1-CD1 3.41Å; F2615-I2619 HydrophobicContact CE1-CG1 4.42Å; F2615-I2619 HydrophobicContact CE2-CD1 4.42Å; F2615-I2619 HydrophobicContact CZ-CD1 3.72Å; F2615-I2619 HydrophobicContact CZ-CG1 4.41Å; F2615-I2619 WeakPolarHBondContact O-CG1 3.5Å; F2615-I2619 PolarHBondContact O-N 3.24Å; L2616-I2619 PolarHBondContact O-N 3.02Å; I2619-A2621 VanDerWaalsContact C-N 3.3Å; I2619-A2621 PolarHBondContact O-N 3.43Å; I2619-L2622 PolarHBondContact O-N 3.47Å; I2619-I2623 HydrophobicContact CG2-CD1 3.76Å; I2619-I2623 HydrophobicContact CG2-CG1 4.39Å; I2619-I2623 WeakPolarHBondContact O-CG1 3.23Å; I2619-I2623 PolarHBondContact O-N 3.27Å
2620L91.6Very high91.9Very high88 Ų8863.5 Ų63.546%0.46132%0.323SS..Hα-helixtrans-59.5-42175.9-179.463.8000111.4L2616 T2617 I2623 I2624L2616-L2620 PolarHBondContact O-N 2.91Å; T2617-L2620 PolarHBondContact O-N 3.24Å; L2620-I2623 PolarHBondContact O-N 3.32Å; L2620-I2624 HydrophobicContact CD1-CD1 4Å; L2620-I2624 HydrophobicContact CD1-CG1 4.44Å; L2620-I2624 HydrophobicContact CG-CD1 3.96Å; L2620-I2624 WeakPolarHBondContact O-CG1 3.22Å; L2620-I2624 PolarHBondContact O-N 2.96Å
2621A91.1Very high92Very high13 Ų1364 Ų6411%0.10733%0.325CS..Hα-helixtrans-57.3-49.2173.500000111.6T2617 G2618 I2619 I2623 I2624 I2625 I2713T2617-A2621 WeakPolarHBondContact O-CB 3.14Å; T2617-A2621 PolarHBondContact O-N 3.25Å; G2618-A2621 WeakPolarHBondContact O-CB 3.3Å; G2618-A2621 PolarHBondContact O-N 3.28Å; I2619-A2621 VanDerWaalsContact C-N 3.3Å; I2619-A2621 PolarHBondContact O-N 3.43Å; A2621-I2623 PolarHBondContact O-N 2.85Å; A2621-I2624 PolarHBondContact O-N 3.25Å; A2621-I2625 WeakPolarHBondContact O-CB 3.44Å; A2621-I2625 WeakPolarHBondContact O-CD1 3.23Å; A2621-I2625 VanDerWaalsContact O-CG1 3.23Å; A2621-I2625 WeakPolarHBondContact O-CG1 3.22Å; A2621-I2625 PolarHBondContact O-N 3.13Å; A2621-I2713 HydrophobicContact CB-CG2 3.64Å
2622L91.6Very high92.2Very high103 Ų10362.8 Ų62.854%0.53931%0.313SS..Hα-helixtrans-62.8-40.1179.5-171.4152000112.1G2618 I2619 Y2626G2618-L2622 PolarHBondContact O-N 2.79Å; I2619-L2622 PolarHBondContact O-N 3.47Å; L2622-Y2626 WeakPolarHBondContact O-CB 3.47Å; L2622-Y2626 PolarHBondContact O-N 2.99Å
2623I93.9Very high92.2Very high84 Ų8457.1 Ų57.143%0.43129%0.292SS..Hα-helixtrans-63.6-44.8175.4-68.5165.9000110.9I2619 L2620 A2621 Y2626 L2627I2619-I2623 HydrophobicContact CG2-CD1 3.76Å; I2619-I2623 HydrophobicContact CG2-CG1 4.39Å; I2619-I2623 WeakPolarHBondContact O-CG1 3.23Å; I2619-I2623 PolarHBondContact O-N 3.27Å; L2620-I2623 PolarHBondContact O-N 3.32Å; A2621-I2623 PolarHBondContact O-N 2.85Å; I2623-Y2626 WeakPolarHBondContact O-CB 3.33Å; I2623-Y2626 PolarHBondContact O-N 3.49Å; I2623-L2627 WeakPolarHBondContact O-CG 3.43Å; I2623-L2627 PolarHBondContact O-N 2.84Å; I2623-L2627 VanDerWaalsContact O-N 3.08Å
2624I93Very high92.3Very high36 Ų3658.2 Ų58.219%0.18530%0.304CS..Hα-helixtrans-65.9-46.3179.5-71.2169.2000110.3L2620 A2621 Y2626 L2627 Y2628 I2708 V2709 I2713L2620-I2624 HydrophobicContact CD1-CD1 4Å; L2620-I2624 HydrophobicContact CD1-CG1 4.44Å; L2620-I2624 HydrophobicContact CG-CD1 3.96Å; L2620-I2624 WeakPolarHBondContact O-CG1 3.22Å; L2620-I2624 PolarHBondContact O-N 2.96Å; A2621-I2624 PolarHBondContact O-N 3.25Å; I2624-Y2626 VanDerWaalsContact C-N 3.31Å; I2624-Y2626 PolarHBondContact O-N 2.83Å; I2624-L2627 WeakPolarHBondContact O-CB 3.34Å; I2624-L2627 PolarHBondContact O-N 3.46Å; I2624-L2627 VanDerWaalsContact O-N 3.16Å; I2624-Y2628 HydrophobicContact CG2-CD2 3.87Å; I2624-Y2628 HydrophobicContact CG2-CE2 3.79Å; I2624-Y2628 VanDerWaalsContact O-CD2 3.3Å; I2624-Y2628 WeakPolarHBondContact O-CD2 3.31Å; I2624-Y2628 PolarHBondContact O-N 3.02Å; I2624-I2708 HydrophobicContact CG2-CG2 4.12Å; I2624-V2709 HydrophobicContact CG2-CG2 3.97Å; I2624-I2713 HydrophobicContact CB-CD1 4.32Å; I2624-I2713 HydrophobicContact CD1-CD1 3.59Å; I2624-I2713 HydrophobicContact CG2-CD1 4.29Å
2625I92.7Very high92.3Very high3 Ų364.5 Ų64.52%0.01533%0.327CS..Hα-helixtrans-58.4-44.2175.6-67.7164.8000110.5A2621 L2627 Y2628 S2629 L2671 L2675 F2705 V2709A2621-I2625 WeakPolarHBondContact O-CB 3.44Å; A2621-I2625 WeakPolarHBondContact O-CD1 3.23Å; A2621-I2625 VanDerWaalsContact O-CG1 3.23Å; A2621-I2625 WeakPolarHBondContact O-CG1 3.22Å; A2621-I2625 PolarHBondContact O-N 3.13Å; I2625-L2627 VanDerWaalsContact C-N 3.34Å; I2625-L2627 PolarHBondContact O-N 3.47Å; I2625-Y2628 CarbonylContact O-C 3.58Å; I2625-Y2628 WeakPolarHBondContact O-CA 3.39Å; I2625-Y2628 WeakPolarHBondContact O-CB 3.4Å; I2625-Y2628 PolarHBondContact O-N 3.11Å; I2625-S2629 PolarHBondContact O-N 3.36Å; I2625-S2629 PolarHBondContact O-OG 3.42Å; I2625-L2671 HydrophobicContact CD1-CD1 3.84Å; I2625-L2671 HydrophobicContact CG2-CB 4.25Å; I2625-L2671 HydrophobicContact CG2-CD1 4.15Å; I2625-L2675 HydrophobicContact CD1-CD1 3.79Å; I2625-L2675 HydrophobicContact CD1-CD2 3.9Å; I2625-L2675 HydrophobicContact CD1-CG 3.9Å; I2625-F2705 HydrophobicContact CG1-CE2 4.46Å; I2625-V2709 HydrophobicContact CD1-CG1 4.01Å; I2625-V2709 HydrophobicContact CG1-CG1 3.89Å; I2625-V2709 HydrophobicContact CG1-CG2 4.36Å
2626Y93.5Very high92.2Very high104 Ų10458.3 Ų58.341%0.40830%0.3SS..Hα-helixtrans-58.1-40.3176.1170.3-104.8000113.3L2622 I2623 I2624 S2629 I2630 I2667L2622-Y2626 WeakPolarHBondContact O-CB 3.47Å; L2622-Y2626 PolarHBondContact O-N 2.99Å; I2623-Y2626 WeakPolarHBondContact O-CB 3.33Å; I2623-Y2626 PolarHBondContact O-N 3.49Å; I2624-Y2626 VanDerWaalsContact C-N 3.31Å; I2624-Y2626 PolarHBondContact O-N 2.83Å; Y2626-S2629 WeakPolarHBondContact O-CB 3.42Å; Y2626-S2629 PolarHBondContact O-N 3.17Å; Y2626-I2630 HydrophobicContact CD1-CD1 4.09Å; Y2626-I2630 HydrophobicContact CE1-CD1 3.56Å; Y2626-I2630 HydrophobicContact CE2-CD1 4.15Å; Y2626-I2630 HydrophobicContact CE2-CG1 4.49Å; Y2626-I2630 WeakPolarHBondContact O-CG1 3.24Å; Y2626-I2630 PolarHBondContact O-N 3.29Å; Y2626-I2667 HydrophobicContact CD2-CD1 3.65Å; Y2626-I2667 HydrophobicContact CD2-CG1 4.06Å; Y2626-I2667 HydrophobicContact CE2-CD1 3.69Å
2627L93.1Very high92Very high92 Ų9257 Ų5748%0.48229%0.291SS..Hα-helixtrans-63.9-43172.8-67.5171.4000111.4I2623 I2624 I2625 S2629 I2630 I2631I2623-L2627 WeakPolarHBondContact O-CG 3.43Å; I2623-L2627 PolarHBondContact O-N 2.84Å; I2623-L2627 VanDerWaalsContact O-N 3.08Å; I2624-L2627 WeakPolarHBondContact O-CB 3.34Å; I2624-L2627 PolarHBondContact O-N 3.46Å; I2624-L2627 VanDerWaalsContact O-N 3.16Å; I2625-L2627 VanDerWaalsContact C-N 3.34Å; I2625-L2627 PolarHBondContact O-N 3.47Å; L2627-S2629 VanDerWaalsContact C-N 3.3Å; L2627-S2629 PolarHBondContact O-N 2.64Å; L2627-I2630 PolarHBondContact O-N 2.94Å; L2627-I2631 WeakPolarHBondContact O-CG1 3.13Å; L2627-I2631 PolarHBondContact O-N 2.8Å
2628Y93.3Very high91.7Very high25 Ų2560.9 Ų60.910%0.09831%0.311CS..Hα-helixtrans-62.1-34.6172.8-83.2-77000112.7I2624 I2625 G2632 Y2701 S2704 F2705 V2709I2624-Y2628 HydrophobicContact CG2-CD2 3.87Å; I2624-Y2628 HydrophobicContact CG2-CE2 3.79Å; I2624-Y2628 VanDerWaalsContact O-CD2 3.3Å; I2624-Y2628 WeakPolarHBondContact O-CD2 3.31Å; I2624-Y2628 PolarHBondContact O-N 3.02Å; I2625-Y2628 CarbonylContact O-C 3.58Å; I2625-Y2628 WeakPolarHBondContact O-CA 3.39Å; I2625-Y2628 WeakPolarHBondContact O-CB 3.4Å; I2625-Y2628 PolarHBondContact O-N 3.11Å; Y2628-G2632 PolarHBondContact O-N 3.35Å; Y2628-Y2701 AromaticContact CD1-CD2 3.98Å; Y2628-Y2701 HydrophobicContact CD1-CD2 3.98Å; Y2628-Y2701 AromaticContact CD1-CE2 3.62Å; Y2628-Y2701 HydrophobicContact CD1-CE2 3.62Å; Y2628-Y2701 HydrophobicContact CE1-CD2 4.33Å; Y2628-Y2701 HydrophobicContact CE1-CE2 4.41Å; Y2628-Y2701 WeakPolarHBondContact O-CE2 3.08Å; Y2628-Y2701 PolarHBondContact O-OH 3.02Å; Y2628-S2704 WeakPolarHBondContact CE1-OG 3.46Å; Y2628-S2704 VanDerWaalsContact OH-CB 3.27Å; Y2628-S2704 WeakPolarHBondContact OH-CB 3.39Å; Y2628-S2704 PolarHBondContact OH-O 2.96Å; Y2628-S2704 PolarHBondContact OH-OG 3.34Å; Y2628-F2705 HydrophobicContact CD1-CB 4.08Å; Y2628-F2705 AromaticContact CD1-CD2 3.87Å; Y2628-F2705 HydrophobicContact CD1-CD2 3.87Å; Y2628-F2705 HydrophobicContact CD1-CG 4.48Å; Y2628-F2705 AromaticContact CD2-CD2 3.87Å; Y2628-F2705 HydrophobicContact CD2-CD2 3.87Å; Y2628-F2705 HydrophobicContact CE1-CB 3.85Å; Y2628-F2705 HydrophobicContact CE1-CD2 4.36Å; Y2628-F2705 HydrophobicContact CE2-CD2 4.37Å; Y2628-F2705 AromaticContact CG-CD2 3.62Å; Y2628-F2705 HydrophobicContact CG-CD2 3.62Å; Y2628-F2705 HydrophobicContact CG-CE2 4.36Å; Y2628-F2705 PolarHBondContact OH-N 3.5Å; Y2628-V2709 HydrophobicContact CD2-CG2 4.26Å; Y2628-V2709 HydrophobicContact CE2-CG2 4.19Å
2629S92.5Very high91.6Very high0 Ų061.3 Ų61.30%031%0.306CS..Hα-helixtrans-65-41.1173.7-41.10000112.3I2625 Y2626 L2627 G2632 Y2633 I2667 T2670I2625-S2629 PolarHBondContact O-N 3.36Å; I2625-S2629 PolarHBondContact O-OG 3.42Å; Y2626-S2629 WeakPolarHBondContact O-CB 3.42Å; Y2626-S2629 PolarHBondContact O-N 3.17Å; L2627-S2629 VanDerWaalsContact C-N 3.3Å; L2627-S2629 PolarHBondContact O-N 2.64Å; S2629-G2632 PolarHBondContact O-N 2.86Å; S2629-Y2633 WeakPolarHBondContact O-CB 3.35Å; S2629-Y2633 PolarHBondContact O-N 3.32Å; S2629-I2667 VanDerWaalsContact CB-CG1 3.43Å; S2629-I2667 WeakPolarHBondContact OG-CA 3.29Å; S2629-T2670 WeakPolarHBondContact CB-OG1 3.45Å; S2629-T2670 PolarHBondContact OG-OG1 2.9Å
2630I94.1Very high91.4Very high62 Ų6258.2 Ų58.232%0.31829%0.29SS..Hα-helixtrans-64.7-46.8176.6-69.5165.9000110.4Y2626 L2627 G2632 Y2633 A2634 L2663Y2626-I2630 HydrophobicContact CD1-CD1 4.09Å; Y2626-I2630 HydrophobicContact CE1-CD1 3.56Å; Y2626-I2630 HydrophobicContact CE2-CD1 4.15Å; Y2626-I2630 HydrophobicContact CE2-CG1 4.49Å; Y2626-I2630 WeakPolarHBondContact O-CG1 3.24Å; Y2626-I2630 PolarHBondContact O-N 3.29Å; L2627-I2630 PolarHBondContact O-N 2.94Å; I2630-G2632 VanDerWaalsContact C-N 3.31Å; I2630-G2632 PolarHBondContact O-N 2.88Å; I2630-Y2633 PolarHBondContact O-N 3.47Å; I2630-A2634 VanDerWaalsContact O-CB 3.31Å; I2630-A2634 WeakPolarHBondContact O-CB 3.41Å; I2630-A2634 PolarHBondContact O-N 3Å; I2630-L2663 HydrophobicContact CG1-CD1 4.16Å
2631I92.5Very high91.1Very high73 Ų7355.5 Ų55.537%0.37428%0.277SS..Hα-helixtrans-62.9-41.4177.6-64164.7000110.2L2627 A2634 Y2635 F2636 Y2701L2627-I2631 WeakPolarHBondContact O-CG1 3.13Å; L2627-I2631 PolarHBondContact O-N 2.8Å; I2631-A2634 PolarHBondContact O-N 3.43Å; I2631-Y2635 HydrophobicContact CG2-CD2 4.05Å; I2631-Y2635 PolarHBondContact O-N 3.04Å; I2631-F2636 HydrophobicContact CG2-CE2 4.49Å; I2631-Y2701 HydrophobicContact CB-CD2 4.38Å; I2631-Y2701 HydrophobicContact CB-CE2 3.95Å; I2631-Y2701 HydrophobicContact CG2-CD2 3.63Å; I2631-Y2701 HydrophobicContact CG2-CE2 3.66Å
2632G91.6Very high90.7Very high0 Ų056.1 Ų56.10%028%0.278CS..Hα-helixtrans-59-47.217400000112.9Y2628 S2629 I2630 F2636 Q2637Y2628-G2632 PolarHBondContact O-N 3.35Å; S2629-G2632 PolarHBondContact O-N 2.86Å; I2630-G2632 VanDerWaalsContact C-N 3.31Å; I2630-G2632 PolarHBondContact O-N 2.88Å; G2632-F2636 CarbonylContact O-C 3.2Å; G2632-F2636 VanDerWaalsContact O-CA 3.29Å; G2632-F2636 WeakPolarHBondContact O-CA 3.42Å; G2632-F2636 WeakPolarHBondContact O-CB 3.41Å; G2632-F2636 PolarHBondContact O-N 2.87Å; G2632-Q2637 PolarHBondContact O-N 3.32Å; G2632-Q2637 VanDerWaalsContact O-N 3.14Å
2633Y92.6Very high90Very high88 Ų8859.1 Ų59.135%0.34529%0.289SS..Hα-helixtrans-67.1-37.7177.6-177.2-95.5000112.9S2629 I2630 C2660 L2663 C2666S2629-Y2633 WeakPolarHBondContact O-CB 3.35Å; S2629-Y2633 PolarHBondContact O-N 3.32Å; I2630-Y2633 PolarHBondContact O-N 3.47Å; Y2633-C2660 WeakPolarHBondContact CD2-O 3.07Å; Y2633-C2660 WeakPolarHBondContact CE2-O 3.45Å; Y2633-L2663 HydrophobicContact CD1-CD1 4.3Å; Y2633-L2663 HydrophobicContact CD2-CB 4.35Å; Y2633-L2663 HydrophobicContact CE2-CB 4.42Å; Y2633-L2663 HydrophobicContact CG-CB 4.44Å; Y2633-L2663 HydrophobicContact CG-CD1 4.02Å; Y2633-C2666 HydrophobicContact CD2-CB 4.32Å
2634A92.1Very high89.1Confident66 Ų6657.8 Ų57.855%0.54528%0.283SS..Hα-helixtrans-76.4-37.1-17700000114I2630 I2631I2630-A2634 VanDerWaalsContact O-CB 3.31Å; I2630-A2634 WeakPolarHBondContact O-CB 3.41Å; I2630-A2634 PolarHBondContact O-N 3Å; I2631-A2634 PolarHBondContact O-N 3.43Å
2635Y90.2Very high87.8Confident161 Ų16163.5 Ų63.563%0.63131%0.313SS*.Hα-helixtrans-114.1-27.3-172.7-65.6-77.3000114.6I2631I2631-Y2635 HydrophobicContact CG2-CD2 4.05Å; I2631-Y2635 PolarHBondContact O-N 3.04Å
2636F89.2Confident86.4Confident11 Ų1167.4 Ų67.45%0.04834%0.337CS..  trans-124.718.2-166.5-57.6-63.2000113.8I2631 G2632 N2638 D2639 F2640 L2694 F2697 R2698 Y2701I2631-F2636 HydrophobicContact CG2-CE2 4.49Å; G2632-F2636 CarbonylContact O-C 3.2Å; G2632-F2636 VanDerWaalsContact O-CA 3.29Å; G2632-F2636 WeakPolarHBondContact O-CA 3.42Å; G2632-F2636 WeakPolarHBondContact O-CB 3.41Å; G2632-F2636 PolarHBondContact O-N 2.87Å; F2636-N2638 PolarHBondContact O-N 3.04Å; F2636-N2638 VanDerWaalsContact O-N 3.09Å; F2636-D2639 PolarHBondContact O-N 3.2Å; F2636-F2640 HydrophobicContact CB-CE2 4.41Å; F2636-F2640 WeakPolarHBondContact O-CD2 3.41Å; F2636-L2694 HydrophobicContact CE1-CB 4.46Å; F2636-F2697 HydrophobicContact CZ-CB 4.46Å; F2636-R2698 HydrophobicContact CE1-CB 3.87Å; F2636-R2698 HydrophobicContact CE1-CG 4.48Å; F2636-R2698 HydrophobicContact CZ-CB 4.26Å; F2636-Y2701 HydrophobicContact CD2-CD1 4.35Å; F2636-Y2701 HydrophobicContact CD2-CD2 4.18Å; F2636-Y2701 HydrophobicContact CD2-CE2 4.36Å; F2636-Y2701 HydrophobicContact CD2-CG 4.16Å; F2636-Y2701 HydrophobicContact CE2-CD1 4.27Å; F2636-Y2701 AromaticContact CE2-CD2 3.81Å; F2636-Y2701 HydrophobicContact CE2-CD2 3.81Å; F2636-Y2701 HydrophobicContact CE2-CE2 4.43Å; F2636-Y2701 AromaticContact CE2-CG 3.71Å; F2636-Y2701 HydrophobicContact CE2-CG 3.71Å
2637Q88.1Confident84.7Confident67 Ų6768.7 Ų68.731%0.31336%0.356SS..G310 helixtrans-48.9-41.9-174.8-164.9-175.811.700113.6G2632 D2639 C2660G2632-Q2637 PolarHBondContact O-N 3.32Å; G2632-Q2637 VanDerWaalsContact O-N 3.14Å; Q2637-D2639 VanDerWaalsContact C-N 3.27Å; Q2637-D2639 PolarHBondContact O-N 2.78Å; Q2637-C2660 HydrophobicContact CG-CB 4.33Å; Q2637-C2660 WeakPolarHBondContact CG-O 3.47Å; Q2637-C2660 PolarHBondContact NE2-O 2.96Å
2638N85.5Confident83Confident103 Ų10370.2 Ų70.255%0.55137%0.365SS*.G310 helixtrans-70.2-16.8-176.3-69.2-43.9000114.7F2636F2636-N2638 PolarHBondContact O-N 3.04Å; F2636-N2638 VanDerWaalsContact O-N 3.09Å
2639D88.7Confident81.3Confident41 Ų4177.1 Ų77.122%0.21940%0.403CS..G310 helixtrans-94-9.5-175.1-64.8-9.2000112.9F2636 Q2637 T2641 L2685 K2686 R2698F2636-D2639 PolarHBondContact O-N 3.2Å; Q2637-D2639 VanDerWaalsContact C-N 3.27Å; Q2637-D2639 PolarHBondContact O-N 2.78Å; D2639-T2641 PolarHBondContact O-N 3.27Å; D2639-L2685 HydrophobicContact CB-CD2 4.26Å; D2639-K2686 HydrophobicContact CB-CB 4.29Å; D2639-K2686 PolarHBondContact O-N 3.4Å; D2639-K2686 VanDerWaalsContact O-N 3.08Å; D2639-R2698 IonicContact OD2-CZ 3.13Å; D2639-R2698 IonicContact OD2-NE 3.1Å; D2639-R2698 PolarHBondContact OD2-NE 2.86Å; D2639-R2698 IonicContact OD2-NH2 3.91Å; D2639-R2698 PolarHBondContact OD2-NH2 3.06Å
2640F88.5Confident79.5Confident2 Ų284.3 Ų84.31%0.00944%0.442CS..  trans-77.949.2173.7-74.3-90.8000111.2F2636 R2658 R2659 C2660 T2669 T2670 I2681 L2685F2636-F2640 HydrophobicContact CB-CE2 4.41Å; F2636-F2640 WeakPolarHBondContact O-CD2 3.41Å; F2640-R2658 WeakPolarHBondContact O-CA 3.47Å; F2640-R2659 PolarHBondContact O-N 3.04Å; F2640-C2660 HydrophobicContact CB-CB 3.42Å; F2640-C2660 VanDerWaalsContact CB-CB 3.42Å; F2640-C2660 HydrophobicContact CD1-CB 4.27Å; F2640-C2660 HydrophobicContact CD2-CB 3.59Å; F2640-C2660 HydrophobicContact CE2-CB 4.39Å; F2640-C2660 HydrophobicContact CG-CB 3.51Å; F2640-T2669 HydrophobicContact CD1-CG2 4.26Å; F2640-T2670 HydrophobicContact CE1-CG2 3.61Å; F2640-T2670 HydrophobicContact CZ-CG2 3.75Å; F2640-I2681 HydrophobicContact CE1-CD1 4.19Å; F2640-I2681 HydrophobicContact CE1-CG1 4.29Å; F2640-L2685 HydrophobicContact CD1-CD2 3.66Å; F2640-L2685 HydrophobicContact CD2-CD2 3.82Å; F2640-L2685 HydrophobicContact CE1-CD2 3.71Å; F2640-L2685 HydrophobicContact CE2-CD2 3.86Å; F2640-L2685 HydrophobicContact CG-CD2 3.72Å; F2640-L2685 HydrophobicContact CZ-CD2 3.81Å
2641T85.8Confident77.5Confident32 Ų3290.4 Ų90.420%0.19647%0.469CS..EExtended strand (participates in β ladder)trans-97.6117.5174.449.40000109.6D2639 E2657 R2658D2639-T2641 PolarHBondContact O-N 3.27Å; T2641-E2657 CarbonylContact C-O 3.58Å; T2641-E2657 WeakPolarHBondContact CA-O 3.35Å; T2641-R2658 HydrophobicContact CG2-CG 3.91Å
2642I81.5Confident75.2Confident25 Ų2593.3 Ų93.313%0.12849%0.49CS..EExtended strand (participates in β ladder)trans-113.7134.8-179.6-64.4173.7000108.8T2656 E2657 R2659 T2669 E2673 V2684I2642-T2656 CarbonylContact O-C 3.49Å; I2642-T2656 WeakPolarHBondContact O-CA 3.25Å; I2642-E2657 PolarHBondContact N-O 3.09Å; I2642-E2657 PolarHBondContact O-N 2.97Å; I2642-R2659 HydrophobicContact CD1-CG 4.24Å; I2642-R2659 VanDerWaalsContact CD1-NH1 3.35Å; I2642-T2669 HydrophobicContact CD1-CG2 4.12Å; I2642-E2673 HydrophobicContact CD1-CG 4.46Å; I2642-V2684 HydrophobicContact CD1-CG1 3.65Å; I2642-V2684 HydrophobicContact CG1-CG1 3.9Å
2643E77.7Confident73.3Confident167 Ų16799.8 Ų99.878%0.7853%0.529SS*.EExtended strand (participates in β ladder)trans-72.6134.6176.1-67173.1-173.300110.1T2656E2643-T2656 HydrophobicContact CG-CG2 3.88Å
2644I74.5Confident71.5Confident56 Ų5698.7 Ų98.729%0.28755%0.545SS..EExtended strand (participates in β ladder)trans-128127.2-178.9-58.9-173.4000110.3V2646 S2655 E2657I2644-V2646 HydrophobicContact CG2-CG2 4.09Å; I2644-V2646 PolarHBondContact O-N 3.27Å; I2644-S2655 PolarHBondContact N-O 3.12Å; I2644-S2655 PolarHBondContact O-OG 3.5Å; I2644-E2657 HydrophobicContact CD1-CB 3.49Å; I2644-E2657 VanDerWaalsContact CD1-CB 3.49Å; I2644-E2657 HydrophobicContact CD1-CG 4.23Å; I2644-E2657 WeakPolarHBondContact CD1-OE2 3.3Å; I2644-E2657 HydrophobicContact CG1-CB 4.25Å
2645D66.8Low70.3Confident155 Ų15598.3 Ų98.383%0.82954%0.539SS*.  trans-76.795.7165.4-64.1-33.9000109.5T2647D2645-T2647 PolarHBondContact O-N 2.91Å
2646V62.7Low69.6Low85 Ų8594.8 Ų94.852%0.51553%0.534SS..  trans-76.6106.5176.8179.60000109.3I2644 N2648 S2655I2644-V2646 HydrophobicContact CG2-CG2 4.09Å; I2644-V2646 PolarHBondContact O-N 3.27Å; V2646-N2648 HydrophobicContact CG1-CB 4.23Å; V2646-N2648 PolarHBondContact O-N 3.35Å; V2646-S2655 WeakPolarHBondContact CG2-OG 3.41Å
2647T57.4Low69.2Low132 Ų13298.9 Ų98.981%0.8155%0.553SS**  trans-82.447.9-178.747.50000113.4D2645D2645-T2647 PolarHBondContact O-N 2.91Å
2648N56.8Low69Low124 Ų124102.2 Ų102.266%0.66356%0.563SS**SBendtrans-118.5142170.4-70.6-32.1000109.2V2646 N2650V2646-N2648 HydrophobicContact CG1-CB 4.23Å; V2646-N2648 PolarHBondContact O-N 3.35Å; N2648-N2650 PolarHBondContact O-N 2.97Å
2649D58.5Low69Low170 Ų17099.7 Ų99.791%0.90955%0.545SS*.SBendtrans-68.422.1-162.2-56.7-62000117.5
2650N54.4Low68.9Low150 Ų15097.7 Ų97.780%0.80254%0.535SS*.SBendtrans-113102.6179.3-68.6-17.7000111.1N2648N2648-N2650 PolarHBondContact O-N 2.97Å
2651E53.4Low68.8Low190 Ų190102.6 Ų102.689%0.88856%0.561SS**  trans26.1113159.4-62.9-174.215100119.3
2652T42.9Very low69.1Low135 Ų135103.8 Ų103.883%0.82857%0.571SS**  trans-28.5134.4165.954.10000117.1
2653V51.3Low69.5Low135 Ų135105.3 Ų105.382%0.81858%0.579SS**  -177.8115.499.7160.30000109.2S2655V2653-S2655 PolarHBondContact O-N 3.29Å
2654G56.3Low70.2Confident66 Ų66105.4 Ų105.468%0.6857%0.572SS**  trans36.164.4158.200000118.9T2656G2654-T2656 PolarHBondContact O-N 3.32Å
2655S65.8Low71Confident58 Ų58106.5 Ų106.541%0.40658%0.577SS.*EExtended strand (participates in β ladder)trans-73.4126.3173.354.10000111.8I2644 V2646 V2653I2644-S2655 PolarHBondContact N-O 3.12Å; I2644-S2655 PolarHBondContact O-OG 3.5Å; V2646-S2655 WeakPolarHBondContact CG2-OG 3.41Å; V2653-S2655 PolarHBondContact O-N 3.29Å
2656T75.6Confident72.1Confident86 Ų8699.1 Ų99.153%0.52854%0.537SS..EExtended strand (participates in β ladder)trans-96.4126.5173.449.20000111I2642 E2643 G2654I2642-T2656 CarbonylContact O-C 3.49Å; I2642-T2656 WeakPolarHBondContact O-CA 3.25Å; E2643-T2656 HydrophobicContact CG-CG2 3.88Å; G2654-T2656 PolarHBondContact O-N 3.32Å
2657E81.7Confident73.5Confident97 Ų9797.1 Ų97.145%0.45352%0.523SS..EExtended strand (participates in β ladder)trans-97.4137.5173.6-175.5-171.7-133.200110.6T2641 I2642 I2644 R2659T2641-E2657 CarbonylContact C-O 3.58Å; T2641-E2657 WeakPolarHBondContact CA-O 3.35Å; I2642-E2657 PolarHBondContact N-O 3.09Å; I2642-E2657 PolarHBondContact O-N 2.97Å; I2644-E2657 HydrophobicContact CD1-CB 3.49Å; I2644-E2657 VanDerWaalsContact CD1-CB 3.49Å; I2644-E2657 HydrophobicContact CD1-CG 4.23Å; I2644-E2657 WeakPolarHBondContact CD1-OE2 3.3Å; I2644-E2657 HydrophobicContact CG1-CB 4.25Å; E2657-R2659 IonicContact OE2-NE 2.75Å; E2657-R2659 PolarHBondContact OE2-NE 3.45Å
2658R83.9Confident75.2Confident137 Ų13794.9 Ų94.952%0.51751%0.506SS..EExtended strand (participates in β ladder)trans-87.8110.8171.4-69.6-179.9-179.8-172.2-1.1110.5F2640 T2641F2640-R2658 WeakPolarHBondContact O-CA 3.47Å; T2641-R2658 HydrophobicContact CG2-CG 3.91Å
2659R84.3Confident76.8Confident50 Ų5089.3 Ų89.319%0.18948%0.477CS..SBendtrans-91-5.9-179.1-64.3-155.1-169.5142.36.3115.4F2640 I2642 E2657 M2665 T2669 E2673F2640-R2659 PolarHBondContact O-N 3.04Å; I2642-R2659 HydrophobicContact CD1-CG 4.24Å; I2642-R2659 VanDerWaalsContact CD1-NH1 3.35Å; E2657-R2659 IonicContact OE2-NE 2.75Å; E2657-R2659 PolarHBondContact OE2-NE 3.45Å; R2659-M2665 CarbonylContact O-C 3.59Å; R2659-M2665 WeakPolarHBondContact O-CB 3.41Å; R2659-T2669 HydrophobicContact CB-CG2 4.18Å; R2659-T2669 WeakPolarHBondContact CB-OG1 3.38Å; R2659-E2673 IonicContact NH1-OE1 3.39Å; R2659-E2673 PolarHBondContact NH1-OE1 3.31Å
2660C87.9Confident78.4Confident0 Ų081.2 Ų81.20%043%0.433CS..  trans-104.622.1-177.8-166.50000113.8Y2633 Q2637 F2640 S2662 C2666Y2633-C2660 WeakPolarHBondContact CD2-O 3.07Å; Y2633-C2660 WeakPolarHBondContact CE2-O 3.45Å; Q2637-C2660 HydrophobicContact CG-CB 4.33Å; Q2637-C2660 WeakPolarHBondContact CG-O 3.47Å; Q2637-C2660 PolarHBondContact NE2-O 2.96Å; F2640-C2660 HydrophobicContact CB-CB 3.42Å; F2640-C2660 VanDerWaalsContact CB-CB 3.42Å; F2640-C2660 HydrophobicContact CD1-CB 4.27Å; F2640-C2660 HydrophobicContact CD2-CB 3.59Å; F2640-C2660 HydrophobicContact CE2-CB 4.39Å; F2640-C2660 HydrophobicContact CG-CB 3.51Å; C2660-S2662 PolarHBondContact O-N 3.13Å; C2660-C2666 HydrophobicContact CB-CB 3.83Å; C2660-C2666 WeakPolarHBondContact CB-SG 3.41Å; C2660-C2666 WeakPolarHBondContact SG-CB 3.48Å; C2660-C2666 CovalentContact SG-SG 2.04Å; C2660-C2666 PolarHBondContact SG-SG 3.46Å
2661D86.7Confident80.2Confident105 Ų10577 Ų7756%0.56141%0.41SS*.SBendtrans-66.4-23.9176.9-74.80.9000113.2
2662S91Very high82Confident56 Ų5675 Ų7539%0.39239%0.394SS..SBendtrans-126.6138.7172.6176.50000110C2660 R2664 M2665 C2666C2660-S2662 PolarHBondContact O-N 3.13Å; S2662-R2664 PolarHBondContact O-N 3.46Å; S2662-R2664 VanDerWaalsContact O-N 3.1Å; S2662-R2664 PolarHBondContact OG-N 3.37Å; S2662-M2665 PolarHBondContact O-N 3.49Å; S2662-C2666 PolarHBondContact O-N 3.4Å
2663L90.4Very high84.2Confident58 Ų5869.6 Ų69.630%0.30436%0.36SS..Hα-helixtrans-50.6-37.3174.9-178.564.7000112.1I2630 Y2633 C2666 I2667I2630-L2663 HydrophobicContact CG1-CD1 4.16Å; Y2633-L2663 HydrophobicContact CD1-CD1 4.3Å; Y2633-L2663 HydrophobicContact CD2-CB 4.35Å; Y2633-L2663 HydrophobicContact CE2-CB 4.42Å; Y2633-L2663 HydrophobicContact CG-CB 4.44Å; Y2633-L2663 HydrophobicContact CG-CD1 4.02Å; L2663-C2666 PolarHBondContact O-N 3.48Å; L2663-I2667 HydrophobicContact CD1-CD1 4.25Å; L2663-I2667 HydrophobicContact CD1-CG1 4.36Å; L2663-I2667 HydrophobicContact CG-CD1 3.87Å; L2663-I2667 HydrophobicContact CG-CG1 4.44Å; L2663-I2667 WeakPolarHBondContact O-CD1 3.41Å; L2663-I2667 VanDerWaalsContact O-CG1 3.23Å; L2663-I2667 WeakPolarHBondContact O-CG1 3.4Å; L2663-I2667 PolarHBondContact O-N 2.98Å
2664R91.8Very high86Confident169 Ų16963.2 Ų63.264%0.63832%0.321SS*.Hα-helixtrans-61.6-46.8176.1-171.8-171.573.2128.13.1112S2662 C2666 I2667 L2668S2662-R2664 PolarHBondContact O-N 3.46Å; S2662-R2664 VanDerWaalsContact O-N 3.1Å; S2662-R2664 PolarHBondContact OG-N 3.37Å; R2664-C2666 VanDerWaalsContact C-N 3.33Å; R2664-I2667 PolarHBondContact O-N 2.94Å; R2664-L2668 HydrophobicContact CG-CD1 4.25Å; R2664-L2668 VanDerWaalsContact O-CG 3.32Å; R2664-L2668 WeakPolarHBondContact O-CG 3.45Å; R2664-L2668 PolarHBondContact O-N 3.44Å
2665M90.8Very high87.5Confident78 Ų7864.1 Ų64.138%0.38431%0.31SS..Hα-helixtrans-70.5-33.3179-64.1-62.3-7400111R2659 S2662 L2668 T2669R2659-M2665 CarbonylContact O-C 3.59Å; R2659-M2665 WeakPolarHBondContact O-CB 3.41Å; S2662-M2665 PolarHBondContact O-N 3.49Å; M2665-L2668 PolarHBondContact O-N 3.01Å; M2665-L2668 HydrophobicContact SD-CD1 4.39Å; M2665-T2669 VanDerWaalsContact O-CB 3.25Å; M2665-T2669 WeakPolarHBondContact O-CB 3.28Å; M2665-T2669 PolarHBondContact O-N 2.69Å; M2665-T2669 PolarHBondContact O-OG1 3.3Å
2666C91.4Very high88.6Confident0 Ų067.3 Ų67.30%032%0.322CS..Hα-helixtrans-67.2-40.6174.2-148.60000112.2Y2633 C2660 S2662 L2663 R2664 T2669 T2670Y2633-C2666 HydrophobicContact CD2-CB 4.32Å; C2660-C2666 HydrophobicContact CB-CB 3.83Å; C2660-C2666 WeakPolarHBondContact CB-SG 3.41Å; C2660-C2666 WeakPolarHBondContact SG-CB 3.48Å; C2660-C2666 CovalentContact SG-SG 2.04Å; C2660-C2666 PolarHBondContact SG-SG 3.46Å; S2662-C2666 PolarHBondContact O-N 3.4Å; L2663-C2666 PolarHBondContact O-N 3.48Å; R2664-C2666 VanDerWaalsContact C-N 3.33Å; C2666-T2669 PolarHBondContact O-N 3.36Å; C2666-T2670 WeakPolarHBondContact O-CB 3.46Å; C2666-T2670 WeakPolarHBondContact O-CG2 3.25Å; C2666-T2670 PolarHBondContact O-N 3.14Å; C2666-T2670 PolarHBondContact O-OG1 3.01Å
2667I91.8Very high89.2Confident43 Ų4365.7 Ų65.722%0.22131%0.31CS..Hα-helixtrans-61.7-48.6171.2-67158.8000111Y2626 S2629 L2663 R2664 T2669 T2670 L2671Y2626-I2667 HydrophobicContact CD2-CD1 3.65Å; Y2626-I2667 HydrophobicContact CD2-CG1 4.06Å; Y2626-I2667 HydrophobicContact CE2-CD1 3.69Å; S2629-I2667 VanDerWaalsContact CB-CG1 3.43Å; S2629-I2667 WeakPolarHBondContact OG-CA 3.29Å; L2663-I2667 HydrophobicContact CD1-CD1 4.25Å; L2663-I2667 HydrophobicContact CD1-CG1 4.36Å; L2663-I2667 HydrophobicContact CG-CD1 3.87Å; L2663-I2667 HydrophobicContact CG-CG1 4.44Å; L2663-I2667 WeakPolarHBondContact O-CD1 3.41Å; L2663-I2667 VanDerWaalsContact O-CG1 3.23Å; L2663-I2667 WeakPolarHBondContact O-CG1 3.4Å; L2663-I2667 PolarHBondContact O-N 2.98Å; R2664-I2667 PolarHBondContact O-N 2.94Å; I2667-T2669 VanDerWaalsContact C-N 3.32Å; I2667-T2669 PolarHBondContact O-N 3.49Å; I2667-T2670 WeakPolarHBondContact CA-OG1 3.32Å; I2667-T2670 PolarHBondContact O-N 3.49Å; I2667-T2670 PolarHBondContact O-OG1 3.17Å; I2667-T2670 VanDerWaalsContact O-OG1 3.11Å; I2667-L2671 WeakPolarHBondContact O-CB 3.47Å; I2667-L2671 PolarHBondContact O-N 3.28Å
2668L92.3Very high89.3Confident86 Ų8663.8 Ų63.845%0.4532%0.317SS..Hα-helixtrans-63.8-37.1179.1-70170.2000112.5R2664 M2665 R2672R2664-L2668 HydrophobicContact CG-CD1 4.25Å; R2664-L2668 VanDerWaalsContact O-CG 3.32Å; R2664-L2668 WeakPolarHBondContact O-CG 3.45Å; R2664-L2668 PolarHBondContact O-N 3.44Å; M2665-L2668 PolarHBondContact O-N 3.01Å; M2665-L2668 HydrophobicContact SD-CD1 4.39Å; L2668-R2672 VanDerWaalsContact O-CB 3.23Å; L2668-R2672 WeakPolarHBondContact O-CB 3.41Å; L2668-R2672 PolarHBondContact O-N 2.86Å
2669T90.9Very high89.4Confident7 Ų758.5 Ų58.54%0.04331%0.305CS..Hα-helixtrans-70.6-46.7177.3-56.90000111.2F2640 I2642 R2659 M2665 C2666 I2667 L2671 R2672 E2673F2640-T2669 HydrophobicContact CD1-CG2 4.26Å; I2642-T2669 HydrophobicContact CD1-CG2 4.12Å; R2659-T2669 HydrophobicContact CB-CG2 4.18Å; R2659-T2669 WeakPolarHBondContact CB-OG1 3.38Å; M2665-T2669 VanDerWaalsContact O-CB 3.25Å; M2665-T2669 WeakPolarHBondContact O-CB 3.28Å; M2665-T2669 PolarHBondContact O-N 2.69Å; M2665-T2669 PolarHBondContact O-OG1 3.3Å; C2666-T2669 PolarHBondContact O-N 3.36Å; I2667-T2669 VanDerWaalsContact C-N 3.32Å; I2667-T2669 PolarHBondContact O-N 3.49Å; T2669-L2671 VanDerWaalsContact C-N 3.34Å; T2669-L2671 PolarHBondContact O-N 3.37Å; T2669-R2672 PolarHBondContact O-N 3.12Å; T2669-E2673 HydrophobicContact CG2-CG 3.84Å; T2669-E2673 VanDerWaalsContact O-CB 3.31Å; T2669-E2673 WeakPolarHBondContact O-CB 3.45Å; T2669-E2673 WeakPolarHBondContact O-CG 3.28Å; T2669-E2673 PolarHBondContact O-N 3.19Å
2670T91.9Very high89.6Confident0 Ų056.1 Ų56.10%030%0.296CS..Hα-helixtrans-65.4-34.9176.547.60000112.8S2629 F2640 C2666 I2667 G2674 I2681S2629-T2670 WeakPolarHBondContact CB-OG1 3.45Å; S2629-T2670 PolarHBondContact OG-OG1 2.9Å; F2640-T2670 HydrophobicContact CE1-CG2 3.61Å; F2640-T2670 HydrophobicContact CZ-CG2 3.75Å; C2666-T2670 WeakPolarHBondContact O-CB 3.46Å; C2666-T2670 WeakPolarHBondContact O-CG2 3.25Å; C2666-T2670 PolarHBondContact O-N 3.14Å; C2666-T2670 PolarHBondContact O-OG1 3.01Å; I2667-T2670 WeakPolarHBondContact CA-OG1 3.32Å; I2667-T2670 PolarHBondContact O-N 3.49Å; I2667-T2670 PolarHBondContact O-OG1 3.17Å; I2667-T2670 VanDerWaalsContact O-OG1 3.11Å; T2670-G2674 WeakPolarHBondContact O-CA 3.44Å; T2670-G2674 PolarHBondContact O-N 3.02Å; T2670-I2681 HydrophobicContact CG2-CD1 4.05Å; T2670-I2681 HydrophobicContact CG2-CG1 4.14Å
2671L91.6Very high89.7Confident60 Ų6056.1 Ų56.131%0.31430%0.296SS..Hα-helixtrans-69.1-46.3174.1-176.768000112.3I2625 I2667 T2669 L2675I2625-L2671 HydrophobicContact CD1-CD1 3.84Å; I2625-L2671 HydrophobicContact CG2-CB 4.25Å; I2625-L2671 HydrophobicContact CG2-CD1 4.15Å; I2667-L2671 WeakPolarHBondContact O-CB 3.47Å; I2667-L2671 PolarHBondContact O-N 3.28Å; T2669-L2671 VanDerWaalsContact C-N 3.34Å; T2669-L2671 PolarHBondContact O-N 3.37Å; L2671-L2675 HydrophobicContact CD1-CD1 3.81Å; L2671-L2675 WeakPolarHBondContact O-CB 3.48Å; L2671-L2675 WeakPolarHBondContact O-CG 3.42Å
2672R91Very high89.7Confident148 Ų14852.3 Ų52.356%0.55828%0.281SS*.Hα-helixtrans-70.8-64.3-179.8180-176.1-169.5-117.85.7111.1L2668 T2669 L2676L2668-R2672 VanDerWaalsContact O-CB 3.23Å; L2668-R2672 WeakPolarHBondContact O-CB 3.41Å; L2668-R2672 PolarHBondContact O-N 2.86Å; T2669-R2672 PolarHBondContact O-N 3.12Å; R2672-L2676 HydrophobicContact CG-CD1 3.8Å; R2672-L2676 WeakPolarHBondContact O-CB 3.41Å; R2672-L2676 WeakPolarHBondContact O-CD1 3.46Å; R2672-L2676 WeakPolarHBondContact O-CG 3.47Å; R2672-L2676 PolarHBondContact O-N 3.02Å; R2672-L2676 VanDerWaalsContact O-N 3.11Å
2673E89.1Confident89.6Confident23 Ų2354.4 Ų54.411%0.10729%0.288CS..Hα-helixtrans-75.5-29.4-170.5-47.7-63.3175.800111.4I2642 R2659 T2669 N2677 I2681 V2684I2642-E2673 HydrophobicContact CD1-CG 4.46Å; R2659-E2673 IonicContact NH1-OE1 3.39Å; R2659-E2673 PolarHBondContact NH1-OE1 3.31Å; T2669-E2673 HydrophobicContact CG2-CG 3.84Å; T2669-E2673 VanDerWaalsContact O-CB 3.31Å; T2669-E2673 WeakPolarHBondContact O-CB 3.45Å; T2669-E2673 WeakPolarHBondContact O-CG 3.28Å; T2669-E2673 PolarHBondContact O-N 3.19Å; E2673-N2677 WeakPolarHBondContact O-CB 3.4Å; E2673-N2677 PolarHBondContact O-N 3.42Å; E2673-N2677 PolarHBondContact O-ND2 3.38Å; E2673-I2681 HydrophobicContact CB-CD1 4.49Å; E2673-V2684 HydrophobicContact CB-CB 4.26Å; E2673-V2684 HydrophobicContact CB-CG1 3.95Å; E2673-V2684 HydrophobicContact CB-CG2 3.68Å; E2673-V2684 HydrophobicContact CG-CG1 4.16Å
2674G88.8Confident89.4Confident0 Ų053.1 Ų53.10%028%0.282CS..Hα-helixtrans-73.7-28.9176.700000114.1T2670 G2680 F2705T2670-G2674 WeakPolarHBondContact O-CA 3.44Å; T2670-G2674 PolarHBondContact O-N 3.02Å; G2674-G2680 WeakPolarHBondContact O-CA 3.32Å; G2674-F2705 VanDerWaalsContact O-CE1 3.31Å; G2674-F2705 WeakPolarHBondContact O-CE1 3.33Å
2675L89.7Confident89.3Confident85 Ų8545.4 Ų45.445%0.44525%0.254SS..Hα-helixtrans-91.8-26.4176.6-71.8178.5000114I2625 L2671 V2709 I2710I2625-L2675 HydrophobicContact CD1-CD1 3.79Å; I2625-L2675 HydrophobicContact CD1-CD2 3.9Å; I2625-L2675 HydrophobicContact CD1-CG 3.9Å; L2671-L2675 HydrophobicContact CD1-CD1 3.81Å; L2671-L2675 WeakPolarHBondContact O-CB 3.48Å; L2671-L2675 WeakPolarHBondContact O-CG 3.42Å; L2675-V2709 HydrophobicContact CD2-CG1 3.71Å; L2675-I2710 HydrophobicContact CD2-CD1 4.21Å
2676L88.8Confident89Confident125 Ų12548 Ų4865%0.65426%0.263SS*.Hα-helixtrans-79.7-31.3-179.6-71.6172.3000113.1R2672R2672-L2676 HydrophobicContact CG-CD1 3.8Å; R2672-L2676 WeakPolarHBondContact O-CB 3.41Å; R2672-L2676 WeakPolarHBondContact O-CD1 3.46Å; R2672-L2676 WeakPolarHBondContact O-CG 3.47Å; R2672-L2676 PolarHBondContact O-N 3.02Å; R2672-L2676 VanDerWaalsContact O-N 3.11Å
2677N87.1Confident88.7Confident53 Ų5359.1 Ų59.128%0.28331%0.305SS..SBendtrans-92.6135.2-177.1-63.6-65.5000111.5E2673 G2679 G2680 D2683 V2684E2673-N2677 WeakPolarHBondContact O-CB 3.4Å; E2673-N2677 PolarHBondContact O-N 3.42Å; E2673-N2677 PolarHBondContact O-ND2 3.38Å; N2677-G2679 PolarHBondContact O-N 2.79Å; N2677-G2680 WeakPolarHBondContact O-CA 3.48Å; N2677-G2680 PolarHBondContact O-N 2.99Å; N2677-D2683 HydrophobicContact CB-CB 4.02Å; N2677-V2684 HydrophobicContact CB-CG2 4.48Å; N2677-V2684 WeakPolarHBondContact ND2-CG2 3.46Å
2678G83.9Confident88.4Confident57 Ų5759 Ų5959%0.58831%0.307SS*.THydrogen-bonded Turntrans-66.2-33-170.100000114.5G2680 F2706G2678-G2680 PolarHBondContact O-N 3.49Å; G2678-F2706 WeakPolarHBondContact O-CD2 3.31Å; G2678-F2706 VanDerWaalsContact O-CE2 3.27Å; G2678-F2706 WeakPolarHBondContact O-CE2 3.37Å
2679G85.3Confident88Confident26 Ų2657.6 Ų57.627%0.26830%0.304SS..THydrogen-bonded Turntrans-80.84.4171.800000113.7N2677 D2683N2677-G2679 PolarHBondContact O-N 2.79Å; G2679-D2683 VanDerWaalsContact CA-OD2 3.22Å; G2679-D2683 WeakPolarHBondContact CA-OD2 3.46Å; G2679-D2683 PolarHBondContact N-OD2 3.2Å
2680G89.4Confident87.7Confident0 Ų064 Ų640%034%0.338CS..G310 helixtrans73.2-153.1-174.700000112.5G2674 N2677 G2678 G2682 D2683G2674-G2680 WeakPolarHBondContact O-CA 3.32Å; N2677-G2680 WeakPolarHBondContact O-CA 3.48Å; N2677-G2680 PolarHBondContact O-N 2.99Å; G2678-G2680 PolarHBondContact O-N 3.49Å; G2680-G2682 PolarHBondContact O-N 3.41Å; G2680-D2683 PolarHBondContact O-N 3.06Å
2681I89.9Confident87.3Confident0 Ų073 Ų730%038%0.377CS..G310 helixtrans-64.2-25.1-173.6-164.257.6000113.9F2640 T2670 E2673 D2683 V2684 L2685 Y2701 F2705F2640-I2681 HydrophobicContact CE1-CD1 4.19Å; F2640-I2681 HydrophobicContact CE1-CG1 4.29Å; T2670-I2681 HydrophobicContact CG2-CD1 4.05Å; T2670-I2681 HydrophobicContact CG2-CG1 4.14Å; E2673-I2681 HydrophobicContact CB-CD1 4.49Å; I2681-D2683 PolarHBondContact O-N 3.34Å; I2681-V2684 PolarHBondContact O-N 3.47Å; I2681-L2685 HydrophobicContact CB-CD1 4.29Å; I2681-L2685 HydrophobicContact CG1-CD1 3.72Å; I2681-L2685 HydrophobicContact CG1-CG 4.11Å; I2681-L2685 HydrophobicContact CG2-CD1 4Å; I2681-L2685 WeakPolarHBondContact O-CD1 3.4Å; I2681-L2685 WeakPolarHBondContact O-CG 3.36Å; I2681-L2685 PolarHBondContact O-N 2.66Å; I2681-Y2701 HydrophobicContact CG2-CD1 4.39Å; I2681-Y2701 HydrophobicContact CG2-CE1 3.7Å; I2681-F2705 HydrophobicContact CB-CD1 4.11Å; I2681-F2705 HydrophobicContact CB-CE1 4.13Å; I2681-F2705 HydrophobicContact CB-CG 4.34Å; I2681-F2705 HydrophobicContact CB-CZ 4.34Å; I2681-F2705 HydrophobicContact CG2-CB 4.03Å; I2681-F2705 HydrophobicContact CG2-CD1 3.82Å; I2681-F2705 HydrophobicContact CG2-CD2 4.03Å; I2681-F2705 HydrophobicContact CG2-CE1 4.32Å; I2681-F2705 HydrophobicContact CG2-CE2 4.49Å; I2681-F2705 HydrophobicContact CG2-CG 3.67Å
2682G87.6Confident86.9Confident24 Ų2474 Ų7425%0.24738%0.383CS..G310 helixtrans-63.9-21.7-179.600000114.8G2680 V2684G2680-G2682 PolarHBondContact O-N 3.41Å; G2682-V2684 VanDerWaalsContact C-N 3.28Å; G2682-V2684 PolarHBondContact O-N 2.95Å
2683D88Confident86.5Confident101 Ų10174.9 Ų74.954%0.5440%0.399SS..G310 helixtrans-70.5-25.7176.5-73-16.9000112.7N2677 G2679 G2680 I2681N2677-D2683 HydrophobicContact CB-CB 4.02Å; G2679-D2683 VanDerWaalsContact CA-OD2 3.22Å; G2679-D2683 WeakPolarHBondContact CA-OD2 3.46Å; G2679-D2683 PolarHBondContact N-OD2 3.2Å; G2680-D2683 PolarHBondContact O-N 3.06Å; I2681-D2683 PolarHBondContact O-N 3.34Å
2684V87.5Confident86.3Confident30 Ų3077.8 Ų77.818%0.18241%0.414CS..THydrogen-bonded Turntrans-102.5-27-170.2176.10000111.6I2642 E2673 N2677 I2681 G2682I2642-V2684 HydrophobicContact CD1-CG1 3.65Å; I2642-V2684 HydrophobicContact CG1-CG1 3.9Å; E2673-V2684 HydrophobicContact CB-CB 4.26Å; E2673-V2684 HydrophobicContact CB-CG1 3.95Å; E2673-V2684 HydrophobicContact CB-CG2 3.68Å; E2673-V2684 HydrophobicContact CG-CG1 4.16Å; N2677-V2684 HydrophobicContact CB-CG2 4.48Å; N2677-V2684 WeakPolarHBondContact ND2-CG2 3.46Å; I2681-V2684 PolarHBondContact O-N 3.47Å; G2682-V2684 VanDerWaalsContact C-N 3.28Å; G2682-V2684 PolarHBondContact O-N 2.95Å
2685L87.8Confident86.2Confident8 Ų881.3 Ų81.34%0.04243%0.43CS..SBendtrans-73.5149.3179.2-71.1162.4000110.9D2639 F2640 I2681 R2687 R2698 Y2701 D2702D2639-L2685 HydrophobicContact CB-CD2 4.26Å; F2640-L2685 HydrophobicContact CD1-CD2 3.66Å; F2640-L2685 HydrophobicContact CD2-CD2 3.82Å; F2640-L2685 HydrophobicContact CE1-CD2 3.71Å; F2640-L2685 HydrophobicContact CE2-CD2 3.86Å; F2640-L2685 HydrophobicContact CG-CD2 3.72Å; F2640-L2685 HydrophobicContact CZ-CD2 3.81Å; I2681-L2685 HydrophobicContact CB-CD1 4.29Å; I2681-L2685 HydrophobicContact CG1-CD1 3.72Å; I2681-L2685 HydrophobicContact CG1-CG 4.11Å; I2681-L2685 HydrophobicContact CG2-CD1 4Å; I2681-L2685 WeakPolarHBondContact O-CD1 3.4Å; I2681-L2685 WeakPolarHBondContact O-CG 3.36Å; I2681-L2685 PolarHBondContact O-N 2.66Å; L2685-R2687 PolarHBondContact O-N 3.26Å; L2685-R2698 VanDerWaalsContact CD1-CZ 3.47Å; L2685-Y2701 HydrophobicContact CD1-CE1 4.18Å; L2685-D2702 WeakPolarHBondContact CD1-OD1 3.35Å
2686K86.3Confident86.2Confident132 Ų13284 Ų8457%0.57444%0.438SS*.PPolyproline II helixtrans-56.8125.3174.1-174.9-178.5176.9-174.80110.6D2639D2639-K2686 HydrophobicContact CB-CB 4.29Å; D2639-K2686 PolarHBondContact O-N 3.4Å; D2639-K2686 VanDerWaalsContact O-N 3.08Å
2687R85Confident86.2Confident233 Ų23384.4 Ų84.488%0.87944%0.435SS*.PPolyproline II helixtrans-56.5121.8177.7-63.1-179-176.1177.42.3110.3L2685L2685-R2687 PolarHBondContact O-N 3.26Å
2688P83.7Confident86.3Confident42 Ų4282 Ų8227%0.27342%0.422SS..PPolyproline II helixtrans-73.4150.3-176.531.5-37000111.5F2695 R2698P2688-F2695 HydrophobicContact CB-CD2 3.98Å; P2688-F2695 HydrophobicContact CG-CD2 3.94Å; P2688-F2695 HydrophobicContact CG-CE2 4.16Å; P2688-R2698 HydrophobicContact CB-CG 4.08Å; P2688-R2698 HydrophobicContact CG-CG 3.86Å
2689S84.5Confident86.5Confident55 Ų5582.2 Ų82.239%0.38541%0.412SS..PPolyproline II helixtrans-87.7144.4175.2-178.70000110.6K2691 D2692 F2695S2689-K2691 PolarHBondContact O-N 3Å; S2689-K2691 PolarHBondContact OG-N 2.84Å; S2689-D2692 WeakPolarHBondContact CA-OD2 3.3Å; S2689-D2692 VanDerWaalsContact CB-OD2 3.26Å; S2689-D2692 WeakPolarHBondContact CB-OD2 3.27Å; S2689-D2692 PolarHBondContact N-OD2 3.04Å; S2689-D2692 WeakPolarHBondContact O-CB 3.46Å; S2689-D2692 PolarHBondContact O-N 3.04Å; S2689-F2695 WeakPolarHBondContact O-CD2 3.18Å
2690N84.7Confident86.8Confident143 Ų14384.9 Ų84.977%0.76542%0.419SS*.THydrogen-bonded Turntrans-60.5-8.2173.1-61.815.4000113.6
2691K84.3Confident87Confident189 Ų18985.4 Ų85.482%0.82242%0.421SS*.THydrogen-bonded Turntrans-92.1-10.5175.9-63.3-178.1179178.50113.7S2689S2689-K2691 PolarHBondContact O-N 3Å; S2689-K2691 PolarHBondContact OG-N 2.84Å
2692D82.8Confident87.1Confident81 Ų8186.8 Ų86.843%0.43343%0.429SS..  trans-83.7127.6-174-58.1-30.5000110S2689 L2694 F2695S2689-D2692 WeakPolarHBondContact CA-OD2 3.3Å; S2689-D2692 VanDerWaalsContact CB-OD2 3.26Å; S2689-D2692 WeakPolarHBondContact CB-OD2 3.27Å; S2689-D2692 PolarHBondContact N-OD2 3.04Å; S2689-D2692 WeakPolarHBondContact O-CB 3.46Å; S2689-D2692 PolarHBondContact O-N 3.04Å; D2692-L2694 PolarHBondContact O-N 2.99Å; D2692-F2695 WeakPolarHBondContact O-CB 3.49Å; D2692-F2695 PolarHBondContact O-N 3.36Å
2693N83.1Confident87.2Confident165 Ų16590.7 Ų90.788%0.88244%0.444SS*.THydrogen-bonded Turntrans-56.5-22178.4-69.2-8000113.3
2694L83.6Confident87.5Confident84 Ų8487.5 Ų87.544%0.4443%0.429SS..THydrogen-bonded Turntrans-90.2-4.7179.4-70.5163.2000113.5F2636 D2692 F2696 F2697 R2698F2636-L2694 HydrophobicContact CE1-CB 4.46Å; D2692-L2694 PolarHBondContact O-N 2.99Å; L2694-F2696 VanDerWaalsContact C-N 3.3Å; L2694-F2696 PolarHBondContact O-N 3.3Å; L2694-F2697 PolarHBondContact O-N 3.44Å; L2694-F2697 VanDerWaalsContact O-N 3.16Å; L2694-R2698 VanDerWaalsContact O-CB 3.28Å; L2694-R2698 WeakPolarHBondContact O-CB 3.44Å; L2694-R2698 PolarHBondContact O-N 3.49Å
2695F87.3Confident87.7Confident74 Ų7486 Ų8633%0.32542%0.42SS..Hα-helixtrans-51.1-45-176176.5-90.8000113.4P2688 S2689 D2692 R2698 T2699P2688-F2695 HydrophobicContact CB-CD2 3.98Å; P2688-F2695 HydrophobicContact CG-CD2 3.94Å; P2688-F2695 HydrophobicContact CG-CE2 4.16Å; S2689-F2695 WeakPolarHBondContact O-CD2 3.18Å; D2692-F2695 WeakPolarHBondContact O-CB 3.49Å; D2692-F2695 PolarHBondContact O-N 3.36Å; F2695-R2698 PolarHBondContact O-N 3.31Å; F2695-T2699 WeakPolarHBondContact O-CB 3.39Å; F2695-T2699 PolarHBondContact O-N 3.13Å; F2695-T2699 PolarHBondContact O-OG1 3.48Å
2696F88.7Confident88Confident142 Ų14289 Ų8962%0.62343%0.433SS*.Hα-helixtrans-68.1-47.2180-175.9-104.4000112.2L2694 R2698 T2699 I2700L2694-F2696 VanDerWaalsContact C-N 3.3Å; L2694-F2696 PolarHBondContact O-N 3.3Å; F2696-R2698 VanDerWaalsContact C-N 3.27Å; F2696-R2698 PolarHBondContact O-N 2.92Å; F2696-T2699 PolarHBondContact O-N 2.96Å; F2696-I2700 HydrophobicContact CD1-CD1 3.85Å; F2696-I2700 HydrophobicContact CE1-CD1 3.37Å; F2696-I2700 HydrophobicContact CE2-CD1 4.35Å; F2696-I2700 HydrophobicContact CZ-CD1 3.67Å; F2696-I2700 WeakPolarHBondContact O-CG1 3.34Å; F2696-I2700 PolarHBondContact O-N 3.11Å; F2696-I2700 VanDerWaalsContact O-N 3.08Å
2697F89.4Confident88.3Confident133 Ų13385.6 Ų85.658%0.58342%0.423SS*.Hα-helixtrans-62.6-35.8175.7-71.5-73.3000112.2F2636 L2694 I2700 Y2701F2636-F2697 HydrophobicContact CZ-CB 4.46Å; L2694-F2697 PolarHBondContact O-N 3.44Å; L2694-F2697 VanDerWaalsContact O-N 3.16Å; F2697-I2700 PolarHBondContact O-N 3.2Å; F2697-Y2701 WeakPolarHBondContact O-CB 3.31Å; F2697-Y2701 PolarHBondContact O-N 3.24Å
2698R89.1Confident88.6Confident2 Ų277.5 Ų77.51%0.00840%0.396CS..Hα-helixtrans-65.5-49.3176.4177.451.4122.1-176.5-3.2111.9F2636 D2639 L2685 P2688 L2694 F2695 F2696 I2700 Y2701 D2702F2636-R2698 HydrophobicContact CE1-CB 3.87Å; F2636-R2698 HydrophobicContact CE1-CG 4.48Å; F2636-R2698 HydrophobicContact CZ-CB 4.26Å; D2639-R2698 IonicContact OD2-CZ 3.13Å; D2639-R2698 IonicContact OD2-NE 3.1Å; D2639-R2698 PolarHBondContact OD2-NE 2.86Å; D2639-R2698 IonicContact OD2-NH2 3.91Å; D2639-R2698 PolarHBondContact OD2-NH2 3.06Å; L2685-R2698 VanDerWaalsContact CD1-CZ 3.47Å; P2688-R2698 HydrophobicContact CB-CG 4.08Å; P2688-R2698 HydrophobicContact CG-CG 3.86Å; L2694-R2698 VanDerWaalsContact O-CB 3.28Å; L2694-R2698 WeakPolarHBondContact O-CB 3.44Å; L2694-R2698 PolarHBondContact O-N 3.49Å; F2695-R2698 PolarHBondContact O-N 3.31Å; F2696-R2698 VanDerWaalsContact C-N 3.27Å; F2696-R2698 PolarHBondContact O-N 2.92Å; R2698-I2700 VanDerWaalsContact C-N 3.26Å; R2698-I2700 PolarHBondContact O-N 3.17Å; R2698-Y2701 WeakPolarHBondContact O-CB 3.34Å; R2698-Y2701 PolarHBondContact O-N 2.89Å; R2698-D2702 WeakPolarHBondContact CD-OD2 3.37Å; R2698-D2702 IonicContact NH1-OD1 3.28Å; R2698-D2702 PolarHBondContact O-N 3.1Å
2699T89.2Confident89Confident62 Ų6275.7 Ų75.738%0.3838%0.384SS..Hα-helixtrans-56.6-41.1175.8-54.50000111.5F2695 F2696 L2703F2695-T2699 WeakPolarHBondContact O-CB 3.39Å; F2695-T2699 PolarHBondContact O-N 3.13Å; F2695-T2699 PolarHBondContact O-OG1 3.48Å; F2696-T2699 PolarHBondContact O-N 2.96Å; T2699-L2703 WeakPolarHBondContact O-CB 3.45Å; T2699-L2703 PolarHBondContact O-N 3.06Å
2700I91.7Very high89.2Confident83 Ų8374.2 Ų74.243%0.42637%0.372SS..Hα-helixtrans-67.2-41.3175.2-69.8172.3000111.9F2696 F2697 R2698 S2704F2696-I2700 HydrophobicContact CD1-CD1 3.85Å; F2696-I2700 HydrophobicContact CE1-CD1 3.37Å; F2696-I2700 HydrophobicContact CE2-CD1 4.35Å; F2696-I2700 HydrophobicContact CZ-CD1 3.67Å; F2696-I2700 WeakPolarHBondContact O-CG1 3.34Å; F2696-I2700 PolarHBondContact O-N 3.11Å; F2696-I2700 VanDerWaalsContact O-N 3.08Å; F2697-I2700 PolarHBondContact O-N 3.2Å; R2698-I2700 VanDerWaalsContact C-N 3.26Å; R2698-I2700 PolarHBondContact O-N 3.17Å; I2700-S2704 WeakPolarHBondContact O-CB 3.47Å; I2700-S2704 PolarHBondContact O-N 2.94Å; I2700-S2704 PolarHBondContact O-OG 2.89Å
2701Y92.6Very high89.6Confident11 Ų1170.3 Ų70.34%0.04335%0.353CS..Hα-helixtrans-59.7-51.9177175.4-89.4000111.1Y2628 I2631 F2636 I2681 L2685 F2697 R2698 S2704 F2705Y2628-Y2701 AromaticContact CD1-CD2 3.98Å; Y2628-Y2701 HydrophobicContact CD1-CD2 3.98Å; Y2628-Y2701 AromaticContact CD1-CE2 3.62Å; Y2628-Y2701 HydrophobicContact CD1-CE2 3.62Å; Y2628-Y2701 HydrophobicContact CE1-CD2 4.33Å; Y2628-Y2701 HydrophobicContact CE1-CE2 4.41Å; Y2628-Y2701 WeakPolarHBondContact O-CE2 3.08Å; Y2628-Y2701 PolarHBondContact O-OH 3.02Å; I2631-Y2701 HydrophobicContact CB-CD2 4.38Å; I2631-Y2701 HydrophobicContact CB-CE2 3.95Å; I2631-Y2701 HydrophobicContact CG2-CD2 3.63Å; I2631-Y2701 HydrophobicContact CG2-CE2 3.66Å; F2636-Y2701 HydrophobicContact CD2-CD1 4.35Å; F2636-Y2701 HydrophobicContact CD2-CD2 4.18Å; F2636-Y2701 HydrophobicContact CD2-CE2 4.36Å; F2636-Y2701 HydrophobicContact CD2-CG 4.16Å; F2636-Y2701 HydrophobicContact CE2-CD1 4.27Å; F2636-Y2701 AromaticContact CE2-CD2 3.81Å; F2636-Y2701 HydrophobicContact CE2-CD2 3.81Å; F2636-Y2701 HydrophobicContact CE2-CE2 4.43Å; F2636-Y2701 AromaticContact CE2-CG 3.71Å; F2636-Y2701 HydrophobicContact CE2-CG 3.71Å; I2681-Y2701 HydrophobicContact CG2-CD1 4.39Å; I2681-Y2701 HydrophobicContact CG2-CE1 3.7Å; L2685-Y2701 HydrophobicContact CD1-CE1 4.18Å; F2697-Y2701 WeakPolarHBondContact O-CB 3.31Å; F2697-Y2701 PolarHBondContact O-N 3.24Å; R2698-Y2701 WeakPolarHBondContact O-CB 3.34Å; R2698-Y2701 PolarHBondContact O-N 2.89Å; Y2701-S2704 PolarHBondContact O-N 3.48Å; Y2701-S2704 PolarHBondContact O-OG 3.48Å; Y2701-S2704 VanDerWaalsContact O-OG 3.05Å; Y2701-F2705 WeakPolarHBondContact O-CB 2.92Å; Y2701-F2705 PolarHBondContact O-N 3.05Å
2702D91.9Very high90Very high29 Ų2965.8 Ų65.816%0.15534%0.337CS..Hα-helixtrans-65.2-47.4-178.3-57.9-31.6000111.4L2685 R2698 S2704 F2705 F2706L2685-D2702 WeakPolarHBondContact CD1-OD1 3.35Å; R2698-D2702 WeakPolarHBondContact CD-OD2 3.37Å; R2698-D2702 IonicContact NH1-OD1 3.28Å; R2698-D2702 PolarHBondContact O-N 3.1Å; D2702-S2704 PolarHBondContact O-N 3.16Å; D2702-F2705 PolarHBondContact O-N 3.32Å; D2702-F2706 PolarHBondContact O-N 2.78Å
2703L91.2Very high90.3Very high106 Ų10662.6 Ų62.656%0.55532%0.32SS*.Hα-helixtrans-63.6-42.3178.9-177.167.4000112.2T2699 F2706 V2707T2699-L2703 WeakPolarHBondContact O-CB 3.45Å; T2699-L2703 PolarHBondContact O-N 3.06Å; L2703-F2706 PolarHBondContact O-N 2.92Å; L2703-V2707 HydrophobicContact CD1-CG2 4.33Å; L2703-V2707 WeakPolarHBondContact O-CB 3.43Å; L2703-V2707 WeakPolarHBondContact O-CG2 3.07Å; L2703-V2707 PolarHBondContact O-N 3.38Å
2704S92.5Very high90.6Very high33 Ų3358.2 Ų58.223%0.23130%0.296CS..Hα-helixtrans-68.2-38.7178.868.10000111.6Y2628 I2700 Y2701 D2702 V2707 I2708Y2628-S2704 WeakPolarHBondContact CE1-OG 3.46Å; Y2628-S2704 VanDerWaalsContact OH-CB 3.27Å; Y2628-S2704 WeakPolarHBondContact OH-CB 3.39Å; Y2628-S2704 PolarHBondContact OH-O 2.96Å; Y2628-S2704 PolarHBondContact OH-OG 3.34Å; I2700-S2704 WeakPolarHBondContact O-CB 3.47Å; I2700-S2704 PolarHBondContact O-N 2.94Å; I2700-S2704 PolarHBondContact O-OG 2.89Å; Y2701-S2704 PolarHBondContact O-N 3.48Å; Y2701-S2704 PolarHBondContact O-OG 3.48Å; Y2701-S2704 VanDerWaalsContact O-OG 3.05Å; D2702-S2704 PolarHBondContact O-N 3.16Å; S2704-V2707 PolarHBondContact O-N 3.02Å; S2704-I2708 VanDerWaalsContact O-CB 3.25Å; S2704-I2708 WeakPolarHBondContact O-CB 3.16Å; S2704-I2708 WeakPolarHBondContact O-CG1 3.42Å; S2704-I2708 PolarHBondContact O-N 3.07Å
2705F92.9Very high91Very high0 Ų058.7 Ų58.70%030%0.299CS..Hα-helixtrans-60.6-49.1173.6-178.3-81.7000110.9I2625 Y2628 G2674 I2681 Y2701 D2702 V2709I2625-F2705 HydrophobicContact CG1-CE2 4.46Å; Y2628-F2705 HydrophobicContact CD1-CB 4.08Å; Y2628-F2705 AromaticContact CD1-CD2 3.87Å; Y2628-F2705 HydrophobicContact CD1-CD2 3.87Å; Y2628-F2705 HydrophobicContact CD1-CG 4.48Å; Y2628-F2705 AromaticContact CD2-CD2 3.87Å; Y2628-F2705 HydrophobicContact CD2-CD2 3.87Å; Y2628-F2705 HydrophobicContact CE1-CB 3.85Å; Y2628-F2705 HydrophobicContact CE1-CD2 4.36Å; Y2628-F2705 HydrophobicContact CE2-CD2 4.37Å; Y2628-F2705 AromaticContact CG-CD2 3.62Å; Y2628-F2705 HydrophobicContact CG-CD2 3.62Å; Y2628-F2705 HydrophobicContact CG-CE2 4.36Å; Y2628-F2705 PolarHBondContact OH-N 3.5Å; G2674-F2705 VanDerWaalsContact O-CE1 3.31Å; G2674-F2705 WeakPolarHBondContact O-CE1 3.33Å; I2681-F2705 HydrophobicContact CB-CD1 4.11Å; I2681-F2705 HydrophobicContact CB-CE1 4.13Å; I2681-F2705 HydrophobicContact CB-CG 4.34Å; I2681-F2705 HydrophobicContact CB-CZ 4.34Å; I2681-F2705 HydrophobicContact CG2-CB 4.03Å; I2681-F2705 HydrophobicContact CG2-CD1 3.82Å; I2681-F2705 HydrophobicContact CG2-CD2 4.03Å; I2681-F2705 HydrophobicContact CG2-CE1 4.32Å; I2681-F2705 HydrophobicContact CG2-CE2 4.49Å; I2681-F2705 HydrophobicContact CG2-CG 3.67Å; Y2701-F2705 WeakPolarHBondContact O-CB 2.92Å; Y2701-F2705 PolarHBondContact O-N 3.05Å; D2702-F2705 PolarHBondContact O-N 3.32Å; F2705-V2709 HydrophobicContact CD1-CB 4.48Å; F2705-V2709 HydrophobicContact CD2-CG2 3.92Å; F2705-V2709 HydrophobicContact CE1-CB 4.25Å; F2705-V2709 HydrophobicContact CE1-CG1 4.47Å; F2705-V2709 HydrophobicContact CE2-CB 4.36Å; F2705-V2709 HydrophobicContact CE2-CG1 4.5Å; F2705-V2709 HydrophobicContact CE2-CG2 3.9Å; F2705-V2709 HydrophobicContact CG-CG2 4.29Å; F2705-V2709 HydrophobicContact CZ-CB 4.19Å; F2705-V2709 HydrophobicContact CZ-CG1 4.12Å; F2705-V2709 HydrophobicContact CZ-CG2 4.24Å; F2705-V2709 WeakPolarHBondContact O-CA 3.17Å; F2705-V2709 VanDerWaalsContact O-CB 3.26Å; F2705-V2709 WeakPolarHBondContact O-CB 3.41Å; F2705-V2709 PolarHBondContact O-N 2.86Å
2706F92.9Very high91.2Very high71 Ų7159 Ų5931%0.31130%0.303SS..Iπ-helixtrans-57.4-51.7176.8170.7-109.4000112G2678 D2702 L2703 I2710 V2711G2678-F2706 WeakPolarHBondContact O-CD2 3.31Å; G2678-F2706 VanDerWaalsContact O-CE2 3.27Å; G2678-F2706 WeakPolarHBondContact O-CE2 3.37Å; D2702-F2706 PolarHBondContact O-N 2.78Å; L2703-F2706 PolarHBondContact O-N 2.92Å; F2706-I2710 HydrophobicContact CD2-CB 4.16Å; F2706-I2710 HydrophobicContact CD2-CG1 4.46Å; F2706-I2710 HydrophobicContact CD2-CG2 4.48Å; F2706-I2710 HydrophobicContact CE2-CG2 4.41Å; F2706-I2710 WeakPolarHBondContact O-CA 3.4Å; F2706-I2710 WeakPolarHBondContact O-CB 3.37Å; F2706-I2710 PolarHBondContact O-N 3.49Å; F2706-I2710 VanDerWaalsContact O-N 3.09Å; F2706-V2711 HydrophobicContact CD1-CG2 4.3Å; F2706-V2711 HydrophobicContact CE1-CG2 3.82Å; F2706-V2711 HydrophobicContact CE2-CG2 4.09Å; F2706-V2711 HydrophobicContact CZ-CG2 3.7Å; F2706-V2711 PolarHBondContact O-N 2.85Å
2707V92.9Very high91.3Very high59 Ų5953.7 Ų53.736%0.35828%0.281SS..Iπ-helixtrans-66.5-45.4-178173.50000111.9L2703 S2704 V2711 I2712L2703-V2707 HydrophobicContact CD1-CG2 4.33Å; L2703-V2707 WeakPolarHBondContact O-CB 3.43Å; L2703-V2707 WeakPolarHBondContact O-CG2 3.07Å; L2703-V2707 PolarHBondContact O-N 3.38Å; S2704-V2707 PolarHBondContact O-N 3.02Å; V2707-V2711 WeakPolarHBondContact O-CB 3.36Å; V2707-V2711 PolarHBondContact O-N 3Å; V2707-I2712 HydrophobicContact CG1-CD1 4.29Å; V2707-I2712 WeakPolarHBondContact O-CG1 3.19Å; V2707-I2712 PolarHBondContact O-N 3.32Å
2708I92.2Very high91.3Very high64 Ų6452.7 Ų52.733%0.32828%0.277SS..Iπ-helixtrans-78.6-48.6-174-65.7169.7000111I2624 S2704 I2712 I2713I2624-I2708 HydrophobicContact CG2-CG2 4.12Å; S2704-I2708 VanDerWaalsContact O-CB 3.25Å; S2704-I2708 WeakPolarHBondContact O-CB 3.16Å; S2704-I2708 WeakPolarHBondContact O-CG1 3.42Å; S2704-I2708 PolarHBondContact O-N 3.07Å; I2708-I2712 WeakPolarHBondContact O-CB 3.32Å; I2708-I2713 HydrophobicContact CG2-CD1 4.44Å; I2708-I2713 VanDerWaalsContact O-CG1 3.3Å; I2708-I2713 WeakPolarHBondContact O-CG1 3.29Å; I2708-I2713 PolarHBondContact O-N 3.29Å; I2708-I2713 VanDerWaalsContact O-N 3.09Å
2709V90.9Very high91.5Very high3 Ų354.4 Ų54.42%0.01830%0.296CS..Iπ-helixtrans-82.4-49.5-173.5-173.60000111.6I2624 I2625 Y2628 L2675 F2705 I2713 L2714I2624-V2709 HydrophobicContact CG2-CG2 3.97Å; I2625-V2709 HydrophobicContact CD1-CG1 4.01Å; I2625-V2709 HydrophobicContact CG1-CG1 3.89Å; I2625-V2709 HydrophobicContact CG1-CG2 4.36Å; Y2628-V2709 HydrophobicContact CD2-CG2 4.26Å; Y2628-V2709 HydrophobicContact CE2-CG2 4.19Å; L2675-V2709 HydrophobicContact CD2-CG1 3.71Å; F2705-V2709 HydrophobicContact CD1-CB 4.48Å; F2705-V2709 HydrophobicContact CD2-CG2 3.92Å; F2705-V2709 HydrophobicContact CE1-CB 4.25Å; F2705-V2709 HydrophobicContact CE1-CG1 4.47Å; F2705-V2709 HydrophobicContact CE2-CB 4.36Å; F2705-V2709 HydrophobicContact CE2-CG1 4.5Å; F2705-V2709 HydrophobicContact CE2-CG2 3.9Å; F2705-V2709 HydrophobicContact CG-CG2 4.29Å; F2705-V2709 HydrophobicContact CZ-CB 4.19Å; F2705-V2709 HydrophobicContact CZ-CG1 4.12Å; F2705-V2709 HydrophobicContact CZ-CG2 4.24Å; F2705-V2709 WeakPolarHBondContact O-CA 3.17Å; F2705-V2709 VanDerWaalsContact O-CB 3.26Å; F2705-V2709 WeakPolarHBondContact O-CB 3.41Å; F2705-V2709 PolarHBondContact O-N 2.86Å; V2709-I2713 WeakPolarHBondContact O-CB 3.44Å; V2709-L2714 PolarHBondContact O-N 3.29Å
2710I90.4Very high91.6Very high25 Ų2553 Ų5313%0.12829%0.286CS..Iπ-helixtrans-82.9-52.2-176.1-51.9-56.8000110.9L2675 F2706 L2714L2675-I2710 HydrophobicContact CD2-CD1 4.21Å; F2706-I2710 HydrophobicContact CD2-CB 4.16Å; F2706-I2710 HydrophobicContact CD2-CG1 4.46Å; F2706-I2710 HydrophobicContact CD2-CG2 4.48Å; F2706-I2710 HydrophobicContact CE2-CG2 4.41Å; F2706-I2710 WeakPolarHBondContact O-CA 3.4Å; F2706-I2710 WeakPolarHBondContact O-CB 3.37Å; F2706-I2710 PolarHBondContact O-N 3.49Å; F2706-I2710 VanDerWaalsContact O-N 3.09Å; I2710-L2714 VanDerWaalsContact O-CB 3.29Å; I2710-L2714 WeakPolarHBondContact O-CB 3.09Å
2711V92Very high91.6Very high61 Ų6151.1 Ų51.137%0.3728%0.277SS..Iπ-helixtrans-77-41.4-174.1-176.80000112.8F2706 V2707 N2715F2706-V2711 HydrophobicContact CD1-CG2 4.3Å; F2706-V2711 HydrophobicContact CE1-CG2 3.82Å; F2706-V2711 HydrophobicContact CE2-CG2 4.09Å; F2706-V2711 HydrophobicContact CZ-CG2 3.7Å; F2706-V2711 PolarHBondContact O-N 2.85Å; V2707-V2711 WeakPolarHBondContact O-CB 3.36Å; V2707-V2711 PolarHBondContact O-N 3Å; V2711-N2715 WeakPolarHBondContact O-CB 3.21Å; V2711-N2715 PolarHBondContact O-ND2 2.97Å
2712I92.3Very high91.5Very high93 Ų9355.3 Ų55.348%0.47730%0.303SS..Iπ-helixtrans-86.4-58.9-178-66.2168.9000111.7V2707 I2708 L2716V2707-I2712 HydrophobicContact CG1-CD1 4.29Å; V2707-I2712 WeakPolarHBondContact O-CG1 3.19Å; V2707-I2712 PolarHBondContact O-N 3.32Å; I2708-I2712 WeakPolarHBondContact O-CB 3.32Å; I2712-L2716 VanDerWaalsContact O-CB 3.3Å; I2712-L2716 WeakPolarHBondContact O-CB 3.36Å; I2712-L2716 PolarHBondContact O-N 3.05Å
2713I90.9Very high91.6Very high14 Ų1458.7 Ų58.77%0.07232%0.322CS..Iπ-helixtrans-69-43.8-169.2-65.7169.3000112.7A2621 I2624 I2708 V2709 L2716 I2717A2621-I2713 HydrophobicContact CB-CG2 3.64Å; I2624-I2713 HydrophobicContact CB-CD1 4.32Å; I2624-I2713 HydrophobicContact CD1-CD1 3.59Å; I2624-I2713 HydrophobicContact CG2-CD1 4.29Å; I2708-I2713 HydrophobicContact CG2-CD1 4.44Å; I2708-I2713 VanDerWaalsContact O-CG1 3.3Å; I2708-I2713 WeakPolarHBondContact O-CG1 3.29Å; I2708-I2713 PolarHBondContact O-N 3.29Å; I2708-I2713 VanDerWaalsContact O-N 3.09Å; V2709-I2713 WeakPolarHBondContact O-CB 3.44Å; I2713-L2716 WeakPolarHBondContact O-CB 3.32Å; I2713-L2716 PolarHBondContact O-N 3.25Å; I2713-I2717 HydrophobicContact CG2-CD1 4.16Å; I2713-I2717 WeakPolarHBondContact O-CG1 3.39Å; I2713-I2717 PolarHBondContact O-N 2.9Å
2714L89Confident91.6Very high74 Ų7453.8 Ų53.839%0.38730%0.296SS..Iπ-helixtrans-65.6-42.6-179.2-169.964.4000111.6V2709 I2710 L2716 I2717 F2718V2709-L2714 PolarHBondContact O-N 3.29Å; I2710-L2714 VanDerWaalsContact O-CB 3.29Å; I2710-L2714 WeakPolarHBondContact O-CB 3.09Å; L2714-L2716 VanDerWaalsContact C-N 3.32Å; L2714-L2716 PolarHBondContact O-N 2.75Å; L2714-I2717 PolarHBondContact O-N 3.02Å; L2714-F2718 HydrophobicContact CD1-CE2 3.99Å; L2714-F2718 HydrophobicContact CD1-CZ 4.19Å; L2714-F2718 HydrophobicContact CD2-CE2 4.03Å; L2714-F2718 HydrophobicContact CG-CD2 4.1Å; L2714-F2718 HydrophobicContact CG-CE2 3.6Å; L2714-F2718 HydrophobicContact CG-CZ 4.29Å; L2714-F2718 VanDerWaalsContact O-CD2 3.31Å; L2714-F2718 WeakPolarHBondContact O-CD2 3.48Å; L2714-F2718 PolarHBondContact O-N 2.77Å
2715N91.6Very high91.4Very high94 Ų9456.1 Ų56.150%0.50330%0.302SS..Hα-helixtrans-67.5-30.1174.4-72.7-37.5000112.9V2711 G2719V2711-N2715 WeakPolarHBondContact O-CB 3.21Å; V2711-N2715 PolarHBondContact O-ND2 2.97Å; N2715-G2719 PolarHBondContact O-N 2.91Å
2716L91.2Very high91.3Very high79 Ų7958.4 Ų58.441%0.41432%0.321SS..Hα-helixtrans-64.9-45172-170.5163.7000110.8T2617 I2712 I2713 L2714 G2719 V2720T2617-L2716 HydrophobicContact CG2-CD2 3.46Å; T2617-L2716 VanDerWaalsContact CG2-CD2 3.46Å; I2712-L2716 VanDerWaalsContact O-CB 3.3Å; I2712-L2716 WeakPolarHBondContact O-CB 3.36Å; I2712-L2716 PolarHBondContact O-N 3.05Å; I2713-L2716 WeakPolarHBondContact O-CB 3.32Å; I2713-L2716 PolarHBondContact O-N 3.25Å; L2714-L2716 VanDerWaalsContact C-N 3.32Å; L2714-L2716 PolarHBondContact O-N 2.75Å; L2716-G2719 PolarHBondContact O-N 3.27Å; L2716-V2720 HydrophobicContact CD2-CG2 4.24Å; L2716-V2720 WeakPolarHBondContact O-CG2 3.24Å; L2716-V2720 PolarHBondContact O-N 2.77Å
2717I90.8Very high91.2Very high32 Ų3257.2 Ų57.216%0.16432%0.324CS..Hα-helixtrans-60.5-47175.7-67.9166.5000110.8I2614 I2713 L2714 G2719 V2720 I2721I2614-I2717 HydrophobicContact CG2-CG2 4.38Å; I2713-I2717 HydrophobicContact CG2-CD1 4.16Å; I2713-I2717 WeakPolarHBondContact O-CG1 3.39Å; I2713-I2717 PolarHBondContact O-N 2.9Å; L2714-I2717 PolarHBondContact O-N 3.02Å; I2717-G2719 PolarHBondContact O-N 3.4Å; I2717-V2720 PolarHBondContact O-N 2.97Å; I2717-I2721 HydrophobicContact CG2-CD1 4.19Å; I2717-I2721 WeakPolarHBondContact O-CG1 3.35Å; I2717-I2721 PolarHBondContact O-N 2.76Å
2718F90.5Very high90.9Very high111 Ų11155.5 Ų55.549%0.48731%0.313SS..Hα-helixtrans-63.7-39.5175.6-68.9-46.5000112.7L2714 V2720 I2721 V2722L2714-F2718 HydrophobicContact CD1-CE2 3.99Å; L2714-F2718 HydrophobicContact CD1-CZ 4.19Å; L2714-F2718 HydrophobicContact CD2-CE2 4.03Å; L2714-F2718 HydrophobicContact CG-CD2 4.1Å; L2714-F2718 HydrophobicContact CG-CE2 3.6Å; L2714-F2718 HydrophobicContact CG-CZ 4.29Å; L2714-F2718 VanDerWaalsContact O-CD2 3.31Å; L2714-F2718 WeakPolarHBondContact O-CD2 3.48Å; L2714-F2718 PolarHBondContact O-N 2.77Å; F2718-V2720 VanDerWaalsContact C-N 3.35Å; F2718-V2720 PolarHBondContact O-N 3.22Å; F2718-I2721 PolarHBondContact O-N 3.01Å; F2718-I2721 VanDerWaalsContact O-N 3.11Å; F2718-V2722 WeakPolarHBondContact O-CG2 2.98Å; F2718-V2722 PolarHBondContact O-N 2.91Å
2719G92.2Very high90.8Very high39 Ų3959.5 Ų59.540%0.40232%0.324SS..Hα-helixtrans-58-44.2176.400000112.6N2715 L2716 I2717 I2721 V2722 D2723N2715-G2719 PolarHBondContact O-N 2.91Å; L2716-G2719 PolarHBondContact O-N 3.27Å; I2717-G2719 PolarHBondContact O-N 3.4Å; G2719-I2721 VanDerWaalsContact C-N 3.32Å; G2719-I2721 PolarHBondContact O-N 3.21Å; G2719-V2722 PolarHBondContact O-N 3.37Å; G2719-D2723 WeakPolarHBondContact O-CB 3.42Å; G2719-D2723 PolarHBondContact O-N 3.36Å
2720V91.7Very high90.8Very high31 Ų3164 Ų6419%0.18835%0.345CS..Hα-helixtrans-61.9-37.9175172.90000111.9N2610 S2613 I2614 L2716 I2717 F2718 T2724N2610-V2720 HydrophobicContact CB-CG1 4.47Å; S2613-V2720 WeakPolarHBondContact OG-CG1 3.38Å; I2614-V2720 HydrophobicContact CD1-CG1 4.38Å; I2614-V2720 HydrophobicContact CG1-CG1 3.8Å; L2716-V2720 HydrophobicContact CD2-CG2 4.24Å; L2716-V2720 WeakPolarHBondContact O-CG2 3.24Å; L2716-V2720 PolarHBondContact O-N 2.77Å; I2717-V2720 PolarHBondContact O-N 2.97Å; F2718-V2720 VanDerWaalsContact C-N 3.35Å; F2718-V2720 PolarHBondContact O-N 3.22Å; V2720-T2724 WeakPolarHBondContact O-CG2 3.34Å; V2720-T2724 PolarHBondContact O-N 3.23Å; V2720-T2724 VanDerWaalsContact O-N 3.12Å
2721I90.8Very high90.6Very high44 Ų4466.9 Ų66.923%0.22636%0.358CS..Hα-helixtrans-72.8-38.3178.8-64.8166.1000111.6V2607 I2614 I2717 F2718 G2719 T2724 F2725V2607-I2721 HydrophobicContact CG2-CG2 4.16Å; I2614-I2721 HydrophobicContact CD1-CD1 4.23Å; I2614-I2721 HydrophobicContact CD1-CG1 3.6Å; I2614-I2721 HydrophobicContact CG1-CG1 4.44Å; I2717-I2721 HydrophobicContact CG2-CD1 4.19Å; I2717-I2721 WeakPolarHBondContact O-CG1 3.35Å; I2717-I2721 PolarHBondContact O-N 2.76Å; F2718-I2721 PolarHBondContact O-N 3.01Å; F2718-I2721 VanDerWaalsContact O-N 3.11Å; G2719-I2721 VanDerWaalsContact C-N 3.32Å; G2719-I2721 PolarHBondContact O-N 3.21Å; I2721-T2724 PolarHBondContact O-OG1 2.9Å; I2721-F2725 WeakPolarHBondContact O-CB 3.25Å; I2721-F2725 PolarHBondContact O-N 3.39Å
2722V91.8Very high90.2Very high99 Ų9969.4 Ų69.460%0.636%0.364SS*.Hα-helixtrans-67.5-40.6176.7173.10000110.7F2718 G2719 F2725 A2726F2718-V2722 WeakPolarHBondContact O-CG2 2.98Å; F2718-V2722 PolarHBondContact O-N 2.91Å; G2719-V2722 PolarHBondContact O-N 3.37Å; V2722-F2725 PolarHBondContact O-N 2.94Å; V2722-A2726 PolarHBondContact O-N 2.92Å
2723D93.8Very high90Very high100 Ų10069.9 Ų69.954%0.53536%0.364SS..Hα-helixtrans-61.1-46.3175-178.462.4000112.3G2719 F2725 A2726 A2727G2719-D2723 WeakPolarHBondContact O-CB 3.42Å; G2719-D2723 PolarHBondContact O-N 3.36Å; D2723-F2725 VanDerWaalsContact C-N 3.27Å; D2723-F2725 PolarHBondContact O-N 3.1Å; D2723-A2726 PolarHBondContact O-N 3.18Å; D2723-A2727 WeakPolarHBondContact O-CB 3.42Å; D2723-A2727 PolarHBondContact O-N 3.11Å
2724T89.9Confident89.9Confident3 Ų372.6 Ų72.62%0.01838%0.379CS..Hα-helixtrans-61-36.6176.357.30000113S2606 N2610 V2720 I2721 L2728S2606-T2724 VanDerWaalsContact O-CB 3.31Å; S2606-T2724 WeakPolarHBondContact O-CB 3.49Å; S2606-T2724 PolarHBondContact O-OG1 3.42Å; N2610-T2724 HydrophobicContact CB-CG2 3.51Å; N2610-T2724 WeakPolarHBondContact ND2-CG2 3.37Å; V2720-T2724 WeakPolarHBondContact O-CG2 3.34Å; V2720-T2724 PolarHBondContact O-N 3.23Å; V2720-T2724 VanDerWaalsContact O-N 3.12Å; I2721-T2724 PolarHBondContact O-OG1 2.9Å; T2724-L2728 WeakPolarHBondContact O-CB 3.29Å; T2724-L2728 WeakPolarHBondContact O-CG 3.44Å; T2724-L2728 PolarHBondContact O-N 3.47Å
2725F88.9Confident89.5Confident82 Ų8271.2 Ų71.236%0.3637%0.373SS..Hα-helixtrans-71.8-38.8179.3-172.6-118.4000111.9I2721 V2722 D2723 R2729I2721-F2725 WeakPolarHBondContact O-CB 3.25Å; I2721-F2725 PolarHBondContact O-N 3.39Å; V2722-F2725 PolarHBondContact O-N 2.94Å; D2723-F2725 VanDerWaalsContact C-N 3.27Å; D2723-F2725 PolarHBondContact O-N 3.1Å; F2725-R2729 PolarHBondContact O-N 2.87Å; F2725-R2729 VanDerWaalsContact O-N 3.09Å
2726A90.8Very high89.2Confident48 Ų4870.5 Ų70.540%0.39737%0.367SS..Hα-helixtrans-63.2-46.8171.500000111.5V2722 D2723 L2728 R2729 Q2730V2722-A2726 PolarHBondContact O-N 2.92Å; D2723-A2726 PolarHBondContact O-N 3.18Å; A2726-L2728 PolarHBondContact O-N 3.46Å; A2726-R2729 PolarHBondContact O-N 2.8Å; A2726-Q2730 PolarHBondContact O-N 3.28Å
2727A91.1Very high88.9Confident46 Ų4671.7 Ų71.738%0.3837%0.371SS..Hα-helixtrans-60.7-45177.800000112.6D2723 R2729 Q2730 E2731D2723-A2727 WeakPolarHBondContact O-CB 3.42Å; D2723-A2727 PolarHBondContact O-N 3.11Å; A2727-R2729 VanDerWaalsContact C-N 3.32Å; A2727-R2729 PolarHBondContact O-N 3.23Å; A2727-Q2730 PolarHBondContact O-N 3.03Å; A2727-E2731 WeakPolarHBondContact O-CB 3.42Å; A2727-E2731 PolarHBondContact O-N 3.15Å
2728L86.8Confident88.6Confident23 Ų2372.8 Ų72.812%0.1238%0.376CS..Hα-helixtrans-63.4-35.5175.8-80.4170000112.8R2605 K2609 T2724 A2726 K2732R2605-L2728 HydrophobicContact CG-CD1 4.47Å; K2609-L2728 HydrophobicContact CD-CD2 3.89Å; K2609-L2728 HydrophobicContact CD-CG 4.25Å; T2724-L2728 WeakPolarHBondContact O-CB 3.29Å; T2724-L2728 WeakPolarHBondContact O-CG 3.44Å; T2724-L2728 PolarHBondContact O-N 3.47Å; A2726-L2728 PolarHBondContact O-N 3.46Å; L2728-K2732 PolarHBondContact O-N 3.01Å; L2728-K2732 VanDerWaalsContact O-N 3.09Å
2729R88.7Confident88.1Confident148 Ų14871.2 Ų71.256%0.55837%0.373SS*.Hα-helixtrans-66.7-45.2173.8-176.5-176.2-68.2135.1-5.2111.2F2725 A2726 A2727 K2732 Q2733F2725-R2729 PolarHBondContact O-N 2.87Å; F2725-R2729 VanDerWaalsContact O-N 3.09Å; A2726-R2729 PolarHBondContact O-N 2.8Å; A2727-R2729 VanDerWaalsContact C-N 3.32Å; A2727-R2729 PolarHBondContact O-N 3.23Å; R2729-K2732 PolarHBondContact O-N 2.91Å; R2729-Q2733 WeakPolarHBondContact O-CB 3.41Å; R2729-Q2733 PolarHBondContact O-N 3.36Å
2730Q91.7Very high87.8Confident97 Ų9774.9 Ų74.945%0.45338%0.378SS..Hα-helixtrans-64.9-41.8178.7-166.466.952.200111.6A2726 A2727 Q2733 N2734A2726-Q2730 PolarHBondContact O-N 3.28Å; A2727-Q2730 PolarHBondContact O-N 3.03Å; Q2730-Q2733 PolarHBondContact O-N 2.99Å; Q2730-N2734 PolarHBondContact NE2-OD1 3.25Å; Q2730-N2734 WeakPolarHBondContact O-CB 3.28Å; Q2730-N2734 PolarHBondContact O-N 2.91Å; Q2730-N2734 PolarHBondContact O-OD1 3.32Å
2731E85.8Confident87.6Confident86 Ų8675.4 Ų75.440%0.40238%0.38SS..Hα-helixtrans-55.7-51.4173.5-173.5178.6174.200110.5K2609 A2727 Q2733 N2734 T2735K2609-E2731 IonicContact NZ-OE1 3.37Å; K2609-E2731 IonicContact NZ-OE2 3.55Å; K2609-E2731 PolarHBondContact NZ-OE2 3.3Å; A2727-E2731 WeakPolarHBondContact O-CB 3.42Å; A2727-E2731 PolarHBondContact O-N 3.15Å; E2731-Q2733 PolarHBondContact O-N 3.08Å; E2731-N2734 PolarHBondContact O-N 3.09Å; E2731-T2735 PolarHBondContact O-N 2.98Å; E2731-T2735 PolarHBondContact O-OG1 3.2Å
2732K83.6Confident87.4Confident114 Ų11475.9 Ų75.950%0.49638%0.381SS..Hα-helixtrans-60.8-45.5176-178.9171.6176.7171.10112.7L2728 R2729 T2735 E2736L2728-K2732 PolarHBondContact O-N 3.01Å; L2728-K2732 VanDerWaalsContact O-N 3.09Å; R2729-K2732 PolarHBondContact O-N 2.91Å; K2732-T2735 PolarHBondContact O-N 2.93Å; K2732-E2736 WeakPolarHBondContact CE-OE1 3.4Å; K2732-E2736 WeakPolarHBondContact O-CG 3.27Å; K2732-E2736 PolarHBondContact O-N 3.35Å
2733Q89.4Confident87.2Confident104 Ų10471.2 Ų71.249%0.48635%0.353SS..Hα-helixtrans-63.3-45.6-179.4-178.7172.9-17.700111.6R2729 Q2730 E2731 T2735 E2736 E2737R2729-Q2733 WeakPolarHBondContact O-CB 3.41Å; R2729-Q2733 PolarHBondContact O-N 3.36Å; Q2730-Q2733 PolarHBondContact O-N 2.99Å; E2731-Q2733 PolarHBondContact O-N 3.08Å; Q2733-T2735 PolarHBondContact O-N 2.98Å; Q2733-E2736 PolarHBondContact O-N 3.14Å; Q2733-E2737 WeakPolarHBondContact O-CB 3.4Å; Q2733-E2737 PolarHBondContact O-N 3.33Å
2734N87.4Confident86.6Confident70 Ų7068 Ų6837%0.37434%0.337SS..Hα-helixtrans-60.5-44.6176.7-68.11.7000111Q2730 E2731 E2737 L2738Q2730-N2734 PolarHBondContact NE2-OD1 3.25Å; Q2730-N2734 WeakPolarHBondContact O-CB 3.28Å; Q2730-N2734 PolarHBondContact O-N 2.91Å; Q2730-N2734 PolarHBondContact O-OD1 3.32Å; E2731-N2734 PolarHBondContact O-N 3.09Å; N2734-E2737 PolarHBondContact O-N 3.36Å; N2734-L2738 WeakPolarHBondContact O-CB 3.34Å; N2734-L2738 VanDerWaalsContact O-CG 3.28Å; N2734-L2738 WeakPolarHBondContact O-CG 3.47Å; N2734-L2738 PolarHBondContact O-N 3.45Å
2735T81.7Confident86.4Confident45 Ų4568.4 Ų68.428%0.27634%0.34SS..Hα-helixtrans-62.9-42.4176.5-55.30000111.9E2731 K2732 Q2733 N2739E2731-T2735 PolarHBondContact O-N 2.98Å; E2731-T2735 PolarHBondContact O-OG1 3.2Å; K2732-T2735 PolarHBondContact O-N 2.93Å; Q2733-T2735 PolarHBondContact O-N 2.98Å; T2735-N2739 VanDerWaalsContact O-CB 3.31Å; T2735-N2739 WeakPolarHBondContact O-CB 3.36Å; T2735-N2739 PolarHBondContact O-N 3.47Å; T2735-N2739 PolarHBondContact O-ND2 3.08Å
2736E84Confident86.3Confident79 Ų7964.7 Ų64.737%0.36932%0.324SS..Hα-helixtrans-65-38.8175.8-79.1-169.8-144.900112.9K2732 Q2733 K2740K2732-E2736 WeakPolarHBondContact CE-OE1 3.4Å; K2732-E2736 WeakPolarHBondContact O-CG 3.27Å; K2732-E2736 PolarHBondContact O-N 3.35Å; Q2733-E2736 PolarHBondContact O-N 3.14Å; E2736-K2740 WeakPolarHBondContact O-CB 3.33Å; E2736-K2740 WeakPolarHBondContact O-CD 3.2Å; E2736-K2740 WeakPolarHBondContact O-CG 3.5Å; E2736-K2740 PolarHBondContact O-N 3.01Å; E2736-K2740 VanDerWaalsContact O-N 3.09Å; E2736-K2740 IonicContact OE2-NZ 3.18Å; E2736-K2740 PolarHBondContact OE2-NZ 3.02Å
2737E86Confident86Confident105 Ų10563 Ų6349%0.49131%0.311SS..Hα-helixtrans-67-47.8176.9-173.3176.8169.800111.4Q2733 N2734 N2739 K2740 N2741Q2733-E2737 WeakPolarHBondContact O-CB 3.4Å; Q2733-E2737 PolarHBondContact O-N 3.33Å; N2734-E2737 PolarHBondContact O-N 3.36Å; E2737-N2739 VanDerWaalsContact C-N 3.31Å; E2737-N2739 PolarHBondContact O-N 3.18Å; E2737-K2740 PolarHBondContact O-N 3.34Å; E2737-N2741 VanDerWaalsContact O-CB 3.32Å; E2737-N2741 WeakPolarHBondContact O-CB 3.49Å; E2737-N2741 PolarHBondContact O-N 3.34Å
2738L83.6Confident85.9Confident54 Ų5462 Ų6228%0.28330%0.299SS..Hα-helixtrans-56.3-45.4174.3-72.3174.2000111.2N2734 K2740 H2742N2734-L2738 WeakPolarHBondContact O-CB 3.34Å; N2734-L2738 VanDerWaalsContact O-CG 3.28Å; N2734-L2738 WeakPolarHBondContact O-CG 3.47Å; N2734-L2738 PolarHBondContact O-N 3.45Å; L2738-K2740 VanDerWaalsContact C-N 3.35Å; L2738-K2740 PolarHBondContact O-N 3.07Å; L2738-H2742 WeakPolarHBondContact O-CB 3.39Å; L2738-H2742 PolarHBondContact O-N 3.25Å
2739N80.3Confident86Confident78 Ų7864.4 Ų64.442%0.41731%0.309SS..Hα-helixtrans-69.6-25.8-179.2-72.3-15.1000114.3M2329 T2735 E2737M2329-N2739 WeakPolarHBondContact CG-OD1 3.39Å; T2735-N2739 VanDerWaalsContact O-CB 3.31Å; T2735-N2739 WeakPolarHBondContact O-CB 3.36Å; T2735-N2739 PolarHBondContact O-N 3.47Å; T2735-N2739 PolarHBondContact O-ND2 3.08Å; E2737-N2739 VanDerWaalsContact C-N 3.31Å; E2737-N2739 PolarHBondContact O-N 3.18Å
2740K85.4Confident86.1Confident117 Ų11761 Ų6151%0.50930%0.297SS..Hα-helixtrans-87.3-30.1178-71.2164.7-166.9163.90113E2736 E2737 L2738 R2750E2736-K2740 WeakPolarHBondContact O-CB 3.33Å; E2736-K2740 WeakPolarHBondContact O-CD 3.2Å; E2736-K2740 WeakPolarHBondContact O-CG 3.5Å; E2736-K2740 PolarHBondContact O-N 3.01Å; E2736-K2740 VanDerWaalsContact O-N 3.09Å; E2736-K2740 IonicContact OE2-NZ 3.18Å; E2736-K2740 PolarHBondContact OE2-NZ 3.02Å; E2737-K2740 PolarHBondContact O-N 3.34Å; L2738-K2740 VanDerWaalsContact C-N 3.35Å; L2738-K2740 PolarHBondContact O-N 3.07Å; K2740-R2750 PolarHBondContact O-NE 3.5Å; K2740-R2750 PolarHBondContact O-NH2 3.37Å
2741N87.9Confident86Confident42 Ų4259.2 Ų59.223%0.22530%0.295CS..Hα-helixtrans-112-13.7-169-65.7-18.4000114.9E2737 H2749 R2750E2737-N2741 VanDerWaalsContact O-CB 3.32Å; E2737-N2741 WeakPolarHBondContact O-CB 3.49Å; E2737-N2741 PolarHBondContact O-N 3.34Å; N2741-H2749 CarbonylContact O-C 3.43Å; N2741-H2749 WeakPolarHBondContact O-CA 3.19Å; N2741-H2749 PolarHBondContact O-CD2 3.32Å; N2741-H2749 VanDerWaalsContact O-CD2 3.29Å; N2741-R2750 PolarHBondContact O-N 3.08Å
2742H87Confident86Confident54 Ų5457 Ų5725%0.2529%0.291CS..BIsolated β-bridgetrans-118.4136.7177-6476.9000111.6L2738 C2744 L2748 H2749L2738-H2742 WeakPolarHBondContact O-CB 3.39Å; L2738-H2742 PolarHBondContact O-N 3.25Å; H2742-C2744 PolarHBondContact O-N 2.94Å; H2742-L2748 WeakPolarHBondContact CA-O 3.31Å; H2742-H2749 AromaticContact CE1-CD2 3.55Å; H2742-H2749 AromaticContact ND1-CD2 3.96Å; H2742-H2749 AromaticContact NE2-CD2 3.72Å
2743C87.4Confident86.2Confident1 Ų151.7 Ų51.71%0.00727%0.268CS..  trans-70.9129.9173.9177.70000110.4V2745 C2746 G2747 L2748 F2760 V2764 H2768C2743-V2745 VanDerWaalsContact C-N 3.27Å; C2743-V2745 PolarHBondContact O-N 3.18Å; C2743-C2746 VanDerWaalsContact CB-SG 3.54Å; C2743-G2747 VanDerWaalsContact O-CA 3.25Å; C2743-G2747 WeakPolarHBondContact O-CA 3.45Å; C2743-G2747 PolarHBondContact O-N 2.9Å; C2743-L2748 PolarHBondContact N-O 2.72Å; C2743-F2760 HydrophobicContact CB-CE2 4.03Å; C2743-F2760 HydrophobicContact CB-CZ 4.4Å; C2743-V2764 HydrophobicContact CB-CG2 4.16Å; C2743-H2768 VanDerWaalsContact SG-CB 3.54Å
2744C81.7Confident85.9Confident31 Ų3152.2 Ų52.221%0.20928%0.275CS..THydrogen-bonded Turntrans-65.4-27.1-177.4-177.70000113.8M2329 H2742 V2770M2329-C2744 HydrophobicContact CE-CB 3.9Å; H2742-C2744 PolarHBondContact O-N 2.94Å; C2744-V2770 HydrophobicContact CB-CG2 3.53Å
2745V85.2Confident85.5Confident13 Ų1357.8 Ų57.88%0.07930%0.298CS..THydrogen-bonded Turntrans-87.5-57.8-176-178.70000110.9C2743 H2768 V2770 Y2773 I2807 P2808C2743-V2745 VanDerWaalsContact C-N 3.27Å; C2743-V2745 PolarHBondContact O-N 3.18Å; V2745-H2768 HydrophobicContact CB-CB 3.95Å; V2745-H2768 HydrophobicContact CG2-CB 4.06Å; V2745-H2768 VanDerWaalsContact CG2-O 3.24Å; V2745-H2768 WeakPolarHBondContact CG2-O 3.46Å; V2745-V2770 HydrophobicContact CG2-CG2 4.41Å; V2745-Y2773 HydrophobicContact CB-CE2 4.33Å; V2745-Y2773 HydrophobicContact CG1-CD2 4.38Å; V2745-Y2773 HydrophobicContact CG1-CE1 4.12Å; V2745-Y2773 HydrophobicContact CG1-CE2 3.75Å; V2745-Y2773 HydrophobicContact CG2-CD2 3.85Å; V2745-Y2773 HydrophobicContact CG2-CE2 3.69Å; V2745-I2807 HydrophobicContact CG1-CG2 3.66Å; V2745-P2808 HydrophobicContact CG1-CG 4.18Å
2746C87.1Confident85.3Confident4 Ų456.5 Ų56.53%0.02729%0.291CS..THydrogen-bonded Turntrans-90.5-16.4-176.561.30000115.4C2743 L2748 H2768 P2808 R2810C2743-C2746 VanDerWaalsContact CB-SG 3.54Å; C2746-L2748 HydrophobicContact CB-CD1 4.45Å; C2746-L2748 HydrophobicContact CB-CG 4.29Å; C2746-L2748 PolarHBondContact O-N 3.2Å; C2746-H2768 WeakPolarHBondContact CB-ND1 3.32Å; C2746-H2768 PolarHBondContact SG-ND1 3.35Å; C2746-H2768 VanDerWaalsContact SG-ND1 3.36Å; C2746-P2808 WeakPolarHBondContact CA-O 3.4Å; C2746-R2810 WeakPolarHBondContact O-CA 3.46Å; C2746-R2810 PolarHBondContact O-N 3.5Å
2747G85.1Confident84.8Confident11 Ų1161.1 Ų61.111%0.11332%0.318CS..  trans72.47.7-17500000114.6C2743C2743-G2747 VanDerWaalsContact O-CA 3.25Å; C2743-G2747 WeakPolarHBondContact O-CA 3.45Å; C2743-G2747 PolarHBondContact O-N 2.9Å
2748L88.3Confident84.4Confident27 Ų2758.1 Ų58.114%0.14131%0.307CS..  trans-71140.6175.4-67.8173.8000111.1H2742 C2743 C2746 F2753 R2810 A2812 L2815H2742-L2748 WeakPolarHBondContact CA-O 3.31Å; C2743-L2748 PolarHBondContact N-O 2.72Å; C2746-L2748 HydrophobicContact CB-CD1 4.45Å; C2746-L2748 HydrophobicContact CB-CG 4.29Å; C2746-L2748 PolarHBondContact O-N 3.2Å; L2748-F2753 HydrophobicContact CB-CE2 3.94Å; L2748-F2753 HydrophobicContact CD1-CE2 4.16Å; L2748-F2753 HydrophobicContact CD1-CZ 3.98Å; L2748-R2810 HydrophobicContact CD2-CB 4.47Å; L2748-A2812 HydrophobicContact CD1-CB 4.2Å; L2748-L2815 HydrophobicContact CD1-CD1 3.7Å
2749H89.5Confident84.5Confident72 Ų7258 Ų5833%0.33331%0.311SS..BIsolated β-bridgetrans-77.8150.9174.5-175.1-110.3000111.3N2741 H2742 S2751 A2752N2741-H2749 CarbonylContact O-C 3.43Å; N2741-H2749 WeakPolarHBondContact O-CA 3.19Å; N2741-H2749 PolarHBondContact O-CD2 3.32Å; N2741-H2749 VanDerWaalsContact O-CD2 3.29Å; H2742-H2749 AromaticContact CE1-CD2 3.55Å; H2742-H2749 AromaticContact ND1-CD2 3.96Å; H2742-H2749 AromaticContact NE2-CD2 3.72Å; H2749-S2751 PolarHBondContact ND1-N 3.06Å; H2749-S2751 PolarHBondContact ND1-OG 2.94Å; H2749-S2751 PolarHBondContact O-N 3.04Å; H2749-S2751 VanDerWaalsContact O-N 3.13Å; H2749-A2752 VanDerWaalsContact O-CB 3.3Å; H2749-A2752 WeakPolarHBondContact O-CB 3.46Å; H2749-A2752 PolarHBondContact O-N 3.46Å
2750R90.2Very high84.9Confident76 Ų7654.9 Ų54.929%0.28729%0.293SS..G310 helixtrans-47.6-42.8179.4-178.5176.6-74.3-91.6-3.2112.6K2740 N2741 A2752 F2753 F2760 D2761K2740-R2750 PolarHBondContact O-NE 3.5Å; K2740-R2750 PolarHBondContact O-NH2 3.37Å; N2741-R2750 PolarHBondContact O-N 3.08Å; R2750-A2752 PolarHBondContact O-N 2.67Å; R2750-A2752 VanDerWaalsContact O-N 3.15Å; R2750-F2753 PolarHBondContact O-N 3.02Å; R2750-F2753 VanDerWaalsContact O-N 3.11Å; R2750-F2760 HydrophobicContact CB-CB 4.48Å; R2750-F2760 HydrophobicContact CB-CD1 4.23Å; R2750-F2760 HydrophobicContact CB-CD2 4.12Å; R2750-F2760 HydrophobicContact CB-CE1 4.45Å; R2750-F2760 HydrophobicContact CB-CE2 4.34Å; R2750-F2760 HydrophobicContact CB-CG 4.02Å; R2750-F2760 HydrophobicContact CB-CZ 4.49Å; R2750-F2760 HydrophobicContact CG-CB 3.9Å; R2750-F2760 HydrophobicContact CG-CD1 4.04Å; R2750-F2760 HydrophobicContact CG-CD2 4.45Å; R2750-F2760 HydrophobicContact CG-CG 3.88Å; R2750-F2760 VanDerWaalsContact CZ-CD1 3.4Å; R2750-D2761 IonicContact CZ-OD1 2.62Å; R2750-D2761 IonicContact CZ-OD2 2.72Å; R2750-D2761 VanDerWaalsContact NH1-CG 3.34Å; R2750-D2761 IonicContact NH1-OD1 2.83Å; R2750-D2761 PolarHBondContact NH1-OD1 2.86Å; R2750-D2761 IonicContact NH1-OD2 2.79Å; R2750-D2761 PolarHBondContact NH1-OD2 3.34Å; R2750-D2761 IonicContact NH2-OD1 3.76Å; R2750-D2761 PolarHBondContact NH2-OD1 2.79Å; R2750-D2761 IonicContact NH2-OD2 3.22Å
2751S89.9Confident85Confident60 Ų6052.8 Ų52.842%0.4229%0.288SS..G310 helixtrans-63.9-18-178.966.80000115.4H2749 F2753 D2754H2749-S2751 PolarHBondContact ND1-N 3.06Å; H2749-S2751 PolarHBondContact ND1-OG 2.94Å; H2749-S2751 PolarHBondContact O-N 3.04Å; H2749-S2751 VanDerWaalsContact O-N 3.13Å; S2751-F2753 PolarHBondContact O-N 3.34Å; S2751-D2754 WeakPolarHBondContact CA-OD2 3.4Å; S2751-D2754 PolarHBondContact O-N 3.32Å
2752A86.5Confident84.8Confident39 Ų3953.1 Ų53.132%0.32229%0.29SS..G310 helixtrans-66.6-20.1175.200000112.4H2749 R2750 L2815H2749-A2752 VanDerWaalsContact O-CB 3.3Å; H2749-A2752 WeakPolarHBondContact O-CB 3.46Å; H2749-A2752 PolarHBondContact O-N 3.46Å; R2750-A2752 PolarHBondContact O-N 2.67Å; R2750-A2752 VanDerWaalsContact O-N 3.15Å; A2752-L2815 HydrophobicContact CB-CD1 4.45Å
2753F87.2Confident84.8Confident4 Ų450.7 Ų50.72%0.01828%0.278CS..G310 helixtrans-98.5-10-177.2-65.6-91.9000113.6L2748 R2750 S2751 H2755 S2756 F2760 H2763 A2812 L2815L2748-F2753 HydrophobicContact CB-CE2 3.94Å; L2748-F2753 HydrophobicContact CD1-CE2 4.16Å; L2748-F2753 HydrophobicContact CD1-CZ 3.98Å; R2750-F2753 PolarHBondContact O-N 3.02Å; R2750-F2753 VanDerWaalsContact O-N 3.11Å; S2751-F2753 PolarHBondContact O-N 3.34Å; F2753-H2755 PolarHBondContact O-N 2.99Å; F2753-S2756 WeakPolarHBondContact O-CB 3.42Å; F2753-S2756 PolarHBondContact O-N 3.44Å; F2753-S2756 PolarHBondContact O-OG 2.79Å; F2753-F2760 HydrophobicContact CB-CB 4.28Å; F2753-F2760 HydrophobicContact CD2-CB 4.41Å; F2753-F2760 AromaticContact CD2-CD2 3.74Å; F2753-F2760 HydrophobicContact CD2-CD2 3.74Å; F2753-F2760 HydrophobicContact CE2-CD2 4Å; F2753-F2760 HydrophobicContact CG-CB 4.47Å; F2753-H2763 HydrophobicContact CD1-CB 4.29Å; F2753-H2763 HydrophobicContact CE1-CB 3.96Å; F2753-H2763 AromaticContact CE1-CD2 3.89Å; F2753-H2763 AromaticContact CE1-CE1 3.99Å; F2753-H2763 AromaticContact CE1-CG 3.54Å; F2753-H2763 AromaticContact CE1-ND1 3.62Å; F2753-H2763 AromaticContact CE2-CD2 3.92Å; F2753-H2763 HydrophobicContact CZ-CB 4.35Å; F2753-H2763 AromaticContact CZ-CD2 3.41Å; F2753-H2763 VanDerWaalsContact CZ-CD2 3.41Å; F2753-H2763 WeakPolarHBondContact CZ-CD2 3.42Å; F2753-H2763 AromaticContact CZ-CE1 3.63Å; F2753-H2763 AromaticContact CZ-CG 3.57Å; F2753-H2763 AromaticContact CZ-ND1 3.71Å; F2753-H2763 AromaticContact CZ-NE2 3.47Å; F2753-H2763 WeakPolarHBondContact CZ-NE2 3.38Å; F2753-A2812 HydrophobicContact CE1-CB 4.47Å; F2753-A2812 HydrophobicContact CZ-CB 4.33Å; F2753-L2815 HydrophobicContact CD1-CD2 4.48Å; F2753-L2815 HydrophobicContact CE1-CD1 4.33Å; F2753-L2815 HydrophobicContact CE1-CG 4.36Å; F2753-L2815 HydrophobicContact CZ-CD1 4.27Å
2754D83.1Confident84.8Confident115 Ų11552.7 Ų52.762%0.61529%0.29SS*.THydrogen-bonded Turntrans-61.5-28.6-176.2-66.4-15.1000113.2S2751S2751-D2754 WeakPolarHBondContact CA-OD2 3.4Å; S2751-D2754 PolarHBondContact O-N 3.32Å
2755H79.6Confident84.9Confident187 Ų18755.8 Ų55.887%0.86631%0.305SS*.THydrogen-bonded Turntrans-91.8-4.9175.3-60.1-51.2000113.7F2753F2753-H2755 PolarHBondContact O-N 2.99Å
2756S76.5Confident84.7Confident18 Ų1856.7 Ų56.713%0.12631%0.31CS..SBendtrans-93.5158.7-178.583.30000111.6F2753 T2758F2753-S2756 WeakPolarHBondContact O-CB 3.42Å; F2753-S2756 PolarHBondContact O-N 3.44Å; F2753-S2756 PolarHBondContact O-OG 2.79Å; S2756-T2758 PolarHBondContact O-N 3.48Å; S2756-T2758 VanDerWaalsContact O-N 3.12Å; S2756-T2758 PolarHBondContact OG-N 2.96Å; S2756-T2758 PolarHBondContact OG-O 3.35Å; S2756-T2758 PolarHBondContact OG-OG1 3.13Å
2757N74.1Confident84.6Confident176 Ų17656.7 Ų56.794%0.94131%0.31SS*.SBendtrans-72.43.6173.7-74.1-42.1000113.8
2758T76.8Confident84.8Confident42 Ų4256.2 Ų56.226%0.25831%0.305SS..SBendtrans-121.7127.8-17445.70000110.7S2756 T2814S2756-T2758 PolarHBondContact O-N 3.48Å; S2756-T2758 VanDerWaalsContact O-N 3.12Å; S2756-T2758 PolarHBondContact OG-N 2.96Å; S2756-T2758 PolarHBondContact OG-O 3.35Å; S2756-T2758 PolarHBondContact OG-OG1 3.13Å; T2758-T2814 HydrophobicContact CG2-CG2 3.9Å
2759S85.5Confident84.8Confident52 Ų5256.5 Ų56.536%0.36431%0.306SS..  trans-68.7148.8175.380.50000110.9D2761 D2762 H2763S2759-D2761 PolarHBondContact O-N 2.77Å; S2759-D2762 PolarHBondContact O-N 3.03Å; S2759-D2762 WeakPolarHBondContact OG-CB 3.46Å; S2759-D2762 PolarHBondContact OG-N 3.15Å; S2759-D2762 PolarHBondContact OG-OD2 3.28Å; S2759-H2763 PolarHBondContact O-N 3.48Å
2760F88.9Confident84.6Confident12 Ų1253.9 Ų53.95%0.05330%0.295CS..Hα-helixtrans-58.7-37.7174.4173.9-95.5000112C2743 R2750 F2753 H2763 V2764C2743-F2760 HydrophobicContact CB-CE2 4.03Å; C2743-F2760 HydrophobicContact CB-CZ 4.4Å; R2750-F2760 HydrophobicContact CB-CB 4.48Å; R2750-F2760 HydrophobicContact CB-CD1 4.23Å; R2750-F2760 HydrophobicContact CB-CD2 4.12Å; R2750-F2760 HydrophobicContact CB-CE1 4.45Å; R2750-F2760 HydrophobicContact CB-CE2 4.34Å; R2750-F2760 HydrophobicContact CB-CG 4.02Å; R2750-F2760 HydrophobicContact CB-CZ 4.49Å; R2750-F2760 HydrophobicContact CG-CB 3.9Å; R2750-F2760 HydrophobicContact CG-CD1 4.04Å; R2750-F2760 HydrophobicContact CG-CD2 4.45Å; R2750-F2760 HydrophobicContact CG-CG 3.88Å; R2750-F2760 VanDerWaalsContact CZ-CD1 3.4Å; F2753-F2760 HydrophobicContact CB-CB 4.28Å; F2753-F2760 HydrophobicContact CD2-CB 4.41Å; F2753-F2760 AromaticContact CD2-CD2 3.74Å; F2753-F2760 HydrophobicContact CD2-CD2 3.74Å; F2753-F2760 HydrophobicContact CE2-CD2 4Å; F2753-F2760 HydrophobicContact CG-CB 4.47Å; F2760-H2763 WeakPolarHBondContact O-CB 3.28Å; F2760-H2763 PolarHBondContact O-N 3.28Å; F2760-V2764 HydrophobicContact CD1-CG2 4.15Å; F2760-V2764 HydrophobicContact CD2-CG2 4.37Å; F2760-V2764 HydrophobicContact CE1-CG2 3.74Å; F2760-V2764 HydrophobicContact CE2-CG2 3.99Å; F2760-V2764 HydrophobicContact CG-CG2 4.48Å; F2760-V2764 HydrophobicContact CZ-CG2 3.66Å; F2760-V2764 WeakPolarHBondContact O-CG2 3.5Å; F2760-V2764 PolarHBondContact O-N 2.97Å
2761D87.4Confident84.6Confident73 Ų7351.7 Ų51.739%0.3929%0.287SS..Hα-helixtrans-71.5-33.6-179.4-57.5-58.9000111.7R2750 S2759 N2765R2750-D2761 IonicContact CZ-OD1 2.62Å; R2750-D2761 IonicContact CZ-OD2 2.72Å; R2750-D2761 VanDerWaalsContact NH1-CG 3.34Å; R2750-D2761 IonicContact NH1-OD1 2.83Å; R2750-D2761 PolarHBondContact NH1-OD1 2.86Å; R2750-D2761 IonicContact NH1-OD2 2.79Å; R2750-D2761 PolarHBondContact NH1-OD2 3.34Å; R2750-D2761 IonicContact NH2-OD1 3.76Å; R2750-D2761 PolarHBondContact NH2-OD1 2.79Å; R2750-D2761 IonicContact NH2-OD2 3.22Å; S2759-D2761 PolarHBondContact O-N 2.77Å; D2761-N2765 VanDerWaalsContact O-CB 3.28Å; D2761-N2765 WeakPolarHBondContact O-CB 3.44Å; D2761-N2765 VanDerWaalsContact O-CG 3.31Å; D2761-N2765 PolarHBondContact O-N 2.62Å; D2761-N2765 PolarHBondContact O-ND2 2.93Å
2762D84.1Confident84.6Confident49 Ų4950.3 Ų50.326%0.26227%0.274SS..Hα-helixtrans-66.4-42.2169-69.2-49.1000111.4N2265 S2759 V2764 N2765 V2766N2265-D2762 PolarHBondContact ND2-OD1 3.39Å; N2265-D2762 PolarHBondContact OD1-OD1 3.37Å; S2759-D2762 PolarHBondContact O-N 3.03Å; S2759-D2762 WeakPolarHBondContact OG-CB 3.46Å; S2759-D2762 PolarHBondContact OG-N 3.15Å; S2759-D2762 PolarHBondContact OG-OD2 3.28Å; D2762-V2764 PolarHBondContact O-N 3.34Å; D2762-N2765 PolarHBondContact O-N 3.01Å; D2762-V2766 WeakPolarHBondContact O-CB 3.4Å; D2762-V2766 PolarHBondContact O-N 3.09Å
2763H87.8Confident84.7Confident3 Ų348.8 Ų48.81%0.01426%0.26CS..Iπ-helixtrans-57.7-49.3176.3168.376.9000111.7F2753 S2759 F2760 D2767 H2768F2753-H2763 HydrophobicContact CD1-CB 4.29Å; F2753-H2763 HydrophobicContact CE1-CB 3.96Å; F2753-H2763 AromaticContact CE1-CD2 3.89Å; F2753-H2763 AromaticContact CE1-CE1 3.99Å; F2753-H2763 AromaticContact CE1-CG 3.54Å; F2753-H2763 AromaticContact CE1-ND1 3.62Å; F2753-H2763 AromaticContact CE2-CD2 3.92Å; F2753-H2763 HydrophobicContact CZ-CB 4.35Å; F2753-H2763 AromaticContact CZ-CD2 3.41Å; F2753-H2763 VanDerWaalsContact CZ-CD2 3.41Å; F2753-H2763 WeakPolarHBondContact CZ-CD2 3.42Å; F2753-H2763 AromaticContact CZ-CE1 3.63Å; F2753-H2763 AromaticContact CZ-CG 3.57Å; F2753-H2763 AromaticContact CZ-ND1 3.71Å; F2753-H2763 AromaticContact CZ-NE2 3.47Å; F2753-H2763 WeakPolarHBondContact CZ-NE2 3.38Å; S2759-H2763 PolarHBondContact O-N 3.48Å; F2760-H2763 WeakPolarHBondContact O-CB 3.28Å; F2760-H2763 PolarHBondContact O-N 3.28Å; H2763-D2767 PolarHBondContact O-N 3.43Å; H2763-H2768 AromaticContact CE1-CD2 3.56Å; H2763-H2768 AromaticContact CE1-CE1 3.49Å; H2763-H2768 PolarHBondContact CE1-CE1 3.33Å; H2763-H2768 VanDerWaalsContact CE1-CE1 3.49Å; H2763-H2768 AromaticContact CE1-CG 3.32Å; H2763-H2768 AromaticContact CE1-ND1 3.3Å; H2763-H2768 PolarHBondContact CE1-ND1 3.24Å; H2763-H2768 VanDerWaalsContact CE1-ND1 3.3Å; H2763-H2768 AromaticContact CE1-NE2 3.66Å; H2763-H2768 AromaticContact NE2-CE1 3.95Å; H2763-H2768 AromaticContact NE2-CG 3.55Å; H2763-H2768 AromaticContact NE2-ND1 3.36Å; H2763-H2768 PolarHBondContact NE2-ND1 3.27Å; H2763-H2768 PolarHBondContact O-N 2.88Å
2764V87Confident84.8Confident43 Ų4348.6 Ų48.626%0.26126%0.259SS..Iπ-helixtrans-67.5-39179.4172.80000112.2C2743 F2760 D2762 H2768 N2769C2743-V2764 HydrophobicContact CB-CG2 4.16Å; F2760-V2764 HydrophobicContact CD1-CG2 4.15Å; F2760-V2764 HydrophobicContact CD2-CG2 4.37Å; F2760-V2764 HydrophobicContact CE1-CG2 3.74Å; F2760-V2764 HydrophobicContact CE2-CG2 3.99Å; F2760-V2764 HydrophobicContact CG-CG2 4.48Å; F2760-V2764 HydrophobicContact CZ-CG2 3.66Å; F2760-V2764 WeakPolarHBondContact O-CG2 3.5Å; F2760-V2764 PolarHBondContact O-N 2.97Å; D2762-V2764 PolarHBondContact O-N 3.34Å; V2764-H2768 CarbonylContact O-C 3.56Å; V2764-N2769 WeakPolarHBondContact O-CA 3.33Å; V2764-N2769 PolarHBondContact O-N 3.27Å
2765N84.3Confident85.1Confident95 Ų9544 Ų4451%0.50823%0.233SC..Iπ-helixtrans-79.3-27.9-176.2-74.5-52.8000114.1D2761 D2762 N2769D2761-N2765 VanDerWaalsContact O-CB 3.28Å; D2761-N2765 WeakPolarHBondContact O-CB 3.44Å; D2761-N2765 VanDerWaalsContact O-CG 3.31Å; D2761-N2765 PolarHBondContact O-N 2.62Å; D2761-N2765 PolarHBondContact O-ND2 2.93Å; D2762-N2765 PolarHBondContact O-N 3.01Å; N2765-N2769 WeakPolarHBondContact O-CB 3.47Å; N2765-N2769 PolarHBondContact O-ND2 3.37Å
2766V80.7Confident85.7Confident32 Ų3235 Ų3519%0.19419%0.192CC..Iπ-helixtrans-114.1-56.5-172.1178.90000112.7N2265 Q2291 D2762N2265-V2766 HydrophobicContact CB-CG2 4.17Å; N2265-V2766 WeakPolarHBondContact ND2-CG2 3.47Å; N2265-V2766 WeakPolarHBondContact OD1-CG2 2.89Å; Q2291-V2766 VanDerWaalsContact NE2-C 3.28Å; Q2291-V2766 VanDerWaalsContact NE2-CG1 3.34Å; Q2291-V2766 PolarHBondContact NE2-O 3.02Å; D2762-V2766 WeakPolarHBondContact O-CB 3.4Å; D2762-V2766 PolarHBondContact O-N 3.09Å
2767D83.9Confident86.3Confident5 Ų534.3 Ų34.33%0.02719%0.187CC..Iπ-helixtrans-81.7-45.9-171.5-70.7-6.7000110.7R2201 Q2291 R2303 H2763R2201-D2767 IonicContact CZ-OD2 2.69Å; R2201-D2767 IonicContact NH1-OD1 3.65Å; R2201-D2767 PolarHBondContact NH1-OD1 3.22Å; R2201-D2767 IonicContact NH1-OD2 3.87Å; R2201-D2767 IonicContact NH2-OD1 2.69Å; R2201-D2767 IonicContact NH2-OD2 2.81Å; R2201-D2767 PolarHBondContact NH2-OD2 3.37Å; Q2291-D2767 PolarHBondContact NE2-OD1 2.97Å; R2303-D2767 IonicContact CZ-OD1 2.84Å; R2303-D2767 VanDerWaalsContact CZ-OD1 3.3Å; R2303-D2767 IonicContact CZ-OD2 3.78Å; R2303-D2767 IonicContact NH1-OD1 2.82Å; R2303-D2767 PolarHBondContact NH1-OD1 2.95Å; R2303-D2767 IonicContact NH1-OD2 2.63Å; R2303-D2767 IonicContact NH2-OD1 3.81Å; R2303-D2767 PolarHBondContact NH2-OD1 2.99Å; R2303-D2767 VanDerWaalsContact NH2-OD1 3.14Å; R2303-D2767 IonicContact NH2-OD2 3.61Å; R2303-D2767 PolarHBondContact NH2-OD2 2.92Å; H2763-D2767 PolarHBondContact O-N 3.43Å
2768H89.1Confident86.9Confident1 Ų126 Ų261%0.00514%0.142CC..SBendtrans-116.341-175.2-77.3-157000112.9E2293 C2743 V2745 C2746 H2763 V2764 V2770E2293-H2768 IonicContact OE2-CD2 2.89Å; E2293-H2768 IonicContact OE2-CE1 3.35Å; E2293-H2768 IonicContact OE2-NE2 2.96Å; E2293-H2768 PolarHBondContact OE2-NE2 3.23Å; C2743-H2768 VanDerWaalsContact SG-CB 3.54Å; V2745-H2768 HydrophobicContact CB-CB 3.95Å; V2745-H2768 HydrophobicContact CG2-CB 4.06Å; V2745-H2768 VanDerWaalsContact CG2-O 3.24Å; V2745-H2768 WeakPolarHBondContact CG2-O 3.46Å; C2746-H2768 WeakPolarHBondContact CB-ND1 3.32Å; C2746-H2768 PolarHBondContact SG-ND1 3.35Å; C2746-H2768 VanDerWaalsContact SG-ND1 3.36Å; H2763-H2768 AromaticContact CE1-CD2 3.56Å; H2763-H2768 AromaticContact CE1-CE1 3.49Å; H2763-H2768 PolarHBondContact CE1-CE1 3.33Å; H2763-H2768 VanDerWaalsContact CE1-CE1 3.49Å; H2763-H2768 AromaticContact CE1-CG 3.32Å; H2763-H2768 AromaticContact CE1-ND1 3.3Å; H2763-H2768 PolarHBondContact CE1-ND1 3.24Å; H2763-H2768 VanDerWaalsContact CE1-ND1 3.3Å; H2763-H2768 AromaticContact CE1-NE2 3.66Å; H2763-H2768 AromaticContact NE2-CE1 3.95Å; H2763-H2768 AromaticContact NE2-CG 3.55Å; H2763-H2768 AromaticContact NE2-ND1 3.36Å; H2763-H2768 PolarHBondContact NE2-ND1 3.27Å; H2763-H2768 PolarHBondContact O-N 2.88Å; V2764-H2768 CarbonylContact O-C 3.56Å; H2768-V2770 PolarHBondContact O-N 2.64Å
2769N87.9Confident87.5Confident32 Ų3225.6 Ų25.617%0.17114%0.136CC..  trans-73.8117.5178.6-172.4-37.6000111.9V2764 N2765 W2771 H2772 Y2773V2764-N2769 WeakPolarHBondContact O-CA 3.33Å; V2764-N2769 PolarHBondContact O-N 3.27Å; N2765-N2769 WeakPolarHBondContact O-CB 3.47Å; N2765-N2769 PolarHBondContact O-ND2 3.37Å; N2769-W2771 PolarHBondContact O-N 3.39Å; N2769-W2771 VanDerWaalsContact O-N 3.17Å; N2769-W2771 PolarHBondContact OD1-N 3.29Å; N2769-H2772 HydrophobicContact CB-CB 4.31Å; N2769-H2772 WeakPolarHBondContact O-CB 3.2Å; N2769-H2772 PolarHBondContact O-N 2.83Å; N2769-Y2773 WeakPolarHBondContact O-CD2 3.29Å; N2769-Y2773 PolarHBondContact O-N 2.81Å
2770V87.3Confident87.6Confident17 Ų1723.5 Ų23.510%0.10312%0.121CC..Hα-helixtrans-55.2-37-176.6-172.90000112.8L2324 L2339 C2744 V2745 H2768 H2772 Y2773 I2774L2324-V2770 HydrophobicContact CD2-CB 4.37Å; L2324-V2770 HydrophobicContact CD2-CG1 3.93Å; L2339-V2770 HydrophobicContact CD1-CG1 3.94Å; L2339-V2770 HydrophobicContact CD2-CG1 4Å; C2744-V2770 HydrophobicContact CB-CG2 3.53Å; V2745-V2770 HydrophobicContact CG2-CG2 4.41Å; H2768-V2770 PolarHBondContact O-N 2.64Å; V2770-H2772 VanDerWaalsContact C-N 3.32Å; V2770-H2772 PolarHBondContact O-N 3.34Å; V2770-Y2773 PolarHBondContact O-N 2.98Å; V2770-Y2773 VanDerWaalsContact O-N 3.17Å; V2770-I2774 HydrophobicContact CG1-CD1 4.3Å; V2770-I2774 PolarHBondContact O-N 3.03Å; V2770-I2774 VanDerWaalsContact O-N 3.15Å
2771W88.4Confident87.3Confident31 Ų3127.9 Ų27.912%0.11714%0.14CC..Hα-helixtrans-68.2-32.5178.4-66.4103.7000112.4L2315 K2320 L2323 L2324 I2346 N2769 Y2773 I2774 Y2775L2315-W2771 HydrophobicContact CD2-CE3 4.14Å; L2315-W2771 HydrophobicContact CD2-CH2 3.99Å; L2315-W2771 HydrophobicContact CD2-CZ3 3.47Å; L2315-W2771 VanDerWaalsContact CD2-CZ3 3.47Å; K2320-W2771 HydrophobicContact CB-CD2 4.37Å; K2320-W2771 HydrophobicContact CB-CH2 3.86Å; K2320-W2771 HydrophobicContact CB-CZ2 3.27Å; K2320-W2771 HydrophobicContact CD-CD2 3.95Å; K2320-W2771 HydrophobicContact CD-CE3 4.35Å; K2320-W2771 HydrophobicContact CD-CG 4.33Å; K2320-W2771 HydrophobicContact CD-CZ2 4.36Å; K2320-W2771 HydrophobicContact CG-CD2 3.99Å; K2320-W2771 HydrophobicContact CG-CE3 4.14Å; K2320-W2771 HydrophobicContact CG-CH2 3.79Å; K2320-W2771 HydrophobicContact CG-CZ2 3.59Å; K2320-W2771 HydrophobicContact CG-CZ3 4.04Å; K2320-W2771 WeakPolarHBondContact O-CZ2 3.31Å; L2323-W2771 HydrophobicContact CB-CH2 4.24Å; L2323-W2771 HydrophobicContact CD1-CH2 4.25Å; L2324-W2771 HydrophobicContact CD1-CZ2 3.85Å; L2324-W2771 HydrophobicContact CD2-CZ2 4.39Å; L2324-W2771 HydrophobicContact CG-CZ2 3.78Å; I2346-W2771 HydrophobicContact CD1-CH2 4.43Å; I2346-W2771 HydrophobicContact CD1-CZ3 4.29Å; N2769-W2771 PolarHBondContact O-N 3.39Å; N2769-W2771 VanDerWaalsContact O-N 3.17Å; N2769-W2771 PolarHBondContact OD1-N 3.29Å; W2771-Y2773 VanDerWaalsContact C-N 3.28Å; W2771-Y2773 PolarHBondContact O-N 3.29Å; W2771-I2774 HydrophobicContact CD2-CD1 4.27Å; W2771-I2774 HydrophobicContact CE3-CB 4.43Å; W2771-I2774 HydrophobicContact CE3-CD1 3.63Å; W2771-I2774 HydrophobicContact CH2-CD1 4Å; W2771-I2774 HydrophobicContact CZ3-CD1 3.49Å; W2771-I2774 VanDerWaalsContact CZ3-CD1 3.49Å; W2771-I2774 PolarHBondContact O-N 3Å; W2771-Y2775 HydrophobicContact CB-CE2 4.14Å; W2771-Y2775 HydrophobicContact CE3-CE1 4.14Å; W2771-Y2775 WeakPolarHBondContact O-CB 3.36Å; W2771-Y2775 WeakPolarHBondContact O-CD2 3.46Å; W2771-Y2775 PolarHBondContact O-N 3.22Å
2772H90.6Very high86.9Confident30 Ų3027.4 Ų27.414%0.13914%0.14CC..Hα-helixtrans-67.1-28173.8-60.9175.1000112.1A2290 Q2291 I2292 Y2306 N2769 V2770 F2776A2290-H2772 HydrophobicContact CB-CB 4.07Å; Q2291-H2772 WeakPolarHBondContact O-CB 3.46Å; Q2291-H2772 PolarHBondContact O-ND1 3.49Å; I2292-H2772 HydrophobicContact CG2-CB 3.61Å; I2292-H2772 WeakPolarHBondContact CG2-O 3.35Å; Y2306-H2772 PolarHBondContact OH-O 2.67Å; N2769-H2772 HydrophobicContact CB-CB 4.31Å; N2769-H2772 WeakPolarHBondContact O-CB 3.2Å; N2769-H2772 PolarHBondContact O-N 2.83Å; V2770-H2772 VanDerWaalsContact C-N 3.32Å; V2770-H2772 PolarHBondContact O-N 3.34Å; H2772-F2776 VanDerWaalsContact O-CB 3.29Å; H2772-F2776 WeakPolarHBondContact O-CB 3.47Å; H2772-F2776 PolarHBondContact O-N 3.05Å; H2772-F2776 VanDerWaalsContact O-N 3.15Å
2773Y89.6Confident86.8Confident7 Ų727.4 Ų27.43%0.02714%0.137CC..Hα-helixtrans-74.4-42.3172-71.5-94.4000111.6I2292 E2293 V2745 N2769 V2770 W2771 F2776 I2777 W2806 I2807I2292-Y2773 HydrophobicContact CB-CD1 4.47Å; I2292-Y2773 HydrophobicContact CB-CE1 4.02Å; I2292-Y2773 HydrophobicContact CB-CE2 4.19Å; I2292-Y2773 HydrophobicContact CG2-CD1 4.2Å; I2292-Y2773 HydrophobicContact CG2-CD2 3.9Å; I2292-Y2773 HydrophobicContact CG2-CE1 4.18Å; I2292-Y2773 HydrophobicContact CG2-CE2 3.85Å; I2292-Y2773 HydrophobicContact CG2-CG 4.06Å; E2293-Y2773 PolarHBondContact N-OH 3.49Å; E2293-Y2773 VanDerWaalsContact N-OH 3.12Å; E2293-Y2773 WeakPolarHBondContact O-CE1 3.23Å; E2293-Y2773 PolarHBondContact O-OH 3.07Å; V2745-Y2773 HydrophobicContact CB-CE2 4.33Å; V2745-Y2773 HydrophobicContact CG1-CD2 4.38Å; V2745-Y2773 HydrophobicContact CG1-CE1 4.12Å; V2745-Y2773 HydrophobicContact CG1-CE2 3.75Å; V2745-Y2773 HydrophobicContact CG2-CD2 3.85Å; V2745-Y2773 HydrophobicContact CG2-CE2 3.69Å; N2769-Y2773 WeakPolarHBondContact O-CD2 3.29Å; N2769-Y2773 PolarHBondContact O-N 2.81Å; V2770-Y2773 PolarHBondContact O-N 2.98Å; V2770-Y2773 VanDerWaalsContact O-N 3.17Å; W2771-Y2773 VanDerWaalsContact C-N 3.28Å; W2771-Y2773 PolarHBondContact O-N 3.29Å; Y2773-F2776 PolarHBondContact O-N 3.37Å; Y2773-I2777 WeakPolarHBondContact O-CD1 3.48Å; Y2773-I2777 WeakPolarHBondContact O-CG1 3.3Å; Y2773-I2777 PolarHBondContact O-N 3.09Å; Y2773-I2777 VanDerWaalsContact O-N 3.15Å; Y2773-W2806 AromaticContact CD1-CH2 3.99Å; Y2773-W2806 HydrophobicContact CD1-CH2 3.99Å; Y2773-W2806 AromaticContact CD1-CZ3 3.95Å; Y2773-W2806 HydrophobicContact CD1-CZ3 3.95Å; Y2773-W2806 HydrophobicContact CE1-CZ3 4.1Å; Y2773-I2807 HydrophobicContact CD1-CG1 4.41Å; Y2773-I2807 HydrophobicContact CE1-CG1 4.47Å
2774I88.1Confident86.1Confident1 Ų130.1 Ų30.11%0.00515%0.152CC..Hα-helixtrans-61.4-48.9176.2-64.6167.3000110.7L2339 I2343 I2346 V2770 W2771 F2776 I2777 I2778L2339-I2774 HydrophobicContact CD1-CD1 4.18Å; L2339-I2774 HydrophobicContact CD2-CG1 4.1Å; L2339-I2774 HydrophobicContact CG-CD1 4.47Å; L2339-I2774 HydrophobicContact CG-CG1 4.38Å; I2343-I2774 HydrophobicContact CG1-CG1 4.37Å; I2343-I2774 HydrophobicContact CG1-CG2 4.4Å; I2346-I2774 HydrophobicContact CD1-CD1 4.27Å; I2346-I2774 HydrophobicContact CG2-CG2 4.49Å; V2770-I2774 HydrophobicContact CG1-CD1 4.3Å; V2770-I2774 PolarHBondContact O-N 3.03Å; V2770-I2774 VanDerWaalsContact O-N 3.15Å; W2771-I2774 HydrophobicContact CD2-CD1 4.27Å; W2771-I2774 HydrophobicContact CE3-CB 4.43Å; W2771-I2774 HydrophobicContact CE3-CD1 3.63Å; W2771-I2774 HydrophobicContact CH2-CD1 4Å; W2771-I2774 HydrophobicContact CZ3-CD1 3.49Å; W2771-I2774 VanDerWaalsContact CZ3-CD1 3.49Å; W2771-I2774 PolarHBondContact O-N 3Å; I2774-F2776 VanDerWaalsContact C-N 3.27Å; I2774-F2776 PolarHBondContact O-N 3.22Å; I2774-I2777 PolarHBondContact O-N 3.47Å; I2774-I2778 HydrophobicContact CG2-CD1 4.05Å; I2774-I2778 WeakPolarHBondContact O-CG1 3.2Å; I2774-I2778 PolarHBondContact O-N 3.44Å
2775Y90.4Very high85.4Confident17 Ų1731.6 Ų31.67%0.06716%0.161CC..Hα-helixtrans-64.2-31.2179.3-63-16.3000112.5Y2306 I2308 C2312 K2320 M2350 W2771 I2778 Y2779Y2306-Y2775 WeakPolarHBondContact OH-CB 3.45Å; I2308-Y2775 HydrophobicContact CD1-CD2 4.22Å; I2308-Y2775 HydrophobicContact CD1-CE2 4.47Å; I2308-Y2775 HydrophobicContact CG1-CD2 4.37Å; I2308-Y2775 HydrophobicContact CG2-CD2 3.93Å; I2308-Y2775 HydrophobicContact CG2-CE2 4.34Å; I2308-Y2775 HydrophobicContact CG2-CG 4.36Å; C2312-Y2775 HydrophobicContact CB-CD1 3.61Å; C2312-Y2775 HydrophobicContact CB-CD2 4.42Å; C2312-Y2775 HydrophobicContact CB-CE1 3.64Å; C2312-Y2775 HydrophobicContact CB-CE2 4.44Å; C2312-Y2775 HydrophobicContact CB-CG 4.02Å; C2312-Y2775 VanDerWaalsContact SG-CD1 3.52Å; K2320-Y2775 VanDerWaalsContact CE-OH 3.24Å; K2320-Y2775 WeakPolarHBondContact CE-OH 3.28Å; K2320-Y2775 PolarHBondContact NZ-OH 2.72Å; M2350-Y2775 HydrophobicContact CE-CD1 4.39Å; M2350-Y2775 HydrophobicContact CE-CE1 3.95Å; W2771-Y2775 HydrophobicContact CB-CE2 4.14Å; W2771-Y2775 HydrophobicContact CE3-CE1 4.14Å; W2771-Y2775 WeakPolarHBondContact O-CB 3.36Å; W2771-Y2775 WeakPolarHBondContact O-CD2 3.46Å; W2771-Y2775 PolarHBondContact O-N 3.22Å; Y2775-I2778 PolarHBondContact O-N 3.16Å; Y2775-Y2779 WeakPolarHBondContact O-CB 3.49Å; Y2775-Y2779 PolarHBondContact O-N 3.3Å
2776F91.3Very high84.6Confident0 Ų030.7 Ų30.70%016%0.156CC..Hα-helixtrans-68.3-40.4175.3-175.5-111.6000111.6I2292 I2304 Y2306 H2772 Y2773 I2774 Y2779 L2780 E2792 I2795 W2806I2292-F2776 HydrophobicContact CD1-CB 3.93Å; I2292-F2776 HydrophobicContact CD1-CD1 3.45Å; I2292-F2776 VanDerWaalsContact CD1-CD1 3.45Å; I2292-F2776 HydrophobicContact CD1-CD2 3.87Å; I2292-F2776 HydrophobicContact CD1-CE1 3.84Å; I2292-F2776 HydrophobicContact CD1-CE2 4.23Å; I2292-F2776 HydrophobicContact CD1-CG 3.46Å; I2292-F2776 VanDerWaalsContact CD1-CG 3.46Å; I2292-F2776 HydrophobicContact CD1-CZ 4.21Å; I2304-F2776 HydrophobicContact CD1-CZ 4.16Å; I2304-F2776 HydrophobicContact CG2-CE2 3.99Å; Y2306-F2776 AromaticContact CD1-CD2 3.63Å; Y2306-F2776 HydrophobicContact CD1-CD2 3.63Å; Y2306-F2776 HydrophobicContact CD1-CE2 4.3Å; Y2306-F2776 HydrophobicContact CD1-CG 4.49Å; Y2306-F2776 HydrophobicContact CD2-CD2 4.1Å; Y2306-F2776 HydrophobicContact CE1-CB 3.8Å; Y2306-F2776 AromaticContact CE1-CD2 3.71Å; Y2306-F2776 HydrophobicContact CE1-CD2 3.71Å; Y2306-F2776 HydrophobicContact CE1-CG 4.15Å; Y2306-F2776 HydrophobicContact CE2-CB 4.27Å; Y2306-F2776 HydrophobicContact CE2-CD2 4.21Å; Y2306-F2776 AromaticContact CG-CD2 3.85Å; Y2306-F2776 HydrophobicContact CG-CD2 3.85Å; Y2306-F2776 HydrophobicContact CG-CE2 4.39Å; Y2306-F2776 PolarHBondContact OH-N 3.05Å; H2772-F2776 VanDerWaalsContact O-CB 3.29Å; H2772-F2776 WeakPolarHBondContact O-CB 3.47Å; H2772-F2776 PolarHBondContact O-N 3.05Å; H2772-F2776 VanDerWaalsContact O-N 3.15Å; Y2773-F2776 PolarHBondContact O-N 3.37Å; I2774-F2776 VanDerWaalsContact C-N 3.27Å; I2774-F2776 PolarHBondContact O-N 3.22Å; F2776-Y2779 AromaticContact CD2-CD1 3.88Å; F2776-Y2779 HydrophobicContact CD2-CD1 3.88Å; F2776-Y2779 HydrophobicContact CD2-CE1 4.39Å; F2776-Y2779 AromaticContact CE2-CD1 3.97Å; F2776-Y2779 HydrophobicContact CE2-CD1 3.97Å; F2776-Y2779 HydrophobicContact CE2-CE1 4.08Å; F2776-Y2779 WeakPolarHBondContact O-CB 3.23Å; F2776-Y2779 PolarHBondContact O-N 2.89Å; F2776-L2780 HydrophobicContact CD1-CD1 4.03Å; F2776-L2780 HydrophobicContact CD1-CG 4.39Å; F2776-L2780 HydrophobicContact CE1-CD1 3.6Å; F2776-L2780 HydrophobicContact CE1-CD2 4.47Å; F2776-L2780 HydrophobicContact CE1-CG 4.06Å; F2776-L2780 HydrophobicContact CZ-CD1 4.09Å; F2776-L2780 HydrophobicContact CZ-CD2 4.12Å; F2776-L2780 HydrophobicContact CZ-CG 4.14Å; F2776-L2780 WeakPolarHBondContact O-CG 3.45Å; F2776-L2780 PolarHBondContact O-N 3.37Å; F2776-E2792 HydrophobicContact CZ-CG 4.32Å; F2776-I2795 HydrophobicContact CE1-CD1 3.68Å; F2776-I2795 HydrophobicContact CE1-CG2 4.15Å; F2776-I2795 HydrophobicContact CZ-CD1 4.09Å; F2776-W2806 HydrophobicContact CD1-CH2 4.16Å; F2776-W2806 HydrophobicContact CD1-CZ3 4.44Å
2777I88.7Confident84.3Confident3 Ų332.1 Ų32.12%0.01516%0.163CC..Hα-helixtrans-67.8-37.7177.4-65158000110.8F2340 I2343 Y2773 I2774 K2781 I2799 W2806F2340-I2777 HydrophobicContact CD1-CD1 4.34Å; F2340-I2777 HydrophobicContact CE1-CD1 3.58Å; F2340-I2777 HydrophobicContact CE1-CG1 4.24Å; F2340-I2777 HydrophobicContact CE1-CG2 4.48Å; F2340-I2777 HydrophobicContact CE2-CD1 3.84Å; F2340-I2777 HydrophobicContact CZ-CD1 3.31Å; F2340-I2777 HydrophobicContact CZ-CG1 4.2Å; I2343-I2777 HydrophobicContact CD1-CB 4.19Å; I2343-I2777 HydrophobicContact CD1-CD1 3.38Å; I2343-I2777 HydrophobicContact CD1-CG1 4.37Å; I2343-I2777 HydrophobicContact CD1-CG2 4.04Å; I2343-I2777 HydrophobicContact CG2-CG2 4.09Å; Y2773-I2777 WeakPolarHBondContact O-CD1 3.48Å; Y2773-I2777 WeakPolarHBondContact O-CG1 3.3Å; Y2773-I2777 PolarHBondContact O-N 3.09Å; Y2773-I2777 VanDerWaalsContact O-N 3.15Å; I2774-I2777 PolarHBondContact O-N 3.47Å; I2777-K2781 PolarHBondContact O-N 3.46Å; I2777-K2781 VanDerWaalsContact O-N 3.09Å; I2777-I2799 HydrophobicContact CG1-CD1 4.08Å; I2777-I2799 HydrophobicContact CG2-CD1 4.42Å; I2777-W2806 HydrophobicContact CD1-CZ2 4.38Å; I2777-W2806 HydrophobicContact CG1-CZ2 4.36Å
2778I86.7Confident84.1Confident2 Ų232.3 Ų32.31%0.0116%0.163CC..Hα-helixtrans-65.3-46.1171.6-64174.1000110.3I2311 I2343 Y2347 M2350 I2774 Y2775 L2780 K2781 T2782I2311-I2778 HydrophobicContact CG2-CG2 4.13Å; I2343-I2778 HydrophobicContact CG2-CG1 4.46Å; Y2347-I2778 HydrophobicContact CD2-CD1 4.28Å; Y2347-I2778 HydrophobicContact CD2-CG1 4.22Å; Y2347-I2778 HydrophobicContact CD2-CG2 3.81Å; Y2347-I2778 HydrophobicContact CE2-CG2 3.77Å; M2350-I2778 HydrophobicContact CE-CD1 3.89Å; M2350-I2778 HydrophobicContact SD-CD1 3.65Å; I2774-I2778 HydrophobicContact CG2-CD1 4.05Å; I2774-I2778 WeakPolarHBondContact O-CG1 3.2Å; I2774-I2778 PolarHBondContact O-N 3.44Å; Y2775-I2778 PolarHBondContact O-N 3.16Å; I2778-L2780 PolarHBondContact O-N 3.09Å; I2778-K2781 CarbonylContact O-C 3.55Å; I2778-K2781 PolarHBondContact O-N 3.48Å; I2778-K2781 VanDerWaalsContact O-N 3.12Å; I2778-T2782 HydrophobicContact CG2-CG2 4.21Å; I2778-T2782 WeakPolarHBondContact O-CG2 3.13Å; I2778-T2782 PolarHBondContact O-N 2.86Å; I2778-T2782 PolarHBondContact O-OG1 3.47Å
2779Y89.4Confident83.7Confident32 Ų3234.1 Ų34.113%0.12518%0.175CC..Hα-helixtrans-54.2-49.9176163.4-99.6000111.8Y2306 P2307 P2309 Y2775 F2776 K2781 T2782 K2783 E2792Y2306-Y2779 HydrophobicContact CD2-CD1 4.05Å; Y2306-Y2779 HydrophobicContact CD2-CD2 4.33Å; Y2306-Y2779 HydrophobicContact CD2-CE1 4.48Å; Y2306-Y2779 AromaticContact CD2-CG 3.97Å; Y2306-Y2779 HydrophobicContact CD2-CG 3.97Å; Y2306-Y2779 HydrophobicContact CE2-CG 4.39Å; P2307-Y2779 HydrophobicContact CG-CE2 4.05Å; P2309-Y2779 HydrophobicContact CG-CD2 4.3Å; P2309-Y2779 HydrophobicContact CG-CG 4.45Å; Y2775-Y2779 WeakPolarHBondContact O-CB 3.49Å; Y2775-Y2779 PolarHBondContact O-N 3.3Å; F2776-Y2779 AromaticContact CD2-CD1 3.88Å; F2776-Y2779 HydrophobicContact CD2-CD1 3.88Å; F2776-Y2779 HydrophobicContact CD2-CE1 4.39Å; F2776-Y2779 AromaticContact CE2-CD1 3.97Å; F2776-Y2779 HydrophobicContact CE2-CD1 3.97Å; F2776-Y2779 HydrophobicContact CE2-CE1 4.08Å; F2776-Y2779 WeakPolarHBondContact O-CB 3.23Å; F2776-Y2779 PolarHBondContact O-N 2.89Å; Y2779-K2781 PolarHBondContact O-N 2.87Å; Y2779-T2782 WeakPolarHBondContact CA-OG1 3.23Å; Y2779-T2782 PolarHBondContact O-N 2.82Å; Y2779-T2782 VanDerWaalsContact O-N 3.15Å; Y2779-T2782 PolarHBondContact O-OG1 3.05Å; Y2779-K2783 HydrophobicContact CE1-CD 4.33Å; Y2779-K2783 HydrophobicContact CE2-CD 4.15Å; Y2779-K2783 WeakPolarHBondContact O-CB 3.49Å; Y2779-K2783 PolarHBondContact O-N 3.16Å; Y2779-K2783 WeakPolarHBondContact OH-CD 3.22Å; Y2779-K2783 PolarHBondContact OH-NZ 2.93Å; Y2779-E2792 WeakPolarHBondContact CE1-OE1 3.34Å; Y2779-E2792 PolarHBondContact OH-OE1 3.2Å
2780L87.8Confident83.3Confident8 Ų833 Ų334%0.04217%0.17CC..Hα-helixtrans-57-46.6174-71.3178.1000112.3F2776 I2778 T2782 K2783 L2788 E2792 I2795 I2799F2776-L2780 HydrophobicContact CD1-CD1 4.03Å; F2776-L2780 HydrophobicContact CD1-CG 4.39Å; F2776-L2780 HydrophobicContact CE1-CD1 3.6Å; F2776-L2780 HydrophobicContact CE1-CD2 4.47Å; F2776-L2780 HydrophobicContact CE1-CG 4.06Å; F2776-L2780 HydrophobicContact CZ-CD1 4.09Å; F2776-L2780 HydrophobicContact CZ-CD2 4.12Å; F2776-L2780 HydrophobicContact CZ-CG 4.14Å; F2776-L2780 WeakPolarHBondContact O-CG 3.45Å; F2776-L2780 PolarHBondContact O-N 3.37Å; I2778-L2780 PolarHBondContact O-N 3.09Å; L2780-T2782 VanDerWaalsContact C-N 3.29Å; L2780-T2782 PolarHBondContact O-N 3.37Å; L2780-K2783 PolarHBondContact O-N 3.4Å; L2780-L2788 HydrophobicContact CD2-CD2 4.09Å; L2780-E2792 HydrophobicContact CD2-CB 3.61Å; L2780-E2792 HydrophobicContact CD2-CG 3.78Å; L2780-I2795 HydrophobicContact CD1-CB 4.3Å; L2780-I2795 HydrophobicContact CD1-CG2 3.78Å; L2780-I2799 HydrophobicContact CD1-CD1 3.87Å
2781K83Confident83.2Confident104 Ų10432.7 Ų32.745%0.45217%0.168SC..Hα-helixtrans-65.9-26.5177.7-76.5-171.1173.6-170.30113.5E2344 I2777 I2778 Y2779E2344-K2781 IonicContact OE1-NZ 3.46Å; E2344-K2781 PolarHBondContact OE1-NZ 3.19Å; I2777-K2781 PolarHBondContact O-N 3.46Å; I2777-K2781 VanDerWaalsContact O-N 3.09Å; I2778-K2781 CarbonylContact O-C 3.55Å; I2778-K2781 PolarHBondContact O-N 3.48Å; I2778-K2781 VanDerWaalsContact O-N 3.12Å; Y2779-K2781 PolarHBondContact O-N 2.87Å
2782T79.4Confident83.2Confident63 Ų6331.6 Ų31.639%0.38717%0.165SC..Hα-helixtrans-88.1-15.2178.256.90000114.6Y2347 I2778 Y2779 L2780Y2347-T2782 HydrophobicContact CE2-CG2 4.43Å; I2778-T2782 HydrophobicContact CG2-CG2 4.21Å; I2778-T2782 WeakPolarHBondContact O-CG2 3.13Å; I2778-T2782 PolarHBondContact O-N 2.86Å; I2778-T2782 PolarHBondContact O-OG1 3.47Å; Y2779-T2782 WeakPolarHBondContact CA-OG1 3.23Å; Y2779-T2782 PolarHBondContact O-N 2.82Å; Y2779-T2782 VanDerWaalsContact O-N 3.15Å; Y2779-T2782 PolarHBondContact O-OG1 3.05Å; L2780-T2782 VanDerWaalsContact C-N 3.29Å; L2780-T2782 PolarHBondContact O-N 3.37Å
2783K81.3Confident82.8Confident50 Ų5030.7 Ų30.722%0.21716%0.16CC..SBendtrans-89.9145.9-174.6-172.9167.2171.4-167.50111.1Y2779 L2780 D2787 L2788 E2792Y2779-K2783 HydrophobicContact CE1-CD 4.33Å; Y2779-K2783 HydrophobicContact CE2-CD 4.15Å; Y2779-K2783 WeakPolarHBondContact O-CB 3.49Å; Y2779-K2783 PolarHBondContact O-N 3.16Å; Y2779-K2783 WeakPolarHBondContact OH-CD 3.22Å; Y2779-K2783 PolarHBondContact OH-NZ 2.93Å; L2780-K2783 PolarHBondContact O-N 3.4Å; K2783-D2787 VanDerWaalsContact CE-C 3.48Å; K2783-D2787 WeakPolarHBondContact CE-O 3.48Å; K2783-D2787 HydrophobicContact CG-CB 4.36Å; K2783-D2787 PolarHBondContact NZ-O 2.96Å; K2783-L2788 HydrophobicContact CB-CD2 4.1Å; K2783-L2788 HydrophobicContact CD-CD2 3.93Å; K2783-L2788 HydrophobicContact CG-CD2 3.98Å; K2783-E2792 VanDerWaalsContact NZ-CD 3.34Å; K2783-E2792 IonicContact NZ-OE1 2.61Å; K2783-E2792 PolarHBondContact NZ-OE1 3.45Å; K2783-E2792 IonicContact NZ-OE2 2.65Å; K2783-E2792 PolarHBondContact NZ-OE2 3.3Å
2784L73.7Confident82.7Confident59 Ų5933.2 Ų33.231%0.30917%0.171SC..  trans-65.9139.7176.7-63.5174.5000110.4T2029 D2786 D2787T2029-L2784 HydrophobicContact CG2-CD1 4.18Å; T2029-L2784 HydrophobicContact CG2-CD2 4.02Å; L2784-D2786 PolarHBondContact O-N 2.87Å; L2784-D2786 VanDerWaalsContact O-N 3.09Å; L2784-D2787 HydrophobicContact CB-CB 4.36Å; L2784-D2787 PolarHBondContact O-N 3.29Å; L2784-D2787 VanDerWaalsContact O-N 3.12Å
2785T72Confident82.7Confident75 Ų7533.2 Ų33.246%0.4617%0.17SC..THydrogen-bonded Turntrans-59.8-24.2-175.450.70000114.4
2786D68.2Low82.5Confident76 Ų7633.9 Ų33.941%0.40618%0.175SC..THydrogen-bonded Turntrans-96.4-12.5-174.1-53.5-19.2000111.8R1917 L2784R1917-D2786 IonicContact CZ-OD1 3.65Å; R1917-D2786 IonicContact NH2-OD1 2.68Å; R1917-D2786 PolarHBondContact NH2-OD1 3.38Å; L2784-D2786 PolarHBondContact O-N 2.87Å; L2784-D2786 VanDerWaalsContact O-N 3.09Å
2787D74.1Confident82.3Confident62 Ų6239.4 Ų39.433%0.33220%0.199SC..SBendtrans-91.3-5.5172.8-83.83.7000112.5Q2032 K2783 L2784Q2032-D2787 PolarHBondContact NE2-OD1 3.45Å; K2783-D2787 VanDerWaalsContact CE-C 3.48Å; K2783-D2787 WeakPolarHBondContact CE-O 3.48Å; K2783-D2787 HydrophobicContact CG-CB 4.36Å; K2783-D2787 PolarHBondContact NZ-O 2.96Å; L2784-D2787 HydrophobicContact CB-CB 4.36Å; L2784-D2787 PolarHBondContact O-N 3.29Å; L2784-D2787 VanDerWaalsContact O-N 3.12Å
2788L79.9Confident82.2Confident8 Ų840.1 Ų40.14%0.04220%0.203CC..  trans-67.9138.4-176.7-64.1175000111.6L2780 K2783 E2792 I2793L2780-L2788 HydrophobicContact CD2-CD2 4.09Å; K2783-L2788 HydrophobicContact CB-CD2 4.1Å; K2783-L2788 HydrophobicContact CD-CD2 3.93Å; K2783-L2788 HydrophobicContact CG-CD2 3.98Å; L2788-E2792 VanDerWaalsContact CA-OE2 3.24Å; L2788-E2792 WeakPolarHBondContact CA-OE2 3.4Å; L2788-E2792 HydrophobicContact CB-CB 4.2Å; L2788-E2792 HydrophobicContact CD2-CB 4.17Å; L2788-I2793 HydrophobicContact CB-CD1 4.2Å; L2788-I2793 HydrophobicContact CB-CG1 3.5Å; L2788-I2793 VanDerWaalsContact CB-CG1 3.5Å; L2788-I2793 HydrophobicContact CD1-CG1 4.22Å
2789T81.1Confident82.2Confident39 Ų3941.2 Ų41.224%0.23921%0.209CC..  trans-75167173.875.40000112.3L2791 E2792 I2793T2789-L2791 VanDerWaalsContact C-N 3.27Å; T2789-L2791 PolarHBondContact O-N 3.39Å; T2789-E2792 PolarHBondContact N-OE2 3.29Å; T2789-E2792 PolarHBondContact O-N 2.99Å; T2789-E2792 VanDerWaalsContact O-N 3.11Å; T2789-E2792 WeakPolarHBondContact OG1-CG 3.44Å; T2789-E2792 PolarHBondContact OG1-N 2.62Å; T2789-I2793 WeakPolarHBondContact O-CB 3.43Å; T2789-I2793 VanDerWaalsContact O-CG1 3.28Å; T2789-I2793 WeakPolarHBondContact O-CG1 3.36Å; T2789-I2793 PolarHBondContact O-N 2.89Å
2790G78.1Confident81.9Confident8 Ų846.3 Ų46.38%0.08223%0.231CC..Hα-helixtrans-56.3-41.618000000112.6Y2794G2790-Y2794 PolarHBondContact O-N 3.35Å; G2790-Y2794 VanDerWaalsContact O-N 3.15Å
2791L84.7Confident81.7Confident11 Ų1152.8 Ų52.86%0.05826%0.259CS..Hα-helixtrans-70-40.7174.7-64.3173000113.3E2140 I2294 R2296 E2302 I2304 T2789 Y2794 I2795E2140-L2791 HydrophobicContact CG-CD1 3.73Å; E2140-L2791 HydrophobicContact CG-CG 4.21Å; E2140-L2791 WeakPolarHBondContact OE1-CG 3.49Å; E2140-L2791 PolarHBondContact OE1-N 3.35Å; I2294-L2791 HydrophobicContact CD1-CB 4.5Å; I2294-L2791 HydrophobicContact CD1-CD1 4.43Å; I2294-L2791 HydrophobicContact CD1-CD2 4.26Å; R2296-L2791 HydrophobicContact CG-CD2 3.76Å; E2302-L2791 HydrophobicContact CG-CD1 4.49Å; E2302-L2791 WeakPolarHBondContact OE1-CD1 3.45Å; I2304-L2791 HydrophobicContact CD1-CB 4.17Å; I2304-L2791 HydrophobicContact CD1-CD1 4.4Å; T2789-L2791 VanDerWaalsContact C-N 3.27Å; T2789-L2791 PolarHBondContact O-N 3.39Å; L2791-Y2794 WeakPolarHBondContact O-CB 3.15Å; L2791-Y2794 PolarHBondContact O-N 3.02Å; L2791-I2795 WeakPolarHBondContact O-CG1 3.47Å; L2791-I2795 PolarHBondContact O-N 2.89Å
2792E88.6Confident81.7Confident9 Ų953.6 Ų53.64%0.04227%0.269CS..Hα-helixtrans-63.3-41.9176.5-70.9172.2172.700111.5F2776 Y2779 L2780 K2783 L2788 T2789 Y2794 I2795 D2796F2776-E2792 HydrophobicContact CZ-CG 4.32Å; Y2779-E2792 WeakPolarHBondContact CE1-OE1 3.34Å; Y2779-E2792 PolarHBondContact OH-OE1 3.2Å; L2780-E2792 HydrophobicContact CD2-CB 3.61Å; L2780-E2792 HydrophobicContact CD2-CG 3.78Å; K2783-E2792 VanDerWaalsContact NZ-CD 3.34Å; K2783-E2792 IonicContact NZ-OE1 2.61Å; K2783-E2792 PolarHBondContact NZ-OE1 3.45Å; K2783-E2792 IonicContact NZ-OE2 2.65Å; K2783-E2792 PolarHBondContact NZ-OE2 3.3Å; L2788-E2792 VanDerWaalsContact CA-OE2 3.24Å; L2788-E2792 WeakPolarHBondContact CA-OE2 3.4Å; L2788-E2792 HydrophobicContact CB-CB 4.2Å; L2788-E2792 HydrophobicContact CD2-CB 4.17Å; T2789-E2792 PolarHBondContact N-OE2 3.29Å; T2789-E2792 PolarHBondContact O-N 2.99Å; T2789-E2792 VanDerWaalsContact O-N 3.11Å; T2789-E2792 WeakPolarHBondContact OG1-CG 3.44Å; T2789-E2792 PolarHBondContact OG1-N 2.62Å; E2792-Y2794 VanDerWaalsContact C-N 3.33Å; E2792-Y2794 PolarHBondContact O-N 3.49Å; E2792-I2795 PolarHBondContact O-N 2.95Å; E2792-D2796 WeakPolarHBondContact O-CB 3.32Å; E2792-D2796 PolarHBondContact O-N 3.28Å
2793I83.8Confident81.9Confident10 Ų1053.6 Ų53.65%0.05126%0.264CS..Hα-helixtrans-61.6-40.2174.4-67.9169.4000111.1R1917 L2788 T2789 K2797R1917-I2793 HydrophobicContact CB-CD1 4Å; R1917-I2793 HydrophobicContact CG-CD1 3.89Å; L2788-I2793 HydrophobicContact CB-CD1 4.2Å; L2788-I2793 HydrophobicContact CB-CG1 3.5Å; L2788-I2793 VanDerWaalsContact CB-CG1 3.5Å; L2788-I2793 HydrophobicContact CD1-CG1 4.22Å; T2789-I2793 WeakPolarHBondContact O-CB 3.43Å; T2789-I2793 VanDerWaalsContact O-CG1 3.28Å; T2789-I2793 WeakPolarHBondContact O-CG1 3.36Å; T2789-I2793 PolarHBondContact O-N 2.89Å; I2793-K2797 HydrophobicContact CG2-CD 4.01Å; I2793-K2797 VanDerWaalsContact CG2-CE 3.46Å; I2793-K2797 VanDerWaalsContact CG2-NZ 3.32Å; I2793-K2797 WeakPolarHBondContact O-CB 3.39Å; I2793-K2797 WeakPolarHBondContact O-CD 3.31Å; I2793-K2797 VanDerWaalsContact O-CG 3.24Å; I2793-K2797 WeakPolarHBondContact O-CG 3.4Å; I2793-K2797 PolarHBondContact O-N 2.92Å; I2793-K2797 VanDerWaalsContact O-N 3.08Å
2794Y86Confident81.9Confident61 Ų6152.4 Ų52.424%0.23926%0.259CS..Hα-helixtrans-62.1-44.4175.6167-103.5000111.5V2295 A2297 G2790 L2791 E2792 L2798 W2806V2295-Y2794 WeakPolarHBondContact O-CE1 3.32Å; A2297-Y2794 HydrophobicContact CB-CE2 3.93Å; A2297-Y2794 PolarHBondContact N-OH 3.2Å; G2790-Y2794 PolarHBondContact O-N 3.35Å; G2790-Y2794 VanDerWaalsContact O-N 3.15Å; L2791-Y2794 WeakPolarHBondContact O-CB 3.15Å; L2791-Y2794 PolarHBondContact O-N 3.02Å; E2792-Y2794 VanDerWaalsContact C-N 3.33Å; E2792-Y2794 PolarHBondContact O-N 3.49Å; Y2794-L2798 HydrophobicContact CD1-CD1 4.32Å; Y2794-L2798 HydrophobicContact CE1-CD1 3.69Å; Y2794-L2798 HydrophobicContact CE2-CD1 3.92Å; Y2794-L2798 HydrophobicContact CE2-CG 4.46Å; Y2794-L2798 VanDerWaalsContact CZ-CD1 3.47Å; Y2794-L2798 WeakPolarHBondContact O-CG 3.38Å; Y2794-L2798 PolarHBondContact O-N 2.85Å; Y2794-W2806 HydrophobicContact CE1-CB 4.31Å
2795I89.2Confident82.5Confident0 Ų056.1 Ų56.10%027%0.272CS..Hα-helixtrans-70.5-43.8179.4-64.7170.9000111.4I2294 I2304 F2776 L2780 L2791 E2792 K2797 L2798 I2799 W2806I2294-I2795 HydrophobicContact CB-CD1 4.37Å; I2294-I2795 HydrophobicContact CD1-CD1 4.1Å; I2294-I2795 HydrophobicContact CG2-CD1 3.89Å; I2304-I2795 HydrophobicContact CD1-CD1 4.28Å; F2776-I2795 HydrophobicContact CE1-CD1 3.68Å; F2776-I2795 HydrophobicContact CE1-CG2 4.15Å; F2776-I2795 HydrophobicContact CZ-CD1 4.09Å; L2780-I2795 HydrophobicContact CD1-CB 4.3Å; L2780-I2795 HydrophobicContact CD1-CG2 3.78Å; L2791-I2795 WeakPolarHBondContact O-CG1 3.47Å; L2791-I2795 PolarHBondContact O-N 2.89Å; E2792-I2795 PolarHBondContact O-N 2.95Å; I2795-K2797 VanDerWaalsContact C-N 3.31Å; I2795-K2797 PolarHBondContact O-N 3.34Å; I2795-L2798 CarbonylContact O-C 3.58Å; I2795-L2798 WeakPolarHBondContact O-CA 3.19Å; I2795-L2798 PolarHBondContact O-N 2.87Å; I2795-I2799 HydrophobicContact CG2-CD1 3.68Å; I2795-I2799 HydrophobicContact CG2-CG1 4.08Å; I2795-I2799 WeakPolarHBondContact O-CG1 3.44Å; I2795-I2799 PolarHBondContact O-N 2.88Å; I2795-W2806 HydrophobicContact CD1-CD2 4.34Å; I2795-W2806 HydrophobicContact CD1-CE3 3.93Å; I2795-W2806 HydrophobicContact CD1-CZ3 4.32Å; I2795-W2806 HydrophobicContact CG1-CB 4.29Å; I2795-W2806 HydrophobicContact CG1-CD2 4.18Å; I2795-W2806 HydrophobicContact CG1-CE3 4.27Å; I2795-W2806 HydrophobicContact CG1-CG 4.22Å; I2795-W2806 HydrophobicContact CG2-CD2 3.79Å; I2795-W2806 HydrophobicContact CG2-CE3 4.23Å; I2795-W2806 HydrophobicContact CG2-CG 4.19Å; I2795-W2806 HydrophobicContact CG2-CH2 4.29Å; I2795-W2806 HydrophobicContact CG2-CZ2 3.84Å; I2795-W2806 HydrophobicContact CG2-CZ3 4.48Å
2796D86.7Confident83.3Confident32 Ų3252.5 Ų52.517%0.17125%0.251CS..Hα-helixtrans-56.7-43.1175.5172.166000111.9E2792 L2798 I2799 K2800E2792-D2796 WeakPolarHBondContact O-CB 3.32Å; E2792-D2796 PolarHBondContact O-N 3.28Å; D2796-L2798 VanDerWaalsContact C-N 3.3Å; D2796-L2798 PolarHBondContact O-N 3.24Å; D2796-I2799 PolarHBondContact O-N 2.94Å; D2796-K2800 VanDerWaalsContact CG-NZ 3.28Å; D2796-K2800 WeakPolarHBondContact O-CB 3.31Å; D2796-K2800 WeakPolarHBondContact O-CG 3.46Å; D2796-K2800 PolarHBondContact O-N 3.12Å; D2796-K2800 WeakPolarHBondContact OD1-CE 3.45Å; D2796-K2800 IonicContact OD1-NZ 3.04Å; D2796-K2800 PolarHBondContact OD1-NZ 3.4Å; D2796-K2800 VanDerWaalsContact OD1-NZ 3.09Å; D2796-K2800 WeakPolarHBondContact OD2-CE 3.26Å; D2796-K2800 IonicContact OD2-NZ 2.76Å; D2796-K2800 PolarHBondContact OD2-NZ 3Å
2797K85.2Confident84.4Confident116 Ų11649.2 Ų49.250%0.50423%0.233SC..Hα-helixtrans-60.9-34.4173.2-75.5167.8-178.8167.10113.2I2793 I2795 K2801I2793-K2797 HydrophobicContact CG2-CD 4.01Å; I2793-K2797 VanDerWaalsContact CG2-CE 3.46Å; I2793-K2797 VanDerWaalsContact CG2-NZ 3.32Å; I2793-K2797 WeakPolarHBondContact O-CB 3.39Å; I2793-K2797 WeakPolarHBondContact O-CD 3.31Å; I2793-K2797 VanDerWaalsContact O-CG 3.24Å; I2793-K2797 WeakPolarHBondContact O-CG 3.4Å; I2793-K2797 PolarHBondContact O-N 2.92Å; I2793-K2797 VanDerWaalsContact O-N 3.08Å; I2795-K2797 VanDerWaalsContact C-N 3.31Å; I2795-K2797 PolarHBondContact O-N 3.34Å; K2797-K2801 VanDerWaalsContact O-CG 3.32Å; K2797-K2801 WeakPolarHBondContact O-CG 3.49Å; K2797-K2801 PolarHBondContact O-N 3.09Å
2798L87.7Confident85Confident18 Ų1846.3 Ų46.39%0.09422%0.217CC..Hα-helixtrans-77.8-38.8176.6-73.3176.9000112.4Y2794 I2795 D2796 K2801 N2802 E2803 W2806Y2794-L2798 HydrophobicContact CD1-CD1 4.32Å; Y2794-L2798 HydrophobicContact CE1-CD1 3.69Å; Y2794-L2798 HydrophobicContact CE2-CD1 3.92Å; Y2794-L2798 HydrophobicContact CE2-CG 4.46Å; Y2794-L2798 VanDerWaalsContact CZ-CD1 3.47Å; Y2794-L2798 WeakPolarHBondContact O-CG 3.38Å; Y2794-L2798 PolarHBondContact O-N 2.85Å; I2795-L2798 CarbonylContact O-C 3.58Å; I2795-L2798 WeakPolarHBondContact O-CA 3.19Å; I2795-L2798 PolarHBondContact O-N 2.87Å; D2796-L2798 VanDerWaalsContact C-N 3.3Å; D2796-L2798 PolarHBondContact O-N 3.24Å; L2798-K2801 CarbonylContact O-C 3.38Å; L2798-K2801 PolarHBondContact O-N 3.37Å; L2798-K2801 VanDerWaalsContact O-N 3.14Å; L2798-N2802 PolarHBondContact O-N 2.94Å; L2798-N2802 VanDerWaalsContact O-N 3.13Å; L2798-E2803 HydrophobicContact CD2-CB 3.9Å; L2798-E2803 PolarHBondContact O-N 3.16Å; L2798-W2806 HydrophobicContact CD1-CB 3.84Å; L2798-W2806 HydrophobicContact CD1-CG 4.32Å
2799I86Confident85.3Confident25 Ų2550.9 Ų50.913%0.12823%0.234CC..Hα-helixtrans-61.3-46.9174.5-67.9173.1000110F2340 I2777 L2780 I2795 D2796 K2801 N2802 W2806F2340-I2799 HydrophobicContact CE1-CD1 4.42Å; F2340-I2799 HydrophobicContact CE1-CG1 4.07Å; F2340-I2799 HydrophobicContact CE1-CG2 4.28Å; F2340-I2799 HydrophobicContact CZ-CG1 4.45Å; I2777-I2799 HydrophobicContact CG1-CD1 4.08Å; I2777-I2799 HydrophobicContact CG2-CD1 4.42Å; L2780-I2799 HydrophobicContact CD1-CD1 3.87Å; I2795-I2799 HydrophobicContact CG2-CD1 3.68Å; I2795-I2799 HydrophobicContact CG2-CG1 4.08Å; I2795-I2799 WeakPolarHBondContact O-CG1 3.44Å; I2795-I2799 PolarHBondContact O-N 2.88Å; D2796-I2799 PolarHBondContact O-N 2.94Å; I2799-K2801 PolarHBondContact O-N 3.19Å; I2799-N2802 PolarHBondContact O-N 2.96Å; I2799-W2806 HydrophobicContact CD1-CZ2 4.35Å
2800K83.2Confident85.5Confident138 Ų13857 Ų5760%0.625%0.253SS*.Hα-helixtrans-61-24.8175.2-74.3168.9177.1162.50113.7D2796D2796-K2800 VanDerWaalsContact CG-NZ 3.28Å; D2796-K2800 WeakPolarHBondContact O-CB 3.31Å; D2796-K2800 WeakPolarHBondContact O-CG 3.46Å; D2796-K2800 PolarHBondContact O-N 3.12Å; D2796-K2800 WeakPolarHBondContact OD1-CE 3.45Å; D2796-K2800 IonicContact OD1-NZ 3.04Å; D2796-K2800 PolarHBondContact OD1-NZ 3.4Å; D2796-K2800 VanDerWaalsContact OD1-NZ 3.09Å; D2796-K2800 WeakPolarHBondContact OD2-CE 3.26Å; D2796-K2800 IonicContact OD2-NZ 2.76Å; D2796-K2800 PolarHBondContact OD2-NZ 3Å
2801K84.6Confident85.9Confident145 Ų14559.4 Ų59.463%0.6326%0.259SS*.THydrogen-bonded Turntrans-89.5-1.9173.3-72.4179.1176.6-169.40114.2K2797 L2798 I2799 E2803K2797-K2801 VanDerWaalsContact O-CG 3.32Å; K2797-K2801 WeakPolarHBondContact O-CG 3.49Å; K2797-K2801 PolarHBondContact O-N 3.09Å; L2798-K2801 CarbonylContact O-C 3.38Å; L2798-K2801 PolarHBondContact O-N 3.37Å; L2798-K2801 VanDerWaalsContact O-N 3.14Å; I2799-K2801 PolarHBondContact O-N 3.19Å; K2801-E2803 HydrophobicContact CB-CB 4.47Å; K2801-E2803 HydrophobicContact CB-CG 4.13Å; K2801-E2803 PolarHBondContact O-N 2.93Å
2802N82.2Confident85.9Confident121 Ų12158.9 Ų58.965%0.64726%0.256SS*.THydrogen-bonded Turntrans5534.1-169.5-68.2-58.8000113.7L2798 I2799L2798-N2802 PolarHBondContact O-N 2.94Å; L2798-N2802 VanDerWaalsContact O-N 3.13Å; I2799-N2802 PolarHBondContact O-N 2.96Å
2803E84.3Confident85.6Confident62 Ų6259.8 Ų59.829%0.2926%0.261SS..  trans-103.1116.8179-74.3-167.2-12600112.5L2798 K2801 K2805L2798-E2803 HydrophobicContact CD2-CB 3.9Å; L2798-E2803 PolarHBondContact O-N 3.16Å; K2801-E2803 HydrophobicContact CB-CB 4.47Å; K2801-E2803 HydrophobicContact CB-CG 4.13Å; K2801-E2803 PolarHBondContact O-N 2.93Å; E2803-K2805 PolarHBondContact O-N 2.9Å; E2803-K2805 WeakPolarHBondContact OE2-CD 3.25Å; E2803-K2805 VanDerWaalsContact OE2-CE 3.24Å; E2803-K2805 WeakPolarHBondContact OE2-CE 3.3Å; E2803-K2805 IonicContact OE2-NZ 2.71Å; E2803-K2805 PolarHBondContact OE2-NZ 3.35Å
2804F81.7Confident85.4Confident25 Ų2560 Ų6011%0.1126%0.263CS..  trans-96.929.8-175.6-50.6-63.8000114.5I2336 P2337 F2340 W2806I2336-F2804 HydrophobicContact CG2-CB 3.85Å; I2336-F2804 HydrophobicContact CG2-CD1 3.72Å; I2336-F2804 HydrophobicContact CG2-CD2 4.31Å; I2336-F2804 HydrophobicContact CG2-CE1 4.4Å; I2336-F2804 HydrophobicContact CG2-CG 3.67Å; P2337-F2804 HydrophobicContact CB-CE2 4.01Å; P2337-F2804 HydrophobicContact CG-CD2 3.89Å; P2337-F2804 HydrophobicContact CG-CE2 3.75Å; F2340-F2804 HydrophobicContact CB-CE1 4.1Å; F2340-F2804 HydrophobicContact CB-CZ 4.15Å; F2340-F2804 AromaticContact CD1-CE1 3.66Å; F2340-F2804 HydrophobicContact CD1-CE1 3.66Å; F2340-F2804 HydrophobicContact CD1-CZ 4.41Å; F2340-F2804 AromaticContact CD2-CD1 3.81Å; F2340-F2804 HydrophobicContact CD2-CD1 3.81Å; F2340-F2804 AromaticContact CD2-CE1 3.37Å; F2340-F2804 HydrophobicContact CD2-CE1 3.37Å; F2340-F2804 HydrophobicContact CD2-CZ 4.13Å; F2340-F2804 HydrophobicContact CE1-CD1 4.34Å; F2340-F2804 AromaticContact CE1-CE1 3.78Å; F2340-F2804 HydrophobicContact CE1-CE1 3.78Å; F2340-F2804 AromaticContact CE2-CD1 3.52Å; F2340-F2804 HydrophobicContact CE2-CD1 3.52Å; F2340-F2804 AromaticContact CE2-CE1 3.49Å; F2340-F2804 HydrophobicContact CE2-CE1 3.49Å; F2340-F2804 VanDerWaalsContact CE2-CE1 3.49Å; F2340-F2804 HydrophobicContact CG-CD1 4.31Å; F2340-F2804 AromaticContact CG-CE1 3.43Å; F2340-F2804 HydrophobicContact CG-CE1 3.43Å; F2340-F2804 VanDerWaalsContact CG-CE1 3.43Å; F2340-F2804 AromaticContact CG-CZ 3.99Å; F2340-F2804 HydrophobicContact CG-CZ 3.99Å; F2340-F2804 AromaticContact CZ-CD1 3.79Å; F2340-F2804 HydrophobicContact CZ-CD1 3.79Å; F2340-F2804 AromaticContact CZ-CE1 3.67Å; F2340-F2804 HydrophobicContact CZ-CE1 3.67Å; F2804-W2806 VanDerWaalsContact C-N 3.28Å; F2804-W2806 PolarHBondContact O-N 3.11Å
2805K85.3Confident85.2Confident137 Ų13758.3 Ų58.360%0.59626%0.258SS*.THydrogen-bonded Turntrans-70.8-23.7-179.5-68.7171.8-178.1156.60113.1V2295 E2803 I2807V2295-K2805 WeakPolarHBondContact CB-O 3.43Å; E2803-K2805 PolarHBondContact O-N 2.9Å; E2803-K2805 WeakPolarHBondContact OE2-CD 3.25Å; E2803-K2805 VanDerWaalsContact OE2-CE 3.24Å; E2803-K2805 WeakPolarHBondContact OE2-CE 3.3Å; E2803-K2805 IonicContact OE2-NZ 2.71Å; E2803-K2805 PolarHBondContact OE2-NZ 3.35Å; K2805-I2807 VanDerWaalsContact C-N 3.28Å; K2805-I2807 PolarHBondContact O-N 2.96Å
2806W89.6Confident84.4Confident0 Ų060.3 Ų60.30%027%0.269CS..THydrogen-bonded Turntrans-75.5-10.7-178.369.7-93.2000114.2I2292 I2294 V2295 F2340 Y2773 F2776 I2777 Y2794 I2795 L2798 I2799 F2804I2292-W2806 HydrophobicContact CD1-CZ3 4.33Å; I2294-W2806 CarbonylContact C-O 3.6Å; I2294-W2806 WeakPolarHBondContact CA-O 3.32Å; I2294-W2806 HydrophobicContact CB-CE3 4.35Å; I2294-W2806 HydrophobicContact CG2-CE3 3.82Å; I2294-W2806 HydrophobicContact CG2-CZ3 3.92Å; V2295-W2806 PolarHBondContact N-O 3.42Å; F2340-W2806 AromaticContact CZ-CZ2 4Å; F2340-W2806 HydrophobicContact CZ-CZ2 4Å; Y2773-W2806 AromaticContact CD1-CH2 3.99Å; Y2773-W2806 HydrophobicContact CD1-CH2 3.99Å; Y2773-W2806 AromaticContact CD1-CZ3 3.95Å; Y2773-W2806 HydrophobicContact CD1-CZ3 3.95Å; Y2773-W2806 HydrophobicContact CE1-CZ3 4.1Å; F2776-W2806 HydrophobicContact CD1-CH2 4.16Å; F2776-W2806 HydrophobicContact CD1-CZ3 4.44Å; I2777-W2806 HydrophobicContact CD1-CZ2 4.38Å; I2777-W2806 HydrophobicContact CG1-CZ2 4.36Å; Y2794-W2806 HydrophobicContact CE1-CB 4.31Å; I2795-W2806 HydrophobicContact CD1-CD2 4.34Å; I2795-W2806 HydrophobicContact CD1-CE3 3.93Å; I2795-W2806 HydrophobicContact CD1-CZ3 4.32Å; I2795-W2806 HydrophobicContact CG1-CB 4.29Å; I2795-W2806 HydrophobicContact CG1-CD2 4.18Å; I2795-W2806 HydrophobicContact CG1-CE3 4.27Å; I2795-W2806 HydrophobicContact CG1-CG 4.22Å; I2795-W2806 HydrophobicContact CG2-CD2 3.79Å; I2795-W2806 HydrophobicContact CG2-CE3 4.23Å; I2795-W2806 HydrophobicContact CG2-CG 4.19Å; I2795-W2806 HydrophobicContact CG2-CH2 4.29Å; I2795-W2806 HydrophobicContact CG2-CZ2 3.84Å; I2795-W2806 HydrophobicContact CG2-CZ3 4.48Å; L2798-W2806 HydrophobicContact CD1-CB 3.84Å; L2798-W2806 HydrophobicContact CD1-CG 4.32Å; I2799-W2806 HydrophobicContact CD1-CZ2 4.35Å; F2804-W2806 VanDerWaalsContact C-N 3.28Å; F2804-W2806 PolarHBondContact O-N 3.11Å
2807I89.7Confident83.3Confident7 Ų764.5 Ų64.54%0.03629%0.291CS..SBendtrans-92131.4178.2-66.6165.1000108.5I2336 F2340 V2745 Y2773 K2805 R2809I2336-I2807 HydrophobicContact CD1-CB 4.13Å; I2336-I2807 HydrophobicContact CD1-CD1 4.28Å; I2336-I2807 HydrophobicContact CD1-CG2 3.63Å; I2336-I2807 HydrophobicContact CG1-CD1 4.46Å; I2336-I2807 HydrophobicContact CG1-CG2 4.5Å; I2336-I2807 HydrophobicContact CG2-CD1 3.56Å; F2340-I2807 HydrophobicContact CE2-CD1 3.92Å; F2340-I2807 HydrophobicContact CZ-CD1 4.43Å; V2745-I2807 HydrophobicContact CG1-CG2 3.66Å; Y2773-I2807 HydrophobicContact CD1-CG1 4.41Å; Y2773-I2807 HydrophobicContact CE1-CG1 4.47Å; K2805-I2807 VanDerWaalsContact C-N 3.28Å; K2805-I2807 PolarHBondContact O-N 2.96Å; I2807-R2809 PolarHBondContact O-N 3.01Å
2808P87.9Confident82.2Confident0 Ų063.5 Ų63.50%029%0.29CS..  trans-61.8126.5-178.824.6-34.5000110.9E2293 V2295 V2745 C2746 R2811E2293-P2808 HydrophobicContact CB-CG 4.23Å; E2293-P2808 VanDerWaalsContact O-CD 3.22Å; E2293-P2808 WeakPolarHBondContact O-CD 3.34Å; V2295-P2808 HydrophobicContact CG2-CB 4.26Å; V2745-P2808 HydrophobicContact CG1-CG 4.18Å; C2746-P2808 WeakPolarHBondContact CA-O 3.4Å; P2808-R2811 HydrophobicContact CB-CG 4.03Å
2809R85.2Confident80.8Confident104 Ų10469.1 Ų69.139%0.39232%0.316SS..  trans-117.5126.2176.9-64.6179.1-178.2-160.1-5.6109.4I2807 R2811I2807-R2809 PolarHBondContact O-N 3.01Å; R2809-R2811 WeakPolarHBondContact O-CG 3.43Å; R2809-R2811 PolarHBondContact O-N 3.27Å; R2809-R2811 VanDerWaalsContact O-N 3.17Å
2810R84.9Confident79.4Confident169 Ų16971.5 Ų71.564%0.63833%0.329SS*.SBendtrans51.331-178.6-62.8-174.9171.5-170.9-5114.8C2746 L2748C2746-R2810 WeakPolarHBondContact O-CA 3.46Å; C2746-R2810 PolarHBondContact O-N 3.5Å; L2748-R2810 HydrophobicContact CD2-CB 4.47Å
2811R87Confident78.1Confident57 Ų5766.6 Ų66.622%0.21532%0.318CS..  trans-153.6155.7-17967-169.9-149.2159.115.5111.1V2295 N2299 R2300 I2301 P2808 R2809V2295-R2811 VanDerWaalsContact CG1-NH2 3.25Å; V2295-R2811 VanDerWaalsContact CG2-NH2 3.28Å; N2299-R2811 PolarHBondContact O-NH1 3.41Å; N2299-R2811 PolarHBondContact O-NH2 3.42Å; R2300-R2811 PolarHBondContact O-NH2 2.75Å; I2301-R2811 HydrophobicContact CD1-CB 4.17Å; I2301-R2811 HydrophobicContact CD1-CG 3.74Å; I2301-R2811 HydrophobicContact CG1-CG 4.45Å; I2301-R2811 VanDerWaalsContact CG1-NH2 3.26Å; P2808-R2811 HydrophobicContact CB-CG 4.03Å; R2809-R2811 WeakPolarHBondContact O-CG 3.43Å; R2809-R2811 PolarHBondContact O-N 3.27Å; R2809-R2811 VanDerWaalsContact O-N 3.17Å
2812A86.2Confident76.9Confident0 Ų063.8 Ų63.80%031%0.314CS..  trans-154.8141.7179.100000109L2748 F2753 T2814 L2815 D2816L2748-A2812 HydrophobicContact CD1-CB 4.2Å; F2753-A2812 HydrophobicContact CE1-CB 4.47Å; F2753-A2812 HydrophobicContact CZ-CB 4.33Å; A2812-T2814 PolarHBondContact O-N 3.27Å; A2812-L2815 PolarHBondContact O-N 3.01Å; A2812-D2816 PolarHBondContact O-N 3.2Å; A2812-D2816 VanDerWaalsContact O-N 3.14Å; A2812-D2816 VanDerWaalsContact O-OD1 3.13Å
2813M81.7Confident75.8Confident28 Ų2861.2 Ų61.214%0.13830%0.303CS..Hα-helixtrans-57.9-26.2-176.2-172.1179.7-77.200113.2E2293 I2301 R2303 L2815 N2817E2293-M2813 WeakPolarHBondContact OE1-CB 3.4Å; E2293-M2813 PolarHBondContact OE2-N 3.23Å; I2301-M2813 HydrophobicContact CB-CE 4.38Å; I2301-M2813 HydrophobicContact CG2-CB 4.3Å; I2301-M2813 HydrophobicContact CG2-CE 3.98Å; I2301-M2813 WeakPolarHBondContact O-CE 3.39Å; R2303-M2813 HydrophobicContact CB-CE 4.12Å; M2813-L2815 VanDerWaalsContact C-N 3.3Å; M2813-L2815 PolarHBondContact O-N 3.04Å; M2813-N2817 VanDerWaalsContact O-CG 3.29Å; M2813-N2817 PolarHBondContact O-ND2 3.33Å
2814T78.9Confident74.9Confident16 Ų1663.9 Ų63.910%0.09832%0.315CS..Hα-helixtrans-69.1-23.8176.6530000113.9T2758 A2812 I2818T2758-T2814 HydrophobicContact CG2-CG2 3.9Å; A2812-T2814 PolarHBondContact O-N 3.27Å; T2814-I2818 WeakPolarHBondContact O-CD1 3.04Å
2815L81.2Confident74Confident25 Ų2569.3 Ų69.313%0.13134%0.339CS..Hα-helixtrans-98.7-44.2-179.9-58.9177.9000111.1L2748 A2752 F2753 A2812 M2813 N2817 I2818 E2819L2748-L2815 HydrophobicContact CD1-CD1 3.7Å; A2752-L2815 HydrophobicContact CB-CD1 4.45Å; F2753-L2815 HydrophobicContact CD1-CD2 4.48Å; F2753-L2815 HydrophobicContact CE1-CD1 4.33Å; F2753-L2815 HydrophobicContact CE1-CG 4.36Å; F2753-L2815 HydrophobicContact CZ-CD1 4.27Å; A2812-L2815 PolarHBondContact O-N 3.01Å; M2813-L2815 VanDerWaalsContact C-N 3.3Å; M2813-L2815 PolarHBondContact O-N 3.04Å; L2815-N2817 PolarHBondContact O-N 3.39Å; L2815-N2817 VanDerWaalsContact O-N 3.12Å; L2815-I2818 WeakPolarHBondContact O-CB 3.41Å; L2815-I2818 PolarHBondContact O-N 2.95Å; L2815-E2819 PolarHBondContact O-N 2.92Å
2816D73Confident73.4Confident42 Ų4266.1 Ų66.123%0.22533%0.334CS..Hα-helixtrans-53.1-36.9178.2-68.127.4000112.5I2301 A2812 I2818 N2820I2301-D2816 WeakPolarHBondContact CD1-OD2 3.12Å; A2812-D2816 PolarHBondContact O-N 3.2Å; A2812-D2816 VanDerWaalsContact O-N 3.14Å; A2812-D2816 VanDerWaalsContact O-OD1 3.13Å; D2816-I2818 VanDerWaalsContact C-N 3.27Å; D2816-I2818 PolarHBondContact O-N 2.87Å; D2816-N2820 PolarHBondContact O-N 3.37Å
2817N64.8Low72.9Confident120 Ų12072.5 Ų72.564%0.64236%0.364SS*.Hα-helixtrans-67-22.2177.3-76.5-16.4000114.2M2813 L2815M2813-N2817 VanDerWaalsContact O-CG 3.29Å; M2813-N2817 PolarHBondContact O-ND2 3.33Å; L2815-N2817 PolarHBondContact O-N 3.39Å; L2815-N2817 VanDerWaalsContact O-N 3.12Å
2818I61.2Low72.3Confident95 Ų9578.9 Ų78.949%0.48739%0.393SS..Hα-helixtrans-86.7-41.2179.6-58.1175.4000109.9T2814 L2815 D2816T2814-I2818 WeakPolarHBondContact O-CD1 3.04Å; L2815-I2818 WeakPolarHBondContact O-CB 3.41Å; L2815-I2818 PolarHBondContact O-N 2.95Å; D2816-I2818 VanDerWaalsContact C-N 3.27Å; D2816-I2818 PolarHBondContact O-N 2.87Å
2819E58.8Low72.1Confident136 Ų13684.5 Ų84.564%0.63642%0.422SS*.Hα-helixtrans-80.6-44.3-172.5-64.2-176.6168.800113.3L2815 T2823L2815-E2819 PolarHBondContact O-N 2.92Å; E2819-T2823 PolarHBondContact O-OG1 3.02Å
2820N55.4Low72.2Confident75 Ų7583 Ų8340%0.40143%0.425SS..THydrogen-bonded Turntrans-99.9-21-169.6-57.9-46.7000114.3D2816 T2823D2816-N2820 PolarHBondContact O-N 3.37Å; N2820-T2823 PolarHBondContact O-OG1 3.23Å
2821G56.3Low72.3Confident35 Ų3577.7 Ų77.736%0.36142%0.417SS..THydrogen-bonded Turntrans-57.6-41.5-173.200000116.9
2822P59.1Low72.4Confident86 Ų8681.2 Ų81.256%0.55844%0.44SS*.THydrogen-bonded Turntrans-93.6-26-17733.5-32.2000114.4S2826P2822-S2826 WeakPolarHBondContact O-CB 3.33Å; P2822-S2826 PolarHBondContact O-N 3.11Å
2823T60.7Low72.6Confident67 Ų6783.2 Ų83.241%0.41146%0.456SS..Hα-helixtrans-75.4-58.4-17342.50000111.7E2819 N2820 K2825 S2826 E2827E2819-T2823 PolarHBondContact O-OG1 3.02Å; N2820-T2823 PolarHBondContact O-OG1 3.23Å; T2823-K2825 VanDerWaalsContact C-N 3.32Å; T2823-K2825 PolarHBondContact O-N 2.94Å; T2823-S2826 WeakPolarHBondContact O-CB 3.37Å; T2823-S2826 PolarHBondContact O-N 3.28Å; T2823-E2827 PolarHBondContact O-N 3.02Å
2824E63.5Low73.1Confident118 Ų11886.6 Ų86.655%0.55148%0.475SS*.Hα-helixtrans-54.6-46.5-177.7-65.3-175.8157.300111.8S2826 E2827 E2828E2824-S2826 VanDerWaalsContact C-N 3.33Å; E2824-S2826 PolarHBondContact O-N 3.24Å; E2824-E2827 PolarHBondContact O-N 3.46Å; E2824-E2828 WeakPolarHBondContact O-CG 3.3Å; E2824-E2828 PolarHBondContact O-N 2.95Å
2825K63.7Low73.6Confident139 Ų13989.1 Ų89.160%0.60449%0.493SS*.Hα-helixtrans-64.1-35.3179-70.3179-179169.50113T2823 I2829T2823-K2825 VanDerWaalsContact C-N 3.32Å; T2823-K2825 PolarHBondContact O-N 2.94Å; K2825-I2829 WeakPolarHBondContact O-CB 3.47Å; K2825-I2829 WeakPolarHBondContact O-CD1 3.4Å; K2825-I2829 WeakPolarHBondContact O-CG1 3.39Å; K2825-I2829 PolarHBondContact O-N 2.71Å
2826S72.7Confident74.2Confident70 Ų7093.2 Ų93.249%0.4951%0.514SS..Hα-helixtrans-70.2-38.4176.8-173.10000111.2P2822 T2823 E2824 T2830P2822-S2826 WeakPolarHBondContact O-CB 3.33Å; P2822-S2826 PolarHBondContact O-N 3.11Å; T2823-S2826 WeakPolarHBondContact O-CB 3.37Å; T2823-S2826 PolarHBondContact O-N 3.28Å; E2824-S2826 VanDerWaalsContact C-N 3.33Å; E2824-S2826 PolarHBondContact O-N 3.24Å; S2826-T2830 WeakPolarHBondContact O-CB 3.37Å; S2826-T2830 VanDerWaalsContact O-CG2 3.29Å; S2826-T2830 WeakPolarHBondContact O-CG2 3.43Å; S2826-T2830 PolarHBondContact O-N 2.81Å; S2826-T2830 PolarHBondContact O-OG1 2.83Å
2827E78.1Confident75.1Confident133 Ų13395.4 Ų95.462%0.62153%0.526SS*.Hα-helixtrans-68.6-43.7176.7-69.8177.9-165.700111.6T2823 E2824 T2830 A2831T2823-E2827 PolarHBondContact O-N 3.02Å; E2824-E2827 PolarHBondContact O-N 3.46Å; E2827-T2830 WeakPolarHBondContact CA-OG1 3.48Å; E2827-T2830 PolarHBondContact O-N 3.41Å; E2827-T2830 PolarHBondContact O-OG1 2.81Å; E2827-T2830 VanDerWaalsContact O-OG1 3.06Å; E2827-A2831 VanDerWaalsContact O-CB 3.26Å; E2827-A2831 WeakPolarHBondContact O-CB 3.31Å; E2827-A2831 PolarHBondContact O-N 3.41Å
2828E78.6Confident76.5Confident141 Ų14195.8 Ų95.866%0.65952%0.522SS*.Hα-helixtrans-61.5-46.3174-74-175166.500112.4E2824 T2830 A2831 L2832E2824-E2828 WeakPolarHBondContact O-CG 3.3Å; E2824-E2828 PolarHBondContact O-N 2.95Å; E2828-T2830 PolarHBondContact O-N 2.88Å; E2828-A2831 PolarHBondContact O-N 3.4Å; E2828-L2832 WeakPolarHBondContact O-CB 3.37Å; E2828-L2832 PolarHBondContact O-N 3.11Å
2829I82.6Confident77.9Confident118 Ų11895.1 Ų95.161%0.60552%0.522SS*.Hα-helixtrans-64.4-41179.4-71.4167.5000111K2825 L2832 A2833K2825-I2829 WeakPolarHBondContact O-CB 3.47Å; K2825-I2829 WeakPolarHBondContact O-CD1 3.4Å; K2825-I2829 WeakPolarHBondContact O-CG1 3.39Å; K2825-I2829 PolarHBondContact O-N 2.71Å; I2829-L2832 PolarHBondContact O-N 2.82Å; I2829-A2833 VanDerWaalsContact O-CB 3.28Å; I2829-A2833 WeakPolarHBondContact O-CB 3.48Å; I2829-A2833 PolarHBondContact O-N 3.45Å
2830T87.1Confident79.6Confident73 Ų7392 Ų9245%0.44851%0.512SS..Hα-helixtrans-70.9-37177.551.80000112.1S2826 E2827 E2828 A2833 N2834S2826-T2830 WeakPolarHBondContact O-CB 3.37Å; S2826-T2830 VanDerWaalsContact O-CG2 3.29Å; S2826-T2830 WeakPolarHBondContact O-CG2 3.43Å; S2826-T2830 PolarHBondContact O-N 2.81Å; S2826-T2830 PolarHBondContact O-OG1 2.83Å; E2827-T2830 WeakPolarHBondContact CA-OG1 3.48Å; E2827-T2830 PolarHBondContact O-N 3.41Å; E2827-T2830 PolarHBondContact O-OG1 2.81Å; E2827-T2830 VanDerWaalsContact O-OG1 3.06Å; E2828-T2830 PolarHBondContact O-N 2.88Å; T2830-A2833 PolarHBondContact O-N 3.44Å; T2830-N2834 VanDerWaalsContact O-CB 3.32Å; T2830-N2834 WeakPolarHBondContact O-CB 3.4Å; T2830-N2834 PolarHBondContact O-N 3.42Å; T2830-N2834 PolarHBondContact O-ND2 3.46Å; T2830-N2834 VanDerWaalsContact O-ND2 3.13Å
2831A88.6Confident81.3Confident58 Ų5895.3 Ų95.348%0.47952%0.523SS..Hα-helixtrans-62.5-44.9172.100000112.1E2827 E2828 N2834 S2835E2827-A2831 VanDerWaalsContact O-CB 3.26Å; E2827-A2831 WeakPolarHBondContact O-CB 3.31Å; E2827-A2831 PolarHBondContact O-N 3.41Å; E2828-A2831 PolarHBondContact O-N 3.4Å; A2831-N2834 PolarHBondContact O-N 3.33Å; A2831-S2835 PolarHBondContact O-N 3Å
2832L88.3Confident83Confident131 Ų13196.3 Ų96.369%0.68653%0.528SS*.Hα-helixtrans-63.5-45.3176.5-164.584.4000111.5E2828 I2829 N2834 S2835 L2836E2828-L2832 WeakPolarHBondContact O-CB 3.37Å; E2828-L2832 PolarHBondContact O-N 3.11Å; I2829-L2832 PolarHBondContact O-N 2.82Å; L2832-N2834 VanDerWaalsContact C-N 3.3Å; L2832-N2834 PolarHBondContact O-N 2.89Å; L2832-S2835 WeakPolarHBondContact O-CB 3.27Å; L2832-S2835 PolarHBondContact O-N 3.45Å; L2832-L2836 PolarHBondContact O-N 2.85Å
2833A90Very high84.5Confident41 Ų4199 Ų9934%0.33954%0.535SS..Hα-helixtrans-61.7-37.9175.900000112.1I2829 T2830 L2836 N2837I2829-A2833 VanDerWaalsContact O-CB 3.28Å; I2829-A2833 WeakPolarHBondContact O-CB 3.48Å; I2829-A2833 PolarHBondContact O-N 3.45Å; T2830-A2833 PolarHBondContact O-N 3.44Å; A2833-L2836 PolarHBondContact O-N 2.88Å; A2833-N2837 WeakPolarHBondContact O-CB 3.22Å; A2833-N2837 VanDerWaalsContact O-CG 3.29Å; A2833-N2837 PolarHBondContact O-N 3.26Å; A2833-N2837 PolarHBondContact O-ND2 3.45Å; A2833-N2837 VanDerWaalsContact O-ND2 3.1Å
2834N92Very high86Confident100 Ų100100.2 Ų100.254%0.53554%0.539SS..Hα-helixtrans-66.6-40.1174.5-75.3-28.1000112.2T2830 A2831 L2832 N2837 K2838T2830-N2834 VanDerWaalsContact O-CB 3.32Å; T2830-N2834 WeakPolarHBondContact O-CB 3.4Å; T2830-N2834 PolarHBondContact O-N 3.42Å; T2830-N2834 PolarHBondContact O-ND2 3.46Å; T2830-N2834 VanDerWaalsContact O-ND2 3.13Å; A2831-N2834 PolarHBondContact O-N 3.33Å; L2832-N2834 VanDerWaalsContact C-N 3.3Å; L2832-N2834 PolarHBondContact O-N 2.89Å; N2834-N2837 PolarHBondContact O-N 3.41Å; N2834-K2838 PolarHBondContact O-N 2.94Å
2835S91Very high87.3Confident68 Ų68102 Ų10248%0.47655%0.545SS..Hα-helixtrans-62.7-46.8174.1-167.70000111.6A2831 L2832 N2837 K2838 T2839A2831-S2835 PolarHBondContact O-N 3Å; L2832-S2835 WeakPolarHBondContact O-CB 3.27Å; L2832-S2835 PolarHBondContact O-N 3.45Å; S2835-N2837 VanDerWaalsContact C-N 3.34Å; S2835-N2837 PolarHBondContact O-N 2.91Å; S2835-K2838 WeakPolarHBondContact O-CB 3.45Å; S2835-K2838 PolarHBondContact O-N 3.38Å; S2835-K2838 VanDerWaalsContact O-N 3.07Å; S2835-T2839 PolarHBondContact O-N 3.08Å
2836L91.9Very high88.7Confident112 Ų112101.3 Ų101.359%0.58655%0.547SS*.Hα-helixtrans-60.2-42.4175.7-173.166.5000112L2832 A2833 K2838 T2839 V2840L2832-L2836 PolarHBondContact O-N 2.85Å; A2833-L2836 PolarHBondContact O-N 2.88Å; L2836-K2838 VanDerWaalsContact C-N 3.29Å; L2836-K2838 PolarHBondContact O-N 2.97Å; L2836-T2839 PolarHBondContact O-N 3.35Å; L2836-T2839 PolarHBondContact O-OG1 3.1Å; L2836-V2840 WeakPolarHBondContact O-CG2 3.39Å; L2836-V2840 PolarHBondContact O-N 2.88Å
2837N93.2Very high89.6Confident88 Ų88102.1 Ų102.147%0.47155%0.546SS..Hα-helixtrans-64.4-30.3175.4-79.2-37.4000113A2833 N2834 S2835 K2841A2833-N2837 WeakPolarHBondContact O-CB 3.22Å; A2833-N2837 VanDerWaalsContact O-CG 3.29Å; A2833-N2837 PolarHBondContact O-N 3.26Å; A2833-N2837 PolarHBondContact O-ND2 3.45Å; A2833-N2837 VanDerWaalsContact O-ND2 3.1Å; N2834-N2837 PolarHBondContact O-N 3.41Å; S2835-N2837 VanDerWaalsContact C-N 3.34Å; S2835-N2837 PolarHBondContact O-N 2.91Å; N2837-K2841 WeakPolarHBondContact O-CG 3.38Å; N2837-K2841 PolarHBondContact O-N 3.39Å
2838K93.3Very high90.2Very high127 Ų127101 Ų10155%0.55254%0.541SS*.Hα-helixtrans-67.5-45.9170.5-74-177.5174.6-168.10111.3N2834 S2835 L2836 V2840 K2841 A2842N2834-K2838 PolarHBondContact O-N 2.94Å; S2835-K2838 WeakPolarHBondContact O-CB 3.45Å; S2835-K2838 PolarHBondContact O-N 3.38Å; S2835-K2838 VanDerWaalsContact O-N 3.07Å; L2836-K2838 VanDerWaalsContact C-N 3.29Å; L2836-K2838 PolarHBondContact O-N 2.97Å; K2838-V2840 PolarHBondContact O-N 2.77Å; K2838-K2841 PolarHBondContact O-N 2.78Å; K2838-A2842 PolarHBondContact O-N 3.38Å
2839T91.1Very high90.7Very high82 Ų8297.5 Ų97.550%0.50353%0.532SS..Hα-helixtrans-64.4-38.9-179.656.70000112.5S2835 L2836 A2842 M2843S2835-T2839 PolarHBondContact O-N 3.08Å; L2836-T2839 PolarHBondContact O-N 3.35Å; L2836-T2839 PolarHBondContact O-OG1 3.1Å; T2839-A2842 PolarHBondContact O-N 3.47Å; T2839-M2843 PolarHBondContact O-N 2.95Å
2840V93.7Very high91.1Very high70 Ų7099 Ų9942%0.42453%0.534SS..Hα-helixtrans-61.8-49174.9173.80000111L2836 K2838 A2842 M2843 D2844L2836-V2840 WeakPolarHBondContact O-CG2 3.39Å; L2836-V2840 PolarHBondContact O-N 2.88Å; K2838-V2840 PolarHBondContact O-N 2.77Å; V2840-A2842 VanDerWaalsContact C-N 3.26Å; V2840-A2842 PolarHBondContact O-N 3.39Å; V2840-M2843 WeakPolarHBondContact O-CB 3.34Å; V2840-M2843 PolarHBondContact O-N 2.77Å; V2840-D2844 PolarHBondContact O-N 3.21Å
2841K92.1Very high91.2Very high144 Ų144100.6 Ų100.663%0.62654%0.537SS*.Hα-helixtrans-61.4-31.4177.4-73.8175.41801790113.6N2837 K2838 K2845N2837-K2841 WeakPolarHBondContact O-CG 3.38Å; N2837-K2841 PolarHBondContact O-N 3.39Å; K2838-K2841 PolarHBondContact O-N 2.78Å; K2841-K2845 WeakPolarHBondContact O-CG 3.38Å; K2841-K2845 PolarHBondContact O-N 3.07Å
2842A92.1Very high91.2Very high57 Ų57103.7 Ų103.747%0.47154%0.539SS..Hα-helixtrans-69.3-40.6173.600000111.6K2838 T2839 V2840 K2845 L2846K2838-A2842 PolarHBondContact O-N 3.38Å; T2839-A2842 PolarHBondContact O-N 3.47Å; V2840-A2842 VanDerWaalsContact C-N 3.26Å; V2840-A2842 PolarHBondContact O-N 3.39Å; A2842-K2845 PolarHBondContact O-N 2.95Å; A2842-L2846 PolarHBondContact O-N 3.46Å; A2842-L2846 VanDerWaalsContact O-N 3.08Å
2843M89.9Confident91.3Very high142 Ų142101.8 Ų101.870%0.753%0.529SS*.Hα-helixtrans-64.7-39.7177-168168.117900112.3T2839 V2840 L2846 N2847T2839-M2843 PolarHBondContact O-N 2.95Å; V2840-M2843 WeakPolarHBondContact O-CB 3.34Å; V2840-M2843 PolarHBondContact O-N 2.77Å; M2843-L2846 PolarHBondContact O-N 3.09Å; M2843-N2847 PolarHBondContact O-N 3.38Å
2844D92.5Very high91.1Very high93 Ų93102.7 Ų102.750%0.49753%0.533SS..Hα-helixtrans-62.2-45.8175.1-70-34.2000112.3V2840 L2846 N2847 E2848V2840-D2844 PolarHBondContact O-N 3.21Å; D2844-L2846 VanDerWaalsContact C-N 3.29Å; D2844-L2846 PolarHBondContact O-N 2.85Å; D2844-N2847 WeakPolarHBondContact O-CB 3.32Å; D2844-N2847 PolarHBondContact O-N 3.37Å; D2844-E2848 PolarHBondContact O-N 2.86Å
2845K91.5Very high91Very high155 Ų155105.3 Ų105.367%0.67454%0.54SS*.Hα-helixtrans-60.2-38.1175.1-75.5-179.2177.4-177.60112.2K2841 A2842 S2849K2841-K2845 WeakPolarHBondContact O-CG 3.38Å; K2841-K2845 PolarHBondContact O-N 3.07Å; A2842-K2845 PolarHBondContact O-N 2.95Å; K2845-S2849 WeakPolarHBondContact O-CB 3.4Å; K2845-S2849 PolarHBondContact O-N 3.43Å; K2845-S2849 VanDerWaalsContact O-N 3.14Å; K2845-S2849 PolarHBondContact O-OG 2.87Å
2846L92.5Very high90.8Very high124 Ų124107.6 Ų107.665%0.64955%0.546SS*.Hα-helixtrans-67-41.8177.5-170.668.7000111.1A2842 M2843 D2844 S2849 F2850A2842-L2846 PolarHBondContact O-N 3.46Å; A2842-L2846 VanDerWaalsContact O-N 3.08Å; M2843-L2846 PolarHBondContact O-N 3.09Å; D2844-L2846 VanDerWaalsContact C-N 3.29Å; D2844-L2846 PolarHBondContact O-N 2.85Å; L2846-S2849 WeakPolarHBondContact O-CB 3.5Å; L2846-S2849 PolarHBondContact O-N 3.09Å; L2846-F2850 PolarHBondContact O-N 2.92Å
2847N91.6Very high90.5Very high88 Ų88105.7 Ų105.747%0.47154%0.536SS..Hα-helixtrans-61.6-45.6176.2-17214.8000112M2843 D2844 S2849 F2850 Q2851M2843-N2847 PolarHBondContact O-N 3.38Å; D2844-N2847 WeakPolarHBondContact O-CB 3.32Å; D2844-N2847 PolarHBondContact O-N 3.37Å; N2847-S2849 VanDerWaalsContact C-N 3.27Å; N2847-S2849 PolarHBondContact O-N 2.96Å; N2847-F2850 PolarHBondContact O-N 2.71Å; N2847-Q2851 WeakPolarHBondContact O-CG 3.43Å; N2847-Q2851 PolarHBondContact O-N 2.7Å
2848E90.7Very high90.1Very high110 Ų110104.9 Ų104.951%0.51454%0.537SS..Hα-helixtrans-56.8-41.8172.5-79.6-161.1-173.200112.7D2844 F2850 Q2851 K2852D2844-E2848 PolarHBondContact O-N 2.86Å; E2848-F2850 VanDerWaalsContact C-N 3.35Å; E2848-Q2851 PolarHBondContact O-N 3.42Å; E2848-K2852 WeakPolarHBondContact O-CG 3.49Å; E2848-K2852 PolarHBondContact O-N 2.73Å; E2848-K2852 IonicContact OE2-NZ 3.72Å; E2848-K2852 PolarHBondContact OE2-NZ 2.04Å
2849S90.1Very high89.7Confident67 Ų67105.1 Ų105.147%0.46954%0.538SS..Hα-helixtrans-66.1-40.5-179-55.60000110.8K2845 L2846 N2847 K2852 L2853K2845-S2849 WeakPolarHBondContact O-CB 3.4Å; K2845-S2849 PolarHBondContact O-N 3.43Å; K2845-S2849 VanDerWaalsContact O-N 3.14Å; K2845-S2849 PolarHBondContact O-OG 2.87Å; L2846-S2849 WeakPolarHBondContact O-CB 3.5Å; L2846-S2849 PolarHBondContact O-N 3.09Å; N2847-S2849 VanDerWaalsContact C-N 3.27Å; N2847-S2849 PolarHBondContact O-N 2.96Å; S2849-K2852 PolarHBondContact O-N 2.86Å; S2849-L2853 WeakPolarHBondContact O-CB 3.48Å; S2849-L2853 PolarHBondContact O-N 3.05Å
2850F89.8Confident89.3Confident148 Ų148106.2 Ų106.265%0.64954%0.538SS*.Hα-helixtrans-64.7-41.8174.9-162.1-91.1000112.2L2846 N2847 E2848 K2852 L2853 S2854L2846-F2850 PolarHBondContact O-N 2.92Å; N2847-F2850 PolarHBondContact O-N 2.71Å; E2848-F2850 VanDerWaalsContact C-N 3.35Å; F2850-K2852 PolarHBondContact O-N 3.07Å; F2850-L2853 PolarHBondContact O-N 3.24Å; F2850-S2854 WeakPolarHBondContact O-CB 3.38Å; F2850-S2854 PolarHBondContact O-N 2.81Å
2851Q88.5Confident88.7Confident107 Ų107109.4 Ų109.450%0.555%0.546SS..Hα-helixtrans-63.3-38.9174.5-69.6-178.42100112.6N2847 E2848 K2855N2847-Q2851 WeakPolarHBondContact O-CG 3.43Å; N2847-Q2851 PolarHBondContact O-N 2.7Å; E2848-Q2851 PolarHBondContact O-N 3.42Å; Q2851-K2855 WeakPolarHBondContact O-CG 3.27Å; Q2851-K2855 PolarHBondContact O-N 3.04Å
2852K90.1Very high88.1Confident123 Ų123109.5 Ų109.554%0.53555%0.55SS.*Hα-helixtrans-63.8-45.6174-73.6160.7-179.61550110.9E2848 S2849 F2850 K2855 L2856E2848-K2852 WeakPolarHBondContact O-CG 3.49Å; E2848-K2852 PolarHBondContact O-N 2.73Å; E2848-K2852 IonicContact OE2-NZ 3.72Å; E2848-K2852 PolarHBondContact OE2-NZ 2.04Å; S2849-K2852 PolarHBondContact O-N 2.86Å; F2850-K2852 PolarHBondContact O-N 3.07Å; K2852-K2855 PolarHBondContact O-N 3.3Å; K2852-L2856 PolarHBondContact O-N 2.88Å
2853L89.1Confident87.6Confident91 Ų91111.8 Ų111.848%0.47655%0.551SS.*Hα-helixtrans-64.4-43.4178.4-175.463.6000112.6S2849 F2850 K2855 L2856 I2857S2849-L2853 WeakPolarHBondContact O-CB 3.48Å; S2849-L2853 PolarHBondContact O-N 3.05Å; F2850-L2853 PolarHBondContact O-N 3.24Å; L2853-K2855 VanDerWaalsContact C-N 3.29Å; L2853-K2855 PolarHBondContact O-N 3.19Å; L2853-L2856 WeakPolarHBondContact O-CB 3.13Å; L2853-L2856 PolarHBondContact O-N 3.3Å; L2853-I2857 HydrophobicContact CD1-CD1 4.34Å; L2853-I2857 HydrophobicContact CD1-CG1 4.45Å; L2853-I2857 HydrophobicContact CD2-CD1 4.46Å; L2853-I2857 HydrophobicContact CG-CD1 3.93Å; L2853-I2857 HydrophobicContact CG-CG1 4.44Å; L2853-I2857 WeakPolarHBondContact O-CG1 3.36Å; L2853-I2857 PolarHBondContact O-N 3.04Å
2854S87.2Confident86.9Confident60 Ų60110.2 Ų110.242%0.4254%0.541SS..Hα-helixtrans-58-39.2177178.40000112.7F2850 S2858F2850-S2854 WeakPolarHBondContact O-CB 3.38Å; F2850-S2854 PolarHBondContact O-N 2.81Å; S2854-S2858 WeakPolarHBondContact O-CB 3.25Å; S2854-S2858 PolarHBondContact O-N 3.38Å; S2854-S2858 PolarHBondContact O-OG 3.16Å
2855K89.1Confident86.2Confident156 Ų156108.8 Ų108.868%0.67854%0.537SS*.Hα-helixtrans-65.2-39.3173.6-74.2176.9179175.50112.5Q2851 K2852 L2853 K2859Q2851-K2855 WeakPolarHBondContact O-CG 3.27Å; Q2851-K2855 PolarHBondContact O-N 3.04Å; K2852-K2855 PolarHBondContact O-N 3.3Å; L2853-K2855 VanDerWaalsContact C-N 3.29Å; L2853-K2855 PolarHBondContact O-N 3.19Å; K2855-K2859 PolarHBondContact O-N 3.49Å
2856L87.8Confident85.5Confident115 Ų115108.5 Ų108.560%0.60254%0.536SS*.Hα-helixtrans-68.1-44.6176.9-69.1172.9000112.2K2852 L2853 S2858 K2859 Q2860K2852-L2856 PolarHBondContact O-N 2.88Å; L2853-L2856 WeakPolarHBondContact O-CB 3.13Å; L2853-L2856 PolarHBondContact O-N 3.3Å; L2856-S2858 VanDerWaalsContact C-N 3.35Å; L2856-S2858 PolarHBondContact O-N 3.43Å; L2856-K2859 WeakPolarHBondContact O-CB 3.48Å; L2856-K2859 PolarHBondContact O-N 3.06Å; L2856-K2859 VanDerWaalsContact O-N 3.13Å; L2856-Q2860 PolarHBondContact O-N 2.87Å
2857I84.9Confident84.7Confident73 Ų73108.9 Ų108.937%0.37454%0.535SS..Hα-helixtrans-59.8-46.2177.3-70.4171.7000110.7L2853 K2859 Q2860 F2861L2853-I2857 HydrophobicContact CD1-CD1 4.34Å; L2853-I2857 HydrophobicContact CD1-CG1 4.45Å; L2853-I2857 HydrophobicContact CD2-CD1 4.46Å; L2853-I2857 HydrophobicContact CG-CD1 3.93Å; L2853-I2857 HydrophobicContact CG-CG1 4.44Å; L2853-I2857 WeakPolarHBondContact O-CG1 3.36Å; L2853-I2857 PolarHBondContact O-N 3.04Å; I2857-K2859 PolarHBondContact O-N 3.24Å; I2857-Q2860 PolarHBondContact O-N 3.31Å; I2857-Q2860 VanDerWaalsContact O-N 3.14Å; I2857-F2861 HydrophobicContact CG2-CD2 3.65Å; I2857-F2861 HydrophobicContact CG2-CE2 3.46Å; I2857-F2861 VanDerWaalsContact CG2-CE2 3.46Å; I2857-F2861 WeakPolarHBondContact O-CD2 3.34Å; I2857-F2861 PolarHBondContact O-N 2.81Å
2858S84.1Confident83.7Confident70 Ų70111.1 Ų111.149%0.4954%0.542SS..Hα-helixtrans-56.2-38.8175.7-580000112.4S2854 L2856 M2862S2854-S2858 WeakPolarHBondContact O-CB 3.25Å; S2854-S2858 PolarHBondContact O-N 3.38Å; S2854-S2858 PolarHBondContact O-OG 3.16Å; L2856-S2858 VanDerWaalsContact C-N 3.35Å; L2856-S2858 PolarHBondContact O-N 3.43Å; S2858-M2862 WeakPolarHBondContact O-CG 3.33Å; S2858-M2862 PolarHBondContact O-N 3.25Å
2859K86Confident82.9Confident132 Ų132111.2 Ų111.257%0.57455%0.546SS*.Hα-helixtrans-68.7-42.9176.6-167.4-177176.1-169.60112.1K2855 L2856 I2857 F2861 M2862 E2863K2855-K2859 PolarHBondContact O-N 3.49Å; L2856-K2859 WeakPolarHBondContact O-CB 3.48Å; L2856-K2859 PolarHBondContact O-N 3.06Å; L2856-K2859 VanDerWaalsContact O-N 3.13Å; I2857-K2859 PolarHBondContact O-N 3.24Å; K2859-F2861 PolarHBondContact O-N 3.18Å; K2859-M2862 WeakPolarHBondContact O-CB 3.16Å; K2859-M2862 PolarHBondContact O-N 3.25Å; K2859-E2863 PolarHBondContact O-N 3.2Å
2860Q82.7Confident82.1Confident106 Ų106113.4 Ų113.450%0.49555%0.552SS.*Hα-helixtrans-66.7-35.6-179.2-165-178.422.300112.9L2856 I2857 M2862 E2863 K2864L2856-Q2860 PolarHBondContact O-N 2.87Å; I2857-Q2860 PolarHBondContact O-N 3.31Å; I2857-Q2860 VanDerWaalsContact O-N 3.14Å; Q2860-M2862 VanDerWaalsContact C-N 3.33Å; Q2860-M2862 PolarHBondContact O-N 3.35Å; Q2860-E2863 PolarHBondContact O-N 3.49Å; Q2860-K2864 PolarHBondContact O-N 3.36Å
2861F80.7Confident81Confident137 Ų137109.2 Ų109.260%0.60154%0.541SS*.Hα-helixtrans-64.2-36.6174.2-84.1-65.9000112.8I2857 K2859 E2863 S2865I2857-F2861 HydrophobicContact CG2-CD2 3.65Å; I2857-F2861 HydrophobicContact CG2-CE2 3.46Å; I2857-F2861 VanDerWaalsContact CG2-CE2 3.46Å; I2857-F2861 WeakPolarHBondContact O-CD2 3.34Å; I2857-F2861 PolarHBondContact O-N 2.81Å; K2859-F2861 PolarHBondContact O-N 3.18Å; F2861-E2863 VanDerWaalsContact C-N 3.34Å; F2861-S2865 WeakPolarHBondContact O-CB 3.29Å; F2861-S2865 PolarHBondContact O-N 3.46Å; F2861-S2865 PolarHBondContact O-OG 2.86Å
2862M78.9Confident79.9Confident145 Ų145107.1 Ų107.171%0.71454%0.538SS*.Hα-helixtrans-65.1-37.9175.1-67.2-77.3-8600111.6S2858 K2859 Q2860 K2866S2858-M2862 WeakPolarHBondContact O-CG 3.33Å; S2858-M2862 PolarHBondContact O-N 3.25Å; K2859-M2862 WeakPolarHBondContact O-CB 3.16Å; K2859-M2862 PolarHBondContact O-N 3.25Å; Q2860-M2862 VanDerWaalsContact C-N 3.33Å; Q2860-M2862 PolarHBondContact O-N 3.35Å; M2862-K2866 PolarHBondContact O-N 2.91Å
2863E81.6Confident78.9Confident105 Ų105106 Ų10649%0.49154%0.537SS..Hα-helixtrans-69-50.2176.6-71.8169.7179.700111.6K2859 Q2860 F2861 S2865 K2866 E2867K2859-E2863 PolarHBondContact O-N 3.2Å; Q2860-E2863 PolarHBondContact O-N 3.49Å; F2861-E2863 VanDerWaalsContact C-N 3.34Å; E2863-S2865 VanDerWaalsContact C-N 3.33Å; E2863-S2865 PolarHBondContact O-N 3.49Å; E2863-K2866 VanDerWaalsContact O-CB 3.27Å; E2863-K2866 WeakPolarHBondContact O-CB 3.45Å; E2863-K2866 PolarHBondContact O-N 2.92Å; E2863-E2867 PolarHBondContact O-N 2.98Å; E2863-E2867 VanDerWaalsContact O-N 3.12Å
2864K76.6Confident77.7Confident110 Ų110108.7 Ų108.748%0.47855%0.545SS..Hα-helixtrans-60.4-37.8177.6-79.5-173.7172.8-179.30113.8Q2860 K2866 E2867 Q2868Q2860-K2864 PolarHBondContact O-N 3.36Å; K2864-K2866 PolarHBondContact O-N 3.08Å; K2864-E2867 PolarHBondContact O-N 2.97Å; K2864-Q2868 PolarHBondContact O-N 2.94Å
2865S76.1Confident76.4Confident62 Ų62110.5 Ų110.543%0.43455%0.55SS.*Hα-helixtrans-61.9-34.4176.5-57.90000111.6F2861 E2863 L2869F2861-S2865 WeakPolarHBondContact O-CB 3.29Å; F2861-S2865 PolarHBondContact O-N 3.46Å; F2861-S2865 PolarHBondContact O-OG 2.86Å; E2863-S2865 VanDerWaalsContact C-N 3.33Å; E2863-S2865 PolarHBondContact O-N 3.49Å; S2865-L2869 WeakPolarHBondContact O-CG 3.41Å; S2865-L2869 PolarHBondContact O-N 3.44Å
2866K77.1Confident75Confident150 Ų150106.4 Ų106.465%0.65254%0.541SS*.Hα-helixtrans-71.2-40.7177.1-159.8177.6-177.7-177.80111.8M2862 E2863 K2864 L2870M2862-K2866 PolarHBondContact O-N 2.91Å; E2863-K2866 VanDerWaalsContact O-CB 3.27Å; E2863-K2866 WeakPolarHBondContact O-CB 3.45Å; E2863-K2866 PolarHBondContact O-N 2.92Å; K2864-K2866 PolarHBondContact O-N 3.08Å; K2866-L2870 WeakPolarHBondContact O-CG 3.26Å; K2866-L2870 PolarHBondContact O-N 3.48Å; K2866-L2870 VanDerWaalsContact O-N 3.16Å
2867E76.4Confident73.6Confident131 Ų131104.3 Ų104.361%0.61253%0.533SS*.Hα-helixtrans-65.2-44174.8-66.6-179.7152.300112.5E2863 K2864 L2869 L2870 S2871E2863-E2867 PolarHBondContact O-N 2.98Å; E2863-E2867 VanDerWaalsContact O-N 3.12Å; K2864-E2867 PolarHBondContact O-N 2.97Å; E2867-L2869 PolarHBondContact O-N 2.88Å; E2867-L2870 PolarHBondContact O-N 3.32Å; E2867-S2871 PolarHBondContact O-N 3.14Å
2868Q71Confident72.2Confident135 Ų135103.3 Ų103.363%0.63153%0.53SS*.Hα-helixtrans-61.9-43.9178.2-77.2-175.5-24.300111.9K2864 L2870 S2871 S2872K2864-Q2868 PolarHBondContact O-N 2.94Å; Q2868-L2870 PolarHBondContact O-N 3.05Å; Q2868-S2871 PolarHBondContact O-N 3.39Å; Q2868-S2871 PolarHBondContact O-OG 3.47Å; Q2868-S2872 PolarHBondContact O-N 3.03Å; Q2868-S2872 PolarHBondContact O-OG 3.2Å
2869L72.5Confident70.7Confident112 Ų112105.5 Ų105.559%0.58654%0.536SS*.Hα-helixtrans-57.8-48.4173.4-78.1166.8000111.7S2865 E2867 S2871 S2872 I2873S2865-L2869 WeakPolarHBondContact O-CG 3.41Å; S2865-L2869 PolarHBondContact O-N 3.44Å; E2867-L2869 PolarHBondContact O-N 2.88Å; L2869-S2871 VanDerWaalsContact C-N 3.35Å; L2869-S2871 PolarHBondContact O-N 2.83Å; L2869-S2872 PolarHBondContact O-N 3.3Å; L2869-S2872 PolarHBondContact O-OG 2.75Å; L2869-I2873 WeakPolarHBondContact O-CG1 3.47Å; L2869-I2873 PolarHBondContact O-N 3.09Å; L2869-I2873 VanDerWaalsContact O-N 3.11Å
2870L73.6Confident69.1Low113 Ų113107 Ų10759%0.59254%0.543SS*.Hα-helixtrans-58.1-43.4176-71.8167.8000112.8K2866 E2867 Q2868 I2873 F2874K2866-L2870 WeakPolarHBondContact O-CG 3.26Å; K2866-L2870 PolarHBondContact O-N 3.48Å; K2866-L2870 VanDerWaalsContact O-N 3.16Å; E2867-L2870 PolarHBondContact O-N 3.32Å; Q2868-L2870 PolarHBondContact O-N 3.05Å; L2870-I2873 PolarHBondContact O-N 3.28Å; L2870-F2874 WeakPolarHBondContact O-CB 3.5Å; L2870-F2874 PolarHBondContact O-N 3.05Å
2871S66.8Low67.4Low60 Ų60108.9 Ų108.942%0.4255%0.549SS..Hα-helixtrans-65.3-39.4179.174.50000113.3E2867 Q2868 L2869 F2874 N2875E2867-S2871 PolarHBondContact O-N 3.14Å; Q2868-S2871 PolarHBondContact O-N 3.39Å; Q2868-S2871 PolarHBondContact O-OG 3.47Å; L2869-S2871 VanDerWaalsContact C-N 3.35Å; L2869-S2871 PolarHBondContact O-N 2.83Å; S2871-F2874 PolarHBondContact O-N 3Å; S2871-N2875 WeakPolarHBondContact O-CB 3.2Å; S2871-N2875 PolarHBondContact O-N 2.91Å
2872S65.1Low65.9Low63 Ų63108.7 Ų108.744%0.44156%0.555SS.*Hα-helixtrans-66.1-40177.470.40000112.3Q2868 L2869 N2875 S2876Q2868-S2872 PolarHBondContact O-N 3.03Å; Q2868-S2872 PolarHBondContact O-OG 3.2Å; L2869-S2872 PolarHBondContact O-N 3.3Å; L2869-S2872 PolarHBondContact O-OG 2.75Å; S2872-N2875 PolarHBondContact O-N 3.3Å; S2872-S2876 PolarHBondContact O-N 3.45Å; S2872-S2876 PolarHBondContact O-OG 3.4Å
2873I69.1Low64.4Low100 Ų100110 Ų11051%0.51356%0.559SS.*Hα-helixtrans-63.8-46.6173.9-66.9165.8000109.5L2869 L2870 N2875 S2876 V2877L2869-I2873 WeakPolarHBondContact O-CG1 3.47Å; L2869-I2873 PolarHBondContact O-N 3.09Å; L2869-I2873 VanDerWaalsContact O-N 3.11Å; L2870-I2873 PolarHBondContact O-N 3.28Å; I2873-N2875 PolarHBondContact O-N 2.88Å; I2873-S2876 PolarHBondContact O-N 2.78Å; I2873-S2876 PolarHBondContact O-OG 3.01Å; I2873-V2877 WeakPolarHBondContact O-CG2 3.28Å; I2873-V2877 PolarHBondContact O-N 2.94Å; I2873-V2877 VanDerWaalsContact O-N 3.09Å
2874F65.2Low62.6Low148 Ų148111.6 Ų111.665%0.64957%0.571SS**Hα-helixtrans-59.9-44178.8-147.3-91.1000112.5L2870 S2871 V2877 T2878L2870-F2874 WeakPolarHBondContact O-CB 3.5Å; L2870-F2874 PolarHBondContact O-N 3.05Å; S2871-F2874 PolarHBondContact O-N 3Å; F2874-V2877 PolarHBondContact O-N 2.94Å; F2874-T2878 HydrophobicContact CD1-CG2 4.06Å; F2874-T2878 HydrophobicContact CE1-CG2 4.09Å; F2874-T2878 WeakPolarHBondContact O-CG2 3.46Å; F2874-T2878 PolarHBondContact O-N 2.93Å; F2874-T2878 PolarHBondContact O-OG1 2.9Å
2875N59.8Low60.9Low98 Ų98108.3 Ų108.352%0.52457%0.568SS.*Hα-helixtrans-69.5-32.5179.3-71.4-15.1000113.6S2871 S2872 I2873 T2878 N2879S2871-N2875 WeakPolarHBondContact O-CB 3.2Å; S2871-N2875 PolarHBondContact O-N 2.91Å; S2872-N2875 PolarHBondContact O-N 3.3Å; I2873-N2875 PolarHBondContact O-N 2.88Å; N2875-T2878 WeakPolarHBondContact CA-OG1 3.44Å; N2875-T2878 PolarHBondContact O-OG1 2.87Å; N2875-N2879 PolarHBondContact O-N 3.08Å
2876S58.7Low59.4Low70 Ų70113.5 Ų113.549%0.4959%0.591SS.*Hα-helixtrans-71.6-31.8173.766.60000112.6S2872 I2873 K2880S2872-S2876 PolarHBondContact O-N 3.45Å; S2872-S2876 PolarHBondContact O-OG 3.4Å; I2873-S2876 PolarHBondContact O-N 2.78Å; I2873-S2876 PolarHBondContact O-OG 3.01Å; S2876-K2880 PolarHBondContact O-N 3.16Å
2877V57.8Low57.8Low71 Ų71115.3 Ų115.343%0.4360%0.599SS.*Hα-helixtrans-77.8-32.7177.2172.60000112.4I2873 F2874 K2881I2873-V2877 WeakPolarHBondContact O-CG2 3.28Å; I2873-V2877 PolarHBondContact O-N 2.94Å; I2873-V2877 VanDerWaalsContact O-N 3.09Å; F2874-V2877 PolarHBondContact O-N 2.94Å; V2877-K2881 WeakPolarHBondContact O-CG 3.48Å; V2877-K2881 PolarHBondContact O-N 3.43Å
2878T56.3Low55.9Low52 Ų52117.7 Ų117.732%0.31961%0.607SS.*Hα-helixtrans-73.6-42.517649.10000112.3F2874 N2875 K2880 K2881 N2882F2874-T2878 HydrophobicContact CD1-CG2 4.06Å; F2874-T2878 HydrophobicContact CE1-CG2 4.09Å; F2874-T2878 WeakPolarHBondContact O-CG2 3.46Å; F2874-T2878 PolarHBondContact O-N 2.93Å; F2874-T2878 PolarHBondContact O-OG1 2.9Å; N2875-T2878 WeakPolarHBondContact CA-OG1 3.44Å; N2875-T2878 PolarHBondContact O-OG1 2.87Å; T2878-K2880 PolarHBondContact O-N 3.39Å; T2878-K2881 PolarHBondContact O-N 3.37Å; T2878-K2881 VanDerWaalsContact O-N 3.12Å; T2878-N2882 PolarHBondContact O-N 3.45Å
2879N53.6Low54.2Low115 Ų115121 Ų12162%0.61562%0.619SS**Hα-helixtrans-64-38.5176.7-79.8-12.3000112.5N2875 K2881 N2882N2875-N2879 PolarHBondContact O-N 3.08Å; N2879-K2881 VanDerWaalsContact C-N 3.29Å; N2879-K2881 PolarHBondContact O-N 3.2Å; N2879-N2882 PolarHBondContact O-N 2.8Å
2880K50.6Low52.2Low164 Ų164126.6 Ų126.671%0.71365%0.649SS**Hα-helixtrans-67.7-22.3173.3-96.9-174.9171.7-178.60114.7S2876 T2878S2876-K2880 PolarHBondContact O-N 3.16Å; T2878-K2880 PolarHBondContact O-N 3.39Å
2881K47.6Very low51.1Low146 Ų146127.3 Ų127.364%0.63565%0.652SS**Hα-helixtrans-81.1-19.7178.1-82.1-178.5175.6-177.10114V2877 T2878 N2879 G2885V2877-K2881 WeakPolarHBondContact O-CG 3.48Å; V2877-K2881 PolarHBondContact O-N 3.43Å; T2878-K2881 PolarHBondContact O-N 3.37Å; T2878-K2881 VanDerWaalsContact O-N 3.12Å; N2879-K2881 VanDerWaalsContact C-N 3.29Å; N2879-K2881 PolarHBondContact O-N 3.2Å; K2881-G2885 PolarHBondContact O-N 2.92Å
2882N48.9Very low50.3Low133 Ų133130.8 Ų130.871%0.71166%0.664SS**Hα-helixtrans-81.4-22.9-179.7-74.1-15.4000113.5T2878 N2879T2878-N2882 PolarHBondContact O-N 3.45Å; N2879-N2882 PolarHBondContact O-N 2.8Å
2883E47.5Very low49.4Very low173 Ų173134.6 Ų134.681%0.80868%0.676SS**Hα-helixtrans-86.6-30.5177.4-67-173.9137.700113.3
2884D44.4Very low48.3Very low137 Ų137136.6 Ų136.673%0.73369%0.686SS**Hα-helixtrans-92.5-7177.8-82.5-40.3000114.4N2886D2884-N2886 PolarHBondContact O-N 2.96Å
2885G41.6Very low47.2Very low41 Ų41135.9 Ų135.942%0.42369%0.688SS.*G310 helixtrans-74.3-21.2-171.400000116.2K2881 K2887K2881-G2885 PolarHBondContact O-N 2.92Å; G2885-K2887 PolarHBondContact O-N 2.97Å
2886N43.6Very low46.4Very low172 Ų172138.4 Ų138.492%0.9270%0.699SS**G310 helixtrans-74.721.8-177-109.9-12.9000114.3D2884D2884-N2886 PolarHBondContact O-N 2.96Å
2887K44Very low45.5Very low188 Ų188143.3 Ų143.382%0.81771%0.714SS**G310 helixtrans-125.8-8.8179.9-81-179.6176.7170.30115.9G2885G2885-K2887 PolarHBondContact O-N 2.97Å
2888K35.6Very low44.6Very low181 Ų181148.8 Ų148.879%0.78774%0.736SS**  trans-156.8141.6171.3-67.4-169.9-179.5177.80112.5
2889K35.2Very low43.6Very low203 Ų203156.9 Ų156.988%0.88377%0.771SS**  cis4398.7-35.4-62.9-177.3-179.8178.70118
2890L30.3Very low42.7Very low230 Ų230160.7 Ų160.7100%1.20479%0.785SS**  cis-45.904.5-81.670.7000114.9

Retrieved 2,890 of 2,890 residues in 2086.3 ms (Link to these results)

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