Z4YKX0_MOUSE Loading...

Hepatic nuclear factor 4, alpha

AlphaFold DB , UniProt , Accession Z4YKX0, Species MOUSE (Mus musculus, Mouse), Gene Hnf4a, Length 465 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M36.3Very low32.5Very low246 Ų246150.1 Ų150.1100%1.21284%0.843SS**  0111.70-95.9177.3172.100106.8
2D30.5Very low32.6Very low164 Ų164148.2 Ų148.288%0.87784%0.842SS**PPolyproline II helixtrans-62.1139.8-165.6-62.2-76000114.7
3M27.8Very low32.6Very low194 Ų194142.8 Ų142.896%0.95683%0.826SS**PPolyproline II helixtrans-76.6117.4162.8-122.8-167.1-167.600107.6D5M3-D5 PolarHBondContact O-N 2.97Å
4A33.8Very low33.5Very low90 Ų90139.1 Ų139.174%0.74479%0.793SS**PPolyproline II helixtrans-74.6117.317500000110.5Y6A4-Y6 PolarHBondContact O-N 3.44Å
5D30.7Very low34Very low139 Ų139135.9 Ų135.974%0.74378%0.777SS**PPolyproline II helixtrans-65.9116.6173.2-152.5-20.2000110M3 S7M3-D5 PolarHBondContact O-N 2.97Å; D5-S7 WeakPolarHBondContact OD1-CB 3.24Å; D5-S7 PolarHBondContact OD1-OG 2.97Å
6Y31.3Very low34.7Very low230 Ų230133 Ų13390%0.90276%0.763SS**  trans-108.960.4177-119.1-86.7000109.4A4A4-Y6 PolarHBondContact O-N 3.44Å
7S33.9Very low35Very low96 Ų96130.8 Ų130.867%0.67175%0.747SS**  trans-119.134.1-178.555.60000113.3D5D5-S7 WeakPolarHBondContact OD1-CB 3.24Å; D5-S7 PolarHBondContact OD1-OG 2.97Å
8A34.6Very low35.7Very low91 Ų91129.2 Ų129.275%0.75273%0.733SS**  trans-128.1127.4173.400000112.9
9A34.6Very low36.5Very low100 Ų100126.2 Ų126.283%0.82671%0.71SS**  trans84.560.5172.200000117.8
10L33.7Very low36.9Very low170 Ų170126.8 Ų126.889%0.8971%0.707SS**  trans-98108.6143.6-70.7174.6000108
11D30.6Very low37Very low131 Ų131126.9 Ų126.970%0.70171%0.706SS**  trans-63.3123.9166.8-171.5-17.7000108.7A13D11-A13 PolarHBondContact O-N 3.34Å; D11-A13 VanDerWaalsContact O-N 3.1Å; D11-A13 PolarHBondContact OD1-N 2.96Å
12P32.8Very low37.3Very low127 Ų127120 Ų12083%0.82568%0.678SS**THydrogen-bonded Turntrans-69.5-0.6-176.3-15.929.8000115.2Y14P12-Y14 PolarHBondContact O-N 3.19Å
13A33.8Very low37.6Very low78 Ų78120.6 Ų120.665%0.64568%0.675SS**THydrogen-bonded Turntrans-83.73.1-171.300000116.6D11D11-A13 PolarHBondContact O-N 3.34Å; D11-A13 VanDerWaalsContact O-N 3.1Å; D11-A13 PolarHBondContact OD1-N 2.96Å
14Y44.3Very low38.2Very low92 Ų92117.4 Ų117.436%0.36167%0.667SS.*  trans-112.566.7-167.9-153.9-92.3000114.5P12 E18 R91P12-Y14 PolarHBondContact O-N 3.19Å; Y14-E18 HydrophobicContact CE2-CG 4.18Å; Y14-E18 WeakPolarHBondContact CE2-OE1 3.36Å; Y14-E18 WeakPolarHBondContact CE2-OE2 3.25Å; Y14-E18 PolarHBondContact OH-OE2 2.71Å; Y14-R91 PolarHBondContact OH-NH1 2.94Å
15T41.9Very low37.9Very low91 Ų91121.1 Ų121.156%0.55867%0.673SS**SBendtrans-88162.4159.345.90000110.3L17T15-L17 PolarHBondContact O-N 2.77Å
16T44.1Very low37.9Very low89 Ų89120.5 Ų120.555%0.54667%0.674SS.*G310 helixtrans-48.92.8-175.539.80000118.5E18T16-E18 PolarHBondContact O-N 3.15Å
17L40.3Very low38Very low95 Ų95118.1 Ų118.150%0.49767%0.674SS.*G310 helixtrans-68-23.6-177.7-71.1164000114.3T15 F19 E20T15-L17 PolarHBondContact O-N 2.77Å; L17-F19 PolarHBondContact O-N 2.95Å; L17-E20 PolarHBondContact O-N 3.23Å
18E47.6Very low37.7Very low103 Ų103117 Ų11748%0.48168%0.677SS.*G310 helixtrans-65.4-20.1179.1-89.2-163.1-174.900114Y14 T16Y14-E18 HydrophobicContact CE2-CG 4.18Å; Y14-E18 WeakPolarHBondContact CE2-OE1 3.36Å; Y14-E18 WeakPolarHBondContact CE2-OE2 3.25Å; Y14-E18 PolarHBondContact OH-OE2 2.71Å; T16-E18 PolarHBondContact O-N 3.15Å
19F51Low37.3Very low71 Ų71119.4 Ų119.431%0.31168%0.677SS.*THydrogen-bonded Turntrans-104.4-12.6179.9-65.7-74.9000113.9L17 Y105 K109 F112L17-F19 PolarHBondContact O-N 2.95Å; F19-Y105 HydrophobicContact CZ-CE2 4.16Å; F19-K109 HydrophobicContact CE1-CB 4.13Å; F19-K109 HydrophobicContact CE1-CG 4.07Å; F19-F112 HydrophobicContact CD1-CD2 4.03Å; F19-F112 HydrophobicContact CE1-CD2 4.49Å
20E44.8Very low37Very low138 Ų138122.6 Ų122.665%0.64568%0.681SS**THydrogen-bonded Turntrans-80.6-23.8175.8-74.4179.1159.700112.2L17L17-E20 PolarHBondContact O-N 3.23Å
21N39Very low36.8Very low129 Ų129119.7 Ų119.769%0.6967%0.67SS**  trans-104.511.9-172.1-72.6-30.1000116.1Q23N21-Q23 PolarHBondContact O-N 3.19Å
22V42.9Very low36.7Very low101 Ų101118.7 Ų118.761%0.61267%0.673SS**  trans-82.771.5173-173.10000109.6
23Q36.4Very low36.9Very low177 Ų177118.7 Ų118.783%0.82767%0.674SS**  trans-82144.2159.4-80.4-176.2-6.800110N21 L25N21-Q23 PolarHBondContact O-N 3.19Å; Q23-L25 PolarHBondContact O-N 3.31Å
24V39.4Very low37.2Very low128 Ų128120.3 Ų120.378%0.77668%0.68SS**  trans-58.8118-171.6176.10000111.4T26V24-T26 HydrophobicContact CG1-CG2 4.36Å
25L27.6Very low36.6Very low167 Ų167125.5 Ų125.587%0.87471%0.708SS**  trans-87.1106.7159.6-71.1175.2000108.7Q23Q23-L25 PolarHBondContact O-N 3.31Å
26T32Very low36.2Very low126 Ų126124.9 Ų124.977%0.77372%0.719SS**  trans-67.8127.6162.241.20000109.8V24V24-T26 HydrophobicContact CG1-CG2 4.36Å
27M32.2Very low35.9Very low181 Ų181125.1 Ų125.189%0.89273%0.73SS**  trans-108.1117161.9-68.6-72-80.100107.6
28G27.1Very low35.5Very low72 Ų72128 Ų12874%0.74275%0.746SS**  trans-75.2-177162.500000110.5
29N27.8Very low35.2Very low141 Ų141130.2 Ų130.275%0.75476%0.761SS**  cis-165.7132.9-1.8-171.649.7000103.7
30D26.6Very low34.5Very low167 Ų167133.8 Ų133.889%0.89378%0.783SS**  trans-138.9136.4161-93.9-32.8000109
31T29.8Very low33.9Very low110 Ų110132.6 Ų132.668%0.67579%0.79SS**  trans-86.6130.7-155.627.50000116.3
32S29.3Very low34Very low109 Ų109131.8 Ų131.876%0.76279%0.794SS**  trans67.4159.2134.2-45.20000121.5
33P37.2Very low33.9Very low128 Ų128134.3 Ų134.383%0.83180%0.804SS**  cis-129.2174.62.138-19.1000115.8
34S39.4Very low34Very low112 Ų112131.7 Ų131.778%0.78381%0.806SS**  trans-91.4131-178.647.70000114.3
35E32.9Very low34.4Very low201 Ų201133.9 Ų133.994%0.93981%0.812SS**  trans-150.9131.4146.9-71.1-164.3137.900106.4
36G31.9Very low35.3Very low78 Ų78128.4 Ų128.480%0.80480%0.796SS**  105.6123.58300000109.8
37A38.6Very low36.3Very low93 Ų93129 Ų12977%0.76980%0.799SS**  trans-58.4142.8-170.400000116.3
38N31Very low37.5Very low157 Ų157125.7 Ų125.784%0.8479%0.793SS**  169.3159.4118.7-94.6-33.9000114.5
39L42.3Very low40.1Very low149 Ų149125 Ų12578%0.7878%0.781SS**  trans-58.5156.7-173.1-83.783.5000116.7
40N36.8Very low43.3Very low146 Ų146123.2 Ų123.278%0.78177%0.771SS**  trans78.8102.5155.9-75.8-5.6000119.4
41S32.1Very low46.7Very low113 Ų113115.4 Ų115.479%0.7973%0.73SS**  -177.9127.3109.6-82.40000112.9
42S40.5Very low49.9Very low111 Ų111112.9 Ų112.978%0.77672%0.72SS**  trans20.1133.2148.654.90000122.2
43N40.2Very low53.2Low155 Ų155107.7 Ų107.783%0.82968%0.684SS**  trans86.978.3157.9-86.66.4000120.2
44S40.3Very low56Low122 Ų122101.9 Ų101.985%0.85365%0.646SS**  trans-122.230.4156.569.70000114.2G46S44-G46 VanDerWaalsContact C-N 3.28Å; S44-G46 PolarHBondContact O-N 3.46Å
45L46.3Very low58.7Low174 Ų17498.8 Ų98.891%0.91163%0.631SS**THydrogen-bonded Turntrans-74.975.1167.4-85.594.9000110.7
46G48.1Very low61.8Low52 Ų5290.7 Ų90.754%0.53660%0.595SS.*THydrogen-bonded Turntrans-136.4-31.4-17900000116.5S44S44-G46 VanDerWaalsContact C-N 3.28Å; S44-G46 PolarHBondContact O-N 3.46Å
47V52.3Low64.9Low139 Ų13996.5 Ų96.584%0.84259%0.592SS**SBendtrans-106.2-15.6-164.8-168.30000113.6
48S56.9Low67.6Low110 Ų11092.9 Ų92.977%0.76956%0.562SS**SBendtrans-96.33.7-179.8-72.70000115.4
49A82Confident70.7Confident59 Ų5988.9 Ų88.949%0.48854%0.543SS..SBendtrans-91.7-10.3-176.300000114.6A58A49-A58 PolarHBondContact O-N 3.24Å
50L95.4Very high73.1Confident102 Ų10283.2 Ų83.253%0.53452%0.522SS..BIsolated β-bridgetrans-116145.7-173.5-59.5177.6000112.5A52 S66L50-A52 PolarHBondContact O-N 3.42Å; L50-S66 PolarHBondContact O-OG 3.22Å
51C97.6Very high75.9Confident4 Ų484.8 Ų84.83%0.02752%0.521CS..  trans-73.1119.8177.6174.10000109.9I53 C54 G55 D56 C68C51-I53 PolarHBondContact O-N 3.05Å; C51-C54 PolarHBondContact O-N 3.18Å; C51-C54 VanDerWaalsContact SG-SG 3.68Å; C51-G55 WeakPolarHBondContact O-CA 3.46Å; C51-G55 PolarHBondContact O-N 3.48Å; C51-D56 WeakPolarHBondContact CB-O 3.34Å; C51-D56 PolarHBondContact N-O 2.98Å; C51-C68 HydrophobicContact CB-CB 4.13Å; C51-C68 PolarHBondContact SG-N 2.77Å; C51-C68 VanDerWaalsContact SG-N 3.45Å; C51-C68 VanDerWaalsContact SG-SG 3.67Å
52A97.1Very high79Confident57 Ų5780.6 Ų80.647%0.47149%0.489SS..THydrogen-bonded Turntrans-62.4-12.6-179.900000114.2L50 S66 A114L50-A52 PolarHBondContact O-N 3.42Å; A52-S66 PolarHBondContact N-O 2.97Å; A52-A114 HydrophobicContact CB-CB 4.06Å
53I98.2Very high81.7Confident0 Ų077.2 Ų77.20%046%0.46CS..THydrogen-bonded Turntrans-94.1-46.7-179.1-58.890.2000111.9C51 C71 V95 R107 K110 A114 M116C51-I53 PolarHBondContact O-N 3.05Å; I53-C71 HydrophobicContact CB-CB 4.31Å; I53-C71 HydrophobicContact CD1-CB 4.27Å; I53-C71 HydrophobicContact CG1-CB 4.48Å; I53-V95 HydrophobicContact CG2-CG1 4.07Å; I53-V95 WeakPolarHBondContact O-CG1 3.36Å; I53-R107 HydrophobicContact CG2-CG 4.36Å; I53-K110 HydrophobicContact CG2-CB 4.32Å; I53-K110 HydrophobicContact CG2-CD 4.4Å; I53-K110 HydrophobicContact CG2-CG 4.27Å; I53-K110 WeakPolarHBondContact O-CD 3.27Å; I53-K110 WeakPolarHBondContact O-CE 3.35Å; I53-K110 PolarHBondContact O-NZ 3.32Å; I53-A114 HydrophobicContact CD1-CB 4.2Å; I53-A114 HydrophobicContact CG1-CB 4.02Å; I53-M116 HydrophobicContact CD1-CE 3.71Å; I53-M116 HydrophobicContact CD1-SD 4.26Å
54C97.1Very high84.3Confident5 Ų572.4 Ų72.43%0.03445%0.447CS..THydrogen-bonded Turntrans-130.62.2-17070.90000114.4C51 D56 C68 V95 D96 K97 R100C51-C54 PolarHBondContact O-N 3.18Å; C51-C54 VanDerWaalsContact SG-SG 3.68Å; C54-D56 PolarHBondContact O-N 3.41Å; C54-D56 VanDerWaalsContact O-N 3.15Å; C54-D56 WeakPolarHBondContact SG-CB 3.36Å; C54-C68 VanDerWaalsContact SG-SG 3.69Å; C54-V95 HydrophobicContact CB-CG1 4.17Å; C54-D96 CarbonylContact O-C 3.57Å; C54-D96 WeakPolarHBondContact O-CA 3.25Å; C54-K97 PolarHBondContact O-N 3.08Å; C54-R100 HydrophobicContact CB-CB 4.11Å; C54-R100 PolarHBondContact SG-NH1 3.21Å; C54-R100 VanDerWaalsContact SG-NH1 3.37Å
55G95.8Very high87Confident47 Ų4766.8 Ų66.849%0.48541%0.408SS..SBendtrans712.3-179.400000115.3C51C51-G55 WeakPolarHBondContact O-CA 3.46Å; C51-G55 PolarHBondContact O-N 3.48Å
56D96.8Very high89.4Confident32 Ų3260 Ų6017%0.17138%0.375CS..SBendtrans-70.2165.5172.8-166.113.5000111C51 C54 A58 C68 K97 R100C51-D56 WeakPolarHBondContact CB-O 3.34Å; C51-D56 PolarHBondContact N-O 2.98Å; C54-D56 PolarHBondContact O-N 3.41Å; C54-D56 VanDerWaalsContact O-N 3.15Å; C54-D56 WeakPolarHBondContact SG-CB 3.36Å; D56-A58 PolarHBondContact O-N 3.48Å; D56-C68 HydrophobicContact CB-CB 4.28Å; D56-K97 HydrophobicContact CB-CB 4.39Å; D56-K97 HydrophobicContact CB-CG 4.12Å; D56-R100 IonicContact OD2-CZ 3.52Å; D56-R100 IonicContact OD2-NH1 2.78Å; D56-R100 PolarHBondContact OD2-NH1 3.4Å; D56-R100 IonicContact OD2-NH2 3.46Å; D56-R100 PolarHBondContact OD2-NH2 2.95Å
57R96.8Very high91.8Very high200 Ų20057.5 Ų57.576%0.75535%0.349SS*.BIsolated β-bridgetrans-59.6123.4179-179.9173.9147.9-157.3-5.7110.9C68R57-C68 VanDerWaalsContact O-CB 3.25Å; R57-C68 WeakPolarHBondContact O-CB 3.46Å
58A96.8Very high94Very high16 Ų1651 Ų5113%0.13231%0.31CS..PPolyproline II helixtrans-73.5141.817700000110.7A49 D56 S66A49-A58 PolarHBondContact O-N 3.24Å; D56-A58 PolarHBondContact O-N 3.48Å; A58-S66 WeakPolarHBondContact CB-OG 3.44Å
59T95.2Very high95.9Very high73 Ų7350.3 Ų50.345%0.44830%0.297SS..  trans-99.6-5.8172.855.50000112.1H62 S67 D69T59-H62 PolarHBondContact OG1-NE2 3.35Å; T59-S67 PolarHBondContact N-O 3.17Å; T59-S67 PolarHBondContact OG1-O 2.82Å; T59-D69 WeakPolarHBondContact CG2-OD2 3.38Å; T59-D69 PolarHBondContact OG1-OD1 2.92Å
60G93.4Very high96.6Very high31 Ų3148.8 Ų48.832%0.3229%0.287SS..EExtended strand (participates in β ladder)trans147.2-165.7177.100000111.7S66 S67G60-S66 WeakPolarHBondContact O-CA 3.48Å; G60-S67 PolarHBondContact O-N 3.31Å
61K95.9Very high96.8Very high178 Ų17843.9 Ų43.977%0.77426%0.262SS*.EExtended strand (participates in β ladder)trans-84.8121.5171-69.9-175.3179179.70109.6A65K61-A65 WeakPolarHBondContact CA-O 3.46Å
62H96.9Very high96.8Very high26 Ų2646.8 Ų46.812%0.1227%0.274CS..EExtended strand (participates in β ladder)trans-124.2127.5174.2-52.1-70.5000109.6T59 G64 A65 S67 K72T59-H62 PolarHBondContact OG1-NE2 3.35Å; H62-G64 PolarHBondContact O-N 3.49Å; H62-G64 VanDerWaalsContact O-N 3.14Å; H62-A65 PolarHBondContact N-O 3.37Å; H62-A65 PolarHBondContact O-N 2.9Å; H62-S67 WeakPolarHBondContact CB-OG 3.39Å; H62-S67 PolarHBondContact CD2-O 2.72Å; H62-S67 PolarHBondContact CD2-OG 2.8Å; H62-S67 VanDerWaalsContact CD2-OG 3.29Å; H62-K72 HydrophobicContact CB-CB 4.02Å; H62-K72 HydrophobicContact CB-CD 4.24Å; H62-K72 HydrophobicContact CB-CG 3.87Å; H62-K72 PolarHBondContact CE1-NZ 3.42Å; H62-K72 WeakPolarHBondContact ND1-CD 3.3Å; H62-K72 WeakPolarHBondContact ND1-CE 3.46Å; H62-K72 PolarHBondContact ND1-NZ 2.94Å
63Y97.1Very high96.8Very high39 Ų3944.5 Ų44.515%0.15326%0.256CS..THydrogen-bonded Turntrans5526.3-178.4-43.7-66.8000114.6K72 F75 R76 M116 K117 A120 V121Y63-K72 HydrophobicContact CE2-CB 4.45Å; Y63-K72 HydrophobicContact CE2-CG 3.8Å; Y63-K72 WeakPolarHBondContact CE2-O 3.2Å; Y63-F75 AromaticContact CD2-CD1 3.6Å; Y63-F75 HydrophobicContact CD2-CD1 3.6Å; Y63-F75 HydrophobicContact CD2-CE1 4.32Å; Y63-F75 HydrophobicContact CD2-CG 4.45Å; Y63-F75 HydrophobicContact CE2-CD1 4.21Å; Y63-F75 AromaticContact CG-CD1 3.89Å; Y63-F75 HydrophobicContact CG-CD1 3.89Å; Y63-F75 HydrophobicContact CG-CE1 4.16Å; Y63-R76 HydrophobicContact CE2-CB 4.34Å; Y63-R76 WeakPolarHBondContact OH-CB 3.47Å; Y63-R76 VanDerWaalsContact OH-CD 3.31Å; Y63-R76 WeakPolarHBondContact OH-CD 3.25Å; Y63-M116 CarbonylContact O-C 3.43Å; Y63-M116 VanDerWaalsContact O-CA 3.31Å; Y63-M116 WeakPolarHBondContact O-CA 3.46Å; Y63-K117 WeakPolarHBondContact O-CB 3.45Å; Y63-K117 PolarHBondContact O-N 3.12Å; Y63-A120 HydrophobicContact CD1-CB 4.07Å; Y63-A120 WeakPolarHBondContact CD1-O 3.45Å; Y63-V121 HydrophobicContact CD1-CG2 3.74Å; Y63-V121 HydrophobicContact CE1-CB 4.41Å; Y63-V121 HydrophobicContact CE1-CG2 3.81Å; Y63-V121 HydrophobicContact CG-CG2 4.25Å
64G94.8Very high96.8Very high54 Ų5445 Ų4556%0.55726%0.258SS*.THydrogen-bonded Turntrans104.4-13.317900000115.5H62H62-G64 PolarHBondContact O-N 3.49Å; H62-G64 VanDerWaalsContact O-N 3.14Å
65A96.1Very high96.8Very high4 Ų444.8 Ų44.83%0.03326%0.257CS..EExtended strand (participates in β ladder)trans-122.8143.6-178.200000113.3K61 H62 S67 A114 M116K61-A65 WeakPolarHBondContact CA-O 3.46Å; H62-A65 PolarHBondContact N-O 3.37Å; H62-A65 PolarHBondContact O-N 2.9Å; A65-S67 PolarHBondContact O-N 3.15Å; A65-S67 PolarHBondContact O-OG 3.48Å; A65-A114 HydrophobicContact CB-CB 4.35Å; A65-A114 WeakPolarHBondContact CB-O 3.4Å; A65-M116 HydrophobicContact CB-CG 3.72Å
66S97.4Very high96.9Very high31 Ų3147 Ų4722%0.21725%0.25CS..EExtended strand (participates in β ladder)trans-62.5117169.8-176.40000110.2L50 A52 A58 G60L50-S66 PolarHBondContact O-OG 3.22Å; A52-S66 PolarHBondContact N-O 2.97Å; A58-S66 WeakPolarHBondContact CB-OG 3.44Å; G60-S66 WeakPolarHBondContact O-CA 3.48Å
67S97.8Very high96.8Very high0 Ų051.9 Ų51.90%027%0.266CS..EExtended strand (participates in β ladder)trans-151.1160.4-172.652.50000114.3T59 G60 H62 A65 M116T59-S67 PolarHBondContact N-O 3.17Å; T59-S67 PolarHBondContact OG1-O 2.82Å; G60-S67 PolarHBondContact O-N 3.31Å; H62-S67 WeakPolarHBondContact CB-OG 3.39Å; H62-S67 PolarHBondContact CD2-O 2.72Å; H62-S67 PolarHBondContact CD2-OG 2.8Å; H62-S67 VanDerWaalsContact CD2-OG 3.29Å; A65-S67 PolarHBondContact O-N 3.15Å; A65-S67 PolarHBondContact O-OG 3.48Å; S67-M116 WeakPolarHBondContact OG-CE 3.39Å
68C97.9Very high96.8Very high3 Ų342.5 Ų42.52%0.0223%0.231CC..  trans-84.1164.3170.863.60000111.8C51 C54 D56 R57 G70 C71 K72 R100C51-C68 HydrophobicContact CB-CB 4.13Å; C51-C68 PolarHBondContact SG-N 2.77Å; C51-C68 VanDerWaalsContact SG-N 3.45Å; C51-C68 VanDerWaalsContact SG-SG 3.67Å; C54-C68 VanDerWaalsContact SG-SG 3.69Å; D56-C68 HydrophobicContact CB-CB 4.28Å; R57-C68 VanDerWaalsContact O-CB 3.25Å; R57-C68 WeakPolarHBondContact O-CB 3.46Å; C68-G70 PolarHBondContact O-N 3.15Å; C68-C71 PolarHBondContact O-N 3.23Å; C68-C71 VanDerWaalsContact O-N 3.12Å; C68-C71 VanDerWaalsContact SG-SG 3.7Å; C68-K72 WeakPolarHBondContact O-CB 3.48Å; C68-K72 PolarHBondContact O-N 2.95Å; C68-R100 PolarHBondContact SG-NH1 3.2Å
69D97.7Very high96.7Very high95 Ų9542.8 Ų42.851%0.50823%0.231SC..Hα-helixtrans-58.8-32.9178.3-67.1-28.1000113.2T59 G73T59-D69 WeakPolarHBondContact CG2-OD2 3.38Å; T59-D69 PolarHBondContact OG1-OD1 2.92Å; D69-G73 PolarHBondContact O-N 3.46Å
70G97.7Very high96.5Very high27 Ų2743.9 Ų43.928%0.27823%0.227SC..Hα-helixtrans-62.6-45.5176.400000112.6C68 F74 R107C68-G70 PolarHBondContact O-N 3.15Å; G70-F74 VanDerWaalsContact O-CB 3.25Å; G70-F74 WeakPolarHBondContact O-CB 3.38Å; G70-F74 PolarHBondContact O-N 3.35Å; G70-R107 VanDerWaalsContact C-NH2 3.32Å; G70-R107 PolarHBondContact O-NH2 3.42Å
71C98.3Very high96.4Very high0 Ų049.5 Ų49.50%024%0.243CC..Hα-helixtrans-76.8-35.7179-66.60000112I53 C68 F74 F75 R107I53-C71 HydrophobicContact CB-CB 4.31Å; I53-C71 HydrophobicContact CD1-CB 4.27Å; I53-C71 HydrophobicContact CG1-CB 4.48Å; C68-C71 PolarHBondContact O-N 3.23Å; C68-C71 VanDerWaalsContact O-N 3.12Å; C68-C71 VanDerWaalsContact SG-SG 3.7Å; C71-F74 PolarHBondContact O-N 3.15Å; C71-F75 WeakPolarHBondContact O-CB 3.34Å; C71-F75 PolarHBondContact O-N 3.31Å; C71-R107 PolarHBondContact SG-NH2 3.01Å
72K97.8Very high96.1Very high65 Ų6545.9 Ų45.928%0.28323%0.232SC..Hα-helixtrans-54.1-54.2168.8173.7-169.6-171.8162.50111.5H62 Y63 C68 F75 R76H62-K72 HydrophobicContact CB-CB 4.02Å; H62-K72 HydrophobicContact CB-CD 4.24Å; H62-K72 HydrophobicContact CB-CG 3.87Å; H62-K72 PolarHBondContact CE1-NZ 3.42Å; H62-K72 WeakPolarHBondContact ND1-CD 3.3Å; H62-K72 WeakPolarHBondContact ND1-CE 3.46Å; H62-K72 PolarHBondContact ND1-NZ 2.94Å; Y63-K72 HydrophobicContact CE2-CB 4.45Å; Y63-K72 HydrophobicContact CE2-CG 3.8Å; Y63-K72 WeakPolarHBondContact CE2-O 3.2Å; C68-K72 WeakPolarHBondContact O-CB 3.48Å; C68-K72 PolarHBondContact O-N 2.95Å; K72-F75 PolarHBondContact O-N 3.38Å; K72-R76 WeakPolarHBondContact O-CB 3.39Å; K72-R76 PolarHBondContact O-N 3.27Å
73G97Very high95.8Very high8 Ų848.4 Ų48.48%0.08224%0.244CC..Hα-helixtrans-66.2-39.5-178.400000112.6D69 R77D69-G73 PolarHBondContact O-N 3.46Å; G73-R77 WeakPolarHBondContact O-CG 3.31Å; G73-R77 PolarHBondContact O-N 2.98Å; G73-R77 PolarHBondContact O-NH1 2.62Å
74F98.2Very high95.6Very high12 Ų1253.5 Ų53.55%0.05327%0.27CS..Hα-helixtrans-61.4-50.2175.6172.1-98.9000112.1G70 C71 R76 R77 S78 Y85 R104 R107 L108G70-F74 VanDerWaalsContact O-CB 3.25Å; G70-F74 WeakPolarHBondContact O-CB 3.38Å; G70-F74 PolarHBondContact O-N 3.35Å; C71-F74 PolarHBondContact O-N 3.15Å; F74-R76 PolarHBondContact O-N 3.46Å; F74-R77 PolarHBondContact O-N 3.37Å; F74-S78 WeakPolarHBondContact O-CB 3.37Å; F74-S78 PolarHBondContact O-N 3.29Å; F74-S78 PolarHBondContact O-OG 3.09Å; F74-Y85 AromaticContact CE2-CE2 3.95Å; F74-Y85 HydrophobicContact CE2-CE2 3.95Å; F74-Y85 HydrophobicContact CZ-CD2 4.3Å; F74-Y85 AromaticContact CZ-CE2 3.74Å; F74-Y85 HydrophobicContact CZ-CE2 3.74Å; F74-R104 HydrophobicContact CE2-CB 4.08Å; F74-R104 HydrophobicContact CE2-CG 4.12Å; F74-R104 HydrophobicContact CZ-CB 4.14Å; F74-R104 WeakPolarHBondContact CZ-O 3.41Å; F74-R107 VanDerWaalsContact CD1-CD 3.46Å; F74-R107 HydrophobicContact CD1-CG 3.89Å; F74-R107 HydrophobicContact CE1-CB 3.94Å; F74-R107 HydrophobicContact CE1-CG 3.71Å; F74-R107 HydrophobicContact CZ-CB 4.13Å; F74-R107 HydrophobicContact CZ-CG 4.27Å; F74-L108 HydrophobicContact CE1-CB 3.8Å; F74-L108 HydrophobicContact CE1-CD1 4.18Å; F74-L108 HydrophobicContact CZ-CB 3.98Å
75F98Very high95.6Very high0 Ų053.5 Ų53.50%025%0.254CS..Hα-helixtrans-60.8-47.4179.1-171.9-102.9000111.3Y63 C71 K72 R77 S78 V79 L108 C111 F112 M116 K117 V121Y63-F75 AromaticContact CD2-CD1 3.6Å; Y63-F75 HydrophobicContact CD2-CD1 3.6Å; Y63-F75 HydrophobicContact CD2-CE1 4.32Å; Y63-F75 HydrophobicContact CD2-CG 4.45Å; Y63-F75 HydrophobicContact CE2-CD1 4.21Å; Y63-F75 AromaticContact CG-CD1 3.89Å; Y63-F75 HydrophobicContact CG-CD1 3.89Å; Y63-F75 HydrophobicContact CG-CE1 4.16Å; C71-F75 WeakPolarHBondContact O-CB 3.34Å; C71-F75 PolarHBondContact O-N 3.31Å; K72-F75 PolarHBondContact O-N 3.38Å; F75-R77 PolarHBondContact O-N 2.94Å; F75-S78 PolarHBondContact O-N 3.17Å; F75-V79 HydrophobicContact CD1-CG2 4.17Å; F75-V79 HydrophobicContact CD2-CG2 4.44Å; F75-V79 HydrophobicContact CE1-CG2 3.86Å; F75-V79 HydrophobicContact CE2-CG2 4.16Å; F75-V79 HydrophobicContact CG-CG2 4.46Å; F75-V79 HydrophobicContact CZ-CG2 3.85Å; F75-V79 WeakPolarHBondContact O-CG2 3.5Å; F75-V79 PolarHBondContact O-N 3.41Å; F75-L108 HydrophobicContact CD2-CD1 3.84Å; F75-L108 HydrophobicContact CE2-CD1 4.18Å; F75-C111 HydrophobicContact CD2-CB 3.49Å; F75-C111 VanDerWaalsContact CD2-CB 3.49Å; F75-C111 HydrophobicContact CE2-CB 3.97Å; F75-C111 HydrophobicContact CG-CB 4.42Å; F75-F112 AromaticContact CE2-CD1 3.92Å; F75-F112 HydrophobicContact CE2-CD1 3.92Å; F75-F112 AromaticContact CE2-CE1 3.57Å; F75-F112 HydrophobicContact CE2-CE1 3.57Å; F75-F112 HydrophobicContact CE2-CE2 4.28Å; F75-F112 HydrophobicContact CE2-CG 4.4Å; F75-F112 AromaticContact CE2-CZ 3.77Å; F75-F112 HydrophobicContact CE2-CZ 3.77Å; F75-F112 HydrophobicContact CZ-CD1 4.15Å; F75-F112 AromaticContact CZ-CE1 3.64Å; F75-F112 HydrophobicContact CZ-CE1 3.64Å; F75-F112 HydrophobicContact CZ-CZ 4.15Å; F75-M116 HydrophobicContact CB-SD 3.7Å; F75-M116 HydrophobicContact CD1-CB 4.09Å; F75-M116 HydrophobicContact CD1-SD 4.13Å; F75-M116 HydrophobicContact CD2-CB 3.95Å; F75-M116 HydrophobicContact CD2-SD 3.87Å; F75-M116 HydrophobicContact CE1-CB 3.8Å; F75-M116 HydrophobicContact CE2-CB 3.64Å; F75-M116 HydrophobicContact CG-CB 4.15Å; F75-M116 HydrophobicContact CG-SD 3.63Å; F75-M116 HydrophobicContact CZ-CB 3.55Å; F75-M116 WeakPolarHBondContact CZ-O 3.35Å; F75-K117 WeakPolarHBondContact CE1-O 3.46Å; F75-V121 HydrophobicContact CD1-CG2 3.93Å; F75-V121 HydrophobicContact CE1-CG2 3.76Å
76R96.6Very high95.6Very high94 Ų9458.1 Ų58.136%0.35529%0.286SS..Hα-helixtrans-54.2-49.2176.1-171.4175.669.1-175.7-0.7112.9Y63 K72 F74 R80 V121Y63-R76 HydrophobicContact CE2-CB 4.34Å; Y63-R76 WeakPolarHBondContact OH-CB 3.47Å; Y63-R76 VanDerWaalsContact OH-CD 3.31Å; Y63-R76 WeakPolarHBondContact OH-CD 3.25Å; K72-R76 WeakPolarHBondContact O-CB 3.39Å; K72-R76 PolarHBondContact O-N 3.27Å; F74-R76 PolarHBondContact O-N 3.46Å; R76-R80 VanDerWaalsContact CD-CZ 3.5Å; R76-R80 VanDerWaalsContact CD-NH1 3.28Å; R76-R80 WeakPolarHBondContact O-CB 3.5Å; R76-R80 WeakPolarHBondContact O-CG 3.39Å; R76-R80 PolarHBondContact O-N 2.86Å; R76-V121 HydrophobicContact CG-CG1 4.1Å
77R96.1Very high95.5Very high134 Ų13457.3 Ų57.351%0.50628%0.28SS..Hα-helixtrans-66.4-39.9179.7-73.1-174-61.5-91.90.6112G73 F74 F75 K81G73-R77 WeakPolarHBondContact O-CG 3.31Å; G73-R77 PolarHBondContact O-N 2.98Å; G73-R77 PolarHBondContact O-NH1 2.62Å; F74-R77 PolarHBondContact O-N 3.37Å; F75-R77 PolarHBondContact O-N 2.94Å; R77-K81 WeakPolarHBondContact O-CB 3.46Å; R77-K81 PolarHBondContact O-N 3.32Å
78S96.3Very high95.4Very high3 Ų368.7 Ų68.72%0.02132%0.323CS..Hα-helixtrans-64.6-43.9-179.9-53.30000111.2F74 F75 N82 H83 Y85F74-S78 WeakPolarHBondContact O-CB 3.37Å; F74-S78 PolarHBondContact O-N 3.29Å; F74-S78 PolarHBondContact O-OG 3.09Å; F75-S78 PolarHBondContact O-N 3.17Å; S78-N82 PolarHBondContact O-N 2.96Å; S78-H83 PolarHBondContact O-N 2.97Å; S78-Y85 WeakPolarHBondContact OG-CE2 3.49Å; S78-Y85 PolarHBondContact OG-OH 3.13Å
79V95.3Very high95.3Very high21 Ų2175 Ų7513%0.12735%0.351CS..Hα-helixtrans-69.5-49178.31700000111.8F75 K81 N82 K118 V121F75-V79 HydrophobicContact CD1-CG2 4.17Å; F75-V79 HydrophobicContact CD2-CG2 4.44Å; F75-V79 HydrophobicContact CE1-CG2 3.86Å; F75-V79 HydrophobicContact CE2-CG2 4.16Å; F75-V79 HydrophobicContact CG-CG2 4.46Å; F75-V79 HydrophobicContact CZ-CG2 3.85Å; F75-V79 WeakPolarHBondContact O-CG2 3.5Å; F75-V79 PolarHBondContact O-N 3.41Å; V79-K81 VanDerWaalsContact C-N 3.34Å; V79-K81 PolarHBondContact O-N 3.29Å; V79-N82 PolarHBondContact O-N 3.19Å; V79-N82 VanDerWaalsContact O-N 3.08Å; V79-K118 HydrophobicContact CB-CG 4.36Å; V79-K118 HydrophobicContact CG1-CD 4.42Å; V79-K118 HydrophobicContact CG1-CG 3.47Å; V79-K118 VanDerWaalsContact CG1-CG 3.47Å; V79-K118 HydrophobicContact CG2-CG 3.99Å; V79-V121 HydrophobicContact CB-CB 4.32Å; V79-V121 HydrophobicContact CB-CG1 4.3Å; V79-V121 HydrophobicContact CB-CG2 4.02Å; V79-V121 HydrophobicContact CG1-CB 3.77Å; V79-V121 HydrophobicContact CG1-CG1 4.01Å; V79-V121 HydrophobicContact CG1-CG2 3.9Å; V79-V121 HydrophobicContact CG2-CG2 4.17Å
80R90Very high95.1Very high97 Ų9774.5 Ų74.537%0.36635%0.354SS..Hα-helixtrans-62-39.2-176.9-76.8-176.1-179.3159.9-3.3113.9R76 N82 V121 Q122R76-R80 VanDerWaalsContact CD-CZ 3.5Å; R76-R80 VanDerWaalsContact CD-NH1 3.28Å; R76-R80 WeakPolarHBondContact O-CB 3.5Å; R76-R80 WeakPolarHBondContact O-CG 3.39Å; R76-R80 PolarHBondContact O-N 2.86Å; R80-N82 VanDerWaalsContact C-N 3.27Å; R80-V121 HydrophobicContact CG-CG1 3.91Å; R80-Q122 PolarHBondContact NE-O 2.84Å; R80-Q122 PolarHBondContact NH2-O 2.85Å
81K90.6Very high95Very high148 Ų14878.1 Ų78.164%0.64336%0.36SS*.THydrogen-bonded Turntrans-90.17178.7-64.9-171.9172.2-166.10112.9R77 V79 H83R77-K81 WeakPolarHBondContact O-CB 3.46Å; R77-K81 PolarHBondContact O-N 3.32Å; V79-K81 VanDerWaalsContact C-N 3.34Å; V79-K81 PolarHBondContact O-N 3.29Å; K81-H83 WeakPolarHBondContact CB-NE2 3.32Å; K81-H83 VanDerWaalsContact CD-NE2 3.31Å; K81-H83 WeakPolarHBondContact CD-NE2 3.49Å; K81-H83 PolarHBondContact O-N 3.2Å; K81-H83 VanDerWaalsContact O-N 3.13Å
82N89.8Confident94.9Very high103 Ų10385.7 Ų85.755%0.55140%0.395SS*.THydrogen-bonded Turntrans44.345.2-174.4-160.842.1000112.8S78 V79 R80 M84S78-N82 PolarHBondContact O-N 2.96Å; V79-N82 PolarHBondContact O-N 3.19Å; V79-N82 VanDerWaalsContact O-N 3.08Å; R80-N82 VanDerWaalsContact C-N 3.27Å; N82-M84 PolarHBondContact O-N 3.17Å
83H91.9Very high94.8Very high78 Ų7884 Ų8436%0.36139%0.392SS..  trans-70123.6-173.1-79.8-46.8000111.6S78 K81 Y85S78-H83 PolarHBondContact O-N 2.97Å; K81-H83 WeakPolarHBondContact CB-NE2 3.32Å; K81-H83 VanDerWaalsContact CD-NE2 3.31Å; K81-H83 WeakPolarHBondContact CD-NE2 3.49Å; K81-H83 PolarHBondContact O-N 3.2Å; K81-H83 VanDerWaalsContact O-N 3.13Å; H83-Y85 HydrophobicContact CB-CE1 3.83Å; H83-Y85 HydrophobicContact CB-CE2 4.02Å; H83-Y85 PolarHBondContact CD2-OH 3.44Å; H83-Y85 VanDerWaalsContact CD2-OH 3.26Å
84M91.8Very high94.8Very high146 Ų14688.7 Ų88.772%0.71942%0.418SS*.  trans-94.6113.9168.7-61.7177.571.700108.9N82N82-M84 PolarHBondContact O-N 3.17Å
85Y96.1Very high94.8Very high55 Ų5588.6 Ų88.622%0.21642%0.418CS..  trans-98.9152.9175.8-60-53.2000110.4F74 S78 H83 R104 Y105 L108F74-Y85 AromaticContact CE2-CE2 3.95Å; F74-Y85 HydrophobicContact CE2-CE2 3.95Å; F74-Y85 HydrophobicContact CZ-CD2 4.3Å; F74-Y85 AromaticContact CZ-CE2 3.74Å; F74-Y85 HydrophobicContact CZ-CE2 3.74Å; S78-Y85 WeakPolarHBondContact OG-CE2 3.49Å; S78-Y85 PolarHBondContact OG-OH 3.13Å; H83-Y85 HydrophobicContact CB-CE1 3.83Å; H83-Y85 HydrophobicContact CB-CE2 4.02Å; H83-Y85 PolarHBondContact CD2-OH 3.44Å; H83-Y85 VanDerWaalsContact CD2-OH 3.26Å; Y85-R104 HydrophobicContact CD1-CB 3.74Å; Y85-R104 HydrophobicContact CD2-CB 3.69Å; Y85-R104 HydrophobicContact CE1-CB 4.01Å; Y85-R104 HydrophobicContact CE1-CG 4.45Å; Y85-R104 HydrophobicContact CE2-CB 3.93Å; Y85-R104 HydrophobicContact CG-CB 3.59Å; Y85-Y105 VanDerWaalsContact O-CD2 3.25Å; Y85-Y105 WeakPolarHBondContact O-CD2 3.21Å; Y85-L108 HydrophobicContact CD2-CB 4.2Å; Y85-L108 HydrophobicContact CD2-CD2 3.79Å; Y85-L108 HydrophobicContact CE2-CD2 4.02Å
86S94.9Very high94.7Very high101 Ų10190.9 Ų90.971%0.70643%0.431SS*.  trans-119144.9169.2-175.50000110.4
87C96.8Very high94.7Very high14 Ų1491.9 Ų91.910%0.09544%0.438CS..  trans-88135.3171.9-169.70000109.3F89 R91 C103 Y105C87-F89 VanDerWaalsContact C-N 3.27Å; C87-F89 PolarHBondContact SG-N 2.87Å; C87-F89 VanDerWaalsContact SG-N 3.42Å; C87-R91 HydrophobicContact CB-CB 4.43Å; C87-R91 HydrophobicContact CB-CG 3.75Å; C87-C103 VanDerWaalsContact SG-SG 3.64Å; C87-Y105 HydrophobicContact CB-CD1 3.67Å; C87-Y105 HydrophobicContact CB-CE1 4.39Å; C87-Y105 HydrophobicContact CB-CG 4.02Å
88R95.8Very high94.6Very high239 Ų23992 Ų9290%0.90245%0.449SS*.SBendtrans-83.8-1.7174.8-62.8-177.1177.5173.8-3.5113.8
89F94.6Very high94.5Very high135 Ų13598.2 Ų98.259%0.59248%0.475SS*.SBendtrans-129.6-159.1-176.1-52.2-70.7000109.6C87 R91C87-F89 VanDerWaalsContact C-N 3.27Å; C87-F89 PolarHBondContact SG-N 2.87Å; C87-F89 VanDerWaalsContact SG-N 3.42Å; F89-R91 PolarHBondContact O-N 2.98Å
90S94.6Very high94.6Very high84 Ų8499.3 Ų99.359%0.58748%0.477SS*.SBendtrans-73.320.5-17859.10000115.9Q92S90-Q92 WeakPolarHBondContact O-CG 3.33Å; S90-Q92 PolarHBondContact O-N 3.18Å; S90-Q92 VanDerWaalsContact O-N 3.09Å
91R94.6Very high94.9Very high103 Ų103100.2 Ų100.239%0.38949%0.489SS..SBendtrans57.820.7-177.1-60.9178.7-179.3-157.93.7114.5Y14 C87 F89 Y105 C106Y14-R91 PolarHBondContact OH-NH1 2.94Å; C87-R91 HydrophobicContact CB-CB 4.43Å; C87-R91 HydrophobicContact CB-CG 3.75Å; F89-R91 PolarHBondContact O-N 2.98Å; R91-Y105 HydrophobicContact CB-CD1 4.42Å; R91-Y105 HydrophobicContact CB-CE1 3.79Å; R91-Y105 HydrophobicContact CG-CD1 4.2Å; R91-Y105 HydrophobicContact CG-CE1 3.61Å; R91-Y105 PolarHBondContact NH1-OH 3.25Å; R91-C106 VanDerWaalsContact C-SG 3.59Å
92Q95.6Very high95.2Very high159 Ų159100.2 Ų100.274%0.74349%0.491SS*.  trans-120.225.8-178.3-66.8173.539.300112.8S90 V94S90-Q92 WeakPolarHBondContact O-CG 3.33Å; S90-Q92 PolarHBondContact O-N 3.18Å; S90-Q92 VanDerWaalsContact O-N 3.09Å; Q92-V94 PolarHBondContact O-N 3.38Å
93C97.1Very high95.6Very high31 Ų3195.9 Ų95.921%0.20947%0.469CS..  trans-61.4133.5-179.6-51.10000111.5V95 C103 C106C93-V95 PolarHBondContact O-N 3.08Å; C93-C103 HydrophobicContact CB-CB 3.84Å; C93-C106 HydrophobicContact CB-CB 3.88Å; C93-C106 VanDerWaalsContact SG-SG 3.62Å
94V96.4Very high95.8Very high105 Ų10599.8 Ų99.864%0.63648%0.48SS*.  trans-63.5133.4173.6179.80000110Q92 D96Q92-V94 PolarHBondContact O-N 3.38Å; V94-D96 HydrophobicContact CG1-CB 4.46Å
95V97.5Very high96.1Very high10 Ų1093.3 Ų93.36%0.06145%0.448CS..  trans-119.796.6176.8-178.60000107.9I53 C54 C93 R100 C106 R107 K110I53-V95 HydrophobicContact CG2-CG1 4.07Å; I53-V95 WeakPolarHBondContact O-CG1 3.36Å; C54-V95 HydrophobicContact CB-CG1 4.17Å; C93-V95 PolarHBondContact O-N 3.08Å; V95-R100 HydrophobicContact CG1-CB 3.95Å; V95-C106 HydrophobicContact CG2-CB 4.27Å; V95-R107 HydrophobicContact CG1-CG 4.21Å; V95-R107 HydrophobicContact CG2-CB 4.49Å; V95-K110 HydrophobicContact CB-CD 3.81Å; V95-K110 HydrophobicContact CG1-CD 4.23Å; V95-K110 HydrophobicContact CG2-CD 4.24Å; V95-K110 PolarHBondContact O-NZ 2.95Å
96D96.6Very high96.2Very high48 Ų4891.1 Ų91.126%0.25744%0.441SS..  trans-120.1-177.4174.859.441.8000110.3C54 V94 D98 K99 R100C54-D96 CarbonylContact O-C 3.57Å; C54-D96 WeakPolarHBondContact O-CA 3.25Å; V94-D96 HydrophobicContact CG1-CB 4.46Å; D96-D98 VanDerWaalsContact C-N 3.27Å; D96-D98 PolarHBondContact O-N 3.44Å; D96-D98 PolarHBondContact OD1-N 3.24Å; D96-D98 VanDerWaalsContact OD1-N 3.09Å; D96-K99 WeakPolarHBondContact OD1-CA 3.47Å; D96-K99 VanDerWaalsContact OD1-CB 3.32Å; D96-K99 WeakPolarHBondContact OD1-CB 3.34Å; D96-K99 PolarHBondContact OD1-N 3.23Å; D96-R100 WeakPolarHBondContact O-CB 3.27Å; D96-R100 PolarHBondContact O-N 3.37Å
97K95.7Very high96.4Very high116 Ų11686.8 Ų86.850%0.50441%0.409SS..THydrogen-bonded Turntrans-56.6-41.7-176.2-178.8-177.8177.1-172.20112.3C54 D56C54-K97 PolarHBondContact O-N 3.08Å; D56-K97 HydrophobicContact CB-CB 4.39Å; D56-K97 HydrophobicContact CB-CG 4.12Å
98D95.3Very high96.5Very high137 Ų13787.1 Ų87.173%0.73341%0.41SS*.THydrogen-bonded Turntrans-89.1-33.6-169.9-54.8-48.7000111.9D96D96-D98 VanDerWaalsContact C-N 3.27Å; D96-D98 PolarHBondContact O-N 3.44Å; D96-D98 PolarHBondContact OD1-N 3.24Å; D96-D98 VanDerWaalsContact OD1-N 3.09Å
99K94.4Very high96.5Very high132 Ų13279 Ų7957%0.57438%0.381SS*.THydrogen-bonded Turntrans-1073.9-173.4-57179.3-174.7176.70113.8D96 N101 Q102D96-K99 WeakPolarHBondContact OD1-CA 3.47Å; D96-K99 VanDerWaalsContact OD1-CB 3.32Å; D96-K99 WeakPolarHBondContact OD1-CB 3.34Å; D96-K99 PolarHBondContact OD1-N 3.23Å; K99-N101 PolarHBondContact O-N 2.97Å; K99-Q102 VanDerWaalsContact O-CB 3.24Å; K99-Q102 WeakPolarHBondContact O-CB 3.48Å; K99-Q102 PolarHBondContact O-N 3.45Å
100R96.7Very high96.7Very high45 Ų4576.1 Ų76.117%0.1737%0.368CS..THydrogen-bonded Turntrans-55.3-20.7176.760.1-170.4-174.1-169.5-5.1115C54 D56 C68 V95 D96 R107C54-R100 HydrophobicContact CB-CB 4.11Å; C54-R100 PolarHBondContact SG-NH1 3.21Å; C54-R100 VanDerWaalsContact SG-NH1 3.37Å; D56-R100 IonicContact OD2-CZ 3.52Å; D56-R100 IonicContact OD2-NH1 2.78Å; D56-R100 PolarHBondContact OD2-NH1 3.4Å; D56-R100 IonicContact OD2-NH2 3.46Å; D56-R100 PolarHBondContact OD2-NH2 2.95Å; C68-R100 PolarHBondContact SG-NH1 3.2Å; V95-R100 HydrophobicContact CG1-CB 3.95Å; D96-R100 WeakPolarHBondContact O-CB 3.27Å; D96-R100 PolarHBondContact O-N 3.37Å; R100-R107 VanDerWaalsContact O-CD 3.29Å; R100-R107 WeakPolarHBondContact O-CD 3.44Å; R100-R107 PolarHBondContact O-NH1 2.68Å
101N96.4Very high96.9Very high116 Ų11672.1 Ų72.162%0.6234%0.34SS*.THydrogen-bonded Turntrans-89.7-9.5178.5-65.6-29.4000113.7K99 C103 R107K99-N101 PolarHBondContact O-N 2.97Å; N101-C103 PolarHBondContact O-N 3.41Å; N101-R107 PolarHBondContact OD1-NH1 2.92Å
102Q96.3Very high97Very high147 Ų14770 Ų7069%0.68733%0.334SS*.SBendtrans-67.2-37.3-174-169.263.428.900113K99K99-Q102 VanDerWaalsContact O-CB 3.24Å; K99-Q102 WeakPolarHBondContact O-CB 3.48Å; K99-Q102 PolarHBondContact O-N 3.45Å
103C97.8Very high97.1Very high12 Ų1271.6 Ų71.68%0.08133%0.333CS..  trans-138.4107.4178.6-173.20000111.5C87 C93 N101 Y105 C106 R107C87-C103 VanDerWaalsContact SG-SG 3.64Å; C93-C103 HydrophobicContact CB-CB 3.84Å; N101-C103 PolarHBondContact O-N 3.41Å; C103-Y105 VanDerWaalsContact C-N 3.33Å; C103-Y105 PolarHBondContact O-N 3.35Å; C103-C106 HydrophobicContact CB-CB 4.16Å; C103-C106 VanDerWaalsContact SG-SG 3.64Å; C103-R107 WeakPolarHBondContact O-CB 3.39Å; C103-R107 PolarHBondContact O-N 2.76Å; C103-R107 VanDerWaalsContact O-N 3.08Å
104R97.8Very high97Very high160 Ų16071.6 Ų71.660%0.60434%0.335SS*.Hα-helixtrans-65.5-35.2179.1-61.6178.8-174.7143.20.5112.4F74 Y85 L108F74-R104 HydrophobicContact CE2-CB 4.08Å; F74-R104 HydrophobicContact CE2-CG 4.12Å; F74-R104 HydrophobicContact CZ-CB 4.14Å; F74-R104 WeakPolarHBondContact CZ-O 3.41Å; Y85-R104 HydrophobicContact CD1-CB 3.74Å; Y85-R104 HydrophobicContact CD2-CB 3.69Å; Y85-R104 HydrophobicContact CE1-CB 4.01Å; Y85-R104 HydrophobicContact CE1-CG 4.45Å; Y85-R104 HydrophobicContact CE2-CB 3.93Å; Y85-R104 HydrophobicContact CG-CB 3.59Å; R104-L108 WeakPolarHBondContact O-CB 3.15Å; R104-L108 PolarHBondContact O-N 3.18Å
105Y98.2Very high97Very high11 Ų1168.3 Ų68.34%0.04332%0.322CS..Hα-helixtrans-59.9-56.8175.2175.1-89.8000111.6F19 Y85 C87 R91 C103 R107 L108 K109F19-Y105 HydrophobicContact CZ-CE2 4.16Å; Y85-Y105 VanDerWaalsContact O-CD2 3.25Å; Y85-Y105 WeakPolarHBondContact O-CD2 3.21Å; C87-Y105 HydrophobicContact CB-CD1 3.67Å; C87-Y105 HydrophobicContact CB-CE1 4.39Å; C87-Y105 HydrophobicContact CB-CG 4.02Å; R91-Y105 HydrophobicContact CB-CD1 4.42Å; R91-Y105 HydrophobicContact CB-CE1 3.79Å; R91-Y105 HydrophobicContact CG-CD1 4.2Å; R91-Y105 HydrophobicContact CG-CE1 3.61Å; R91-Y105 PolarHBondContact NH1-OH 3.25Å; C103-Y105 VanDerWaalsContact C-N 3.33Å; C103-Y105 PolarHBondContact O-N 3.35Å; Y105-R107 VanDerWaalsContact C-N 3.27Å; Y105-R107 PolarHBondContact O-N 3.17Å; Y105-L108 PolarHBondContact O-N 2.92Å; Y105-K109 HydrophobicContact CE1-CD 4Å; Y105-K109 WeakPolarHBondContact O-CB 3.41Å; Y105-K109 PolarHBondContact O-N 3.2Å
106C98.1Very high97Very high9 Ų968 Ų686%0.06132%0.32CS..Hα-helixtrans-63.4-35.5-178.1-65.40000111.7R91 C93 V95 C103 K110R91-C106 VanDerWaalsContact C-SG 3.59Å; C93-C106 HydrophobicContact CB-CB 3.88Å; C93-C106 VanDerWaalsContact SG-SG 3.62Å; V95-C106 HydrophobicContact CG2-CB 4.27Å; C103-C106 HydrophobicContact CB-CB 4.16Å; C103-C106 VanDerWaalsContact SG-SG 3.64Å; C106-K110 VanDerWaalsContact O-CB 3.28Å; C106-K110 WeakPolarHBondContact O-CB 3.42Å; C106-K110 PolarHBondContact O-N 2.97Å
107R98.4Very high97Very high9 Ų971.2 Ų71.23%0.03433%0.332CS..Hα-helixtrans-63.9-47.7174.2-169.4-170.6-170160.9-3.3112.2I53 G70 C71 F74 V95 R100 N101 C103 Y105 K110 C111I53-R107 HydrophobicContact CG2-CG 4.36Å; G70-R107 VanDerWaalsContact C-NH2 3.32Å; G70-R107 PolarHBondContact O-NH2 3.42Å; C71-R107 PolarHBondContact SG-NH2 3.01Å; F74-R107 VanDerWaalsContact CD1-CD 3.46Å; F74-R107 HydrophobicContact CD1-CG 3.89Å; F74-R107 HydrophobicContact CE1-CB 3.94Å; F74-R107 HydrophobicContact CE1-CG 3.71Å; F74-R107 HydrophobicContact CZ-CB 4.13Å; F74-R107 HydrophobicContact CZ-CG 4.27Å; V95-R107 HydrophobicContact CG1-CG 4.21Å; V95-R107 HydrophobicContact CG2-CB 4.49Å; R100-R107 VanDerWaalsContact O-CD 3.29Å; R100-R107 WeakPolarHBondContact O-CD 3.44Å; R100-R107 PolarHBondContact O-NH1 2.68Å; N101-R107 PolarHBondContact OD1-NH1 2.92Å; C103-R107 WeakPolarHBondContact O-CB 3.39Å; C103-R107 PolarHBondContact O-N 2.76Å; C103-R107 VanDerWaalsContact O-N 3.08Å; Y105-R107 VanDerWaalsContact C-N 3.27Å; Y105-R107 PolarHBondContact O-N 3.17Å; R107-K110 PolarHBondContact O-N 3.48Å; R107-C111 PolarHBondContact O-N 3.21Å; R107-C111 PolarHBondContact O-SG 3.41Å
108L98Very high96.9Very high22 Ų2270.6 Ų70.612%0.11533%0.33CS..Hα-helixtrans-66.1-42.7179.8-175.560.2000111.5F74 F75 Y85 R104 Y105 K110 C111 F112F74-L108 HydrophobicContact CE1-CB 3.8Å; F74-L108 HydrophobicContact CE1-CD1 4.18Å; F74-L108 HydrophobicContact CZ-CB 3.98Å; F75-L108 HydrophobicContact CD2-CD1 3.84Å; F75-L108 HydrophobicContact CE2-CD1 4.18Å; Y85-L108 HydrophobicContact CD2-CB 4.2Å; Y85-L108 HydrophobicContact CD2-CD2 3.79Å; Y85-L108 HydrophobicContact CE2-CD2 4.02Å; R104-L108 WeakPolarHBondContact O-CB 3.15Å; R104-L108 PolarHBondContact O-N 3.18Å; Y105-L108 PolarHBondContact O-N 2.92Å; L108-K110 VanDerWaalsContact C-N 3.28Å; L108-K110 PolarHBondContact O-N 2.85Å; L108-C111 VanDerWaalsContact O-CB 3.3Å; L108-C111 WeakPolarHBondContact O-CB 3.28Å; L108-C111 PolarHBondContact O-N 3.47Å; L108-C111 VanDerWaalsContact O-N 3.12Å; L108-F112 HydrophobicContact CD1-CD2 4.45Å; L108-F112 HydrophobicContact CD1-CE2 3.88Å; L108-F112 HydrophobicContact CD1-CZ 4.45Å; L108-F112 HydrophobicContact CD2-CE2 4.39Å; L108-F112 HydrophobicContact CG-CD2 4.28Å; L108-F112 HydrophobicContact CG-CE2 3.82Å; L108-F112 VanDerWaalsContact O-CD2 3.31Å; L108-F112 WeakPolarHBondContact O-CD2 3.36Å; L108-F112 PolarHBondContact O-N 3.36Å
109K97.3Very high96.8Very high69 Ų6970.8 Ų70.830%0.333%0.326SS..Hα-helixtrans-57.1-42.5172.3-178.8168-175.3172.10111.5F19 Y105 F112 R113F19-K109 HydrophobicContact CE1-CB 4.13Å; F19-K109 HydrophobicContact CE1-CG 4.07Å; Y105-K109 HydrophobicContact CE1-CD 4Å; Y105-K109 WeakPolarHBondContact O-CB 3.41Å; Y105-K109 PolarHBondContact O-N 3.2Å; K109-F112 PolarHBondContact O-N 2.93Å; K109-R113 WeakPolarHBondContact O-CG 3.43Å; K109-R113 PolarHBondContact O-N 3.29Å
110K97.9Very high96.7Very high73 Ų7366.6 Ų66.632%0.31732%0.316SS..Hα-helixtrans-68.9-31.9176.8-164.8171.3-178.5-172.30112.8I53 V95 C106 R107 L108 R113 A114I53-K110 HydrophobicContact CG2-CB 4.32Å; I53-K110 HydrophobicContact CG2-CD 4.4Å; I53-K110 HydrophobicContact CG2-CG 4.27Å; I53-K110 WeakPolarHBondContact O-CD 3.27Å; I53-K110 WeakPolarHBondContact O-CE 3.35Å; I53-K110 PolarHBondContact O-NZ 3.32Å; V95-K110 HydrophobicContact CB-CD 3.81Å; V95-K110 HydrophobicContact CG1-CD 4.23Å; V95-K110 HydrophobicContact CG2-CD 4.24Å; V95-K110 PolarHBondContact O-NZ 2.95Å; C106-K110 VanDerWaalsContact O-CB 3.28Å; C106-K110 WeakPolarHBondContact O-CB 3.42Å; C106-K110 PolarHBondContact O-N 2.97Å; R107-K110 PolarHBondContact O-N 3.48Å; L108-K110 VanDerWaalsContact C-N 3.28Å; L108-K110 PolarHBondContact O-N 2.85Å; K110-R113 PolarHBondContact O-N 2.91Å; K110-A114 VanDerWaalsContact O-CB 3.3Å; K110-A114 WeakPolarHBondContact O-CB 3.32Å; K110-A114 PolarHBondContact O-N 3.4Å
111C98.1Very high96.5Very high0 Ų065.2 Ų65.20%031%0.313CS..Hα-helixtrans-58.7-49.8171.4-70.40000111.8F75 R107 L108 A114 G115 M116F75-C111 HydrophobicContact CD2-CB 3.49Å; F75-C111 VanDerWaalsContact CD2-CB 3.49Å; F75-C111 HydrophobicContact CE2-CB 3.97Å; F75-C111 HydrophobicContact CG-CB 4.42Å; R107-C111 PolarHBondContact O-N 3.21Å; R107-C111 PolarHBondContact O-SG 3.41Å; L108-C111 VanDerWaalsContact O-CB 3.3Å; L108-C111 WeakPolarHBondContact O-CB 3.28Å; L108-C111 PolarHBondContact O-N 3.47Å; L108-C111 VanDerWaalsContact O-N 3.12Å; C111-A114 PolarHBondContact O-N 3.36Å; C111-G115 PolarHBondContact O-N 3.04Å; C111-M116 HydrophobicContact CB-CB 4.28Å; C111-M116 HydrophobicContact CB-CG 4.29Å; C111-M116 HydrophobicContact CB-SD 3.62Å; C111-M116 VanDerWaalsContact O-CB 3.28Å; C111-M116 WeakPolarHBondContact O-CB 3.29Å; C111-M116 PolarHBondContact O-N 3.38Å
112F97.5Very high96Very high59 Ų5965.2 Ų65.226%0.25931%0.309SS..Hα-helixtrans-62.9-45.5177-71.1-63.4000112F19 F75 L108 K109 A114 G115 M116 K118F19-F112 HydrophobicContact CD1-CD2 4.03Å; F19-F112 HydrophobicContact CE1-CD2 4.49Å; F75-F112 AromaticContact CE2-CD1 3.92Å; F75-F112 HydrophobicContact CE2-CD1 3.92Å; F75-F112 AromaticContact CE2-CE1 3.57Å; F75-F112 HydrophobicContact CE2-CE1 3.57Å; F75-F112 HydrophobicContact CE2-CE2 4.28Å; F75-F112 HydrophobicContact CE2-CG 4.4Å; F75-F112 AromaticContact CE2-CZ 3.77Å; F75-F112 HydrophobicContact CE2-CZ 3.77Å; F75-F112 HydrophobicContact CZ-CD1 4.15Å; F75-F112 AromaticContact CZ-CE1 3.64Å; F75-F112 HydrophobicContact CZ-CE1 3.64Å; F75-F112 HydrophobicContact CZ-CZ 4.15Å; L108-F112 HydrophobicContact CD1-CD2 4.45Å; L108-F112 HydrophobicContact CD1-CE2 3.88Å; L108-F112 HydrophobicContact CD1-CZ 4.45Å; L108-F112 HydrophobicContact CD2-CE2 4.39Å; L108-F112 HydrophobicContact CG-CD2 4.28Å; L108-F112 HydrophobicContact CG-CE2 3.82Å; L108-F112 VanDerWaalsContact O-CD2 3.31Å; L108-F112 WeakPolarHBondContact O-CD2 3.36Å; L108-F112 PolarHBondContact O-N 3.36Å; K109-F112 PolarHBondContact O-N 2.93Å; F112-A114 PolarHBondContact O-N 2.74Å; F112-G115 PolarHBondContact O-N 3.19Å; F112-M116 WeakPolarHBondContact CD1-O 3.39Å; F112-K118 HydrophobicContact CE1-CB 4.26Å
113R96.8Very high95.3Very high192 Ų19264.9 Ų64.973%0.72531%0.312SS*.Hα-helixtrans-60.1-31176.3-73.2-179.665.1-171.51.5113.7K109 K110 G115K109-R113 WeakPolarHBondContact O-CG 3.43Å; K109-R113 PolarHBondContact O-N 3.29Å; K110-R113 PolarHBondContact O-N 2.91Å; R113-G115 PolarHBondContact O-N 3.41Å
114A96.4Very high94.3Very high31 Ų3172.1 Ų72.126%0.25635%0.345SS..THydrogen-bonded Turntrans-78.6-1.4175.800000113.3A52 I53 A65 K110 C111 F112A52-A114 HydrophobicContact CB-CB 4.06Å; I53-A114 HydrophobicContact CD1-CB 4.2Å; I53-A114 HydrophobicContact CG1-CB 4.02Å; A65-A114 HydrophobicContact CB-CB 4.35Å; A65-A114 WeakPolarHBondContact CB-O 3.4Å; K110-A114 VanDerWaalsContact O-CB 3.3Å; K110-A114 WeakPolarHBondContact O-CB 3.32Å; K110-A114 PolarHBondContact O-N 3.4Å; C111-A114 PolarHBondContact O-N 3.36Å; F112-A114 PolarHBondContact O-N 2.74Å
115G96.1Very high93.5Very high36 Ų3673.5 Ų73.537%0.37135%0.35SS..THydrogen-bonded Turntrans93.118.5178.600000115C111 F112 R113 K117C111-G115 PolarHBondContact O-N 3.04Å; F112-G115 PolarHBondContact O-N 3.19Å; R113-G115 PolarHBondContact O-N 3.41Å; G115-K117 PolarHBondContact O-N 3.12Å
116M97.9Very high92.1Very high4 Ų480.2 Ų80.22%0.0239%0.386CS..  trans-72.9124.7171.1-68.1-173.1156.900111I53 Y63 A65 S67 F75 C111 F112I53-M116 HydrophobicContact CD1-CE 3.71Å; I53-M116 HydrophobicContact CD1-SD 4.26Å; Y63-M116 CarbonylContact O-C 3.43Å; Y63-M116 VanDerWaalsContact O-CA 3.31Å; Y63-M116 WeakPolarHBondContact O-CA 3.46Å; A65-M116 HydrophobicContact CB-CG 3.72Å; S67-M116 WeakPolarHBondContact OG-CE 3.39Å; F75-M116 HydrophobicContact CB-SD 3.7Å; F75-M116 HydrophobicContact CD1-CB 4.09Å; F75-M116 HydrophobicContact CD1-SD 4.13Å; F75-M116 HydrophobicContact CD2-CB 3.95Å; F75-M116 HydrophobicContact CD2-SD 3.87Å; F75-M116 HydrophobicContact CE1-CB 3.8Å; F75-M116 HydrophobicContact CE2-CB 3.64Å; F75-M116 HydrophobicContact CG-CB 4.15Å; F75-M116 HydrophobicContact CG-SD 3.63Å; F75-M116 HydrophobicContact CZ-CB 3.55Å; F75-M116 WeakPolarHBondContact CZ-O 3.35Å; C111-M116 HydrophobicContact CB-CB 4.28Å; C111-M116 HydrophobicContact CB-CG 4.29Å; C111-M116 HydrophobicContact CB-SD 3.62Å; C111-M116 VanDerWaalsContact O-CB 3.28Å; C111-M116 WeakPolarHBondContact O-CB 3.29Å; C111-M116 PolarHBondContact O-N 3.38Å; F112-M116 WeakPolarHBondContact CD1-O 3.39Å
117K95.9Very high90.8Very high115 Ų11590.4 Ų90.450%0.542%0.423SS..  trans-96.7123.8-174.3-75.1-178.6171-156.30111.5Y63 F75 G115 E119 A120Y63-K117 WeakPolarHBondContact O-CB 3.45Å; Y63-K117 PolarHBondContact O-N 3.12Å; F75-K117 WeakPolarHBondContact CE1-O 3.46Å; G115-K117 PolarHBondContact O-N 3.12Å; K117-E119 VanDerWaalsContact C-N 3.3Å; K117-E119 VanDerWaalsContact CB-CD 3.5Å; K117-E119 HydrophobicContact CB-CG 4.35Å; K117-E119 WeakPolarHBondContact CB-OE1 3.49Å; K117-E119 WeakPolarHBondContact CB-OE2 3.34Å; K117-E119 VanDerWaalsContact CD-OE1 3.24Å; K117-E119 WeakPolarHBondContact CD-OE1 3.28Å; K117-E119 VanDerWaalsContact CG-OE1 3.29Å; K117-E119 WeakPolarHBondContact CG-OE1 3.42Å; K117-E119 PolarHBondContact O-N 3.21Å; K117-A120 HydrophobicContact CB-CB 3.95Å; K117-A120 WeakPolarHBondContact O-CB 3.49Å; K117-A120 PolarHBondContact O-N 3.5Å
118K94.3Very high89.4Confident104 Ų10498.2 Ų98.245%0.45246%0.464SS..G310 helixtrans-63.1-41.2179.9-174.1-175.2176.7-179.70110.6V79 F112 A120 V121V79-K118 HydrophobicContact CB-CG 4.36Å; V79-K118 HydrophobicContact CG1-CD 4.42Å; V79-K118 HydrophobicContact CG1-CG 3.47Å; V79-K118 VanDerWaalsContact CG1-CG 3.47Å; V79-K118 HydrophobicContact CG2-CG 3.99Å; F112-K118 HydrophobicContact CE1-CB 4.26Å; K118-A120 PolarHBondContact O-N 3.27Å; K118-V121 WeakPolarHBondContact O-CB 3.42Å; K118-V121 PolarHBondContact O-N 3.35Å
119E92.1Very high87.6Confident140 Ų140100.3 Ų100.365%0.65448%0.481SS*.G310 helixtrans-63.9-21.3178.969.6-81.6-167.500113.4K117 V121K117-E119 VanDerWaalsContact C-N 3.3Å; K117-E119 VanDerWaalsContact CB-CD 3.5Å; K117-E119 HydrophobicContact CB-CG 4.35Å; K117-E119 WeakPolarHBondContact CB-OE1 3.49Å; K117-E119 WeakPolarHBondContact CB-OE2 3.34Å; K117-E119 VanDerWaalsContact CD-OE1 3.24Å; K117-E119 WeakPolarHBondContact CD-OE1 3.28Å; K117-E119 VanDerWaalsContact CG-OE1 3.29Å; K117-E119 WeakPolarHBondContact CG-OE1 3.42Å; K117-E119 PolarHBondContact O-N 3.21Å; E119-V121 PolarHBondContact O-N 3.28Å
120A92.8Very high85.5Confident44 Ų44104.1 Ų104.136%0.36451%0.51SS..G310 helixtrans-78.1-6.7174.700000113.1Y63 K117 K118 Q122Y63-A120 HydrophobicContact CD1-CB 4.07Å; Y63-A120 WeakPolarHBondContact CD1-O 3.45Å; K117-A120 HydrophobicContact CB-CB 3.95Å; K117-A120 WeakPolarHBondContact O-CB 3.49Å; K117-A120 PolarHBondContact O-N 3.5Å; K118-A120 PolarHBondContact O-N 3.27Å; A120-Q122 PolarHBondContact O-N 2.82Å
121V91.7Very high83.3Confident17 Ų17110.6 Ų110.610%0.10353%0.532CS..  trans-87.4104.4178-177.30000109.6Y63 F75 R76 V79 R80 K118 E119Y63-V121 HydrophobicContact CD1-CG2 3.74Å; Y63-V121 HydrophobicContact CE1-CB 4.41Å; Y63-V121 HydrophobicContact CE1-CG2 3.81Å; Y63-V121 HydrophobicContact CG-CG2 4.25Å; F75-V121 HydrophobicContact CD1-CG2 3.93Å; F75-V121 HydrophobicContact CE1-CG2 3.76Å; R76-V121 HydrophobicContact CG-CG1 4.1Å; V79-V121 HydrophobicContact CB-CB 4.32Å; V79-V121 HydrophobicContact CB-CG1 4.3Å; V79-V121 HydrophobicContact CB-CG2 4.02Å; V79-V121 HydrophobicContact CG1-CB 3.77Å; V79-V121 HydrophobicContact CG1-CG1 4.01Å; V79-V121 HydrophobicContact CG1-CG2 3.9Å; V79-V121 HydrophobicContact CG2-CG2 4.17Å; R80-V121 HydrophobicContact CG-CG1 3.91Å; K118-V121 WeakPolarHBondContact O-CB 3.42Å; K118-V121 PolarHBondContact O-N 3.35Å; E119-V121 PolarHBondContact O-N 3.28Å
122Q87.6Confident81.3Confident115 Ų115118.7 Ų118.754%0.53756%0.563SS.*PPolyproline II helixtrans-69.3153.1175.1-65.2178.7-11.700112.5R80 A120R80-Q122 PolarHBondContact NE-O 2.84Å; R80-Q122 PolarHBondContact NH2-O 2.85Å; A120-Q122 PolarHBondContact O-N 2.82Å
123N80.1Confident78.9Confident140 Ų140121.2 Ų121.275%0.74959%0.588SS**PPolyproline II helixtrans-57.6167.2170.9-71.1-17.6000111.8R125N123-R125 PolarHBondContact O-N 2.88Å
124E78.3Confident76.8Confident165 Ų165115.8 Ų115.877%0.77158%0.58SS**PPolyproline II helixtrans-59.6138.7173.4-62.8-162.9155.600109.7
125R79.7Confident74.6Confident188 Ų188125.3 Ų125.371%0.70961%0.611SS**PPolyproline II helixtrans-99160171.4-61-176-171.7-178.6-0.5107.4N123N123-R125 PolarHBondContact O-N 2.88Å
126D68.6Low72.6Confident153 Ų153129 Ų12982%0.81862%0.618SS**PPolyproline II helixtrans-51.4146.7173-62.7-36.2000111.2I128D126-I128 PolarHBondContact O-N 3.35Å
127R71Confident70.6Confident222 Ų222133.5 Ų133.584%0.83864%0.642SS**  trans-62.7115.1179.7-70.5-178.9175.7-126.82.3108.5S129R127-S129 PolarHBondContact O-N 3.25Å
128I70.2Confident68.8Low173 Ų173134 Ų13489%0.88766%0.66SS**  trans-75.430165.9-39.9173.8000110D126D126-I128 PolarHBondContact O-N 3.35Å
129S59.3Low67.2Low66 Ų66131.8 Ų131.846%0.46266%0.657SS.*  trans-104.4124.2-178.9-171.50000108.7R127 R131R127-S129 PolarHBondContact O-N 3.25Å; S129-R131 PolarHBondContact O-N 3.05Å; S129-R131 PolarHBondContact OG-N 3.47Å
130T54.1Low66.3Low149 Ų149127.8 Ų127.891%0.91464%0.64SS**SBendtrans-69.5-1.9171.539.50000113.5R132T130-R132 PolarHBondContact O-N 2.85Å
131R50.2Low65.7Low210 Ų210126 Ų12679%0.79263%0.625SS**  trans-90.698.2175.4-66-166.5-173.7-153.71.7109.9S129 S133S129-R131 PolarHBondContact O-N 3.05Å; S129-R131 PolarHBondContact OG-N 3.47Å; R131-S133 PolarHBondContact O-N 3.35Å
132R55.8Low65.6Low169 Ų169127.5 Ų127.564%0.63864%0.636SS**  trans-62.2129.7158.8-74.3-174.7176.6168.13.7108T130 S134 D316T130-R132 PolarHBondContact O-N 2.85Å; R132-S134 PolarHBondContact O-N 3.28Å; R132-D316 IonicContact CZ-OD1 3.04Å; R132-D316 IonicContact CZ-OD2 3.87Å; R132-D316 IonicContact NH1-OD1 2.79Å; R132-D316 PolarHBondContact NH1-OD1 3.41Å; R132-D316 IonicContact NH1-OD2 3.15Å; R132-D316 PolarHBondContact NH1-OD2 2.69Å; R132-D316 VanDerWaalsContact NH1-OD2 3.15Å; R132-D316 IonicContact NH2-OD1 2.66Å; R132-D316 PolarHBondContact NH2-OD1 3.2Å
133S46.9Very low65.8Low112 Ų112123 Ų12378%0.78362%0.616SS**  trans-82.988.2171.21760000106.9R131 Y135R131-S133 PolarHBondContact O-N 3.35Å; S133-Y135 PolarHBondContact O-N 3.29Å
134S52.7Low66.4Low79 Ų79122 Ų12255%0.55261%0.61SS**  trans-79.4120.2172.764.20000108.8R132 E136R132-S134 PolarHBondContact O-N 3.28Å; S134-E136 PolarHBondContact O-N 3.1Å; S134-E136 WeakPolarHBondContact OG-CG 3.23Å
135Y50.5Low67.1Low231 Ų231115.6 Ų115.691%0.90659%0.586SS**  trans-85.167168.4-133.3-90.7000105.6S133 D137S133-Y135 PolarHBondContact O-N 3.29Å; Y135-D137 PolarHBondContact O-N 3.44Å
136E54.3Low67.9Low114 Ų114106.7 Ų106.753%0.53355%0.552SS.*  trans-75.3113.8-176-69-63.8115.500109.8S134 S138S134-E136 PolarHBondContact O-N 3.1Å; S134-E136 WeakPolarHBondContact OG-CG 3.23Å; E136-S138 PolarHBondContact O-N 3.02Å
137D56.9Low69.2Low98 Ų98101 Ų10152%0.52452%0.522SS..  trans-66.9115.9162.9-174.4-5.4000108.3Y135 S139 L140Y135-D137 PolarHBondContact O-N 3.44Å; D137-S139 PolarHBondContact O-N 3.4Å; D137-S139 PolarHBondContact OD1-N 2.85Å; D137-S139 PolarHBondContact OD1-OG 3.33Å; D137-S139 PolarHBondContact OD2-OG 3.22Å; D137-L140 HydrophobicContact CB-CD1 4.25Å; D137-L140 PolarHBondContact O-N 3.35Å
138S57.6Low70.3Confident124 Ų12495.6 Ų95.687%0.86751%0.506SS*.THydrogen-bonded Turntrans-68-4-173.4-56.70000114.2E136E136-S138 PolarHBondContact O-N 3.02Å
139S60.6Low71.5Confident58 Ų5887.4 Ų87.441%0.40646%0.464SS..THydrogen-bonded Turntrans-86.7-6.4179.263.50000114.3D137D137-S139 PolarHBondContact O-N 3.4Å; D137-S139 PolarHBondContact OD1-N 2.85Å; D137-S139 PolarHBondContact OD1-OG 3.33Å; D137-S139 PolarHBondContact OD2-OG 3.22Å
140L73.4Confident73.2Confident56 Ų5685 Ų8529%0.29345%0.445SS..SBendtrans-103.3146.1-174-68.4172.4000112.7D137 S142 L302 Q305D137-L140 HydrophobicContact CB-CD1 4.25Å; D137-L140 PolarHBondContact O-N 3.35Å; L140-S142 PolarHBondContact O-N 3.31Å; L140-S142 VanDerWaalsContact O-N 3.13Å; L140-L302 HydrophobicContact CD2-CD2 4.1Å; L140-Q305 HydrophobicContact CB-CG 4.01Å; L140-Q305 HydrophobicContact CD1-CG 3.91Å; L140-Q305 HydrophobicContact CD2-CB 4.37Å; L140-Q305 HydrophobicContact CD2-CG 4.34Å; L140-Q305 HydrophobicContact CG-CG 4.3Å
141P79.6Confident75.1Confident8 Ų880.9 Ų80.95%0.05242%0.42CS..  trans-71.3110.9-178.927.8-32.6000110.8L146 L302 V306P141-L146 HydrophobicContact CB-CD2 4.11Å; P141-L146 HydrophobicContact CB-CG 4.48Å; P141-L302 HydrophobicContact CG-CD2 4.32Å; P141-V306 HydrophobicContact CG-CG2 3.9Å
142S89.6Confident77.2Confident47 Ų4773.7 Ų73.733%0.32940%0.397SS..  trans-77.215517069.60000111.6L140 N144 A145 L146L140-S142 PolarHBondContact O-N 3.31Å; L140-S142 VanDerWaalsContact O-N 3.13Å; S142-N144 PolarHBondContact O-N 3.27Å; S142-A145 WeakPolarHBondContact O-CB 3.43Å; S142-A145 PolarHBondContact O-N 3.36Å; S142-A145 PolarHBondContact OG-N 3.36Å; S142-L146 PolarHBondContact O-N 2.91Å; S142-L146 VanDerWaalsContact O-N 3.12Å
143I92.1Very high78.9Confident22 Ų2265.7 Ų65.711%0.11337%0.367CS..Hα-helixtrans-53.3-40175.3-62.6-174.1000111.5A145 L146 L147 N275 S309 Y313I143-A145 VanDerWaalsContact C-N 3.35Å; I143-A145 PolarHBondContact O-N 3.06Å; I143-L146 PolarHBondContact O-N 3.15Å; I143-L147 WeakPolarHBondContact O-CB 3.38Å; I143-L147 PolarHBondContact O-N 2.99Å; I143-N275 HydrophobicContact CG2-CB 3.77Å; I143-S309 WeakPolarHBondContact CD1-O 3.31Å; I143-Y313 HydrophobicContact CD1-CD2 3.89Å; I143-Y313 HydrophobicContact CD1-CG 3.94Å
144N92.1Very high80.7Confident117 Ų11765.5 Ų65.563%0.62635%0.353SS*.Hα-helixtrans-62.8-40.7178-70.9-27.9000112.1S142 L146 L147 Q148S142-N144 PolarHBondContact O-N 3.27Å; N144-L146 VanDerWaalsContact C-N 3.34Å; N144-L147 PolarHBondContact O-N 2.89Å; N144-Q148 WeakPolarHBondContact O-CB 3.37Å; N144-Q148 VanDerWaalsContact O-CG 3.23Å; N144-Q148 WeakPolarHBondContact O-CG 3.2Å; N144-Q148 PolarHBondContact O-N 2.97Å
145A93.4Very high82Confident31 Ų3168.6 Ų68.626%0.25636%0.359SS..Hα-helixtrans-64-41.5176.500000111.3S142 I143 Q148 A149S142-A145 WeakPolarHBondContact O-CB 3.43Å; S142-A145 PolarHBondContact O-N 3.36Å; S142-A145 PolarHBondContact OG-N 3.36Å; I143-A145 VanDerWaalsContact C-N 3.35Å; I143-A145 PolarHBondContact O-N 3.06Å; A145-Q148 PolarHBondContact O-N 3.25Å; A145-A149 PolarHBondContact O-N 2.72Å
146L96.3Very high83.1Confident1 Ų161.8 Ų61.81%0.00534%0.338CS..Hα-helixtrans-65.1-42.6177-60178.1000112.2P141 S142 I143 N144 A149 E150 I196 A278 A282 V306P141-L146 HydrophobicContact CB-CD2 4.11Å; P141-L146 HydrophobicContact CB-CG 4.48Å; S142-L146 PolarHBondContact O-N 2.91Å; S142-L146 VanDerWaalsContact O-N 3.12Å; I143-L146 PolarHBondContact O-N 3.15Å; N144-L146 VanDerWaalsContact C-N 3.34Å; L146-A149 PolarHBondContact O-N 2.75Å; L146-E150 PolarHBondContact O-N 3.26Å; L146-E150 VanDerWaalsContact O-N 3.13Å; L146-I196 HydrophobicContact CD2-CD1 3.99Å; L146-I196 HydrophobicContact CD2-CG1 4.34Å; L146-I196 HydrophobicContact CD2-CG2 4.43Å; L146-A278 HydrophobicContact CB-CB 4.01Å; L146-A282 HydrophobicContact CD1-CB 3.64Å; L146-A282 HydrophobicContact CD2-CB 3.84Å; L146-A282 HydrophobicContact CG-CB 4.35Å; L146-V306 HydrophobicContact CD1-CG1 4.03Å; L146-V306 HydrophobicContact CD1-CG2 4.2Å
147L95.6Very high83.7Confident34 Ų3457.3 Ų57.318%0.17832%0.318CS..Hα-helixtrans-64.1-43.4176.6-179.566.2000111.5I143 N144 A149 E150 V151 D274I143-L147 WeakPolarHBondContact O-CB 3.38Å; I143-L147 PolarHBondContact O-N 2.99Å; N144-L147 PolarHBondContact O-N 2.89Å; L147-A149 VanDerWaalsContact C-N 3.34Å; L147-A149 PolarHBondContact O-N 3.2Å; L147-E150 WeakPolarHBondContact O-CB 3.33Å; L147-E150 PolarHBondContact O-N 3.48Å; L147-V151 WeakPolarHBondContact O-CG2 3.48Å; L147-V151 PolarHBondContact O-N 2.96Å; L147-D274 HydrophobicContact CD1-CB 3.69Å
148Q95Very high83.4Confident108 Ų10857.2 Ų57.251%0.50533%0.325SS..Hα-helixtrans-62.6-41.8176.9-71.9-61.1-43.500111.7N144 A145 E150 V151 L152N144-Q148 WeakPolarHBondContact O-CB 3.37Å; N144-Q148 VanDerWaalsContact O-CG 3.23Å; N144-Q148 WeakPolarHBondContact O-CG 3.2Å; N144-Q148 PolarHBondContact O-N 2.97Å; A145-Q148 PolarHBondContact O-N 3.25Å; Q148-E150 VanDerWaalsContact C-N 3.27Å; Q148-E150 PolarHBondContact O-N 2.91Å; Q148-V151 PolarHBondContact O-N 2.92Å; Q148-L152 VanDerWaalsContact O-CG 3.29Å; Q148-L152 WeakPolarHBondContact O-CG 3.43Å; Q148-L152 PolarHBondContact O-N 3.24Å
149A96.2Very high83.1Confident1 Ų157.3 Ų57.31%0.00832%0.323CS..Hα-helixtrans-58.2-40.4174.600000112A145 L146 L147 S153 I196A145-A149 PolarHBondContact O-N 2.72Å; L146-A149 PolarHBondContact O-N 2.75Å; L147-A149 VanDerWaalsContact C-N 3.34Å; L147-A149 PolarHBondContact O-N 3.2Å; A149-S153 WeakPolarHBondContact O-CB 3.32Å; A149-S153 PolarHBondContact O-N 3.01Å; A149-S153 VanDerWaalsContact O-N 3.07Å; A149-S153 PolarHBondContact O-OG 3.49Å; A149-I196 HydrophobicContact CB-CG1 3.92Å
150E95.1Very high82.6Confident16 Ų1657.8 Ų57.88%0.07532%0.32CS..Hα-helixtrans-63.5-50.1176.3-173.359.9-155.700111.9L146 L147 Q148 L152 S153 Q154 Y277 K281L146-E150 PolarHBondContact O-N 3.26Å; L146-E150 VanDerWaalsContact O-N 3.13Å; L147-E150 WeakPolarHBondContact O-CB 3.33Å; L147-E150 PolarHBondContact O-N 3.48Å; Q148-E150 VanDerWaalsContact C-N 3.27Å; Q148-E150 PolarHBondContact O-N 2.91Å; E150-L152 VanDerWaalsContact C-N 3.32Å; E150-L152 PolarHBondContact O-N 3.32Å; E150-S153 PolarHBondContact O-N 3.22Å; E150-S153 PolarHBondContact O-OG 2.88Å; E150-Q154 WeakPolarHBondContact O-CG 3.49Å; E150-Q154 PolarHBondContact O-N 3.43Å; E150-Q154 PolarHBondContact OE1-NE2 3.25Å; E150-Y277 VanDerWaalsContact CD-CE1 3.48Å; E150-Y277 HydrophobicContact CG-CD1 4.4Å; E150-Y277 HydrophobicContact CG-CE1 3.86Å; E150-Y277 WeakPolarHBondContact OE1-CE1 3.44Å; E150-K281 IonicContact OE2-NZ 3.6Å; E150-K281 PolarHBondContact OE2-NZ 3.45Å
151V93.7Very high81.3Confident63 Ų6359.5 Ų59.538%0.38234%0.337SS..Hα-helixtrans-59.4-41.8179.41730000112L147 Q148L147-V151 WeakPolarHBondContact O-CG2 3.48Å; L147-V151 PolarHBondContact O-N 2.96Å; Q148-V151 PolarHBondContact O-N 2.92Å
152L93.9Very high79.8Confident59 Ų5961.2 Ų61.231%0.30936%0.356SS..Hα-helixtrans-68.6-39.8179.8-68.5172.6000112Q148 E150 Q154 Q155 Y195Q148-L152 VanDerWaalsContact O-CG 3.29Å; Q148-L152 WeakPolarHBondContact O-CG 3.43Å; Q148-L152 PolarHBondContact O-N 3.24Å; E150-L152 VanDerWaalsContact C-N 3.32Å; E150-L152 PolarHBondContact O-N 3.32Å; L152-Q154 VanDerWaalsContact C-N 3.28Å; L152-Q154 PolarHBondContact O-N 2.93Å; L152-Q155 PolarHBondContact O-N 2.92Å; L152-Y195 HydrophobicContact CB-CD2 3.72Å; L152-Y195 HydrophobicContact CB-CE1 4.45Å; L152-Y195 HydrophobicContact CB-CE2 3.6Å; L152-Y195 HydrophobicContact CB-CG 4.21Å; L152-Y195 HydrophobicContact CD1-CD1 3.86Å; L152-Y195 HydrophobicContact CD1-CD2 4.4Å; L152-Y195 HydrophobicContact CD1-CE1 4.09Å; L152-Y195 HydrophobicContact CD1-CG 4.04Å
153S92.3Very high78.1Confident0 Ų064.3 Ų64.30%037%0.368CS..Hα-helixtrans-64.8-30.8-179.370.50000113.5A149 E150 Q155 I156A149-S153 WeakPolarHBondContact O-CB 3.32Å; A149-S153 PolarHBondContact O-N 3.01Å; A149-S153 VanDerWaalsContact O-N 3.07Å; A149-S153 PolarHBondContact O-OG 3.49Å; E150-S153 PolarHBondContact O-N 3.22Å; E150-S153 PolarHBondContact O-OG 2.88Å; S153-Q155 VanDerWaalsContact C-N 3.3Å; S153-Q155 PolarHBondContact O-N 3.15Å; S153-I156 PolarHBondContact O-N 3.32Å
154Q83.1Confident76Confident108 Ų10871.2 Ų71.251%0.50541%0.405SS..Hα-helixtrans-70.8-23.5179.6-69.1175.37.600113.3E150 L152 I156E150-Q154 WeakPolarHBondContact O-CG 3.49Å; E150-Q154 PolarHBondContact O-N 3.43Å; E150-Q154 PolarHBondContact OE1-NE2 3.25Å; L152-Q154 VanDerWaalsContact C-N 3.28Å; L152-Q154 PolarHBondContact O-N 2.93Å; Q154-I156 PolarHBondContact O-N 3.14Å
155Q80.6Confident74.4Confident145 Ų14567.1 Ų67.168%0.67839%0.39SS*.THydrogen-bonded Turntrans-74.2-11.8-179.6-63.8176.813.600113.5L152 S153L152-Q155 PolarHBondContact O-N 2.92Å; S153-Q155 VanDerWaalsContact C-N 3.3Å; S153-Q155 PolarHBondContact O-N 3.15Å
156I73.6Confident73.6Confident87 Ų8770.1 Ų70.145%0.44640%0.402SS..THydrogen-bonded Turntrans-82.2-27.9-177-57.2177.3000111.2S153 Q154 E191 Y195S153-I156 PolarHBondContact O-N 3.32Å; Q154-I156 PolarHBondContact O-N 3.14Å; I156-E191 HydrophobicContact CD1-CB 3.4Å; I156-E191 HydrophobicContact CD1-CG 3.65Å; I156-Y195 HydrophobicContact CD1-CE2 4.43Å
157T66.3Low73.1Confident21 Ų2171.7 Ų71.713%0.12941%0.41CS..SBendtrans-76.8138.4173-45.20000107.7
158S52.2Low72.3Confident95 Ų9580.6 Ų80.666%0.66444%0.441SS*.  trans-41.4138.8175.627.50000110.5I160S158-I160 PolarHBondContact O-N 2.72Å
159P49.7Very low71.9Confident126 Ų12679.5 Ų79.582%0.81845%0.45SS*.  trans-55.2104.1-169.522.3-31.9000108.1S161P159-S161 PolarHBondContact O-N 2.84Å
160I51.2Low71.7Confident69 Ų6981.1 Ų81.135%0.35446%0.457SS..  trans-52.1111.5172.2-61.8167000102.7S158 G162S158-I160 PolarHBondContact O-N 2.72Å; I160-G162 VanDerWaalsContact C-N 3.33Å; I160-G162 VanDerWaalsContact O-CA 3.29Å; I160-G162 WeakPolarHBondContact O-CA 3.29Å; I160-G162 PolarHBondContact O-N 3.39Å
161S45.8Very low71.6Confident91 Ų9187.4 Ų87.464%0.63649%0.485SS*.  trans-50113.2166-81.90000103.7P159P159-S161 PolarHBondContact O-N 2.84Å
162G48.5Very low71.7Confident45 Ų4588 Ų8846%0.46449%0.485SS..  trans-48.3165.4-150.400000113.3I160 N164 G165I160-G162 VanDerWaalsContact C-N 3.33Å; I160-G162 VanDerWaalsContact O-CA 3.29Å; I160-G162 WeakPolarHBondContact O-CA 3.29Å; I160-G162 PolarHBondContact O-N 3.39Å; G162-N164 CarbonylContact O-C 3.22Å; G162-N164 WeakPolarHBondContact O-CA 3.35Å; G162-N164 PolarHBondContact O-N 2.87Å; G162-G165 PolarHBondContact O-N 2.9Å
163I54.2Low71.7Confident112 Ų11285.2 Ų85.257%0.57447%0.47SS*.THydrogen-bonded Turntrans-46.7-12.1174.7-62.3167.5000113.4V229 F230I163-V229 HydrophobicContact CG2-CG2 3.85Å; I163-F230 HydrophobicContact CG2-CZ 4.36Å
164N48.2Very low71.8Confident166 Ų16688.1 Ų88.189%0.88849%0.486SS*.THydrogen-bonded Turntrans-75.3-2.5166.7-69.48000117.5G162G162-N164 CarbonylContact O-C 3.22Å; G162-N164 WeakPolarHBondContact O-CA 3.35Å; G162-N164 PolarHBondContact O-N 2.87Å
165G57.6Low72.3Confident31 Ų3184.6 Ų84.632%0.3247%0.47SS..SBendtrans-71.3135.5172.700000110.6G162 I167G162-G165 PolarHBondContact O-N 2.9Å; G165-I167 PolarHBondContact O-N 2.89Å
166D76.4Confident72.9Confident95 Ų9581.6 Ų81.651%0.50846%0.462SS..  trans-58111.2177.1-174.1-0.4000109.7R168 A169D166-R168 PolarHBondContact O-N 2.96Å; D166-R168 VanDerWaalsContact OD1-CB 3.25Å; D166-R168 WeakPolarHBondContact OD1-CB 3.49Å; D166-R168 VanDerWaalsContact OD1-CG 3.27Å; D166-R168 WeakPolarHBondContact OD1-CG 3.32Å; D166-R168 PolarHBondContact OD1-N 2.96Å; D166-A169 WeakPolarHBondContact O-CB 3.46Å; D166-A169 PolarHBondContact O-N 3.49Å
167I85.1Confident73.9Confident34 Ų3478.3 Ų78.317%0.17445%0.445CS..G310 helixtrans-56.9-23.9179.1-170.5155.7000111.9G165 A169 K170 F230 V233 I241G165-I167 PolarHBondContact O-N 2.89Å; I167-A169 PolarHBondContact O-N 2.86Å; I167-K170 HydrophobicContact CG1-CD 4.43Å; I167-K170 WeakPolarHBondContact O-CB 3.45Å; I167-K170 PolarHBondContact O-N 3.44Å; I167-F230 HydrophobicContact CB-CD1 4.2Å; I167-F230 HydrophobicContact CB-CE1 4.09Å; I167-F230 HydrophobicContact CD1-CB 3.84Å; I167-F230 HydrophobicContact CD1-CD1 3.35Å; I167-F230 HydrophobicContact CD1-CD2 3.69Å; I167-F230 HydrophobicContact CD1-CE1 3.73Å; I167-F230 HydrophobicContact CD1-CE2 4.06Å; I167-F230 HydrophobicContact CD1-CG 3.33Å; I167-F230 HydrophobicContact CD1-CZ 4.06Å; I167-F230 HydrophobicContact CG1-CD1 4.37Å; I167-F230 HydrophobicContact CG1-CE1 4.46Å; I167-F230 HydrophobicContact CG2-CD1 4.37Å; I167-V233 HydrophobicContact CD1-CB 4.44Å; I167-V233 HydrophobicContact CD1-CG1 3.41Å; I167-V233 VanDerWaalsContact CD1-CG1 3.41Å; I167-V233 HydrophobicContact CD1-CG2 4.15Å; I167-V233 HydrophobicContact CG1-CG1 4.43Å; I167-I241 HydrophobicContact CD1-CG2 4.24Å; I167-I241 HydrophobicContact CG1-CG2 3.96Å
168R80.1Confident75.2Confident221 Ų22178.2 Ų78.283%0.83445%0.445SS*.G310 helixtrans-69.6-19.5176.3-57.7173.5-178.31782.2113.3D166 K170D166-R168 PolarHBondContact O-N 2.96Å; D166-R168 VanDerWaalsContact OD1-CB 3.25Å; D166-R168 WeakPolarHBondContact OD1-CB 3.49Å; D166-R168 VanDerWaalsContact OD1-CG 3.27Å; D166-R168 WeakPolarHBondContact OD1-CG 3.32Å; D166-R168 PolarHBondContact OD1-N 2.96Å; R168-K170 VanDerWaalsContact C-N 3.35Å
169A87.1Confident77.3Confident84 Ų8474.3 Ų74.369%0.69442%0.417SS*.G310 helixtrans-84.8-10.9175.900000112.8D166 I167D166-A169 WeakPolarHBondContact O-CB 3.46Å; D166-A169 PolarHBondContact O-N 3.49Å; I167-A169 PolarHBondContact O-N 2.86Å
170K90.3Very high79.4Confident35 Ų3573 Ų7315%0.15240%0.4CS..SBendtrans-78146.1179.7-62.9-175.9-178.6-78.30110.8I167 R168 L235 D239 I241I167-K170 HydrophobicContact CG1-CD 4.43Å; I167-K170 WeakPolarHBondContact O-CB 3.45Å; I167-K170 PolarHBondContact O-N 3.44Å; R168-K170 VanDerWaalsContact C-N 3.35Å; K170-L235 HydrophobicContact CD-CD1 3.55Å; K170-D239 WeakPolarHBondContact CD-O 3.45Å; K170-D239 IonicContact NZ-OD1 3.87Å; K170-D239 PolarHBondContact NZ-OD1 2.97Å; K170-D239 IonicContact NZ-OD2 3.36Å; K170-D239 PolarHBondContact NZ-OD2 3.31Å; K170-I241 HydrophobicContact CB-CD1 4.48Å; K170-I241 HydrophobicContact CB-CG1 4.24Å; K170-I241 HydrophobicContact CB-CG2 3.68Å; K170-I241 HydrophobicContact CD-CG2 3.8Å; K170-I241 HydrophobicContact CG-CG2 4.36Å
171K94.1Very high81.5Confident149 Ų14970 Ų7065%0.64839%0.385SS*.PPolyproline II helixtrans-81.7147.4-178.8-66.6-179.6-178.6177.20111Y240 I241K171-Y240 HydrophobicContact CB-CD1 3.68Å; K171-Y240 HydrophobicContact CB-CE1 3.62Å; K171-Y240 HydrophobicContact CD-CE1 4.12Å; K171-Y240 WeakPolarHBondContact O-CA 3.36Å; K171-Y240 WeakPolarHBondContact O-CD1 3.14Å; K171-I241 WeakPolarHBondContact O-CG1 3.38Å; K171-I241 PolarHBondContact O-N 2.97Å
172I94.9Very high84Confident75 Ų7566.3 Ų66.339%0.38536%0.358SS..BIsolated β-bridgetrans-70.9134.6172.8-59.7176.5000108.9I241 P243I172-I241 WeakPolarHBondContact CA-O 3.47Å; I172-P243 HydrophobicContact CD1-CG 4.39Å; I172-P243 HydrophobicContact CG1-CG 4.24Å
173A95.4Very high86.2Confident0 Ų067.8 Ų67.80%035%0.351CS..PPolyproline II helixtrans-81.8135.9-179.100000111.6D177 V178 L236 Y240 I241 V242A173-D177 HydrophobicContact CB-CB 4.06Å; A173-V178 HydrophobicContact CB-CG2 4.23Å; A173-L236 HydrophobicContact CB-CD1 3.61Å; A173-Y240 HydrophobicContact CB-CD1 4.5Å; A173-Y240 HydrophobicContact CB-CG 4.4Å; A173-I241 PolarHBondContact N-O 3.17Å; A173-V242 HydrophobicContact CB-CG2 3.93Å
174N93.8Very high88.2Confident62 Ų6265.7 Ų65.733%0.33234%0.339SS..  trans-91.8178.7161.169.263.4000111T176 D177 V178N174-T176 VanDerWaalsContact C-N 3.27Å; N174-T176 PolarHBondContact O-N 3.13Å; N174-T176 WeakPolarHBondContact OD1-CA 3.24Å; N174-T176 WeakPolarHBondContact OD1-CB 3.32Å; N174-T176 PolarHBondContact OD1-N 3.45Å; N174-T176 PolarHBondContact OD1-OG1 2.95Å; N174-D177 PolarHBondContact N-OD2 3.44Å; N174-D177 PolarHBondContact ND2-OD2 3.19Å; N174-D177 PolarHBondContact O-N 3.15Å; N174-D177 PolarHBondContact OD1-N 3.4Å; N174-V178 WeakPolarHBondContact O-CG2 3.35Å; N174-V178 PolarHBondContact O-N 2.92Å; N174-V178 VanDerWaalsContact O-N 3.12Å
175I92.6Very high90.5Very high33 Ų3359.4 Ų59.417%0.16931%0.305CS..Hα-helixtrans-58.4-37.8-177.8-61.3174.1000112.3V178 C179 L249 I349 A355I175-V178 PolarHBondContact O-N 2.94Å; I175-C179 PolarHBondContact O-N 3.08Å; I175-C179 PolarHBondContact O-SG 2.97Å; I175-C179 VanDerWaalsContact O-SG 3.4Å; I175-L249 HydrophobicContact CG1-CD2 3.88Å; I175-I349 HydrophobicContact CD1-CD1 4.5Å; I175-I349 HydrophobicContact CG2-CD1 3.89Å; I175-I349 HydrophobicContact CG2-CG1 4.5Å; I175-I349 HydrophobicContact CG2-CG2 3.93Å; I175-A355 HydrophobicContact CG2-CB 3.85Å
176T93.1Very high92.3Very high83 Ų8358 Ų5851%0.50929%0.289SS..Hα-helixtrans-66.9-42.9179.9-51.20000110.8N174 V178 C179 E180N174-T176 VanDerWaalsContact C-N 3.27Å; N174-T176 PolarHBondContact O-N 3.13Å; N174-T176 WeakPolarHBondContact OD1-CA 3.24Å; N174-T176 WeakPolarHBondContact OD1-CB 3.32Å; N174-T176 PolarHBondContact OD1-N 3.45Å; N174-T176 PolarHBondContact OD1-OG1 2.95Å; T176-V178 VanDerWaalsContact C-N 3.27Å; T176-V178 PolarHBondContact O-N 3.31Å; T176-C179 PolarHBondContact O-N 3.23Å; T176-E180 WeakPolarHBondContact O-CB 3.17Å; T176-E180 PolarHBondContact O-N 3.37Å
177D94.8Very high93.3Very high17 Ų1757.8 Ų57.89%0.09129%0.288CS..Hα-helixtrans-63.1-36.3177.7-51.9-40.4000111A173 N174 S181 N238 Y240A173-D177 HydrophobicContact CB-CB 4.06Å; N174-D177 PolarHBondContact N-OD2 3.44Å; N174-D177 PolarHBondContact ND2-OD2 3.19Å; N174-D177 PolarHBondContact O-N 3.15Å; N174-D177 PolarHBondContact OD1-N 3.4Å; D177-S181 WeakPolarHBondContact O-CB 3.37Å; D177-S181 PolarHBondContact O-N 3.43Å; D177-N238 PolarHBondContact O-ND2 3.19Å; D177-Y240 HydrophobicContact CB-CD1 4.44Å; D177-Y240 HydrophobicContact CB-CD2 4.21Å; D177-Y240 HydrophobicContact CB-CE2 4.44Å; D177-Y240 HydrophobicContact CB-CG 4.2Å
178V94.9Very high93.8Very high20 Ų2056.9 Ų56.912%0.12128%0.284CS..Hα-helixtrans-64-51.1173.6175.40000110.6A173 N174 I175 T176 E180 S181 M182 L236 V242 L249A173-V178 HydrophobicContact CB-CG2 4.23Å; N174-V178 WeakPolarHBondContact O-CG2 3.35Å; N174-V178 PolarHBondContact O-N 2.92Å; N174-V178 VanDerWaalsContact O-N 3.12Å; I175-V178 PolarHBondContact O-N 2.94Å; T176-V178 VanDerWaalsContact C-N 3.27Å; T176-V178 PolarHBondContact O-N 3.31Å; V178-E180 VanDerWaalsContact C-N 3.32Å; V178-E180 PolarHBondContact O-N 3.34Å; V178-S181 PolarHBondContact O-N 3.08Å; V178-M182 HydrophobicContact CG1-CG 4.49Å; V178-M182 HydrophobicContact CG1-SD 4.2Å; V178-M182 VanDerWaalsContact O-CG 3.28Å; V178-M182 WeakPolarHBondContact O-CG 3.42Å; V178-M182 PolarHBondContact O-N 3.17Å; V178-L236 HydrophobicContact CG2-CD1 3.9Å; V178-V242 HydrophobicContact CG2-CG2 4.47Å; V178-L249 HydrophobicContact CG2-CD2 4.08Å
179C95.1Very high94.6Very high12 Ų1246.7 Ų46.78%0.08125%0.246CC..Hα-helixtrans-62.3-37.9179.5-68.90000112.7I175 T176 M182 K183 L361I175-C179 PolarHBondContact O-N 3.08Å; I175-C179 PolarHBondContact O-SG 2.97Å; I175-C179 VanDerWaalsContact O-SG 3.4Å; T176-C179 PolarHBondContact O-N 3.23Å; C179-M182 PolarHBondContact O-N 3.41Å; C179-K183 PolarHBondContact O-N 2.85Å; C179-K183 VanDerWaalsContact O-N 3.1Å; C179-L361 HydrophobicContact CB-CD2 4.33Å
180E94.8Very high95.1Very high99 Ų9944.6 Ų44.646%0.46323%0.225SC..Hα-helixtrans-63.4-47.3174.2-176.1172.5-131.700111T176 V178 M182 K183 E184T176-E180 WeakPolarHBondContact O-CB 3.17Å; T176-E180 PolarHBondContact O-N 3.37Å; V178-E180 VanDerWaalsContact C-N 3.32Å; V178-E180 PolarHBondContact O-N 3.34Å; E180-M182 VanDerWaalsContact C-N 3.32Å; E180-M182 PolarHBondContact O-N 3.34Å; E180-K183 WeakPolarHBondContact O-CB 3.34Å; E180-K183 PolarHBondContact O-N 3.47Å; E180-K183 VanDerWaalsContact O-N 3.08Å; E180-E184 PolarHBondContact O-N 2.92Å; E180-E184 VanDerWaalsContact O-N 3.08Å
181S95.6Very high95.4Very high6 Ų645.6 Ų45.64%0.04223%0.23CC..Hα-helixtrans-59.9-42.7176.2-168.70000112.1D177 V178 K183 E184 Q185 G237 N238D177-S181 WeakPolarHBondContact O-CB 3.37Å; D177-S181 PolarHBondContact O-N 3.43Å; V178-S181 PolarHBondContact O-N 3.08Å; S181-K183 VanDerWaalsContact C-N 3.26Å; S181-K183 PolarHBondContact O-N 3.12Å; S181-E184 PolarHBondContact O-N 3.18Å; S181-Q185 WeakPolarHBondContact O-CB 3.39Å; S181-Q185 WeakPolarHBondContact O-CG 3.29Å; S181-Q185 PolarHBondContact O-N 3.39Å; S181-G237 WeakPolarHBondContact OG-CA 3.46Å; S181-G237 PolarHBondContact OG-N 3.17Å; S181-N238 WeakPolarHBondContact CB-OD1 3.33Å
182M96.6Very high95.6Very high14 Ų1438.5 Ų38.57%0.06920%0.199CC..Hα-helixtrans-58.3-40.6176.3-69.2178.380.900111.4V178 C179 E180 Q185 L186 L219 M342 I346 L361 L365V178-M182 HydrophobicContact CG1-CG 4.49Å; V178-M182 HydrophobicContact CG1-SD 4.2Å; V178-M182 VanDerWaalsContact O-CG 3.28Å; V178-M182 WeakPolarHBondContact O-CG 3.42Å; V178-M182 PolarHBondContact O-N 3.17Å; C179-M182 PolarHBondContact O-N 3.41Å; E180-M182 VanDerWaalsContact C-N 3.32Å; E180-M182 PolarHBondContact O-N 3.34Å; M182-Q185 PolarHBondContact O-N 3.49Å; M182-L186 VanDerWaalsContact O-CG 3.29Å; M182-L186 WeakPolarHBondContact O-CG 3.21Å; M182-L186 PolarHBondContact O-N 2.98Å; M182-L219 HydrophobicContact CB-CD1 3.99Å; M182-L219 HydrophobicContact CE-CD1 3.42Å; M182-L219 VanDerWaalsContact CE-CD1 3.42Å; M182-L219 HydrophobicContact CG-CD1 4.08Å; M182-M342 HydrophobicContact CE-CE 3.71Å; M182-M342 HydrophobicContact CE-SD 3.62Å; M182-M342 HydrophobicContact SD-SD 4.44Å; M182-I346 HydrophobicContact CE-CD1 3.47Å; M182-I346 VanDerWaalsContact CE-CD1 3.47Å; M182-I346 HydrophobicContact SD-CD1 3.73Å; M182-L361 HydrophobicContact CB-CD2 4.1Å; M182-L361 HydrophobicContact CB-CG 4.44Å; M182-L365 HydrophobicContact CE-CD1 3.53Å
183K95.8Very high95.7Very high75 Ų7535 Ų3533%0.32618%0.181SC..Hα-helixtrans-62.3-50178.3-176.2-172.2172.7170.90111.4C179 E180 S181 Q185 L186 L187 D358 L360 L361C179-K183 PolarHBondContact O-N 2.85Å; C179-K183 VanDerWaalsContact O-N 3.1Å; E180-K183 WeakPolarHBondContact O-CB 3.34Å; E180-K183 PolarHBondContact O-N 3.47Å; E180-K183 VanDerWaalsContact O-N 3.08Å; S181-K183 VanDerWaalsContact C-N 3.26Å; S181-K183 PolarHBondContact O-N 3.12Å; K183-Q185 VanDerWaalsContact C-N 3.31Å; K183-Q185 PolarHBondContact O-N 3.41Å; K183-L186 PolarHBondContact O-N 3.45Å; K183-L187 PolarHBondContact O-N 3.05Å; K183-D358 HydrophobicContact CD-CB 3.97Å; K183-D358 VanDerWaalsContact CE-CG 3.47Å; K183-D358 WeakPolarHBondContact CE-OD1 2.96Å; K183-D358 VanDerWaalsContact CE-OD2 3.28Å; K183-D358 WeakPolarHBondContact CE-OD2 3.46Å; K183-D358 HydrophobicContact CG-CB 4.43Å; K183-D358 IonicContact NZ-OD1 2.87Å; K183-D358 IonicContact NZ-OD2 2.7Å; K183-D358 PolarHBondContact NZ-OD2 2.74Å; K183-L360 HydrophobicContact CG-CD2 4.34Å; K183-L361 HydrophobicContact CB-CD1 3.45Å; K183-L361 VanDerWaalsContact CB-CD1 3.45Å; K183-L361 HydrophobicContact CG-CD1 4.04Å
184E95.4Very high95.8Very high69 Ų6939.7 Ų39.732%0.32220%0.202SC..Hα-helixtrans-59.7-44.1178.6-67.6177.1169.100111.1E180 S181 L186 L187 V188E180-E184 PolarHBondContact O-N 2.92Å; E180-E184 VanDerWaalsContact O-N 3.08Å; S181-E184 PolarHBondContact O-N 3.18Å; E184-L186 VanDerWaalsContact C-N 3.34Å; E184-L186 PolarHBondContact O-N 3.3Å; E184-L187 WeakPolarHBondContact O-CB 3.4Å; E184-L187 PolarHBondContact O-N 3.23Å; E184-V188 WeakPolarHBondContact O-CG2 3.43Å; E184-V188 PolarHBondContact O-N 3.12Å
185Q96.3Very high95.9Very high34 Ų3441.3 Ų41.316%0.15920%0.203CC..Hα-helixtrans-71.2-27.1-178.7-64.4-60.6-8000113.1S181 M182 K183 V188 L189 L219S181-Q185 WeakPolarHBondContact O-CB 3.39Å; S181-Q185 WeakPolarHBondContact O-CG 3.29Å; S181-Q185 PolarHBondContact O-N 3.39Å; M182-Q185 PolarHBondContact O-N 3.49Å; K183-Q185 VanDerWaalsContact C-N 3.31Å; K183-Q185 PolarHBondContact O-N 3.41Å; Q185-V188 PolarHBondContact O-N 2.92Å; Q185-L189 PolarHBondContact O-N 2.92Å; Q185-L219 HydrophobicContact CB-CD2 3.4Å; Q185-L219 VanDerWaalsContact CB-CD2 3.4Å
186L96.8Very high96.1Very high0 Ų039.7 Ų39.70%020%0.195CC..Hα-helixtrans-66.9-37.5169.4-73.7175.6000112M182 K183 E184 V188 L189 V190 A215 L219 L360 L361 M364 L365M182-L186 VanDerWaalsContact O-CG 3.29Å; M182-L186 WeakPolarHBondContact O-CG 3.21Å; M182-L186 PolarHBondContact O-N 2.98Å; K183-L186 PolarHBondContact O-N 3.45Å; E184-L186 VanDerWaalsContact C-N 3.34Å; E184-L186 PolarHBondContact O-N 3.3Å; L186-V188 VanDerWaalsContact C-N 3.35Å; L186-L189 HydrophobicContact CD2-CD2 4.48Å; L186-L189 WeakPolarHBondContact O-CB 3.44Å; L186-L189 PolarHBondContact O-N 3.26Å; L186-V190 WeakPolarHBondContact O-CG2 3.33Å; L186-V190 PolarHBondContact O-N 3.4Å; L186-V190 VanDerWaalsContact O-N 3.15Å; L186-A215 HydrophobicContact CD2-CB 3.84Å; L186-L219 HydrophobicContact CD2-CD1 4Å; L186-L219 HydrophobicContact CD2-CD2 4.18Å; L186-L219 HydrophobicContact CD2-CG 4.09Å; L186-L219 HydrophobicContact CG-CD1 4.12Å; L186-L219 HydrophobicContact CG-CD2 4.17Å; L186-L219 HydrophobicContact CG-CG 4.45Å; L186-L360 HydrophobicContact CB-CD2 3.88Å; L186-L360 HydrophobicContact CB-CG 4.33Å; L186-L360 HydrophobicContact CD1-CG 4.27Å; L186-L361 HydrophobicContact CD1-CD1 4.07Å; L186-L361 HydrophobicContact CD1-CG 4.18Å; L186-M364 HydrophobicContact CB-SD 4.11Å; L186-M364 HydrophobicContact CD1-CB 4.1Å; L186-M364 HydrophobicContact CD1-SD 4.25Å; L186-M364 HydrophobicContact CD2-CB 4.34Å; L186-M364 HydrophobicContact CD2-CE 4.04Å; L186-M364 HydrophobicContact CD2-SD 4.15Å; L186-M364 HydrophobicContact CG-SD 4.4Å; L186-L365 HydrophobicContact CD1-CD1 4.06Å; L186-L365 HydrophobicContact CD1-CG 4.38Å
187L95.9Very high96.1Very high91 Ų9139.4 Ų39.448%0.47620%0.195SC..Hα-helixtrans-65.4-40.7173.2-65.3171.7000111.3K183 E184 L189 V190 E191 L360K183-L187 PolarHBondContact O-N 3.05Å; E184-L187 WeakPolarHBondContact O-CB 3.4Å; E184-L187 PolarHBondContact O-N 3.23Å; L187-L189 VanDerWaalsContact C-N 3.28Å; L187-L189 PolarHBondContact O-N 2.97Å; L187-V190 PolarHBondContact O-N 2.66Å; L187-E191 PolarHBondContact O-N 3.03Å; L187-E191 VanDerWaalsContact O-N 3.1Å; L187-L360 HydrophobicContact CD2-CD2 3.63Å; L187-L360 HydrophobicContact CG-CD2 3.77Å
188V96.5Very high96.1Very high16 Ų1639 Ų3910%0.09719%0.193CC..Hα-helixtrans-60.9-38173.6175.60000111.4E184 Q185 L186 E191 W192E184-V188 WeakPolarHBondContact O-CG2 3.43Å; E184-V188 PolarHBondContact O-N 3.12Å; Q185-V188 PolarHBondContact O-N 2.92Å; L186-V188 VanDerWaalsContact C-N 3.35Å; V188-E191 PolarHBondContact O-N 3.13Å; V188-W192 WeakPolarHBondContact O-CB 3.49Å; V188-W192 PolarHBondContact O-N 3.36Å
189L97.8Very high96.2Very high7 Ų738.1 Ų38.14%0.03719%0.188CC..Hα-helixtrans-61.4-42.9175.1177.363.7000112.1Q185 L186 L187 W192 A193 L211 H218 M364Q185-L189 PolarHBondContact O-N 2.92Å; L186-L189 HydrophobicContact CD2-CD2 4.48Å; L186-L189 WeakPolarHBondContact O-CB 3.44Å; L186-L189 PolarHBondContact O-N 3.26Å; L187-L189 VanDerWaalsContact C-N 3.28Å; L187-L189 PolarHBondContact O-N 2.97Å; L189-W192 HydrophobicContact CD1-CE3 3.7Å; L189-W192 HydrophobicContact CD1-CZ3 3.99Å; L189-W192 PolarHBondContact O-N 3.45Å; L189-A193 PolarHBondContact O-N 2.98Å; L189-L211 HydrophobicContact CG-CD2 4.22Å; L189-H218 HydrophobicContact CD1-CB 3.99Å; L189-H218 HydrophobicContact CD2-CB 3.83Å; L189-M364 HydrophobicContact CD2-CE 4.41Å
190V97.1Very high96.2Very high39 Ų3940.6 Ų40.624%0.23621%0.205CC..Hα-helixtrans-61.2-46.2176.3175.10000110.8L186 L187 A193 K194 L211L186-V190 WeakPolarHBondContact O-CG2 3.33Å; L186-V190 PolarHBondContact O-N 3.4Å; L186-V190 VanDerWaalsContact O-N 3.15Å; L187-V190 PolarHBondContact O-N 2.66Å; V190-A193 PolarHBondContact O-N 3Å; V190-K194 HydrophobicContact CG1-CD 4.11Å; V190-K194 WeakPolarHBondContact O-CG 3.27Å; V190-K194 PolarHBondContact O-N 3.23Å; V190-K194 VanDerWaalsContact O-N 3.17Å; V190-L211 HydrophobicContact CG2-CD1 4.26Å; V190-L211 HydrophobicContact CG2-CD2 4.09Å
191E96.3Very high96.3Very high57 Ų5741.8 Ų41.827%0.26621%0.21SC..Hα-helixtrans-68.1-39.1178.9-67.7-58.813900112.5I156 L187 V188 A193 K194 Y195I156-E191 HydrophobicContact CD1-CB 3.4Å; I156-E191 HydrophobicContact CD1-CG 3.65Å; L187-E191 PolarHBondContact O-N 3.03Å; L187-E191 VanDerWaalsContact O-N 3.1Å; V188-E191 PolarHBondContact O-N 3.13Å; E191-A193 VanDerWaalsContact C-N 3.32Å; E191-A193 PolarHBondContact O-N 3.09Å; E191-K194 PolarHBondContact O-N 3.05Å; E191-K194 IonicContact OE1-NZ 2.79Å; E191-K194 PolarHBondContact OE1-NZ 3.26Å; E191-K194 IonicContact OE2-NZ 2.73Å; E191-K194 PolarHBondContact OE2-NZ 3.49Å; E191-Y195 WeakPolarHBondContact O-CD2 3.48Å; E191-Y195 PolarHBondContact O-N 3.48Å
192W98.1Very high96.3Very high0 Ų042.1 Ų42.10%021%0.212CC..Hα-helixtrans-55.1-47.3171.5168.982.4000111.9V188 L189 K194 Y195 I196 K281 F285V188-W192 WeakPolarHBondContact O-CB 3.49Å; V188-W192 PolarHBondContact O-N 3.36Å; L189-W192 HydrophobicContact CD1-CE3 3.7Å; L189-W192 HydrophobicContact CD1-CZ3 3.99Å; L189-W192 PolarHBondContact O-N 3.45Å; W192-K194 VanDerWaalsContact C-N 3.3Å; W192-K194 PolarHBondContact O-N 2.98Å; W192-Y195 PolarHBondContact O-N 3.28Å; W192-Y195 VanDerWaalsContact O-N 3.14Å; W192-I196 HydrophobicContact CD2-CD1 4.17Å; W192-I196 HydrophobicContact CE3-CD1 4.32Å; W192-I196 HydrophobicContact CH2-CD1 3.77Å; W192-I196 HydrophobicContact CZ2-CD1 3.57Å; W192-I196 HydrophobicContact CZ3-CD1 4.14Å; W192-K281 HydrophobicContact CH2-CD 4.5Å; W192-K281 HydrophobicContact CH2-CG 3.91Å; W192-K281 HydrophobicContact CZ2-CB 4.23Å; W192-K281 HydrophobicContact CZ2-CD 3.97Å; W192-K281 HydrophobicContact CZ2-CG 3.74Å; W192-F285 HydrophobicContact CH2-CB 3.8Å; W192-F285 HydrophobicContact CH2-CD1 4.12Å; W192-F285 HydrophobicContact CH2-CD2 4.44Å; W192-F285 AromaticContact CH2-CG 3.88Å; W192-F285 HydrophobicContact CH2-CG 3.88Å; W192-F285 HydrophobicContact CZ3-CB 3.97Å; W192-F285 AromaticContact CZ3-CD1 3.88Å; W192-F285 HydrophobicContact CZ3-CD1 3.88Å; W192-F285 AromaticContact CZ3-CD2 3.74Å; W192-F285 HydrophobicContact CZ3-CD2 3.74Å; W192-F285 HydrophobicContact CZ3-CE1 4.27Å; W192-F285 HydrophobicContact CZ3-CE2 4.15Å; W192-F285 AromaticContact CZ3-CG 3.59Å; W192-F285 HydrophobicContact CZ3-CG 3.59Å; W192-F285 HydrophobicContact CZ3-CZ 4.39Å
193A98Very high96.4Very high0 Ų046.7 Ų46.70%024%0.236CC..Hα-helixtrans-62.1-39.5-179.600000111.6L189 V190 E191 Y195 I196 F199 L211 F285L189-A193 PolarHBondContact O-N 2.98Å; V190-A193 PolarHBondContact O-N 3Å; E191-A193 VanDerWaalsContact C-N 3.32Å; E191-A193 PolarHBondContact O-N 3.09Å; A193-Y195 PolarHBondContact O-N 2.92Å; A193-I196 WeakPolarHBondContact O-CB 3.21Å; A193-I196 PolarHBondContact O-N 3.41Å; A193-F199 VanDerWaalsContact C-CD1 3.42Å; A193-F199 HydrophobicContact CB-CD1 3.83Å; A193-F199 HydrophobicContact CB-CD2 4.3Å; A193-F199 HydrophobicContact CB-CE1 3.67Å; A193-F199 HydrophobicContact CB-CE2 4.14Å; A193-F199 HydrophobicContact CB-CG 4.12Å; A193-F199 HydrophobicContact CB-CZ 3.82Å; A193-F199 WeakPolarHBondContact O-CD1 3.34Å; A193-L211 HydrophobicContact CB-CD2 4.15Å; A193-F285 HydrophobicContact CB-CE1 4.15Å; A193-F285 HydrophobicContact CB-CE2 4.31Å; A193-F285 HydrophobicContact CB-CZ 3.63Å
194K96.8Very high96.4Very high100 Ų10049.1 Ų49.144%0.43525%0.252SS..Hα-helixtrans-64.7-18.4177.7-69.8164.869.7-150.70114V190 E191 W192 I196 F199 C200V190-K194 HydrophobicContact CG1-CD 4.11Å; V190-K194 WeakPolarHBondContact O-CG 3.27Å; V190-K194 PolarHBondContact O-N 3.23Å; V190-K194 VanDerWaalsContact O-N 3.17Å; E191-K194 PolarHBondContact O-N 3.05Å; E191-K194 IonicContact OE1-NZ 2.79Å; E191-K194 PolarHBondContact OE1-NZ 3.26Å; E191-K194 IonicContact OE2-NZ 2.73Å; E191-K194 PolarHBondContact OE2-NZ 3.49Å; W192-K194 VanDerWaalsContact C-N 3.3Å; W192-K194 PolarHBondContact O-N 2.98Å; K194-I196 VanDerWaalsContact C-N 3.32Å; K194-F199 HydrophobicContact CG-CE1 4.37Å; K194-C200 PolarHBondContact O-SG 3.18Å
195Y96.3Very high96.5Very high95 Ų9551.9 Ų51.937%0.37327%0.269SS..THydrogen-bonded Turntrans-84.9-2.7172.5-67.7-54.5000113.8L152 I156 E191 W192 A193 P197L152-Y195 HydrophobicContact CB-CD2 3.72Å; L152-Y195 HydrophobicContact CB-CE1 4.45Å; L152-Y195 HydrophobicContact CB-CE2 3.6Å; L152-Y195 HydrophobicContact CB-CG 4.21Å; L152-Y195 HydrophobicContact CD1-CD1 3.86Å; L152-Y195 HydrophobicContact CD1-CD2 4.4Å; L152-Y195 HydrophobicContact CD1-CE1 4.09Å; L152-Y195 HydrophobicContact CD1-CG 4.04Å; I156-Y195 HydrophobicContact CD1-CE2 4.43Å; E191-Y195 WeakPolarHBondContact O-CD2 3.48Å; E191-Y195 PolarHBondContact O-N 3.48Å; W192-Y195 PolarHBondContact O-N 3.28Å; W192-Y195 VanDerWaalsContact O-N 3.14Å; A193-Y195 PolarHBondContact O-N 2.92Å; Y195-P197 WeakPolarHBondContact O-CD 3.34Å
196I96.6Very high96.6Very high0 Ų050.7 Ų50.70%026%0.263CS..  trans-98.5111.4177.3-57173.6000109.1L146 A149 W192 A193 K194 A198 F199 C200 F286L146-I196 HydrophobicContact CD2-CD1 3.99Å; L146-I196 HydrophobicContact CD2-CG1 4.34Å; L146-I196 HydrophobicContact CD2-CG2 4.43Å; A149-I196 HydrophobicContact CB-CG1 3.92Å; W192-I196 HydrophobicContact CD2-CD1 4.17Å; W192-I196 HydrophobicContact CE3-CD1 4.32Å; W192-I196 HydrophobicContact CH2-CD1 3.77Å; W192-I196 HydrophobicContact CZ2-CD1 3.57Å; W192-I196 HydrophobicContact CZ3-CD1 4.14Å; A193-I196 WeakPolarHBondContact O-CB 3.21Å; A193-I196 PolarHBondContact O-N 3.41Å; K194-I196 VanDerWaalsContact C-N 3.32Å; I196-A198 VanDerWaalsContact C-N 3.31Å; I196-A198 HydrophobicContact CG2-CB 4.42Å; I196-A198 PolarHBondContact O-N 2.86Å; I196-F199 HydrophobicContact CB-CB 4.19Å; I196-F199 HydrophobicContact CG2-CB 4.45Å; I196-F199 WeakPolarHBondContact O-CB 3.34Å; I196-F199 PolarHBondContact O-N 3.05Å; I196-C200 PolarHBondContact O-N 3.21Å; I196-F286 HydrophobicContact CG2-CZ 4.1Å
197P93.6Very high96.7Very high77 Ų7752.4 Ų52.450%0.527%0.272SS..Hα-helixtrans-55.4-43.1-175.8-28.335.9000113.8Y195 F199 C200 E201Y195-P197 WeakPolarHBondContact O-CD 3.34Å; P197-F199 PolarHBondContact O-N 2.98Å; P197-C200 PolarHBondContact O-N 3.36Å; P197-C200 VanDerWaalsContact O-N 3.09Å; P197-E201 PolarHBondContact O-N 3.42Å
198A94.1Very high96.7Very high7 Ų750.5 Ų50.56%0.05826%0.263CS..Hα-helixtrans-60.4-28179.300000113.6I196 L202 L302I196-A198 VanDerWaalsContact C-N 3.31Å; I196-A198 HydrophobicContact CG2-CB 4.42Å; I196-A198 PolarHBondContact O-N 2.86Å; A198-L202 WeakPolarHBondContact O-CG 3.42Å; A198-L302 HydrophobicContact CB-CD1 4.3Å; A198-L302 HydrophobicContact CB-CD2 3.89Å
199F96.8Very high96.8Very high2 Ų250.2 Ų50.21%0.00926%0.263CS..Hα-helixtrans-75.9-43.2174.6169.5-98.1000111.5A193 K194 I196 P197 E201 L202 Q207 L211 F285A193-F199 VanDerWaalsContact C-CD1 3.42Å; A193-F199 HydrophobicContact CB-CD1 3.83Å; A193-F199 HydrophobicContact CB-CD2 4.3Å; A193-F199 HydrophobicContact CB-CE1 3.67Å; A193-F199 HydrophobicContact CB-CE2 4.14Å; A193-F199 HydrophobicContact CB-CG 4.12Å; A193-F199 HydrophobicContact CB-CZ 3.82Å; A193-F199 WeakPolarHBondContact O-CD1 3.34Å; K194-F199 HydrophobicContact CG-CE1 4.37Å; I196-F199 HydrophobicContact CB-CB 4.19Å; I196-F199 HydrophobicContact CG2-CB 4.45Å; I196-F199 WeakPolarHBondContact O-CB 3.34Å; I196-F199 PolarHBondContact O-N 3.05Å; P197-F199 PolarHBondContact O-N 2.98Å; F199-E201 PolarHBondContact O-N 3.3Å; F199-L202 HydrophobicContact CD2-CD1 4.29Å; F199-L202 VanDerWaalsContact O-CB 3.3Å; F199-L202 WeakPolarHBondContact O-CB 3.42Å; F199-L202 WeakPolarHBondContact O-CG 3.43Å; F199-L202 PolarHBondContact O-N 2.89Å; F199-Q207 HydrophobicContact CD2-CB 4.47Å; F199-Q207 HydrophobicContact CD2-CG 4.08Å; F199-Q207 HydrophobicContact CE1-CB 4.36Å; F199-Q207 HydrophobicContact CE1-CG 4.08Å; F199-Q207 HydrophobicContact CE2-CB 3.56Å; F199-Q207 HydrophobicContact CE2-CG 3.62Å; F199-Q207 HydrophobicContact CZ-CB 3.5Å; F199-Q207 VanDerWaalsContact CZ-CB 3.5Å; F199-Q207 HydrophobicContact CZ-CG 3.62Å; F199-Q207 PolarHBondContact O-NE2 2.79Å; F199-L211 HydrophobicContact CE2-CG 4.37Å; F199-L211 HydrophobicContact CZ-CD1 3.93Å; F199-L211 HydrophobicContact CZ-CG 4.19Å; F199-F285 AromaticContact CD2-CE1 3.53Å; F199-F285 HydrophobicContact CD2-CE1 3.53Å; F199-F285 AromaticContact CD2-CZ 3.63Å; F199-F285 HydrophobicContact CD2-CZ 3.63Å; F199-F285 AromaticContact CE2-CE1 3.99Å; F199-F285 HydrophobicContact CE2-CE1 3.99Å; F199-F285 AromaticContact CE2-CZ 3.57Å; F199-F285 HydrophobicContact CE2-CZ 3.57Å; F199-F285 HydrophobicContact CG-CE1 4.22Å; F199-F285 HydrophobicContact CG-CZ 4.48Å; F199-F285 HydrophobicContact CZ-CZ 4.4Å
200C96.2Very high96.8Very high65 Ų6550 Ų5044%0.43926%0.262SS..Hα-helixtrans-63.4-22.5179.2-63.90000113.4K194 I196 P197 L202K194-C200 PolarHBondContact O-SG 3.18Å; I196-C200 PolarHBondContact O-N 3.21Å; P197-C200 PolarHBondContact O-N 3.36Å; P197-C200 VanDerWaalsContact O-N 3.09Å; C200-L202 VanDerWaalsContact C-N 3.34Å
201E95.3Very high96.9Very high123 Ų12349 Ų4958%0.57526%0.255SS*.THydrogen-bonded Turntrans-83.9-3.4174.6-67.8177.6-171.200114.1P197 F199P197-E201 PolarHBondContact O-N 3.42Å; F199-E201 PolarHBondContact O-N 3.3Å
202L96.6Very high96.9Very high13 Ų1351.7 Ų51.77%0.06826%0.263CS..SBendtrans-81.9157.7175.7-58.6177.7000111.1A198 F199 C200 D206 Q207 L210 K298 I299A198-L202 WeakPolarHBondContact O-CG 3.42Å; F199-L202 HydrophobicContact CD2-CD1 4.29Å; F199-L202 VanDerWaalsContact O-CB 3.3Å; F199-L202 WeakPolarHBondContact O-CB 3.42Å; F199-L202 WeakPolarHBondContact O-CG 3.43Å; F199-L202 PolarHBondContact O-N 2.89Å; C200-L202 VanDerWaalsContact C-N 3.34Å; L202-D206 HydrophobicContact CB-CB 4.21Å; L202-Q207 HydrophobicContact CB-CG 3.95Å; L202-Q207 PolarHBondContact O-NE2 3.22Å; L202-L210 HydrophobicContact CD1-CD1 3.49Å; L202-L210 VanDerWaalsContact CD1-CD1 3.49Å; L202-K298 HydrophobicContact CD2-CD 3.93Å; L202-I299 HydrophobicContact CD1-CD1 3.76Å; L202-I299 HydrophobicContact CD2-CD1 3.88Å
203L97.4Very high96.8Very high111 Ų11153.5 Ų53.558%0.58128%0.278SS*.  trans-63.9150.4171.1-61.9177.8000110.1D205 D206 Q207L203-D205 VanDerWaalsContact C-N 3.25Å; L203-D205 PolarHBondContact O-N 2.96Å; L203-D206 WeakPolarHBondContact O-CB 3.43Å; L203-D206 PolarHBondContact O-N 3.22Å; L203-Q207 WeakPolarHBondContact O-CG 3.42Å; L203-Q207 PolarHBondContact O-N 2.92Å
204L97.6Very high96.8Very high126 Ų12654.9 Ų54.966%0.6628%0.284SS*.Hα-helixtrans-58-39.4-177.1-173.664.9000112.2D206 Q207 V208L204-D206 VanDerWaalsContact C-N 3.34Å; L204-D206 PolarHBondContact O-N 3.26Å; L204-Q207 WeakPolarHBondContact O-CB 3.37Å; L204-Q207 PolarHBondContact O-N 3.36Å; L204-V208 WeakPolarHBondContact O-CG2 3.46Å; L204-V208 PolarHBondContact O-N 2.94Å
205D97.3Very high96.9Very high127 Ų12750.2 Ų50.268%0.67926%0.264SS*.Hα-helixtrans-64.3-39.2177.4-64.5-25.7000111.9L203 V208 A209L203-D205 VanDerWaalsContact C-N 3.25Å; L203-D205 PolarHBondContact O-N 2.96Å; D205-V208 PolarHBondContact O-N 3.47Å; D205-A209 WeakPolarHBondContact O-CB 3.23Å; D205-A209 PolarHBondContact O-N 3.07Å
206D98Very high97Very high8 Ų845.8 Ų45.84%0.04325%0.248CC..Hα-helixtrans-67-40.5174.9-63.6-28000111.2L202 L203 L204 V208 A209 L210 L293 S294L202-D206 HydrophobicContact CB-CB 4.21Å; L203-D206 WeakPolarHBondContact O-CB 3.43Å; L203-D206 PolarHBondContact O-N 3.22Å; L204-D206 VanDerWaalsContact C-N 3.34Å; L204-D206 PolarHBondContact O-N 3.26Å; D206-V208 VanDerWaalsContact C-N 3.32Å; D206-V208 PolarHBondContact O-N 3.02Å; D206-A209 PolarHBondContact O-N 3.03Å; D206-L210 WeakPolarHBondContact O-CG 3.26Å; D206-L210 PolarHBondContact O-N 3.01Å; D206-L293 HydrophobicContact CB-CD2 3.93Å; D206-L293 WeakPolarHBondContact OD1-CA 3.46Å; D206-S294 WeakPolarHBondContact OD1-CB 3.44Å; D206-S294 PolarHBondContact OD1-N 3.19Å; D206-S294 PolarHBondContact OD1-OG 2.88Å; D206-S294 PolarHBondContact OD2-OG 3.49Å
207Q98.2Very high97.1Very high37 Ų3746.7 Ų46.717%0.17325%0.252CS..Hα-helixtrans-59.1-45.1176-70-179.329.700111.1F199 L202 L203 L204 L211F199-Q207 HydrophobicContact CD2-CB 4.47Å; F199-Q207 HydrophobicContact CD2-CG 4.08Å; F199-Q207 HydrophobicContact CE1-CB 4.36Å; F199-Q207 HydrophobicContact CE1-CG 4.08Å; F199-Q207 HydrophobicContact CE2-CB 3.56Å; F199-Q207 HydrophobicContact CE2-CG 3.62Å; F199-Q207 HydrophobicContact CZ-CB 3.5Å; F199-Q207 VanDerWaalsContact CZ-CB 3.5Å; F199-Q207 HydrophobicContact CZ-CG 3.62Å; F199-Q207 PolarHBondContact O-NE2 2.79Å; L202-Q207 HydrophobicContact CB-CG 3.95Å; L202-Q207 PolarHBondContact O-NE2 3.22Å; L203-Q207 WeakPolarHBondContact O-CG 3.42Å; L203-Q207 PolarHBondContact O-N 2.92Å; L204-Q207 WeakPolarHBondContact O-CB 3.37Å; L204-Q207 PolarHBondContact O-N 3.36Å; Q207-L211 WeakPolarHBondContact O-CB 3.25Å; Q207-L211 WeakPolarHBondContact O-CG 3.32Å; Q207-L211 PolarHBondContact O-N 3.37Å
208V97.4Very high97.3Very high50 Ų5043.6 Ų43.630%0.30323%0.231SC..Hα-helixtrans-66-42176.4173.10000111.2L204 D205 D206 L210 L211 R212L204-V208 WeakPolarHBondContact O-CG2 3.46Å; L204-V208 PolarHBondContact O-N 2.94Å; D205-V208 PolarHBondContact O-N 3.47Å; D206-V208 VanDerWaalsContact C-N 3.32Å; D206-V208 PolarHBondContact O-N 3.02Å; V208-L210 PolarHBondContact O-N 3.35Å; V208-L211 PolarHBondContact O-N 3.37Å; V208-R212 HydrophobicContact CG1-CG 4.41Å; V208-R212 WeakPolarHBondContact O-CB 3.23Å; V208-R212 WeakPolarHBondContact O-CG 3.43Å; V208-R212 PolarHBondContact O-N 3.01Å
209A97.6Very high97.5Very high11 Ų1144 Ų449%0.09123%0.232CC..Hα-helixtrans-58.3-47.3177.600000111.6D205 D206 R212 A213 L293D205-A209 WeakPolarHBondContact O-CB 3.23Å; D205-A209 PolarHBondContact O-N 3.07Å; D206-A209 PolarHBondContact O-N 3.03Å; A209-R212 PolarHBondContact O-N 3.49Å; A209-A213 WeakPolarHBondContact O-CB 3.4Å; A209-A213 PolarHBondContact O-N 2.89Å; A209-L293 HydrophobicContact CB-CD2 4.11Å; A209-L293 HydrophobicContact CB-CG 4.47Å
210L98.3Very high97.6Very high1 Ų144.2 Ų44.21%0.00523%0.233CC..Hα-helixtrans-66.6-43.3178.6-64.9175000112.5L202 D206 V208 R212 A213 F285 F286 A290 L293 I299L202-L210 HydrophobicContact CD1-CD1 3.49Å; L202-L210 VanDerWaalsContact CD1-CD1 3.49Å; D206-L210 WeakPolarHBondContact O-CG 3.26Å; D206-L210 PolarHBondContact O-N 3.01Å; V208-L210 PolarHBondContact O-N 3.35Å; L210-R212 PolarHBondContact O-N 2.65Å; L210-A213 PolarHBondContact O-N 2.82Å; L210-F285 HydrophobicContact CB-CE1 4.47Å; L210-F285 HydrophobicContact CB-CE2 4.27Å; L210-F285 HydrophobicContact CB-CZ 4.12Å; L210-F285 WeakPolarHBondContact CD2-O 3.45Å; L210-F286 HydrophobicContact CD1-CD1 4.28Å; L210-A290 HydrophobicContact CD2-CB 4.2Å; L210-L293 HydrophobicContact CD2-CD1 4.36Å; L210-L293 HydrophobicContact CD2-CD2 4.05Å; L210-L293 HydrophobicContact CG-CD2 4.11Å; L210-I299 HydrophobicContact CD1-CD1 4Å; L210-I299 HydrophobicContact CD2-CG2 4.03Å
211L97.9Very high97.7Very high20 Ų2041.5 Ų41.511%0.10521%0.214CC..Hα-helixtrans-61.4-30.4177.5-79.6167.7000112.8L189 V190 A193 F199 Q207 V208 F285 M364L189-L211 HydrophobicContact CG-CD2 4.22Å; V190-L211 HydrophobicContact CG2-CD1 4.26Å; V190-L211 HydrophobicContact CG2-CD2 4.09Å; A193-L211 HydrophobicContact CB-CD2 4.15Å; F199-L211 HydrophobicContact CE2-CG 4.37Å; F199-L211 HydrophobicContact CZ-CD1 3.93Å; F199-L211 HydrophobicContact CZ-CG 4.19Å; Q207-L211 WeakPolarHBondContact O-CB 3.25Å; Q207-L211 WeakPolarHBondContact O-CG 3.32Å; Q207-L211 PolarHBondContact O-N 3.37Å; V208-L211 PolarHBondContact O-N 3.37Å; L211-F285 HydrophobicContact CD2-CE2 3.93Å; L211-F285 HydrophobicContact CD2-CZ 4.24Å; L211-F285 HydrophobicContact CG-CE2 4.26Å; L211-F285 HydrophobicContact CG-CZ 4.36Å; L211-M364 HydrophobicContact CB-CE 4.09Å; L211-M364 WeakPolarHBondContact O-CE 3.5Å
212R96.6Very high97.8Very high112 Ų11236.1 Ų36.142%0.42319%0.191SC..Hα-helixtrans-87.4-31.1179.3-71.3179.4172.8166.6-2.4113.5V208 A209 L210 H214 E363V208-R212 HydrophobicContact CG1-CG 4.41Å; V208-R212 WeakPolarHBondContact O-CB 3.23Å; V208-R212 WeakPolarHBondContact O-CG 3.43Å; V208-R212 PolarHBondContact O-N 3.01Å; A209-R212 PolarHBondContact O-N 3.49Å; L210-R212 PolarHBondContact O-N 2.65Å; R212-H214 PolarHBondContact O-N 2.9Å; R212-E363 IonicContact NH2-OE2 3.48Å; R212-E363 PolarHBondContact NH2-OE2 2.88Å
213A97Very high97.9Very high38 Ų3836.1 Ų36.131%0.31419%0.194SC..Hα-helixtrans-56.8-45.4-169.600000113.7A209 L210 A290A209-A213 WeakPolarHBondContact O-CB 3.4Å; A209-A213 PolarHBondContact O-N 2.89Å; L210-A213 PolarHBondContact O-N 2.82Å; A213-A290 HydrophobicContact CB-CB 3.67Å
214H97.8Very high98Very high30 Ų3030.9 Ų30.914%0.13917%0.166CC..THydrogen-bonded Turntrans-133.335.2-172.9-63.2-62.9000113.3R212 G216 E217 H218 I284 D287R212-H214 PolarHBondContact O-N 2.9Å; H214-G216 PolarHBondContact O-N 3Å; H214-E217 VanDerWaalsContact C-OE2 3.26Å; H214-E217 WeakPolarHBondContact CA-OE2 3.4Å; H214-E217 HydrophobicContact CB-CB 4.26Å; H214-E217 HydrophobicContact CB-CG 4.44Å; H214-E217 IonicContact CE1-OE1 2.8Å; H214-E217 IonicContact CG-OE1 2.74Å; H214-E217 IonicContact ND1-OE1 2.98Å; H214-E217 PolarHBondContact ND1-OE1 3.29Å; H214-E217 IonicContact ND1-OE2 2.71Å; H214-E217 PolarHBondContact O-N 3.03Å; H214-H218 PolarHBondContact O-CD2 3.38Å; H214-H218 PolarHBondContact O-N 2.99Å; H214-H218 VanDerWaalsContact O-N 3.15Å; H214-I284 HydrophobicContact CB-CG2 3.67Å; H214-I284 PolarHBondContact CD2-O 3.32Å; H214-D287 WeakPolarHBondContact NE2-CB 3.44Å; H214-D287 IonicContact NE2-OD2 2.71Å; H214-D287 PolarHBondContact NE2-OD2 3.31Å
215A98.1Very high98Very high2 Ų226.3 Ų26.32%0.01714%0.141CC..Hα-helixtrans-58.7-37.3-177.700000112.3L186 H218 L219 M364 L365L186-A215 HydrophobicContact CD2-CB 3.84Å; A215-H218 PolarHBondContact O-N 2.82Å; A215-L219 WeakPolarHBondContact O-CG 3.46Å; A215-L219 PolarHBondContact O-N 2.92Å; A215-M364 HydrophobicContact CB-CB 4.05Å; A215-M364 HydrophobicContact CB-CE 4.31Å; A215-M364 WeakPolarHBondContact CB-O 3.24Å; A215-L365 HydrophobicContact CB-CD2 4.09Å
216G98.3Very high97.9Very high2 Ų222.6 Ų22.62%0.02112%0.118CC..Hα-helixtrans-69.3-41.3179.800000112.8H214 H218 L219 L220 L365H214-G216 PolarHBondContact O-N 3Å; G216-H218 VanDerWaalsContact C-N 3.29Å; G216-H218 PolarHBondContact O-N 3.5Å; G216-L219 PolarHBondContact O-N 3.25Å; G216-L220 PolarHBondContact O-N 3.46Å; G216-L365 VanDerWaalsContact N-CD2 3.33Å
217E98.7Very high97.8Very high18 Ų1822.2 Ų22.28%0.08412%0.115CC..Hα-helixtrans-61.2-40.4175.9-6789.4148.200110.5H214 L220 L221 I284 L335 T339H214-E217 VanDerWaalsContact C-OE2 3.26Å; H214-E217 WeakPolarHBondContact CA-OE2 3.4Å; H214-E217 HydrophobicContact CB-CB 4.26Å; H214-E217 HydrophobicContact CB-CG 4.44Å; H214-E217 IonicContact CE1-OE1 2.8Å; H214-E217 IonicContact CG-OE1 2.74Å; H214-E217 IonicContact ND1-OE1 2.98Å; H214-E217 PolarHBondContact ND1-OE1 3.29Å; H214-E217 IonicContact ND1-OE2 2.71Å; H214-E217 PolarHBondContact O-N 3.03Å; E217-L220 PolarHBondContact O-N 3.37Å; E217-L221 WeakPolarHBondContact O-CB 3.36Å; E217-L221 PolarHBondContact O-N 3.49Å; E217-I284 HydrophobicContact CB-CG2 4.01Å; E217-L335 HydrophobicContact CB-CD2 3.92Å; E217-L335 HydrophobicContact CB-CG 4.02Å; E217-L335 HydrophobicContact CG-CD2 4.41Å; E217-L335 HydrophobicContact CG-CG 4.15Å; E217-T339 WeakPolarHBondContact CA-OG1 3.3Å; E217-T339 HydrophobicContact CG-CG2 4.27Å
218H98.6Very high97.7Very high12 Ų1221.8 Ų21.86%0.05611%0.114CC..Hα-helixtrans-63.7-40175.2-78.5-65.6000113.4L189 H214 A215 G216 G222 K281 F285L189-H218 HydrophobicContact CD1-CB 3.99Å; L189-H218 HydrophobicContact CD2-CB 3.83Å; H214-H218 PolarHBondContact O-CD2 3.38Å; H214-H218 PolarHBondContact O-N 2.99Å; H214-H218 VanDerWaalsContact O-N 3.15Å; A215-H218 PolarHBondContact O-N 2.82Å; G216-H218 VanDerWaalsContact C-N 3.29Å; G216-H218 PolarHBondContact O-N 3.5Å; H218-G222 PolarHBondContact O-N 3.14Å; H218-K281 PolarHBondContact CE1-O 3.07Å; H218-K281 VanDerWaalsContact CE1-O 3.27Å; H218-K281 WeakPolarHBondContact ND1-CG 3.45Å; H218-F285 AromaticContact NE2-CD2 3.54Å
219L98.4Very high97.5Very high17 Ų1723.7 Ų23.79%0.08913%0.125CC..Hα-helixtrans-63.4-47176.4-69.1176.8000111.5M182 Q185 L186 A215 G216 G222 A223 L365M182-L219 HydrophobicContact CB-CD1 3.99Å; M182-L219 HydrophobicContact CE-CD1 3.42Å; M182-L219 VanDerWaalsContact CE-CD1 3.42Å; M182-L219 HydrophobicContact CG-CD1 4.08Å; Q185-L219 HydrophobicContact CB-CD2 3.4Å; Q185-L219 VanDerWaalsContact CB-CD2 3.4Å; L186-L219 HydrophobicContact CD2-CD1 4Å; L186-L219 HydrophobicContact CD2-CD2 4.18Å; L186-L219 HydrophobicContact CD2-CG 4.09Å; L186-L219 HydrophobicContact CG-CD1 4.12Å; L186-L219 HydrophobicContact CG-CD2 4.17Å; L186-L219 HydrophobicContact CG-CG 4.45Å; A215-L219 WeakPolarHBondContact O-CG 3.46Å; A215-L219 PolarHBondContact O-N 2.92Å; G216-L219 PolarHBondContact O-N 3.25Å; L219-G222 PolarHBondContact O-N 2.87Å; L219-A223 WeakPolarHBondContact O-CB 3.45Å; L219-A223 PolarHBondContact O-N 3.36Å; L219-L365 HydrophobicContact CD1-CD1 3.86Å; L219-L365 HydrophobicContact CD1-CD2 4Å; L219-L365 HydrophobicContact CD1-CG 4.44Å
220L98.6Very high97.4Very high6 Ų624.4 Ų24.43%0.03113%0.126CC..Hα-helixtrans-66.5-42.2178.7-97.960.6000112G216 E217 A223 T224 I259 L335 I338 M342G216-L220 PolarHBondContact O-N 3.46Å; E217-L220 PolarHBondContact O-N 3.37Å; L220-A223 PolarHBondContact O-N 3.47Å; L220-T224 VanDerWaalsContact O-CB 3.32Å; L220-T224 WeakPolarHBondContact O-CB 3.42Å; L220-T224 PolarHBondContact O-N 3.12Å; L220-T224 PolarHBondContact O-OG1 2.7Å; L220-I259 HydrophobicContact CD1-CD1 4.29Å; L220-I259 HydrophobicContact CD2-CD1 4.2Å; L220-I259 HydrophobicContact CD2-CG1 4.17Å; L220-I259 HydrophobicContact CG-CD1 3.83Å; L220-I259 HydrophobicContact CG-CG1 4.17Å; L220-L335 HydrophobicContact CB-CD1 3.53Å; L220-L335 HydrophobicContact CD2-CD1 4.4Å; L220-I338 HydrophobicContact CD2-CB 3.91Å; L220-I338 HydrophobicContact CD2-CG2 3.58Å; L220-M342 HydrophobicContact CD1-CE 3.64Å; L220-M342 HydrophobicContact CD1-SD 3.27Å; L220-M342 WeakPolarHBondContact CD1-SD 3.42Å
221L98.6Very high97.2Very high7 Ų732.6 Ų32.64%0.03716%0.162CC..Hα-helixtrans-62.4-44.6178-171.371.1000111.1E217 T224 K225 F267 Y277 K281 I284 L335E217-L221 WeakPolarHBondContact O-CB 3.36Å; E217-L221 PolarHBondContact O-N 3.49Å; L221-T224 WeakPolarHBondContact O-CB 3.46Å; L221-T224 PolarHBondContact O-N 2.99Å; L221-K225 PolarHBondContact O-N 3.36Å; L221-F267 HydrophobicContact CD1-CE2 4.28Å; L221-F267 HydrophobicContact CD1-CZ 3.61Å; L221-Y277 HydrophobicContact CD2-CD2 4.49Å; L221-Y277 HydrophobicContact CD2-CE2 4.14Å; L221-Y277 HydrophobicContact CG-CD2 4.27Å; L221-Y277 HydrophobicContact CG-CE2 3.84Å; L221-K281 HydrophobicContact CD2-CB 4.01Å; L221-K281 HydrophobicContact CD2-CG 4.26Å; L221-I284 HydrophobicContact CD2-CD1 3.85Å; L221-L335 HydrophobicContact CB-CD2 4.21Å; L221-L335 HydrophobicContact CD1-CD2 4.17Å
222G97.8Very high97.1Very high10 Ų1035.3 Ų35.310%0.10318%0.177CC..Hα-helixtrans-64.7-43.3176.400000112.7H218 L219 T224 K225 R226H218-G222 PolarHBondContact O-N 3.14Å; L219-G222 PolarHBondContact O-N 2.87Å; G222-T224 VanDerWaalsContact C-N 3.34Å; G222-T224 PolarHBondContact O-N 3.25Å; G222-K225 PolarHBondContact O-N 2.94Å; G222-R226 WeakPolarHBondContact O-CB 3.23Å; G222-R226 PolarHBondContact O-N 3.22Å
223A97.9Very high97.1Very high14 Ų1430.7 Ų30.712%0.11616%0.161CC..Hα-helixtrans-62.6-40.5174.300000112.2L219 L220 S227L219-A223 WeakPolarHBondContact O-CB 3.45Å; L219-A223 PolarHBondContact O-N 3.36Å; L220-A223 PolarHBondContact O-N 3.47Å; A223-S227 VanDerWaalsContact O-CB 3.23Å; A223-S227 WeakPolarHBondContact O-CB 3.36Å; A223-S227 PolarHBondContact O-N 3.14Å; A223-S227 PolarHBondContact O-OG 3.39Å
224T98.6Very high97.1Very high0 Ų029.3 Ų29.30%015%0.148CC..Hα-helixtrans-60.9-53.5176-60.10000110.7L220 L221 G222 R226 S227 M228 L263 V264 F267L220-T224 VanDerWaalsContact O-CB 3.32Å; L220-T224 WeakPolarHBondContact O-CB 3.42Å; L220-T224 PolarHBondContact O-N 3.12Å; L220-T224 PolarHBondContact O-OG1 2.7Å; L221-T224 WeakPolarHBondContact O-CB 3.46Å; L221-T224 PolarHBondContact O-N 2.99Å; G222-T224 VanDerWaalsContact C-N 3.34Å; G222-T224 PolarHBondContact O-N 3.25Å; T224-R226 VanDerWaalsContact C-N 3.34Å; T224-R226 PolarHBondContact O-N 2.94Å; T224-S227 PolarHBondContact O-N 3.27Å; T224-M228 PolarHBondContact O-N 3.19Å; T224-L263 HydrophobicContact CG2-CB 3.72Å; T224-V264 HydrophobicContact CG2-CG2 3.93Å; T224-F267 HydrophobicContact CG2-CB 4.21Å; T224-F267 HydrophobicContact CG2-CD1 3.93Å; T224-F267 HydrophobicContact CG2-CD2 3.66Å; T224-F267 HydrophobicContact CG2-CE1 4.21Å; T224-F267 HydrophobicContact CG2-CE2 3.95Å; T224-F267 HydrophobicContact CG2-CG 3.65Å; T224-F267 HydrophobicContact CG2-CZ 4.23Å
225K97.5Very high97Very high31 Ų3128 Ų2814%0.13514%0.142CC..Hα-helixtrans-58-44.7179.6177.365.5-174.7-166.40112L221 G222 S227 M228 F267 I272 D274 Y277L221-K225 PolarHBondContact O-N 3.36Å; G222-K225 PolarHBondContact O-N 2.94Å; K225-S227 VanDerWaalsContact C-N 3.25Å; K225-S227 PolarHBondContact O-N 2.98Å; K225-M228 HydrophobicContact CD-SD 3.68Å; K225-M228 VanDerWaalsContact O-CG 3.26Å; K225-M228 WeakPolarHBondContact O-CG 3.41Å; K225-F267 HydrophobicContact CB-CE1 4.4Å; K225-I272 PolarHBondContact NZ-O 3.22Å; K225-I272 VanDerWaalsContact NZ-O 3.12Å; K225-D274 WeakPolarHBondContact CE-OD1 3.4Å; K225-D274 IonicContact NZ-OD1 2.68Å; K225-D274 PolarHBondContact NZ-OD1 3.43Å; K225-Y277 HydrophobicContact CB-CD2 3.73Å; K225-Y277 HydrophobicContact CB-CE2 3.43Å; K225-Y277 VanDerWaalsContact CB-CE2 3.43Å; K225-Y277 HydrophobicContact CB-CG 4.47Å; K225-Y277 HydrophobicContact CD-CD1 4.42Å; K225-Y277 HydrophobicContact CD-CD2 3.94Å; K225-Y277 HydrophobicContact CD-CE2 4.42Å; K225-Y277 HydrophobicContact CD-CG 3.94Å; K225-Y277 HydrophobicContact CG-CD1 4.21Å; K225-Y277 HydrophobicContact CG-CD2 3.78Å; K225-Y277 HydrophobicContact CG-CE1 4.19Å; K225-Y277 HydrophobicContact CG-CE2 3.74Å; K225-Y277 HydrophobicContact CG-CG 4.01Å
226R95.4Very high96.9Very high49 Ų4928.8 Ų28.819%0.18515%0.146CC..Hα-helixtrans-67.1-27.1178.6-175.5170.556.5-105.9-7112.9G222 T224 L235 L236G222-R226 WeakPolarHBondContact O-CB 3.23Å; G222-R226 PolarHBondContact O-N 3.22Å; T224-R226 VanDerWaalsContact C-N 3.34Å; T224-R226 PolarHBondContact O-N 2.94Å; R226-L235 HydrophobicContact CG-CB 4.32Å; R226-L235 HydrophobicContact CG-CD2 3.94Å; R226-L235 HydrophobicContact CG-CG 4.16Å; R226-L235 VanDerWaalsContact CZ-O 3.28Å; R226-L235 PolarHBondContact NE-O 3.41Å; R226-L235 PolarHBondContact NH2-O 3.27Å; R226-L236 PolarHBondContact NE-O 3.39Å
227S97.1Very high96.6Very high0 Ų029 Ų290%015%0.148CC..Hα-helixtrans-93.2-13.1-176.3-530000113.9A223 T224 K225 V229 F230 L234 L235A223-S227 VanDerWaalsContact O-CB 3.23Å; A223-S227 WeakPolarHBondContact O-CB 3.36Å; A223-S227 PolarHBondContact O-N 3.14Å; A223-S227 PolarHBondContact O-OG 3.39Å; T224-S227 PolarHBondContact O-N 3.27Å; K225-S227 VanDerWaalsContact C-N 3.25Å; K225-S227 PolarHBondContact O-N 2.98Å; S227-V229 PolarHBondContact O-N 3.44Å; S227-F230 PolarHBondContact O-N 3.1Å; S227-L234 WeakPolarHBondContact OG-CA 3.38Å; S227-L235 PolarHBondContact OG-N 3.02Å
228M95.5Very high96.3Very high27 Ų2729.4 Ų29.413%0.13315%0.151CC..THydrogen-bonded Turntrans-60.9-17.6-174.979.4-175.7-70.800114.5T224 K225 F230 F267 Q268T224-M228 PolarHBondContact O-N 3.19Å; K225-M228 HydrophobicContact CD-SD 3.68Å; K225-M228 VanDerWaalsContact O-CG 3.26Å; K225-M228 WeakPolarHBondContact O-CG 3.41Å; M228-F230 VanDerWaalsContact C-N 3.32Å; M228-F267 HydrophobicContact CB-CB 4.37Å; M228-F267 HydrophobicContact CE-CB 4.47Å; M228-F267 WeakPolarHBondContact CE-O 3.26Å; M228-F267 HydrophobicContact SD-CD1 4.38Å; M228-Q268 HydrophobicContact CB-CG 4.25Å; M228-Q268 VanDerWaalsContact O-CG 3.23Å; M228-Q268 WeakPolarHBondContact O-CG 3.25Å; M228-Q268 PolarHBondContact O-NE2 3.01Å
229V93.9Very high96.1Very high90 Ų9031.4 Ų31.455%0.54516%0.162SC..THydrogen-bonded Turntrans-83.6-8.6176.6-59.90000113.3I163 S227I163-V229 HydrophobicContact CG2-CG2 3.85Å; S227-V229 PolarHBondContact O-N 3.44Å
230F94.6Very high95.9Very high27 Ų2733.5 Ų33.512%0.11817%0.169CC..SBendtrans-114.4160.3-177.5-51.1-68000111.7I163 I167 S227 M228 V233 L235 Q268I163-F230 HydrophobicContact CG2-CZ 4.36Å; I167-F230 HydrophobicContact CB-CD1 4.2Å; I167-F230 HydrophobicContact CB-CE1 4.09Å; I167-F230 HydrophobicContact CD1-CB 3.84Å; I167-F230 HydrophobicContact CD1-CD1 3.35Å; I167-F230 HydrophobicContact CD1-CD2 3.69Å; I167-F230 HydrophobicContact CD1-CE1 3.73Å; I167-F230 HydrophobicContact CD1-CE2 4.06Å; I167-F230 HydrophobicContact CD1-CG 3.33Å; I167-F230 HydrophobicContact CD1-CZ 4.06Å; I167-F230 HydrophobicContact CG1-CD1 4.37Å; I167-F230 HydrophobicContact CG1-CE1 4.46Å; I167-F230 HydrophobicContact CG2-CD1 4.37Å; S227-F230 PolarHBondContact O-N 3.1Å; M228-F230 VanDerWaalsContact C-N 3.32Å; F230-V233 HydrophobicContact CB-CG1 3.5Å; F230-V233 VanDerWaalsContact CB-CG1 3.5Å; F230-V233 HydrophobicContact CG-CG1 4.31Å; F230-L235 HydrophobicContact CD2-CB 4.3Å; F230-L235 HydrophobicContact CE2-CB 4.04Å; F230-L235 HydrophobicContact CE2-CD2 3.61Å; F230-L235 HydrophobicContact CE2-CG 4.44Å; F230-L235 HydrophobicContact CZ-CD2 4.11Å; F230-Q268 PolarHBondContact O-NE2 2.78Å
231K94.1Very high95.8Very high173 Ų17334 Ų3475%0.75217%0.171SC*.SBendtrans-108.2129.9179.3179.4174.4178.7176.60110.6V233K231-V233 WeakPolarHBondContact O-CG1 3.38Å; K231-V233 PolarHBondContact O-N 3.21Å
232D95.4Very high95.7Very high77 Ų7733.9 Ų33.941%0.41217%0.171SC..SBendtrans57.128.9173.4-67.3-55.1000114.8R244D232-R244 HydrophobicContact CB-CB 4.17Å; D232-R244 WeakPolarHBondContact O-CB 3.27Å; D232-R244 PolarHBondContact O-N 3.15Å; D232-R244 IonicContact OD1-NH1 3.57Å
233V96.3Very high95.5Very high15 Ų1534.8 Ų34.89%0.09118%0.175CC..EExtended strand (participates in β ladder)trans-152.7138.8-178.162.20000111.2I167 F230 K231 I241I167-V233 HydrophobicContact CD1-CB 4.44Å; I167-V233 HydrophobicContact CD1-CG1 3.41Å; I167-V233 VanDerWaalsContact CD1-CG1 3.41Å; I167-V233 HydrophobicContact CD1-CG2 4.15Å; I167-V233 HydrophobicContact CG1-CG1 4.43Å; F230-V233 HydrophobicContact CB-CG1 3.5Å; F230-V233 VanDerWaalsContact CB-CG1 3.5Å; F230-V233 HydrophobicContact CG-CG1 4.31Å; K231-V233 WeakPolarHBondContact O-CG1 3.38Å; K231-V233 PolarHBondContact O-N 3.21Å; V233-I241 HydrophobicContact CG2-CB 3.75Å; V233-I241 HydrophobicContact CG2-CD1 4.27Å; V233-I241 HydrophobicContact CG2-CG2 4.12Å
234L97.2Very high95.3Very high8 Ų838.1 Ų38.14%0.04219%0.185CC..EExtended strand (participates in β ladder)trans-96.6137.6169.8-56.8175.1000110.2S227 I241 V242 I259 L260 V264S227-L234 WeakPolarHBondContact OG-CA 3.38Å; L234-I241 CarbonylContact O-C 3.51Å; L234-I241 VanDerWaalsContact O-CA 3.29Å; L234-I241 WeakPolarHBondContact O-CA 3.25Å; L234-V242 HydrophobicContact CB-CB 4.25Å; L234-V242 PolarHBondContact N-O 2.86Å; L234-V242 PolarHBondContact O-N 3.42Å; L234-I259 HydrophobicContact CD1-CB 4.13Å; L234-I259 HydrophobicContact CD1-CD1 4.2Å; L234-I259 HydrophobicContact CD1-CG2 4.01Å; L234-I259 HydrophobicContact CD2-CB 4.5Å; L234-I259 HydrophobicContact CD2-CG2 3.73Å; L234-L260 HydrophobicContact CD2-CD2 3.56Å; L234-L260 HydrophobicContact CD2-CG 3.97Å; L234-L260 HydrophobicContact CG-CD2 3.94Å; L234-L260 HydrophobicContact CG-CG 4.09Å; L234-V264 HydrophobicContact CD2-CG2 3.8Å
235L96.1Very high95Very high4 Ų445.7 Ų45.72%0.02122%0.22CC..EExtended strand (participates in β ladder)trans-101121.3171.4177.860.3000109.7K170 R226 S227 F230 I241K170-L235 HydrophobicContact CD-CD1 3.55Å; R226-L235 HydrophobicContact CG-CB 4.32Å; R226-L235 HydrophobicContact CG-CD2 3.94Å; R226-L235 HydrophobicContact CG-CG 4.16Å; R226-L235 VanDerWaalsContact CZ-O 3.28Å; R226-L235 PolarHBondContact NE-O 3.41Å; R226-L235 PolarHBondContact NH2-O 3.27Å; S227-L235 PolarHBondContact OG-N 3.02Å; F230-L235 HydrophobicContact CD2-CB 4.3Å; F230-L235 HydrophobicContact CE2-CB 4.04Å; F230-L235 HydrophobicContact CE2-CD2 3.61Å; F230-L235 HydrophobicContact CE2-CG 4.44Å; F230-L235 HydrophobicContact CZ-CD2 4.11Å; L235-I241 HydrophobicContact CD1-CG2 4.1Å
236L95.9Very high94.5Very high17 Ų1744.3 Ų44.39%0.08921%0.214CC..PPolyproline II helixtrans-80.9166176.5-56.3-172.4000111.4A173 V178 R226 N238 D239 Y240 V242A173-L236 HydrophobicContact CB-CD1 3.61Å; V178-L236 HydrophobicContact CG2-CD1 3.9Å; R226-L236 PolarHBondContact NE-O 3.39Å; L236-N238 VanDerWaalsContact C-N 3.28Å; L236-N238 VanDerWaalsContact CB-OD1 3.24Å; L236-N238 WeakPolarHBondContact CB-OD1 3.34Å; L236-N238 PolarHBondContact O-N 3.06Å; L236-D239 PolarHBondContact O-N 3.1Å; L236-Y240 WeakPolarHBondContact CB-O 3.36Å; L236-Y240 PolarHBondContact N-O 2.95Å; L236-V242 HydrophobicContact CD1-CG2 4.14Å; L236-V242 HydrophobicContact CD2-CG2 4.2Å; L236-V242 HydrophobicContact CG-CG2 4.26Å
237G92.6Very high94.1Very high6 Ų646.5 Ų46.56%0.06223%0.234CC..THydrogen-bonded Turntrans-69.8-25.6179.900000113.6S181 D239S181-G237 WeakPolarHBondContact OG-CA 3.46Å; S181-G237 PolarHBondContact OG-N 3.17Å; G237-D239 VanDerWaalsContact C-N 3.29Å; G237-D239 PolarHBondContact O-N 3.45Å
238N93.2Very high93.4Very high27 Ų2751.6 Ų51.614%0.14426%0.258CS..THydrogen-bonded Turntrans-93.322.4176.460.7-5.6000112.8D177 S181 L236 Y240D177-N238 PolarHBondContact O-ND2 3.19Å; S181-N238 WeakPolarHBondContact CB-OD1 3.33Å; L236-N238 VanDerWaalsContact C-N 3.28Å; L236-N238 VanDerWaalsContact CB-OD1 3.24Å; L236-N238 WeakPolarHBondContact CB-OD1 3.34Å; L236-N238 PolarHBondContact O-N 3.06Å; N238-Y240 HydrophobicContact CB-CD2 4.39Å; N238-Y240 WeakPolarHBondContact O-CD2 3.46Å; N238-Y240 PolarHBondContact O-N 2.98Å; N238-Y240 VanDerWaalsContact O-N 3.12Å
239D92.5Very high92.7Very high54 Ų5450.6 Ų50.629%0.28925%0.254SS..SBendtrans687.1172.9-111.414000117K170 L236 G237K170-D239 WeakPolarHBondContact CD-O 3.45Å; K170-D239 IonicContact NZ-OD1 3.87Å; K170-D239 PolarHBondContact NZ-OD1 2.97Å; K170-D239 IonicContact NZ-OD2 3.36Å; K170-D239 PolarHBondContact NZ-OD2 3.31Å; L236-D239 PolarHBondContact O-N 3.1Å; G237-D239 VanDerWaalsContact C-N 3.29Å; G237-D239 PolarHBondContact O-N 3.45Å
240Y94.9Very high92.1Very high62 Ų6249.4 Ų49.424%0.24325%0.253CS..  trans-79.6159166.1-72.4-95.1000112K171 A173 D177 L236 N238K171-Y240 HydrophobicContact CB-CD1 3.68Å; K171-Y240 HydrophobicContact CB-CE1 3.62Å; K171-Y240 HydrophobicContact CD-CE1 4.12Å; K171-Y240 WeakPolarHBondContact O-CA 3.36Å; K171-Y240 WeakPolarHBondContact O-CD1 3.14Å; A173-Y240 HydrophobicContact CB-CD1 4.5Å; A173-Y240 HydrophobicContact CB-CG 4.4Å; D177-Y240 HydrophobicContact CB-CD1 4.44Å; D177-Y240 HydrophobicContact CB-CD2 4.21Å; D177-Y240 HydrophobicContact CB-CE2 4.44Å; D177-Y240 HydrophobicContact CB-CG 4.2Å; L236-Y240 WeakPolarHBondContact CB-O 3.36Å; L236-Y240 PolarHBondContact N-O 2.95Å; N238-Y240 HydrophobicContact CB-CD2 4.39Å; N238-Y240 WeakPolarHBondContact O-CD2 3.46Å; N238-Y240 PolarHBondContact O-N 2.98Å; N238-Y240 VanDerWaalsContact O-N 3.12Å
241I95.8Very high91.5Very high16 Ų1652.9 Ų52.98%0.08227%0.27CS..EExtended strand (participates in β ladder)trans-117.3149.2178.358.4165000112.4I167 K170 K171 I172 A173 V233 L234 L235 P243I167-I241 HydrophobicContact CD1-CG2 4.24Å; I167-I241 HydrophobicContact CG1-CG2 3.96Å; K170-I241 HydrophobicContact CB-CD1 4.48Å; K170-I241 HydrophobicContact CB-CG1 4.24Å; K170-I241 HydrophobicContact CB-CG2 3.68Å; K170-I241 HydrophobicContact CD-CG2 3.8Å; K170-I241 HydrophobicContact CG-CG2 4.36Å; K171-I241 WeakPolarHBondContact O-CG1 3.38Å; K171-I241 PolarHBondContact O-N 2.97Å; I172-I241 WeakPolarHBondContact CA-O 3.47Å; A173-I241 PolarHBondContact N-O 3.17Å; V233-I241 HydrophobicContact CG2-CB 3.75Å; V233-I241 HydrophobicContact CG2-CD1 4.27Å; V233-I241 HydrophobicContact CG2-CG2 4.12Å; L234-I241 CarbonylContact O-C 3.51Å; L234-I241 VanDerWaalsContact O-CA 3.29Å; L234-I241 WeakPolarHBondContact O-CA 3.25Å; L235-I241 HydrophobicContact CD1-CG2 4.1Å; I241-P243 HydrophobicContact CD1-CG 4.32Å
242V96.5Very high90.9Very high4 Ų445.8 Ų45.82%0.02424%0.239CC..EExtended strand (participates in β ladder)trans-119.296.4169.5-178.80000108.3A173 V178 L234 L236 C246 L249A173-V242 HydrophobicContact CB-CG2 3.93Å; V178-V242 HydrophobicContact CG2-CG2 4.47Å; L234-V242 HydrophobicContact CB-CB 4.25Å; L234-V242 PolarHBondContact N-O 2.86Å; L234-V242 PolarHBondContact O-N 3.42Å; L236-V242 HydrophobicContact CD1-CG2 4.14Å; L236-V242 HydrophobicContact CD2-CG2 4.2Å; L236-V242 HydrophobicContact CG-CG2 4.26Å; V242-C246 HydrophobicContact CG1-CB 4.2Å; V242-L249 HydrophobicContact CB-CD1 4.33Å; V242-L249 HydrophobicContact CG1-CD1 3.43Å; V242-L249 VanDerWaalsContact CG1-CD1 3.43Å; V242-L249 HydrophobicContact CG2-CD1 3.94Å
243P95.1Very high90.5Very high30 Ų3043.4 Ų43.420%0.19523%0.229CC..EExtended strand (participates in β ladder)trans-63156.6173.9-20.532.9000111.7I172 I241 H245 C246I172-P243 HydrophobicContact CD1-CG 4.39Å; I172-P243 HydrophobicContact CG1-CG 4.24Å; I241-P243 HydrophobicContact CD1-CG 4.32Å; P243-H245 PolarHBondContact O-N 3.43Å; P243-C246 WeakPolarHBondContact O-CB 3.35Å
244R94.1Very high90.4Very high83 Ų8349.6 Ų49.631%0.31325%0.251SS..SBendtrans-50-42.7175.5-174.6-178.1-172.478.58.7113D232 I257 L260 D261D232-R244 HydrophobicContact CB-CB 4.17Å; D232-R244 WeakPolarHBondContact O-CB 3.27Å; D232-R244 PolarHBondContact O-N 3.15Å; D232-R244 IonicContact OD1-NH1 3.57Å; R244-I257 HydrophobicContact CG-CG1 4.39Å; R244-L260 HydrophobicContact CB-CD1 3.91Å; R244-L260 HydrophobicContact CG-CD1 4.21Å; R244-D261 IonicContact CZ-OD1 2.73Å; R244-D261 IonicContact CZ-OD2 2.98Å; R244-D261 IonicContact NH1-OD1 3.33Å; R244-D261 PolarHBondContact NH1-OD1 3.43Å; R244-D261 IonicContact NH1-OD2 3.64Å; R244-D261 IonicContact NH2-OD1 3.66Å; R244-D261 PolarHBondContact NH2-OD1 2.71Å; R244-D261 VanDerWaalsContact NH2-OD1 3.17Å; R244-D261 IonicContact NH2-OD2 3.2Å; R244-D261 PolarHBondContact NH2-OD2 2.98Å
245H90.8Very high90.3Very high159 Ų15949.4 Ų49.474%0.73625%0.25SC*.SBendtrans-103.496.8172.2-173.665.4000109.4P243P243-H245 PolarHBondContact O-N 3.43Å
246C88.3Confident90.3Very high3 Ų349.6 Ų49.62%0.0225%0.251CS..  trans-121.791.4178.9-169.30000110.1V242 P243 E248 L249V242-C246 HydrophobicContact CG1-CB 4.2Å; P243-C246 WeakPolarHBondContact O-CB 3.35Å; C246-E248 PolarHBondContact O-N 2.75Å; C246-L249 HydrophobicContact CB-CD1 4.25Å; C246-L249 PolarHBondContact O-N 3.47Å
247P85.9Confident90.3Very high94 Ų9451.3 Ų51.361%0.6126%0.26SS*.G310 helixtrans-65.2-25.1-179.926.2-33.6000112.6L249 A250P247-L249 PolarHBondContact O-N 3.06Å; P247-A250 PolarHBondContact O-N 3.24Å
248E82.2Confident90.6Very high107 Ų10753.5 Ų53.550%0.527%0.266SS..G310 helixtrans-62.8-19.8179.5-61.8177.8-153.900113.5C246C246-E248 PolarHBondContact O-N 2.75Å
249L81.6Confident90.9Very high7 Ų752.8 Ų52.84%0.03726%0.262CS..G310 helixtrans-100-1.6-179.3-69177.1000113.9I175 V178 V242 C246 P247 E251 M252I175-L249 HydrophobicContact CG1-CD2 3.88Å; V178-L249 HydrophobicContact CG2-CD2 4.08Å; V242-L249 HydrophobicContact CB-CD1 4.33Å; V242-L249 HydrophobicContact CG1-CD1 3.43Å; V242-L249 VanDerWaalsContact CG1-CD1 3.43Å; V242-L249 HydrophobicContact CG2-CD1 3.94Å; C246-L249 HydrophobicContact CB-CD1 4.25Å; C246-L249 PolarHBondContact O-N 3.47Å; P247-L249 PolarHBondContact O-N 3.06Å; L249-E251 PolarHBondContact O-N 3.41Å; L249-M252 HydrophobicContact CB-CB 4.07Å; L249-M252 VanDerWaalsContact O-CB 3.3Å; L249-M252 WeakPolarHBondContact O-CB 3.49Å; L249-M252 PolarHBondContact O-N 2.7Å
250A82.1Confident91.1Very high65 Ų6550.4 Ų50.454%0.53725%0.25SC..G310 helixtrans44.6-122-179.600000112.5P247 M252 S253P247-A250 PolarHBondContact O-N 3.24Å; A250-M252 VanDerWaalsContact C-N 3.29Å; A250-M252 PolarHBondContact O-N 3.08Å; A250-S253 VanDerWaalsContact O-CB 3.25Å; A250-S253 WeakPolarHBondContact O-CB 3.43Å; A250-S253 PolarHBondContact O-N 3.14Å; A250-S253 VanDerWaalsContact O-N 3.13Å; A250-S253 PolarHBondContact O-OG 3.12Å
251E80.1Confident91.3Very high100 Ų10050.3 Ų50.347%0.46725%0.254SS..G310 helixtrans-66.6-22.7-178.6-64-59.7137.400114.1L249 S253 R254L249-E251 PolarHBondContact O-N 3.41Å; E251-S253 PolarHBondContact O-N 2.88Å; E251-R254 WeakPolarHBondContact O-CB 3.45Å; E251-R254 PolarHBondContact O-N 2.98Å; E251-R254 VanDerWaalsContact O-N 3.15Å; E251-R254 IonicContact OE1-NH2 3.86Å; E251-R254 IonicContact OE2-CZ 3.36Å; E251-R254 IonicContact OE2-NE 2.71Å; E251-R254 PolarHBondContact OE2-NE 3.05Å; E251-R254 IonicContact OE2-NH2 3.15Å; E251-R254 PolarHBondContact OE2-NH2 2.89Å; E251-R254 VanDerWaalsContact OE2-NH2 3.15Å
252M83.4Confident91.4Very high23 Ų2352.8 Ų52.811%0.11327%0.265CS..G310 helixtrans-64.8-20.7173.1-77.2-70.6-67.400112.6L249 A250 R254 V255 S256 M342 Q345 I349L249-M252 HydrophobicContact CB-CB 4.07Å; L249-M252 VanDerWaalsContact O-CB 3.3Å; L249-M252 WeakPolarHBondContact O-CB 3.49Å; L249-M252 PolarHBondContact O-N 2.7Å; A250-M252 VanDerWaalsContact C-N 3.29Å; A250-M252 PolarHBondContact O-N 3.08Å; M252-R254 PolarHBondContact O-N 2.9Å; M252-V255 WeakPolarHBondContact O-CB 3.48Å; M252-V255 PolarHBondContact O-N 3.46Å; M252-V255 VanDerWaalsContact O-N 3.09Å; M252-S256 PolarHBondContact O-N 2.73Å; M252-M342 HydrophobicContact CE-CG 4.47Å; M252-Q345 HydrophobicContact CG-CB 4.35Å; M252-Q345 HydrophobicContact SD-CB 3.25Å; M252-Q345 WeakPolarHBondContact SD-CB 3.41Å; M252-Q345 HydrophobicContact SD-CG 4Å; M252-I349 HydrophobicContact CG-CD1 3.64Å; M252-I349 HydrophobicContact SD-CD1 3.99Å
253S87.1Confident91.5Very high27 Ų2752.8 Ų52.819%0.18927%0.265CS..Hα-helixtrans-60.4-26.8174.367.70000112.6A250 E251 V255 S256 I257A250-S253 VanDerWaalsContact O-CB 3.25Å; A250-S253 WeakPolarHBondContact O-CB 3.43Å; A250-S253 PolarHBondContact O-N 3.14Å; A250-S253 VanDerWaalsContact O-N 3.13Å; A250-S253 PolarHBondContact O-OG 3.12Å; E251-S253 PolarHBondContact O-N 2.88Å; S253-V255 VanDerWaalsContact C-N 3.32Å; S253-V255 PolarHBondContact O-N 3.41Å; S253-S256 WeakPolarHBondContact CA-OG 3.4Å; S253-S256 PolarHBondContact O-N 2.71Å; S253-S256 PolarHBondContact O-OG 3.03Å; S253-I257 WeakPolarHBondContact O-CD1 3.3Å; S253-I257 WeakPolarHBondContact O-CG1 3.48Å; S253-I257 PolarHBondContact O-N 3.23Å
254R92.6Very high91.7Very high146 Ų14651.5 Ų51.555%0.55126%0.256SS*.Hα-helixtrans-64.9-38.6175.5-61.5-175.3-169.6-111.91.9111.7E251 M252 R258E251-R254 WeakPolarHBondContact O-CB 3.45Å; E251-R254 PolarHBondContact O-N 2.98Å; E251-R254 VanDerWaalsContact O-N 3.15Å; E251-R254 IonicContact OE1-NH2 3.86Å; E251-R254 IonicContact OE2-CZ 3.36Å; E251-R254 IonicContact OE2-NE 2.71Å; E251-R254 PolarHBondContact OE2-NE 3.05Å; E251-R254 IonicContact OE2-NH2 3.15Å; E251-R254 PolarHBondContact OE2-NH2 2.89Å; E251-R254 VanDerWaalsContact OE2-NH2 3.15Å; M252-R254 PolarHBondContact O-N 2.9Å; R254-R258 WeakPolarHBondContact O-CG 3.4Å; R254-R258 PolarHBondContact O-N 3.03Å; R254-R258 VanDerWaalsContact O-N 3.15Å
255V95.8Very high91.9Very high3 Ų351 Ų512%0.01826%0.26CS..Hα-helixtrans-67.4-46.6178.1-179.90000109.7M252 S253 I257 R258 I259 I338 Q341 M342 Q345M252-V255 WeakPolarHBondContact O-CB 3.48Å; M252-V255 PolarHBondContact O-N 3.46Å; M252-V255 VanDerWaalsContact O-N 3.09Å; S253-V255 VanDerWaalsContact C-N 3.32Å; S253-V255 PolarHBondContact O-N 3.41Å; V255-I257 VanDerWaalsContact C-N 3.34Å; V255-I257 PolarHBondContact O-N 3.34Å; V255-R258 PolarHBondContact O-N 3.47Å; V255-I259 HydrophobicContact CG1-CD1 4.05Å; V255-I259 HydrophobicContact CG1-CG1 4.49Å; V255-I259 WeakPolarHBondContact O-CG1 3.11Å; V255-I259 PolarHBondContact O-N 3Å; V255-I338 HydrophobicContact CG1-CG2 4.02Å; V255-Q341 HydrophobicContact CG2-CG 4.1Å; V255-M342 HydrophobicContact CG1-CB 3.86Å; V255-M342 HydrophobicContact CG1-CG 4.29Å; V255-Q345 HydrophobicContact CG2-CG 3.98Å
256S96.3Very high92.2Very high8 Ų844.8 Ų44.86%0.05623%0.233CC..Hα-helixtrans-63.6-37.7179.362.50000112.9M252 S253 I259 L260M252-S256 PolarHBondContact O-N 2.73Å; S253-S256 WeakPolarHBondContact CA-OG 3.4Å; S253-S256 PolarHBondContact O-N 2.71Å; S253-S256 PolarHBondContact O-OG 3.03Å; S256-I259 PolarHBondContact O-N 3.35Å; S256-L260 WeakPolarHBondContact O-CG 3.44Å; S256-L260 PolarHBondContact O-N 2.88Å
257I96.6Very high92.7Very high54 Ų5444.7 Ų44.728%0.27723%0.232SC..Hα-helixtrans-61.4-45.7174.2-69163.7000110.8R244 S253 V255 I259 L260 D261R244-I257 HydrophobicContact CG-CG1 4.39Å; S253-I257 WeakPolarHBondContact O-CD1 3.3Å; S253-I257 WeakPolarHBondContact O-CG1 3.48Å; S253-I257 PolarHBondContact O-N 3.23Å; V255-I257 VanDerWaalsContact C-N 3.34Å; V255-I257 PolarHBondContact O-N 3.34Å; I257-I259 PolarHBondContact O-N 3.25Å; I257-L260 PolarHBondContact O-N 3.5Å; I257-D261 PolarHBondContact O-N 2.97Å
258R98Very high93.3Very high51 Ų5142.5 Ų42.519%0.19221%0.214CC..Hα-helixtrans-63.5-39.4176.1-71-169.369.7-154.5-5.9112.7R254 V255 L260 D261 E262 S337 I338R254-R258 WeakPolarHBondContact O-CG 3.4Å; R254-R258 PolarHBondContact O-N 3.03Å; R254-R258 VanDerWaalsContact O-N 3.15Å; V255-R258 PolarHBondContact O-N 3.47Å; R258-L260 VanDerWaalsContact C-N 3.31Å; R258-L260 PolarHBondContact O-N 2.92Å; R258-D261 PolarHBondContact O-N 3Å; R258-E262 WeakPolarHBondContact CG-OE1 3.22Å; R258-E262 IonicContact CZ-OE1 3.8Å; R258-E262 IonicContact CZ-OE2 3.78Å; R258-E262 IonicContact NE-OE1 2.72Å; R258-E262 PolarHBondContact NE-OE1 2.9Å; R258-E262 IonicContact NE-OE2 2.85Å; R258-E262 PolarHBondContact NE-OE2 3.49Å; R258-E262 IonicContact NH2-OE1 3.79Å; R258-E262 IonicContact NH2-OE2 3.74Å; R258-E262 PolarHBondContact NH2-OE2 3.34Å; R258-E262 VanDerWaalsContact O-CB 3.31Å; R258-E262 WeakPolarHBondContact O-CB 3.36Å; R258-E262 PolarHBondContact O-N 2.74Å; R258-S337 PolarHBondContact NH1-OG 3.42Å; R258-S337 PolarHBondContact NH2-OG 3.23Å; R258-I338 HydrophobicContact CB-CD1 4.16Å; R258-I338 HydrophobicContact CB-CG1 4.12Å; R258-I338 HydrophobicContact CB-CG2 4.31Å
259I98.4Very high93.9Very high12 Ų1244.7 Ų44.76%0.06222%0.224CC..Hα-helixtrans-59.7-44.9174-64.1167000110.1L220 L234 V255 S256 I257 L263 V264 I338L220-I259 HydrophobicContact CD1-CD1 4.29Å; L220-I259 HydrophobicContact CD2-CD1 4.2Å; L220-I259 HydrophobicContact CD2-CG1 4.17Å; L220-I259 HydrophobicContact CG-CD1 3.83Å; L220-I259 HydrophobicContact CG-CG1 4.17Å; L234-I259 HydrophobicContact CD1-CB 4.13Å; L234-I259 HydrophobicContact CD1-CD1 4.2Å; L234-I259 HydrophobicContact CD1-CG2 4.01Å; L234-I259 HydrophobicContact CD2-CB 4.5Å; L234-I259 HydrophobicContact CD2-CG2 3.73Å; V255-I259 HydrophobicContact CG1-CD1 4.05Å; V255-I259 HydrophobicContact CG1-CG1 4.49Å; V255-I259 WeakPolarHBondContact O-CG1 3.11Å; V255-I259 PolarHBondContact O-N 3Å; S256-I259 PolarHBondContact O-N 3.35Å; I257-I259 PolarHBondContact O-N 3.25Å; I259-L263 HydrophobicContact CG2-CD1 4.38Å; I259-L263 WeakPolarHBondContact O-CA 3.43Å; I259-L263 WeakPolarHBondContact O-CB 3.47Å; I259-L263 PolarHBondContact O-N 3.42Å; I259-L263 VanDerWaalsContact O-N 3.14Å; I259-V264 HydrophobicContact CG2-CG2 4.26Å; I259-V264 PolarHBondContact O-N 2.76Å; I259-I338 HydrophobicContact CG1-CG2 3.75Å
260L98.4Very high94.5Very high5 Ų545.7 Ų45.73%0.02623%0.229CC..Iπ-helixtrans-62.7-47.8178.7-72.4168.1000112L234 R244 S256 I257 R258 V264 L265L234-L260 HydrophobicContact CD2-CD2 3.56Å; L234-L260 HydrophobicContact CD2-CG 3.97Å; L234-L260 HydrophobicContact CG-CD2 3.94Å; L234-L260 HydrophobicContact CG-CG 4.09Å; R244-L260 HydrophobicContact CB-CD1 3.91Å; R244-L260 HydrophobicContact CG-CD1 4.21Å; S256-L260 WeakPolarHBondContact O-CG 3.44Å; S256-L260 PolarHBondContact O-N 2.88Å; I257-L260 PolarHBondContact O-N 3.5Å; R258-L260 VanDerWaalsContact C-N 3.31Å; R258-L260 PolarHBondContact O-N 2.92Å; L260-V264 HydrophobicContact CD2-CB 4.49Å; L260-V264 HydrophobicContact CD2-CG2 4.35Å; L260-L265 PolarHBondContact O-N 3.32Å
261D98.3Very high95.1Very high60 Ų6049.1 Ų49.132%0.32123%0.234SC..Iπ-helixtrans-79.8-39.6-171.5-69.8-17.4000113.4R244 I257 R258R244-D261 IonicContact CZ-OD1 2.73Å; R244-D261 IonicContact CZ-OD2 2.98Å; R244-D261 IonicContact NH1-OD1 3.33Å; R244-D261 PolarHBondContact NH1-OD1 3.43Å; R244-D261 IonicContact NH1-OD2 3.64Å; R244-D261 IonicContact NH2-OD1 3.66Å; R244-D261 PolarHBondContact NH2-OD1 2.71Å; R244-D261 VanDerWaalsContact NH2-OD1 3.17Å; R244-D261 IonicContact NH2-OD2 3.2Å; R244-D261 PolarHBondContact NH2-OD2 2.98Å; I257-D261 PolarHBondContact O-N 2.97Å; R258-D261 PolarHBondContact O-N 3Å
262E98.6Very high95.8Very high68 Ų6844.5 Ų44.532%0.31821%0.213SC..Iπ-helixtrans-106.2-8.3-169.3-54.5173-140.500113R258 P266 T334 I338R258-E262 WeakPolarHBondContact CG-OE1 3.22Å; R258-E262 IonicContact CZ-OE1 3.8Å; R258-E262 IonicContact CZ-OE2 3.78Å; R258-E262 IonicContact NE-OE1 2.72Å; R258-E262 PolarHBondContact NE-OE1 2.9Å; R258-E262 IonicContact NE-OE2 2.85Å; R258-E262 PolarHBondContact NE-OE2 3.49Å; R258-E262 IonicContact NH2-OE1 3.79Å; R258-E262 IonicContact NH2-OE2 3.74Å; R258-E262 PolarHBondContact NH2-OE2 3.34Å; R258-E262 VanDerWaalsContact O-CB 3.31Å; R258-E262 WeakPolarHBondContact O-CB 3.36Å; R258-E262 PolarHBondContact O-N 2.74Å; E262-P266 WeakPolarHBondContact O-CG 3.48Å; E262-T334 HydrophobicContact CB-CG2 3.56Å; E262-I338 HydrophobicContact CB-CD1 4.09Å
263L98.6Very high96.4Very high3 Ų344.9 Ų44.92%0.01622%0.215CC..Iπ-helixtrans-124.8-55.8175.3-58.5175.1000112.7T224 I259 P266 F267 T334 L335 I338T224-L263 HydrophobicContact CG2-CB 3.72Å; I259-L263 HydrophobicContact CG2-CD1 4.38Å; I259-L263 WeakPolarHBondContact O-CA 3.43Å; I259-L263 WeakPolarHBondContact O-CB 3.47Å; I259-L263 PolarHBondContact O-N 3.42Å; I259-L263 VanDerWaalsContact O-N 3.14Å; L263-P266 WeakPolarHBondContact O-CD 3.28Å; L263-F267 WeakPolarHBondContact O-CB 3.27Å; L263-F267 WeakPolarHBondContact O-CD2 3.4Å; L263-F267 PolarHBondContact O-N 3.42Å; L263-T334 HydrophobicContact CD2-CG2 4.01Å; L263-L335 HydrophobicContact CD1-CD1 3.79Å; L263-L335 HydrophobicContact CD2-CB 4.16Å; L263-I338 HydrophobicContact CD1-CD1 3.81Å; L263-I338 HydrophobicContact CD2-CD1 4.39Å; L263-I338 HydrophobicContact CG-CD1 3.76Å
264V98.6Very high96.8Very high4 Ų447.9 Ų47.92%0.02423%0.229CC..Iπ-helixtrans-64.9-46.8-175.7175.10000111.4T224 L234 I259 L260 F267 Q268T224-V264 HydrophobicContact CG2-CG2 3.93Å; L234-V264 HydrophobicContact CD2-CG2 3.8Å; I259-V264 HydrophobicContact CG2-CG2 4.26Å; I259-V264 PolarHBondContact O-N 2.76Å; L260-V264 HydrophobicContact CD2-CB 4.49Å; L260-V264 HydrophobicContact CD2-CG2 4.35Å; V264-F267 WeakPolarHBondContact O-CB 3.49Å; V264-F267 PolarHBondContact O-N 3.37Å; V264-Q268 HydrophobicContact CG1-CG 4.49Å; V264-Q268 WeakPolarHBondContact O-CG 3.46Å; V264-Q268 PolarHBondContact O-N 3.31Å
265L98.2Very high97Very high73 Ų7342.3 Ų42.338%0.38221%0.21SC..Hα-helixtrans-58.8-52.3175.9-84.9177.7000112L260 F267 Q268 E269L260-L265 PolarHBondContact O-N 3.32Å; L265-F267 VanDerWaalsContact C-N 3.3Å; L265-F267 PolarHBondContact O-N 2.89Å; L265-Q268 WeakPolarHBondContact O-CB 3.36Å; L265-Q268 PolarHBondContact O-N 2.98Å; L265-E269 WeakPolarHBondContact O-CG 3.39Å; L265-E269 PolarHBondContact O-N 3.35Å
266P98.1Very high97.1Very high27 Ų2742.2 Ų42.218%0.17521%0.21CC..Hα-helixtrans-57.1-37.9173.6-3137.8000114.4E262 L263 Q268 E269 L270 L331E262-P266 WeakPolarHBondContact O-CG 3.48Å; L263-P266 WeakPolarHBondContact O-CD 3.28Å; P266-Q268 VanDerWaalsContact C-N 3.3Å; P266-Q268 PolarHBondContact O-N 3.17Å; P266-E269 PolarHBondContact O-N 2.97Å; P266-L270 VanDerWaalsContact O-CB 3.25Å; P266-L270 WeakPolarHBondContact O-CB 3.31Å; P266-L270 VanDerWaalsContact O-CG 3.26Å; P266-L270 WeakPolarHBondContact O-CG 3.09Å; P266-L270 PolarHBondContact O-N 2.98Å; P266-L331 HydrophobicContact CB-CD2 3.67Å; P266-L331 HydrophobicContact CG-CD2 4.47Å
267F98.1Very high97.2Very high2 Ų242.2 Ų42.21%0.00921%0.208CC..Hα-helixtrans-60.9-39.2174.3-96.3-120.2000112.4L221 T224 K225 M228 L263 V264 L265 Q271 I272 Y277 L331L221-F267 HydrophobicContact CD1-CE2 4.28Å; L221-F267 HydrophobicContact CD1-CZ 3.61Å; T224-F267 HydrophobicContact CG2-CB 4.21Å; T224-F267 HydrophobicContact CG2-CD1 3.93Å; T224-F267 HydrophobicContact CG2-CD2 3.66Å; T224-F267 HydrophobicContact CG2-CE1 4.21Å; T224-F267 HydrophobicContact CG2-CE2 3.95Å; T224-F267 HydrophobicContact CG2-CG 3.65Å; T224-F267 HydrophobicContact CG2-CZ 4.23Å; K225-F267 HydrophobicContact CB-CE1 4.4Å; M228-F267 HydrophobicContact CB-CB 4.37Å; M228-F267 HydrophobicContact CE-CB 4.47Å; M228-F267 WeakPolarHBondContact CE-O 3.26Å; M228-F267 HydrophobicContact SD-CD1 4.38Å; L263-F267 WeakPolarHBondContact O-CB 3.27Å; L263-F267 WeakPolarHBondContact O-CD2 3.4Å; L263-F267 PolarHBondContact O-N 3.42Å; V264-F267 WeakPolarHBondContact O-CB 3.49Å; V264-F267 PolarHBondContact O-N 3.37Å; L265-F267 VanDerWaalsContact C-N 3.3Å; L265-F267 PolarHBondContact O-N 2.89Å; F267-Q271 WeakPolarHBondContact O-CA 3.47Å; F267-Q271 PolarHBondContact O-N 3.14Å; F267-I272 HydrophobicContact CB-CD1 4.39Å; F267-I272 HydrophobicContact CD1-CB 4.17Å; F267-I272 HydrophobicContact CD1-CD1 3.89Å; F267-I272 HydrophobicContact CD1-CG1 4.4Å; F267-I272 HydrophobicContact CD2-CD1 3.58Å; F267-I272 HydrophobicContact CE1-CB 4.4Å; F267-I272 HydrophobicContact CE1-CD1 3.95Å; F267-I272 HydrophobicContact CE1-CG2 4.37Å; F267-I272 HydrophobicContact CE2-CD1 3.67Å; F267-I272 HydrophobicContact CG-CD1 3.69Å; F267-I272 HydrophobicContact CG-CG1 4.36Å; F267-I272 HydrophobicContact CZ-CD1 3.83Å; F267-I272 PolarHBondContact O-N 3.05Å; F267-Y277 HydrophobicContact CE1-CD2 4.33Å; F267-L331 HydrophobicContact CD2-CD1 4.11Å; F267-L331 HydrophobicContact CE2-CD1 3.79Å
268Q97.4Very high97.2Very high47 Ų4739.6 Ų39.622%0.2220%0.195CC..Hα-helixtrans-71.7-44.7176.7-71.9171.1-13.300111.7M228 F230 V264 L265 P266 Q271M228-Q268 HydrophobicContact CB-CG 4.25Å; M228-Q268 VanDerWaalsContact O-CG 3.23Å; M228-Q268 WeakPolarHBondContact O-CG 3.25Å; M228-Q268 PolarHBondContact O-NE2 3.01Å; F230-Q268 PolarHBondContact O-NE2 2.78Å; V264-Q268 HydrophobicContact CG1-CG 4.49Å; V264-Q268 WeakPolarHBondContact O-CG 3.46Å; V264-Q268 PolarHBondContact O-N 3.31Å; L265-Q268 WeakPolarHBondContact O-CB 3.36Å; L265-Q268 PolarHBondContact O-N 2.98Å; P266-Q268 VanDerWaalsContact C-N 3.3Å; P266-Q268 PolarHBondContact O-N 3.17Å; Q268-Q271 WeakPolarHBondContact O-CG 3.38Å; Q268-Q271 PolarHBondContact O-N 3.39Å; Q268-Q271 PolarHBondContact O-NE2 3.32Å
269E95.4Very high97.2Very high154 Ų15437.2 Ų37.272%0.7219%0.186SC*.Hα-helixtrans-63.9-43.1179.2-70.5177.3172.500111.4L265 P266 Q271L265-E269 WeakPolarHBondContact O-CG 3.39Å; L265-E269 PolarHBondContact O-N 3.35Å; P266-E269 PolarHBondContact O-N 2.97Å; E269-Q271 VanDerWaalsContact C-N 3.29Å; E269-Q271 PolarHBondContact O-N 2.84Å
270L94.1Very high97.3Very high27 Ų2736.7 Ų36.714%0.14118%0.183CC..THydrogen-bonded Turntrans-77.7-13.5177.8-65.2171.7000113.1P266 I272 R324 E327 L328 L331P266-L270 VanDerWaalsContact O-CB 3.25Å; P266-L270 WeakPolarHBondContact O-CB 3.31Å; P266-L270 VanDerWaalsContact O-CG 3.26Å; P266-L270 WeakPolarHBondContact O-CG 3.09Å; P266-L270 PolarHBondContact O-N 2.98Å; L270-I272 HydrophobicContact CB-CD1 4.47Å; L270-I272 HydrophobicContact CB-CG1 3.84Å; L270-I272 HydrophobicContact CD1-CD1 4.37Å; L270-I272 PolarHBondContact O-N 3.33Å; L270-R324 VanDerWaalsContact O-CZ 3.27Å; L270-R324 PolarHBondContact O-NH1 2.96Å; L270-R324 PolarHBondContact O-NH2 3.4Å; L270-E327 HydrophobicContact CD1-CB 4.28Å; L270-E327 HydrophobicContact CD2-CB 4.04Å; L270-E327 VanDerWaalsContact CD2-OE2 3.23Å; L270-E327 WeakPolarHBondContact CD2-OE2 3.47Å; L270-L328 HydrophobicContact CD1-CD2 4.25Å; L270-L331 HydrophobicContact CD1-CD1 4.18Å
271Q94.8Very high97.3Very high137 Ų13737 Ų3764%0.6418%0.184SC*.THydrogen-bonded Turntrans48.555.9-174.2-66.4-69.2-45.800111.6F267 Q268 E269 D273 R324F267-Q271 WeakPolarHBondContact O-CA 3.47Å; F267-Q271 PolarHBondContact O-N 3.14Å; Q268-Q271 WeakPolarHBondContact O-CG 3.38Å; Q268-Q271 PolarHBondContact O-N 3.39Å; Q268-Q271 PolarHBondContact O-NE2 3.32Å; E269-Q271 VanDerWaalsContact C-N 3.29Å; E269-Q271 PolarHBondContact O-N 2.84Å; Q271-D273 PolarHBondContact O-N 3.35Å; Q271-R324 PolarHBondContact O-NH2 3.46Å
272I95.8Very high97.3Very high3 Ų334.1 Ų34.12%0.01517%0.169CC..  trans-64.3120.6-175.6-57.5-175.8000110.2K225 F267 L270 E276 L328 L331K225-I272 PolarHBondContact NZ-O 3.22Å; K225-I272 VanDerWaalsContact NZ-O 3.12Å; F267-I272 HydrophobicContact CB-CD1 4.39Å; F267-I272 HydrophobicContact CD1-CB 4.17Å; F267-I272 HydrophobicContact CD1-CD1 3.89Å; F267-I272 HydrophobicContact CD1-CG1 4.4Å; F267-I272 HydrophobicContact CD2-CD1 3.58Å; F267-I272 HydrophobicContact CE1-CB 4.4Å; F267-I272 HydrophobicContact CE1-CD1 3.95Å; F267-I272 HydrophobicContact CE1-CG2 4.37Å; F267-I272 HydrophobicContact CE2-CD1 3.67Å; F267-I272 HydrophobicContact CG-CD1 3.69Å; F267-I272 HydrophobicContact CG-CG1 4.36Å; F267-I272 HydrophobicContact CZ-CD1 3.83Å; F267-I272 PolarHBondContact O-N 3.05Å; L270-I272 HydrophobicContact CB-CD1 4.47Å; L270-I272 HydrophobicContact CB-CG1 3.84Å; L270-I272 HydrophobicContact CD1-CD1 4.37Å; L270-I272 PolarHBondContact O-N 3.33Å; I272-E276 WeakPolarHBondContact CA-OE2 3.48Å; I272-E276 HydrophobicContact CG2-CB 3.8Å; I272-L328 HydrophobicContact CD1-CD2 3.52Å; I272-L328 HydrophobicContact CG1-CD2 3.68Å; I272-L328 HydrophobicContact CG2-CD2 4.39Å; I272-L331 HydrophobicContact CD1-CD1 3.59Å
273D95.1Very high97.3Very high31 Ų3131.1 Ų31.117%0.16616%0.155CC..  trans-83.5175179.676.437.7000112.8Q271 N275 E276 Y277 Y313 R317Q271-D273 PolarHBondContact O-N 3.35Å; D273-N275 VanDerWaalsContact C-N 3.3Å; D273-N275 PolarHBondContact O-N 3.44Å; D273-N275 WeakPolarHBondContact OD1-CA 3.48Å; D273-N275 WeakPolarHBondContact OD1-CB 3.27Å; D273-N275 PolarHBondContact OD1-N 3.29Å; D273-E276 PolarHBondContact N-OE2 3.21Å; D273-E276 PolarHBondContact OD1-N 3Å; D273-Y277 VanDerWaalsContact O-CB 3.31Å; D273-Y277 WeakPolarHBondContact O-CB 3.45Å; D273-Y277 PolarHBondContact O-N 2.87Å; D273-Y313 PolarHBondContact OD2-OH 3.09Å; D273-Y313 VanDerWaalsContact OD2-OH 3.07Å; D273-R317 IonicContact OD2-CZ 3.83Å; D273-R317 IonicContact OD2-NH1 3.25Å; D273-R317 PolarHBondContact OD2-NH1 3.19Å; D273-R317 IonicContact OD2-NH2 2.88Å; D273-R317 PolarHBondContact OD2-NH2 3.37Å
274D96.5Very high97.3Very high90 Ų9031.7 Ų31.748%0.48116%0.158SC..Hα-helixtrans-69.9-26.7-175-61.8-22.2000113.1L147 K225 A278L147-D274 HydrophobicContact CD1-CB 3.69Å; K225-D274 WeakPolarHBondContact CE-OD1 3.4Å; K225-D274 IonicContact NZ-OD1 2.68Å; K225-D274 PolarHBondContact NZ-OD1 3.43Å; D274-A278 VanDerWaalsContact O-CB 3.27Å; D274-A278 WeakPolarHBondContact O-CB 3.36Å; D274-A278 PolarHBondContact O-N 2.7Å
275N96.1Very high97.3Very high30 Ų3031.5 Ų31.516%0.1616%0.157CC..Hα-helixtrans-74.7-44.9177.9-61.1-86.3000110.3I143 D273 A278 C279 Y313I143-N275 HydrophobicContact CG2-CB 3.77Å; D273-N275 VanDerWaalsContact C-N 3.3Å; D273-N275 PolarHBondContact O-N 3.44Å; D273-N275 WeakPolarHBondContact OD1-CA 3.48Å; D273-N275 WeakPolarHBondContact OD1-CB 3.27Å; D273-N275 PolarHBondContact OD1-N 3.29Å; N275-A278 PolarHBondContact O-N 3.18Å; N275-C279 PolarHBondContact O-N 2.8Å; N275-C279 PolarHBondContact O-SG 3.02Å; N275-Y313 HydrophobicContact CB-CE1 3.96Å; N275-Y313 HydrophobicContact CB-CE2 3.81Å; N275-Y313 VanDerWaalsContact CB-CZ 3.47Å; N275-Y313 WeakPolarHBondContact CB-OH 3.39Å; N275-Y313 VanDerWaalsContact CG-OH 3.29Å; N275-Y313 PolarHBondContact ND2-OH 3.18Å
276E97.1Very high97.3Very high0 Ų028 Ų280%014%0.139CC..Hα-helixtrans-62.3-45176.3-67.4170153.700110.8I272 D273 A278 C279 L280 L310 Y313 R324 L328I272-E276 WeakPolarHBondContact CA-OE2 3.48Å; I272-E276 HydrophobicContact CG2-CB 3.8Å; D273-E276 PolarHBondContact N-OE2 3.21Å; D273-E276 PolarHBondContact OD1-N 3Å; E276-A278 PolarHBondContact O-N 3.22Å; E276-C279 PolarHBondContact O-N 3.2Å; E276-L280 WeakPolarHBondContact O-CG 3.32Å; E276-L280 PolarHBondContact O-N 3.15Å; E276-L310 HydrophobicContact CB-CD1 4.35Å; E276-L310 HydrophobicContact CG-CD1 4.08Å; E276-Y313 HydrophobicContact CG-CD1 4.19Å; E276-Y313 HydrophobicContact CG-CE1 3.95Å; E276-R324 VanDerWaalsContact CD-NH2 3.31Å; E276-R324 IonicContact OE1-CZ 2.77Å; E276-R324 IonicContact OE1-NE 3.17Å; E276-R324 PolarHBondContact OE1-NE 3.34Å; E276-R324 IonicContact OE1-NH2 3.61Å; E276-R324 PolarHBondContact OE1-NH2 2.78Å; E276-R324 VanDerWaalsContact OE1-NH2 3.14Å; E276-R324 IonicContact OE2-CZ 3.56Å; E276-R324 IonicContact OE2-NE 3.64Å; E276-R324 IonicContact OE2-NH2 2.76Å; E276-R324 PolarHBondContact OE2-NH2 3.14Å; E276-L328 HydrophobicContact CB-CD1 4.21Å; E276-L328 HydrophobicContact CG-CD1 4.15Å
277Y98.4Very high97.3Very high8 Ų827.6 Ų27.63%0.03114%0.135CC..Hα-helixtrans-59-46.4173.8166.7-100.2000112.1E150 L221 K225 F267 D273 C279 L280 K281E150-Y277 VanDerWaalsContact CD-CE1 3.48Å; E150-Y277 HydrophobicContact CG-CD1 4.4Å; E150-Y277 HydrophobicContact CG-CE1 3.86Å; E150-Y277 WeakPolarHBondContact OE1-CE1 3.44Å; L221-Y277 HydrophobicContact CD2-CD2 4.49Å; L221-Y277 HydrophobicContact CD2-CE2 4.14Å; L221-Y277 HydrophobicContact CG-CD2 4.27Å; L221-Y277 HydrophobicContact CG-CE2 3.84Å; K225-Y277 HydrophobicContact CB-CD2 3.73Å; K225-Y277 HydrophobicContact CB-CE2 3.43Å; K225-Y277 VanDerWaalsContact CB-CE2 3.43Å; K225-Y277 HydrophobicContact CB-CG 4.47Å; K225-Y277 HydrophobicContact CD-CD1 4.42Å; K225-Y277 HydrophobicContact CD-CD2 3.94Å; K225-Y277 HydrophobicContact CD-CE2 4.42Å; K225-Y277 HydrophobicContact CD-CG 3.94Å; K225-Y277 HydrophobicContact CG-CD1 4.21Å; K225-Y277 HydrophobicContact CG-CD2 3.78Å; K225-Y277 HydrophobicContact CG-CE1 4.19Å; K225-Y277 HydrophobicContact CG-CE2 3.74Å; K225-Y277 HydrophobicContact CG-CG 4.01Å; F267-Y277 HydrophobicContact CE1-CD2 4.33Å; D273-Y277 VanDerWaalsContact O-CB 3.31Å; D273-Y277 WeakPolarHBondContact O-CB 3.45Å; D273-Y277 PolarHBondContact O-N 2.87Å; Y277-C279 VanDerWaalsContact C-N 3.28Å; Y277-C279 PolarHBondContact O-N 3.35Å; Y277-L280 PolarHBondContact O-N 3.3Å; Y277-K281 HydrophobicContact CE1-CD 4.23Å; Y277-K281 WeakPolarHBondContact O-CB 3.5Å; Y277-K281 PolarHBondContact O-N 2.79Å
278A98.2Very high97.3Very high0 Ų028 Ų280%014%0.138CC..Hα-helixtrans-61-38.2177.500000112.1L146 D274 N275 E276 A282L146-A278 HydrophobicContact CB-CB 4.01Å; D274-A278 VanDerWaalsContact O-CB 3.27Å; D274-A278 WeakPolarHBondContact O-CB 3.36Å; D274-A278 PolarHBondContact O-N 2.7Å; N275-A278 PolarHBondContact O-N 3.18Å; E276-A278 PolarHBondContact O-N 3.22Å; A278-A282 WeakPolarHBondContact O-CB 3.15Å; A278-A282 PolarHBondContact O-N 3.15Å
279C98.3Very high97.3Very high0 Ų031.8 Ų31.80%016%0.16CC..Hα-helixtrans-67.7-47.4175.1-65.40000112N275 E276 Y277 K281 A282 I283 V306 L310N275-C279 PolarHBondContact O-N 2.8Å; N275-C279 PolarHBondContact O-SG 3.02Å; E276-C279 PolarHBondContact O-N 3.2Å; Y277-C279 VanDerWaalsContact C-N 3.28Å; Y277-C279 PolarHBondContact O-N 3.35Å; C279-K281 VanDerWaalsContact C-N 3.28Å; C279-K281 PolarHBondContact O-N 3.06Å; C279-A282 PolarHBondContact O-N 3.3Å; C279-A282 VanDerWaalsContact O-N 3.14Å; C279-I283 VanDerWaalsContact O-CG1 3.25Å; C279-I283 WeakPolarHBondContact O-CG1 3.39Å; C279-I283 PolarHBondContact O-N 3.32Å; C279-V306 HydrophobicContact CB-CG1 4.03Å; C279-L310 HydrophobicContact CB-CB 3.99Å; C279-L310 HydrophobicContact CB-CD1 3.86Å; C279-L310 HydrophobicContact CB-CD2 3.98Å; C279-L310 HydrophobicContact CB-CG 4.15Å
280L98.6Very high97.4Very high1 Ų124.9 Ų24.91%0.00513%0.129CC..Hα-helixtrans-58-43.7177-72.8172.6000111.3E276 Y277 A282 I283 I284 L328 L329 L332E276-L280 WeakPolarHBondContact O-CG 3.32Å; E276-L280 PolarHBondContact O-N 3.15Å; Y277-L280 PolarHBondContact O-N 3.3Å; L280-A282 PolarHBondContact O-N 2.92Å; L280-I283 PolarHBondContact O-N 2.73Å; L280-I284 WeakPolarHBondContact O-CD1 3.44Å; L280-I284 WeakPolarHBondContact O-CG1 3.33Å; L280-I284 PolarHBondContact O-N 2.69Å; L280-L328 HydrophobicContact CD1-CB 4.42Å; L280-L328 HydrophobicContact CD1-CD2 4.28Å; L280-L328 HydrophobicContact CD2-CB 4.21Å; L280-L329 HydrophobicContact CD2-CD2 4.37Å; L280-L332 HydrophobicContact CD2-CD1 3.81Å
281K98.6Very high97.5Very high11 Ų1133.1 Ų33.15%0.04816%0.164CC..Hα-helixtrans-58.3-46.9175-163.6169.4-176.3-115.50111.2E150 W192 H218 L221 Y277 C279 I284 F285E150-K281 IonicContact OE2-NZ 3.6Å; E150-K281 PolarHBondContact OE2-NZ 3.45Å; W192-K281 HydrophobicContact CH2-CD 4.5Å; W192-K281 HydrophobicContact CH2-CG 3.91Å; W192-K281 HydrophobicContact CZ2-CB 4.23Å; W192-K281 HydrophobicContact CZ2-CD 3.97Å; W192-K281 HydrophobicContact CZ2-CG 3.74Å; H218-K281 PolarHBondContact CE1-O 3.07Å; H218-K281 VanDerWaalsContact CE1-O 3.27Å; H218-K281 WeakPolarHBondContact ND1-CG 3.45Å; L221-K281 HydrophobicContact CD2-CB 4.01Å; L221-K281 HydrophobicContact CD2-CG 4.26Å; Y277-K281 HydrophobicContact CE1-CD 4.23Å; Y277-K281 WeakPolarHBondContact O-CB 3.5Å; Y277-K281 PolarHBondContact O-N 2.79Å; C279-K281 VanDerWaalsContact C-N 3.28Å; C279-K281 PolarHBondContact O-N 3.06Å; K281-I284 PolarHBondContact O-N 2.91Å; K281-F285 WeakPolarHBondContact O-CB 3.29Å; K281-F285 PolarHBondContact O-N 2.84Å
282A98.6Very high97.4Very high0 Ų029.7 Ų29.70%017%0.165CC..Hα-helixtrans-68.2-34.4177.200000113.7L146 A278 C279 L280 I284 F285 F286 V306L146-A282 HydrophobicContact CD1-CB 3.64Å; L146-A282 HydrophobicContact CD2-CB 3.84Å; L146-A282 HydrophobicContact CG-CB 4.35Å; A278-A282 WeakPolarHBondContact O-CB 3.15Å; A278-A282 PolarHBondContact O-N 3.15Å; C279-A282 PolarHBondContact O-N 3.3Å; C279-A282 VanDerWaalsContact O-N 3.14Å; L280-A282 PolarHBondContact O-N 2.92Å; A282-I284 VanDerWaalsContact C-N 3.34Å; A282-F285 PolarHBondContact O-N 2.87Å; A282-F286 HydrophobicContact CB-CD2 4.31Å; A282-F286 HydrophobicContact CB-CE2 4.34Å; A282-F286 VanDerWaalsContact O-CD2 3.27Å; A282-F286 WeakPolarHBondContact O-CD2 3.31Å; A282-F286 PolarHBondContact O-N 2.73Å; A282-V306 HydrophobicContact CB-CG1 3.99Å; A282-V306 HydrophobicContact CB-CG2 4.23Å
283I98.8Very high97.5Very high5 Ų530.7 Ų30.73%0.02617%0.171CC..Hα-helixtrans-62.8-42.4175.7-71.2165.7000110.8C279 L280 R303 V306 Q307 L310 L329 L332C279-I283 VanDerWaalsContact O-CG1 3.25Å; C279-I283 WeakPolarHBondContact O-CG1 3.39Å; C279-I283 PolarHBondContact O-N 3.32Å; L280-I283 PolarHBondContact O-N 2.73Å; I283-R303 HydrophobicContact CG2-CG 4.31Å; I283-R303 WeakPolarHBondContact O-CD 3.48Å; I283-V306 HydrophobicContact CD1-CG1 4.33Å; I283-V306 HydrophobicContact CG1-CB 4.26Å; I283-V306 HydrophobicContact CG1-CG1 3.76Å; I283-Q307 HydrophobicContact CD1-CG 3.81Å; I283-Q307 HydrophobicContact CG1-CG 3.9Å; I283-Q307 HydrophobicContact CG2-CG 4.49Å; I283-L310 HydrophobicContact CD1-CD2 3.84Å; I283-L329 HydrophobicContact CD1-CD2 4.13Å; I283-L332 HydrophobicContact CG2-CD2 3.98Å
284I98.7Very high97.6Very high15 Ų1532.8 Ų32.88%0.07719%0.188CC..Hα-helixtrans-67.1-43.4175.4-67.3159000110.3H214 E217 L221 L280 K281 A282 L332 L335H214-I284 HydrophobicContact CB-CG2 3.67Å; H214-I284 PolarHBondContact CD2-O 3.32Å; E217-I284 HydrophobicContact CB-CG2 4.01Å; L221-I284 HydrophobicContact CD2-CD1 3.85Å; L280-I284 WeakPolarHBondContact O-CD1 3.44Å; L280-I284 WeakPolarHBondContact O-CG1 3.33Å; L280-I284 PolarHBondContact O-N 2.69Å; K281-I284 PolarHBondContact O-N 2.91Å; A282-I284 VanDerWaalsContact C-N 3.34Å; I284-L332 HydrophobicContact CD1-CD1 4.41Å; I284-L332 HydrophobicContact CD1-CG 4.3Å; I284-L332 HydrophobicContact CG1-CD2 4.21Å; I284-L332 HydrophobicContact CG1-CG 4.03Å; I284-L335 HydrophobicContact CD1-CD2 3.54Å
285F98.7Very high97.6Very high1 Ų131.8 Ų31.80%0.00418%0.182CC..Hα-helixtrans-67-44-175.2-172.5-112.7000113.6W192 A193 F199 L210 L211 H218 K281 A282 D287W192-F285 HydrophobicContact CH2-CB 3.8Å; W192-F285 HydrophobicContact CH2-CD1 4.12Å; W192-F285 HydrophobicContact CH2-CD2 4.44Å; W192-F285 AromaticContact CH2-CG 3.88Å; W192-F285 HydrophobicContact CH2-CG 3.88Å; W192-F285 HydrophobicContact CZ3-CB 3.97Å; W192-F285 AromaticContact CZ3-CD1 3.88Å; W192-F285 HydrophobicContact CZ3-CD1 3.88Å; W192-F285 AromaticContact CZ3-CD2 3.74Å; W192-F285 HydrophobicContact CZ3-CD2 3.74Å; W192-F285 HydrophobicContact CZ3-CE1 4.27Å; W192-F285 HydrophobicContact CZ3-CE2 4.15Å; W192-F285 AromaticContact CZ3-CG 3.59Å; W192-F285 HydrophobicContact CZ3-CG 3.59Å; W192-F285 HydrophobicContact CZ3-CZ 4.39Å; A193-F285 HydrophobicContact CB-CE1 4.15Å; A193-F285 HydrophobicContact CB-CE2 4.31Å; A193-F285 HydrophobicContact CB-CZ 3.63Å; F199-F285 AromaticContact CD2-CE1 3.53Å; F199-F285 HydrophobicContact CD2-CE1 3.53Å; F199-F285 AromaticContact CD2-CZ 3.63Å; F199-F285 HydrophobicContact CD2-CZ 3.63Å; F199-F285 AromaticContact CE2-CE1 3.99Å; F199-F285 HydrophobicContact CE2-CE1 3.99Å; F199-F285 AromaticContact CE2-CZ 3.57Å; F199-F285 HydrophobicContact CE2-CZ 3.57Å; F199-F285 HydrophobicContact CG-CE1 4.22Å; F199-F285 HydrophobicContact CG-CZ 4.48Å; F199-F285 HydrophobicContact CZ-CZ 4.4Å; L210-F285 HydrophobicContact CB-CE1 4.47Å; L210-F285 HydrophobicContact CB-CE2 4.27Å; L210-F285 HydrophobicContact CB-CZ 4.12Å; L210-F285 WeakPolarHBondContact CD2-O 3.45Å; L211-F285 HydrophobicContact CD2-CE2 3.93Å; L211-F285 HydrophobicContact CD2-CZ 4.24Å; L211-F285 HydrophobicContact CG-CE2 4.26Å; L211-F285 HydrophobicContact CG-CZ 4.36Å; H218-F285 AromaticContact NE2-CD2 3.54Å; K281-F285 WeakPolarHBondContact O-CB 3.29Å; K281-F285 PolarHBondContact O-N 2.84Å; A282-F285 PolarHBondContact O-N 2.87Å; F285-D287 PolarHBondContact O-N 2.63Å
286F98.4Very high97.7Very high0 Ų033.1 Ų33.10%019%0.193CC..SBendtrans-83.359.4-179.4-67.7-60.2000111.7I196 L210 A282 P288 I299 L302 R303I196-F286 HydrophobicContact CG2-CZ 4.1Å; L210-F286 HydrophobicContact CD1-CD1 4.28Å; A282-F286 HydrophobicContact CB-CD2 4.31Å; A282-F286 HydrophobicContact CB-CE2 4.34Å; A282-F286 VanDerWaalsContact O-CD2 3.27Å; A282-F286 WeakPolarHBondContact O-CD2 3.31Å; A282-F286 PolarHBondContact O-N 2.73Å; F286-P288 WeakPolarHBondContact O-CD 3.44Å; F286-I299 HydrophobicContact CB-CG2 3.99Å; F286-I299 WeakPolarHBondContact O-CG2 3.46Å; F286-L302 HydrophobicContact CD1-CB 4.32Å; F286-L302 HydrophobicContact CD1-CD1 4.06Å; F286-L302 HydrophobicContact CD2-CB 4.44Å; F286-L302 HydrophobicContact CE1-CD1 3.96Å; F286-L302 HydrophobicContact CG-CB 4.19Å; F286-R303 HydrophobicContact CB-CB 4.04Å; F286-R303 WeakPolarHBondContact O-CB 3.29Å; F286-R303 WeakPolarHBondContact O-CD 3.45Å
287D98.4Very high97.7Very high17 Ų1734.5 Ų34.59%0.09121%0.206CC..  trans-81113176.1-176.240.3000111.9H214 F285 D289 A290 L293 R303H214-D287 WeakPolarHBondContact NE2-CB 3.44Å; H214-D287 IonicContact NE2-OD2 2.71Å; H214-D287 PolarHBondContact NE2-OD2 3.31Å; F285-D287 PolarHBondContact O-N 2.63Å; D287-D289 PolarHBondContact O-N 3.12Å; D287-D289 PolarHBondContact OD1-N 2.88Å; D287-D289 VanDerWaalsContact OD2-C 3.29Å; D287-D289 PolarHBondContact OD2-N 3.13Å; D287-A290 WeakPolarHBondContact O-CB 3.46Å; D287-A290 PolarHBondContact O-N 2.84Å; D287-A290 PolarHBondContact OD2-N 3.24Å; D287-L293 WeakPolarHBondContact O-CD1 3.46Å; D287-R303 IonicContact OD1-CZ 3.14Å; D287-R303 IonicContact OD1-NH1 3.81Å; D287-R303 PolarHBondContact OD1-NH1 2.72Å
288P98.1Very high97.6Very high10 Ų1037.2 Ų37.27%0.06522%0.219CC..THydrogen-bonded Turntrans-71.5-13175.733.6-35.3000112.8F286 A290 P296 I299 K300 R303F286-P288 WeakPolarHBondContact O-CD 3.44Å; P288-A290 VanDerWaalsContact C-N 3.3Å; P288-P296 HydrophobicContact CB-CB 4.42Å; P288-P296 VanDerWaalsContact CB-O 3.27Å; P288-P296 WeakPolarHBondContact CB-O 3.39Å; P288-P296 WeakPolarHBondContact O-CB 3.29Å; P288-I299 HydrophobicContact CB-CB 4.24Å; P288-I299 HydrophobicContact CB-CG2 4.33Å; P288-K300 HydrophobicContact CB-CB 3.84Å; P288-K300 HydrophobicContact CG-CB 4.04Å; P288-K300 HydrophobicContact CG-CG 4.45Å; P288-R303 VanDerWaalsContact CD-NH1 3.26Å; P288-R303 VanDerWaalsContact CG-NH2 3.26Å
289D97.8Very high97.5Very high127 Ų12737.3 Ų37.368%0.67922%0.219SC*.THydrogen-bonded Turntrans-90.42.3178.7-57.8-49.8000111.9D287 K291D287-D289 PolarHBondContact O-N 3.12Å; D287-D289 PolarHBondContact OD1-N 2.88Å; D287-D289 VanDerWaalsContact OD2-C 3.29Å; D287-D289 PolarHBondContact OD2-N 3.13Å; D289-K291 PolarHBondContact O-N 3.44Å
290A97.3Very high97.5Very high10 Ų1043.5 Ų43.58%0.08325%0.246CC..  trans-59.5129.9175.100000111.2L210 A213 D287 P288 G292 L293L210-A290 HydrophobicContact CD2-CB 4.2Å; A213-A290 HydrophobicContact CB-CB 3.67Å; D287-A290 WeakPolarHBondContact O-CB 3.46Å; D287-A290 PolarHBondContact O-N 2.84Å; D287-A290 PolarHBondContact OD2-N 3.24Å; P288-A290 VanDerWaalsContact C-N 3.3Å; A290-G292 PolarHBondContact O-N 2.99Å; A290-L293 HydrophobicContact CB-CD1 3.82Å; A290-L293 HydrophobicContact CB-CG 4.03Å; A290-L293 WeakPolarHBondContact O-CG 3.23Å
291K95.1Very high97.3Very high200 Ų20050.3 Ų50.387%0.8727%0.271SS*.THydrogen-bonded Turntrans-68.2131.4-177.8-66.6-178.4-178.81770110.8D289D289-K291 PolarHBondContact O-N 3.44Å
292G93.5Very high97.2Very high65 Ų6550.2 Ų50.267%0.6727%0.271SS*.THydrogen-bonded Turntrans96.53.7176.500000114.9A290A290-G292 PolarHBondContact O-N 2.99Å
293L97.4Very high97.2Very high24 Ų2452.8 Ų52.813%0.12628%0.281CS..  trans-67.9137.5175.8-71.7176.7000113.1D206 A209 L210 D287 A290 P296 I299D206-L293 HydrophobicContact CB-CD2 3.93Å; D206-L293 WeakPolarHBondContact OD1-CA 3.46Å; A209-L293 HydrophobicContact CB-CD2 4.11Å; A209-L293 HydrophobicContact CB-CG 4.47Å; L210-L293 HydrophobicContact CD2-CD1 4.36Å; L210-L293 HydrophobicContact CD2-CD2 4.05Å; L210-L293 HydrophobicContact CG-CD2 4.11Å; D287-L293 WeakPolarHBondContact O-CD1 3.46Å; A290-L293 HydrophobicContact CB-CD1 3.82Å; A290-L293 HydrophobicContact CB-CG 4.03Å; A290-L293 WeakPolarHBondContact O-CG 3.23Å; L293-P296 HydrophobicContact CB-CG 4.07Å; L293-I299 HydrophobicContact CD1-CB 4.39Å; L293-I299 HydrophobicContact CD1-CG1 3.94Å; L293-I299 HydrophobicContact CD2-CG1 4.12Å
294S97.6Very high97Very high75 Ų7554.7 Ų54.752%0.52430%0.295SS..SBendtrans-78.7-44.6176.7750000113D206D206-S294 WeakPolarHBondContact OD1-CB 3.44Å; D206-S294 PolarHBondContact OD1-N 3.19Å; D206-S294 PolarHBondContact OD1-OG 2.88Å; D206-S294 PolarHBondContact OD2-OG 3.49Å
295D96.2Very high96.8Very high69 Ų6956.4 Ų56.437%0.36930%0.303SS..  trans-129.382.8174.2-177.73.6000111.3G297 K298 I299 R301D295-G297 PolarHBondContact O-N 3.02Å; D295-G297 VanDerWaalsContact O-N 3.13Å; D295-G297 VanDerWaalsContact OD1-CA 3.27Å; D295-G297 WeakPolarHBondContact OD1-CA 3.31Å; D295-G297 PolarHBondContact OD1-N 3.44Å; D295-K298 HydrophobicContact CB-CB 4.19Å; D295-K298 PolarHBondContact O-N 3.21Å; D295-K298 VanDerWaalsContact O-N 3.12Å; D295-K298 PolarHBondContact OD1-N 3.44Å; D295-K298 WeakPolarHBondContact OD2-CB 3.32Å; D295-I299 PolarHBondContact O-N 3.13Å; D295-R301 IonicContact OD2-NH2 3.12Å
296P97.6Very high96.7Very high58 Ų5856.4 Ų56.438%0.37730%0.303SS..Hα-helixtrans-52.6-29.7170.8-30.337.8000113.9P288 L293 I299 K300P288-P296 HydrophobicContact CB-CB 4.42Å; P288-P296 VanDerWaalsContact CB-O 3.27Å; P288-P296 WeakPolarHBondContact CB-O 3.39Å; P288-P296 WeakPolarHBondContact O-CB 3.29Å; L293-P296 HydrophobicContact CB-CG 4.07Å; P296-I299 PolarHBondContact O-N 3.39Å; P296-K300 WeakPolarHBondContact O-CB 3.24Å; P296-K300 PolarHBondContact O-N 3.3Å
297G96.9Very high96.6Very high28 Ų2859.2 Ų59.229%0.28932%0.316SS..Hα-helixtrans-65.5-39.9179.100000112.5D295 K300 R301D295-G297 PolarHBondContact O-N 3.02Å; D295-G297 VanDerWaalsContact O-N 3.13Å; D295-G297 VanDerWaalsContact OD1-CA 3.27Å; D295-G297 WeakPolarHBondContact OD1-CA 3.31Å; D295-G297 PolarHBondContact OD1-N 3.44Å; G297-K300 PolarHBondContact O-N 3.25Å; G297-R301 VanDerWaalsContact C-NH1 3.33Å; G297-R301 WeakPolarHBondContact O-CG 3.45Å; G297-R301 PolarHBondContact O-N 2.95Å; G297-R301 VanDerWaalsContact O-N 3.12Å; G297-R301 PolarHBondContact O-NH1 3.05Å
298K95.8Very high96.3Very high66 Ų6661.6 Ų61.629%0.28733%0.331SS..Hα-helixtrans-61.5-47.7173.7-177.5176-179.8-178.50111.1L202 D295 K300 R301 L302L202-K298 HydrophobicContact CD2-CD 3.93Å; D295-K298 HydrophobicContact CB-CB 4.19Å; D295-K298 PolarHBondContact O-N 3.21Å; D295-K298 VanDerWaalsContact O-N 3.12Å; D295-K298 PolarHBondContact OD1-N 3.44Å; D295-K298 WeakPolarHBondContact OD2-CB 3.32Å; K298-K300 VanDerWaalsContact C-N 3.33Å; K298-K300 PolarHBondContact O-N 3.3Å; K298-R301 VanDerWaalsContact CA-NH2 3.28Å; K298-R301 PolarHBondContact O-N 3.36Å; K298-L302 PolarHBondContact O-N 3.07Å; K298-L302 VanDerWaalsContact O-N 3.1Å
299I98.1Very high96.1Very high2 Ų262 Ų621%0.0133%0.334CS..Hα-helixtrans-62.9-41.8179.7-54.5-49000111.1L202 L210 F286 P288 L293 D295 P296 R301 L302 R303L202-I299 HydrophobicContact CD1-CD1 3.76Å; L202-I299 HydrophobicContact CD2-CD1 3.88Å; L210-I299 HydrophobicContact CD1-CD1 4Å; L210-I299 HydrophobicContact CD2-CG2 4.03Å; F286-I299 HydrophobicContact CB-CG2 3.99Å; F286-I299 WeakPolarHBondContact O-CG2 3.46Å; P288-I299 HydrophobicContact CB-CB 4.24Å; P288-I299 HydrophobicContact CB-CG2 4.33Å; L293-I299 HydrophobicContact CD1-CB 4.39Å; L293-I299 HydrophobicContact CD1-CG1 3.94Å; L293-I299 HydrophobicContact CD2-CG1 4.12Å; D295-I299 PolarHBondContact O-N 3.13Å; P296-I299 PolarHBondContact O-N 3.39Å; I299-R301 VanDerWaalsContact C-N 3.31Å; I299-R301 PolarHBondContact O-N 3.35Å; I299-L302 HydrophobicContact CD1-CD1 4.32Å; I299-L302 WeakPolarHBondContact O-CB 3.48Å; I299-L302 PolarHBondContact O-N 2.99Å; I299-R303 PolarHBondContact O-N 3.4Å
300K97.3Very high95.9Very high129 Ų12956 Ų5656%0.56130%0.302SS*.Hα-helixtrans-59.2-40.7175.9-175.1173.5-180173.50112.4P288 P296 G297 K298 S304P288-K300 HydrophobicContact CB-CB 3.84Å; P288-K300 HydrophobicContact CG-CB 4.04Å; P288-K300 HydrophobicContact CG-CG 4.45Å; P296-K300 WeakPolarHBondContact O-CB 3.24Å; P296-K300 PolarHBondContact O-N 3.3Å; G297-K300 PolarHBondContact O-N 3.25Å; K298-K300 VanDerWaalsContact C-N 3.33Å; K298-K300 PolarHBondContact O-N 3.3Å; K300-S304 WeakPolarHBondContact O-CB 3.47Å; K300-S304 PolarHBondContact O-N 3.32Å; K300-S304 PolarHBondContact O-OG 2.87Å
301R95.2Very high95.7Very high144 Ų14459.6 Ų59.654%0.54332%0.317SS..Hα-helixtrans-64.4-44.1176.2-72.9-175.6-64.4-85.54.2111.5D295 G297 K298 I299 S304 Q305D295-R301 IonicContact OD2-NH2 3.12Å; G297-R301 VanDerWaalsContact C-NH1 3.33Å; G297-R301 WeakPolarHBondContact O-CG 3.45Å; G297-R301 PolarHBondContact O-N 2.95Å; G297-R301 VanDerWaalsContact O-N 3.12Å; G297-R301 PolarHBondContact O-NH1 3.05Å; K298-R301 VanDerWaalsContact CA-NH2 3.28Å; K298-R301 PolarHBondContact O-N 3.36Å; I299-R301 VanDerWaalsContact C-N 3.31Å; I299-R301 PolarHBondContact O-N 3.35Å; R301-S304 PolarHBondContact O-N 3.19Å; R301-Q305 PolarHBondContact O-N 3.36Å
302L96.3Very high95.4Very high9 Ų954 Ų545%0.04730%0.296CS..Hα-helixtrans-58.6-50.5175.4-66.8173.4000111.3L140 P141 A198 F286 K298 I299 S304 Q305 V306L140-L302 HydrophobicContact CD2-CD2 4.1Å; P141-L302 HydrophobicContact CG-CD2 4.32Å; A198-L302 HydrophobicContact CB-CD1 4.3Å; A198-L302 HydrophobicContact CB-CD2 3.89Å; F286-L302 HydrophobicContact CD1-CB 4.32Å; F286-L302 HydrophobicContact CD1-CD1 4.06Å; F286-L302 HydrophobicContact CD2-CB 4.44Å; F286-L302 HydrophobicContact CE1-CD1 3.96Å; F286-L302 HydrophobicContact CG-CB 4.19Å; K298-L302 PolarHBondContact O-N 3.07Å; K298-L302 VanDerWaalsContact O-N 3.1Å; I299-L302 HydrophobicContact CD1-CD1 4.32Å; I299-L302 WeakPolarHBondContact O-CB 3.48Å; I299-L302 PolarHBondContact O-N 2.99Å; L302-S304 PolarHBondContact O-N 3.35Å; L302-Q305 PolarHBondContact O-N 2.66Å; L302-V306 WeakPolarHBondContact O-CG2 3.36Å; L302-V306 PolarHBondContact O-N 3.27Å; L302-V306 VanDerWaalsContact O-N 3.14Å
303R97.6Very high95.3Very high54 Ų5453 Ų5320%0.20427%0.273CS..Hα-helixtrans-59.6-45177.3-174.8166.871.2-173.10.7112.6I283 F286 D287 P288 I299 Q305 V306 Q307I283-R303 HydrophobicContact CG2-CG 4.31Å; I283-R303 WeakPolarHBondContact O-CD 3.48Å; F286-R303 HydrophobicContact CB-CB 4.04Å; F286-R303 WeakPolarHBondContact O-CB 3.29Å; F286-R303 WeakPolarHBondContact O-CD 3.45Å; D287-R303 IonicContact OD1-CZ 3.14Å; D287-R303 IonicContact OD1-NH1 3.81Å; D287-R303 PolarHBondContact OD1-NH1 2.72Å; P288-R303 VanDerWaalsContact CD-NH1 3.26Å; P288-R303 VanDerWaalsContact CG-NH2 3.26Å; I299-R303 PolarHBondContact O-N 3.4Å; R303-Q305 VanDerWaalsContact C-N 3.29Å; R303-Q305 PolarHBondContact O-N 2.79Å; R303-V306 PolarHBondContact O-N 3.34Å; R303-Q307 WeakPolarHBondContact O-CG 3.47Å; R303-Q307 PolarHBondContact O-N 3.23Å
304S95.3Very high95Very high46 Ų4652 Ų5232%0.32227%0.267SS..Hα-helixtrans-61.3-39.4179.6-55.40000111.3K300 R301 L302 Q307 V308K300-S304 WeakPolarHBondContact O-CB 3.47Å; K300-S304 PolarHBondContact O-N 3.32Å; K300-S304 PolarHBondContact O-OG 2.87Å; R301-S304 PolarHBondContact O-N 3.19Å; L302-S304 PolarHBondContact O-N 3.35Å; S304-Q307 PolarHBondContact O-N 3.35Å; S304-V308 WeakPolarHBondContact O-CG2 3.36Å; S304-V308 PolarHBondContact O-N 3.03Å
305Q94.1Very high94.4Very high51 Ų5151.8 Ų51.824%0.23826%0.261CS..Hα-helixtrans-64.5-41.9176.7-177.363.231.500112.3L140 R301 L302 R303 Q307 V308 S309L140-Q305 HydrophobicContact CB-CG 4.01Å; L140-Q305 HydrophobicContact CD1-CG 3.91Å; L140-Q305 HydrophobicContact CD2-CB 4.37Å; L140-Q305 HydrophobicContact CD2-CG 4.34Å; L140-Q305 HydrophobicContact CG-CG 4.3Å; R301-Q305 PolarHBondContact O-N 3.36Å; L302-Q305 PolarHBondContact O-N 2.66Å; R303-Q305 VanDerWaalsContact C-N 3.29Å; R303-Q305 PolarHBondContact O-N 2.79Å; Q305-Q307 VanDerWaalsContact C-N 3.32Å; Q305-Q307 PolarHBondContact O-N 3.48Å; Q305-V308 PolarHBondContact O-N 3.19Å; Q305-S309 WeakPolarHBondContact O-CB 3.42Å; Q305-S309 PolarHBondContact O-N 3.46Å; Q305-S309 PolarHBondContact O-OG 3.15Å
306V96.5Very high93.8Very high1 Ų152.9 Ų52.91%0.00627%0.267CS..Hα-helixtrans-63.5-40.7176.2179.30000110.7P141 L146 C279 A282 I283 L302 R303 S309 L310P141-V306 HydrophobicContact CG-CG2 3.9Å; L146-V306 HydrophobicContact CD1-CG1 4.03Å; L146-V306 HydrophobicContact CD1-CG2 4.2Å; C279-V306 HydrophobicContact CB-CG1 4.03Å; A282-V306 HydrophobicContact CB-CG1 3.99Å; A282-V306 HydrophobicContact CB-CG2 4.23Å; I283-V306 HydrophobicContact CD1-CG1 4.33Å; I283-V306 HydrophobicContact CG1-CB 4.26Å; I283-V306 HydrophobicContact CG1-CG1 3.76Å; L302-V306 WeakPolarHBondContact O-CG2 3.36Å; L302-V306 PolarHBondContact O-N 3.27Å; L302-V306 VanDerWaalsContact O-N 3.14Å; R303-V306 PolarHBondContact O-N 3.34Å; V306-S309 PolarHBondContact O-N 2.94Å; V306-L310 WeakPolarHBondContact O-CB 3.44Å; V306-L310 PolarHBondContact O-N 3.41Å
307Q95.8Very high92.9Very high59 Ų5955.8 Ų55.828%0.27627%0.27SS..Hα-helixtrans-61.1-47.6176.2-71.5172.2-25.700112.1I283 R303 S304 Q305 S309 L310 E311 F325I283-Q307 HydrophobicContact CD1-CG 3.81Å; I283-Q307 HydrophobicContact CG1-CG 3.9Å; I283-Q307 HydrophobicContact CG2-CG 4.49Å; R303-Q307 WeakPolarHBondContact O-CG 3.47Å; R303-Q307 PolarHBondContact O-N 3.23Å; S304-Q307 PolarHBondContact O-N 3.35Å; Q305-Q307 VanDerWaalsContact C-N 3.32Å; Q305-Q307 PolarHBondContact O-N 3.48Å; Q307-S309 VanDerWaalsContact C-N 3.34Å; Q307-S309 PolarHBondContact O-N 3.06Å; Q307-L310 PolarHBondContact O-N 3.48Å; Q307-E311 PolarHBondContact O-N 3.41Å; Q307-F325 HydrophobicContact CB-CZ 4.44Å
308V93.1Very high91Very high67 Ų6761.7 Ų61.741%0.40629%0.29SS..Hα-helixtrans-61.8-43.4176.1172.20000110.9S304 Q305 L310 E311 D312S304-V308 WeakPolarHBondContact O-CG2 3.36Å; S304-V308 PolarHBondContact O-N 3.03Å; Q305-V308 PolarHBondContact O-N 3.19Å; V308-L310 VanDerWaalsContact C-N 3.33Å; V308-L310 PolarHBondContact O-N 3.26Å; V308-E311 PolarHBondContact O-N 3.43Å; V308-D312 PolarHBondContact O-N 3.31Å
309S93.2Very high89.4Confident19 Ų1968.9 Ų68.913%0.13332%0.317CS..Hα-helixtrans-62.1-42178.4-56.20000111.6I143 Q305 V306 Q307 D312 Y313I143-S309 WeakPolarHBondContact CD1-O 3.31Å; Q305-S309 WeakPolarHBondContact O-CB 3.42Å; Q305-S309 PolarHBondContact O-N 3.46Å; Q305-S309 PolarHBondContact O-OG 3.15Å; V306-S309 PolarHBondContact O-N 2.94Å; Q307-S309 VanDerWaalsContact C-N 3.34Å; Q307-S309 PolarHBondContact O-N 3.06Å; S309-D312 PolarHBondContact O-N 3.08Å; S309-Y313 VanDerWaalsContact O-CB 3.31Å; S309-Y313 WeakPolarHBondContact O-CB 3.38Å; S309-Y313 PolarHBondContact O-N 3.37Å
310L94.3Very high87.9Confident0 Ų075.3 Ų75.30%035%0.351CS..Hα-helixtrans-64.4-42.4175.5177.959.6000111.7E276 C279 I283 V306 Q307 V308 Y313 I314 F325 L328E276-L310 HydrophobicContact CB-CD1 4.35Å; E276-L310 HydrophobicContact CG-CD1 4.08Å; C279-L310 HydrophobicContact CB-CB 3.99Å; C279-L310 HydrophobicContact CB-CD1 3.86Å; C279-L310 HydrophobicContact CB-CD2 3.98Å; C279-L310 HydrophobicContact CB-CG 4.15Å; I283-L310 HydrophobicContact CD1-CD2 3.84Å; V306-L310 WeakPolarHBondContact O-CB 3.44Å; V306-L310 PolarHBondContact O-N 3.41Å; Q307-L310 PolarHBondContact O-N 3.48Å; V308-L310 VanDerWaalsContact C-N 3.33Å; V308-L310 PolarHBondContact O-N 3.26Å; L310-Y313 WeakPolarHBondContact O-CB 3.4Å; L310-Y313 PolarHBondContact O-N 3.21Å; L310-I314 HydrophobicContact CD1-CD1 3.89Å; L310-I314 HydrophobicContact CD1-CG1 4.25Å; L310-I314 HydrophobicContact CG-CD1 3.94Å; L310-I314 WeakPolarHBondContact O-CD1 3.47Å; L310-I314 VanDerWaalsContact O-CG1 3.28Å; L310-I314 WeakPolarHBondContact O-CG1 3.39Å; L310-I314 PolarHBondContact O-N 3.43Å; L310-F325 HydrophobicContact CB-CE2 4.3Å; L310-F325 HydrophobicContact CD2-CD2 4.24Å; L310-F325 HydrophobicContact CD2-CE2 4.09Å; L310-F325 HydrophobicContact CG-CD2 4.1Å; L310-F325 HydrophobicContact CG-CE2 4.13Å; L310-L328 HydrophobicContact CD1-CD1 4.43Å
311E92.3Very high86.7Confident86 Ų8670.2 Ų70.240%0.40233%0.332SS..Hα-helixtrans-61.1-46.7175.8-179.5171.4-157.800111.3Q307 V308 Y313 I314 N315 F325Q307-E311 PolarHBondContact O-N 3.41Å; V308-E311 PolarHBondContact O-N 3.43Å; E311-Y313 VanDerWaalsContact C-N 3.35Å; E311-Y313 PolarHBondContact O-N 2.87Å; E311-I314 PolarHBondContact O-N 3.06Å; E311-N315 WeakPolarHBondContact CG-ND2 3.31Å; E311-N315 WeakPolarHBondContact O-CB 3.39Å; E311-N315 PolarHBondContact O-N 2.68Å; E311-N315 PolarHBondContact O-ND2 3.24Å; E311-N315 VanDerWaalsContact O-ND2 3.08Å; E311-F325 HydrophobicContact CB-CD2 4.09Å; E311-F325 HydrophobicContact CB-CE2 3.99Å; E311-F325 HydrophobicContact CB-CG 4.48Å; E311-F325 HydrophobicContact CB-CZ 4.3Å
312D90.1Very high86.1Confident81 Ų8175.2 Ų75.243%0.43335%0.351SS..Hα-helixtrans-61.3-42.7175.8-78.6-21.1000112V308 S309 I314 N315 D316V308-D312 PolarHBondContact O-N 3.31Å; S309-D312 PolarHBondContact O-N 3.08Å; D312-I314 VanDerWaalsContact C-N 3.34Å; D312-I314 PolarHBondContact O-N 3.26Å; D312-N315 PolarHBondContact O-N 3.38Å; D312-D316 PolarHBondContact O-N 3.47Å
313Y90.3Very high85.7Confident45 Ų4577 Ų7718%0.17637%0.371CS..Hα-helixtrans-58.7-44.8177.1-179-94.3000112.4I143 D273 N275 E276 S309 L310 E311 R317I143-Y313 HydrophobicContact CD1-CD2 3.89Å; I143-Y313 HydrophobicContact CD1-CG 3.94Å; D273-Y313 PolarHBondContact OD2-OH 3.09Å; D273-Y313 VanDerWaalsContact OD2-OH 3.07Å; N275-Y313 HydrophobicContact CB-CE1 3.96Å; N275-Y313 HydrophobicContact CB-CE2 3.81Å; N275-Y313 VanDerWaalsContact CB-CZ 3.47Å; N275-Y313 WeakPolarHBondContact CB-OH 3.39Å; N275-Y313 VanDerWaalsContact CG-OH 3.29Å; N275-Y313 PolarHBondContact ND2-OH 3.18Å; E276-Y313 HydrophobicContact CG-CD1 4.19Å; E276-Y313 HydrophobicContact CG-CE1 3.95Å; S309-Y313 VanDerWaalsContact O-CB 3.31Å; S309-Y313 WeakPolarHBondContact O-CB 3.38Å; S309-Y313 PolarHBondContact O-N 3.37Å; L310-Y313 WeakPolarHBondContact O-CB 3.4Å; L310-Y313 PolarHBondContact O-N 3.21Å; E311-Y313 VanDerWaalsContact C-N 3.35Å; E311-Y313 PolarHBondContact O-N 2.87Å; Y313-R317 PolarHBondContact OH-NH2 2.91Å
314I90.7Very high85.5Confident2 Ų275.9 Ų75.91%0.0137%0.367CS..Hα-helixtrans-68.5-43.6178.1-69.8165.7000110.3L310 E311 D312 D316 R317 S321 R324 F325 L328L310-I314 HydrophobicContact CD1-CD1 3.89Å; L310-I314 HydrophobicContact CD1-CG1 4.25Å; L310-I314 HydrophobicContact CG-CD1 3.94Å; L310-I314 WeakPolarHBondContact O-CD1 3.47Å; L310-I314 VanDerWaalsContact O-CG1 3.28Å; L310-I314 WeakPolarHBondContact O-CG1 3.39Å; L310-I314 PolarHBondContact O-N 3.43Å; E311-I314 PolarHBondContact O-N 3.06Å; D312-I314 VanDerWaalsContact C-N 3.34Å; D312-I314 PolarHBondContact O-N 3.26Å; I314-D316 VanDerWaalsContact C-N 3.26Å; I314-D316 PolarHBondContact O-N 3.05Å; I314-R317 WeakPolarHBondContact O-CB 3.5Å; I314-R317 PolarHBondContact O-N 3Å; I314-S321 VanDerWaalsContact O-CB 3.22Å; I314-S321 WeakPolarHBondContact O-CB 3.35Å; I314-R324 HydrophobicContact CD1-CG 4.5Å; I314-R324 HydrophobicContact CG2-CB 3.98Å; I314-R324 HydrophobicContact CG2-CG 4.26Å; I314-F325 HydrophobicContact CD1-CB 3.9Å; I314-F325 HydrophobicContact CD1-CD2 3.98Å; I314-F325 HydrophobicContact CD1-CG 4.46Å; I314-L328 HydrophobicContact CD1-CD1 3.69Å
315N86.6Confident85.5Confident72 Ų7276 Ų7639%0.38536%0.361SS..Hα-helixtrans-66.1-26-177.3-76.2-33000113.6E311 D312 R317E311-N315 WeakPolarHBondContact CG-ND2 3.31Å; E311-N315 WeakPolarHBondContact O-CB 3.39Å; E311-N315 PolarHBondContact O-N 2.68Å; E311-N315 PolarHBondContact O-ND2 3.24Å; E311-N315 VanDerWaalsContact O-ND2 3.08Å; D312-N315 PolarHBondContact O-N 3.38Å; N315-R317 PolarHBondContact O-N 3.26Å
316D83.2Confident85.5Confident92 Ų9275.1 Ų75.149%0.49237%0.366SS..THydrogen-bonded Turntrans-67.9-17.9173.6-77.3-10.9000112.8R132 D312 I314 Q318R132-D316 IonicContact CZ-OD1 3.04Å; R132-D316 IonicContact CZ-OD2 3.87Å; R132-D316 IonicContact NH1-OD1 2.79Å; R132-D316 PolarHBondContact NH1-OD1 3.41Å; R132-D316 IonicContact NH1-OD2 3.15Å; R132-D316 PolarHBondContact NH1-OD2 2.69Å; R132-D316 VanDerWaalsContact NH1-OD2 3.15Å; R132-D316 IonicContact NH2-OD1 2.66Å; R132-D316 PolarHBondContact NH2-OD1 3.2Å; D312-D316 PolarHBondContact O-N 3.47Å; I314-D316 VanDerWaalsContact C-N 3.26Å; I314-D316 PolarHBondContact O-N 3.05Å; D316-Q318 PolarHBondContact O-N 3.42Å
317R77.9Confident85.5Confident119 Ų11979.9 Ų79.945%0.44939%0.388SS..SBendtrans-95.864.4174.2-60.5-176.7176.7-172.62.2111.5D273 Y313 I314 N315 Y319 D320 S321D273-R317 IonicContact OD2-CZ 3.83Å; D273-R317 IonicContact OD2-NH1 3.25Å; D273-R317 PolarHBondContact OD2-NH1 3.19Å; D273-R317 IonicContact OD2-NH2 2.88Å; D273-R317 PolarHBondContact OD2-NH2 3.37Å; Y313-R317 PolarHBondContact OH-NH2 2.91Å; I314-R317 WeakPolarHBondContact O-CB 3.5Å; I314-R317 PolarHBondContact O-N 3Å; N315-R317 PolarHBondContact O-N 3.26Å; R317-Y319 PolarHBondContact O-N 2.88Å; R317-D320 PolarHBondContact O-N 3.13Å; R317-D320 VanDerWaalsContact O-N 3.15Å; R317-S321 PolarHBondContact O-N 2.96Å
318Q57.4Low85.6Confident151 Ų15177.1 Ų77.171%0.70638%0.375SS*.THydrogen-bonded Turntrans-49.2-17.4-166.9-65.4-173.6-22.900118D316D316-Q318 PolarHBondContact O-N 3.42Å
319Y61.3Low85.8Confident218 Ų21876 Ų7686%0.85537%0.367SS*.THydrogen-bonded Turntrans-98.3-17.7-175-61.5-75.1000114.6R317R317-Y319 PolarHBondContact O-N 2.88Å
320D68.3Low86Confident136 Ų13681 Ų8173%0.72739%0.391SS*.THydrogen-bonded Turntrans-122.76.1-179.9-93.5-24.1000113.3R317R317-D320 PolarHBondContact O-N 3.13Å; R317-D320 VanDerWaalsContact O-N 3.15Å
321S70.8Confident86.2Confident23 Ų2381.8 Ų81.816%0.16140%0.396CS..  trans-82.7-19.9-167.261.90000115.3I314 R317 G323 R324I314-S321 VanDerWaalsContact O-CB 3.22Å; I314-S321 WeakPolarHBondContact O-CB 3.35Å; R317-S321 PolarHBondContact O-N 2.96Å; S321-G323 PolarHBondContact O-N 3.36Å; S321-G323 VanDerWaalsContact O-N 3.09Å; S321-R324 PolarHBondContact O-N 3.26Å
322R83.8Confident86.5Confident249 Ų24979.8 Ų79.894%0.9439%0.387SS*.THydrogen-bonded Turntrans-70111-172.3-173.3-177.9178.2113.20.9110.8R324R322-R324 VanDerWaalsContact C-N 3.29Å; R322-R324 PolarHBondContact O-N 3.46Å
323G87.4Confident86.9Confident45 Ų4579.5 Ų79.546%0.46439%0.39SS..THydrogen-bonded Turntrans90.8-20177.600000114.2S321 F325 G326 E327S321-G323 PolarHBondContact O-N 3.36Å; S321-G323 VanDerWaalsContact O-N 3.09Å; G323-F325 PolarHBondContact O-N 3.05Å; G323-G326 WeakPolarHBondContact O-CA 3.28Å; G323-G326 PolarHBondContact O-N 3.33Å; G323-E327 PolarHBondContact O-N 3.1Å
324R93.4Very high87.3Confident31 Ų3179.3 Ų79.312%0.11739%0.393CS..Hα-helixtrans-55.2-44.1-176-175.4176.3-175.3790.9113.8L270 Q271 E276 I314 S321 R322 G326 E327 L328L270-R324 VanDerWaalsContact O-CZ 3.27Å; L270-R324 PolarHBondContact O-NH1 2.96Å; L270-R324 PolarHBondContact O-NH2 3.4Å; Q271-R324 PolarHBondContact O-NH2 3.46Å; E276-R324 VanDerWaalsContact CD-NH2 3.31Å; E276-R324 IonicContact OE1-CZ 2.77Å; E276-R324 IonicContact OE1-NE 3.17Å; E276-R324 PolarHBondContact OE1-NE 3.34Å; E276-R324 IonicContact OE1-NH2 3.61Å; E276-R324 PolarHBondContact OE1-NH2 2.78Å; E276-R324 VanDerWaalsContact OE1-NH2 3.14Å; E276-R324 IonicContact OE2-CZ 3.56Å; E276-R324 IonicContact OE2-NE 3.64Å; E276-R324 IonicContact OE2-NH2 2.76Å; E276-R324 PolarHBondContact OE2-NH2 3.14Å; I314-R324 HydrophobicContact CD1-CG 4.5Å; I314-R324 HydrophobicContact CG2-CB 3.98Å; I314-R324 HydrophobicContact CG2-CG 4.26Å; S321-R324 PolarHBondContact O-N 3.26Å; R322-R324 VanDerWaalsContact C-N 3.29Å; R322-R324 PolarHBondContact O-N 3.46Å; R324-G326 VanDerWaalsContact C-N 3.28Å; R324-G326 PolarHBondContact O-N 3.26Å; R324-E327 PolarHBondContact O-N 3.37Å; R324-L328 HydrophobicContact CG-CD1 4.43Å; R324-L328 HydrophobicContact CG-CG 4.46Å; R324-L328 WeakPolarHBondContact O-CG 3.44Å; R324-L328 PolarHBondContact O-N 3.35Å
325F94.7Very high87.7Confident49 Ų4979.4 Ų79.422%0.21539%0.394CS..Hα-helixtrans-58.3-42.3176.8179.8-108.7000111.9Q307 L310 E311 I314 G323 L329Q307-F325 HydrophobicContact CB-CZ 4.44Å; L310-F325 HydrophobicContact CB-CE2 4.3Å; L310-F325 HydrophobicContact CD2-CD2 4.24Å; L310-F325 HydrophobicContact CD2-CE2 4.09Å; L310-F325 HydrophobicContact CG-CD2 4.1Å; L310-F325 HydrophobicContact CG-CE2 4.13Å; E311-F325 HydrophobicContact CB-CD2 4.09Å; E311-F325 HydrophobicContact CB-CE2 3.99Å; E311-F325 HydrophobicContact CB-CG 4.48Å; E311-F325 HydrophobicContact CB-CZ 4.3Å; I314-F325 HydrophobicContact CD1-CB 3.9Å; I314-F325 HydrophobicContact CD1-CD2 3.98Å; I314-F325 HydrophobicContact CD1-CG 4.46Å; G323-F325 PolarHBondContact O-N 3.05Å; F325-L329 HydrophobicContact CD1-CD1 4.15Å; F325-L329 HydrophobicContact CE1-CD1 3.55Å; F325-L329 HydrophobicContact CE1-CG 4.47Å; F325-L329 HydrophobicContact CE2-CD1 4.16Å; F325-L329 HydrophobicContact CE2-CG 4.44Å; F325-L329 HydrophobicContact CZ-CD1 3.57Å; F325-L329 HydrophobicContact CZ-CG 4.32Å; F325-L329 WeakPolarHBondContact O-CG 3.43Å; F325-L329 PolarHBondContact O-N 3.03Å
326G95.4Very high88.2Confident32 Ų3280 Ų8033%0.3339%0.394SS..Hα-helixtrans-65.3-45.5175.900000112.2G323 R324 L328 L329 L330G323-G326 WeakPolarHBondContact O-CA 3.28Å; G323-G326 PolarHBondContact O-N 3.33Å; R324-G326 VanDerWaalsContact C-N 3.28Å; R324-G326 PolarHBondContact O-N 3.26Å; G326-L328 VanDerWaalsContact C-N 3.35Å; G326-L328 PolarHBondContact O-N 3.38Å; G326-L329 PolarHBondContact O-N 3.19Å; G326-L330 WeakPolarHBondContact O-CB 3.41Å; G326-L330 VanDerWaalsContact O-CG 3.23Å; G326-L330 WeakPolarHBondContact O-CG 3.3Å; G326-L330 PolarHBondContact O-N 3.42Å
327E95.6Very high89Confident102 Ų10278.2 Ų78.248%0.47739%0.389SS..Hα-helixtrans-59.5-43.4178.3-68.9179150.700112.2L270 G323 R324 L330L270-E327 HydrophobicContact CD1-CB 4.28Å; L270-E327 HydrophobicContact CD2-CB 4.04Å; L270-E327 VanDerWaalsContact CD2-OE2 3.23Å; L270-E327 WeakPolarHBondContact CD2-OE2 3.47Å; G323-E327 PolarHBondContact O-N 3.1Å; R324-E327 PolarHBondContact O-N 3.37Å; E327-L330 PolarHBondContact O-N 3.12Å
328L96.9Very high90Very high0 Ų072.5 Ų72.50%037%0.368CS..Hα-helixtrans-62.1-44.1176-68178.9000112.2L270 I272 E276 L280 L310 I314 R324 G326 L330 L331L270-L328 HydrophobicContact CD1-CD2 4.25Å; I272-L328 HydrophobicContact CD1-CD2 3.52Å; I272-L328 HydrophobicContact CG1-CD2 3.68Å; I272-L328 HydrophobicContact CG2-CD2 4.39Å; E276-L328 HydrophobicContact CB-CD1 4.21Å; E276-L328 HydrophobicContact CG-CD1 4.15Å; L280-L328 HydrophobicContact CD1-CB 4.42Å; L280-L328 HydrophobicContact CD1-CD2 4.28Å; L280-L328 HydrophobicContact CD2-CB 4.21Å; L310-L328 HydrophobicContact CD1-CD1 4.43Å; I314-L328 HydrophobicContact CD1-CD1 3.69Å; R324-L328 HydrophobicContact CG-CD1 4.43Å; R324-L328 HydrophobicContact CG-CG 4.46Å; R324-L328 WeakPolarHBondContact O-CG 3.44Å; R324-L328 PolarHBondContact O-N 3.35Å; G326-L328 VanDerWaalsContact C-N 3.35Å; G326-L328 PolarHBondContact O-N 3.38Å; L328-L330 VanDerWaalsContact C-N 3.32Å; L328-L330 PolarHBondContact O-N 3.05Å; L328-L331 HydrophobicContact CD2-CD1 4.46Å; L328-L331 WeakPolarHBondContact O-CB 3.37Å; L328-L331 PolarHBondContact O-N 3.5Å
329L97.7Very high91.9Very high45 Ų4565.4 Ų65.424%0.23634%0.335CS..Hα-helixtrans-70-29.5178.9-67.5-173.6000112.8L280 I283 F325 G326 L331 L332L280-L329 HydrophobicContact CD2-CD2 4.37Å; I283-L329 HydrophobicContact CD1-CD2 4.13Å; F325-L329 HydrophobicContact CD1-CD1 4.15Å; F325-L329 HydrophobicContact CE1-CD1 3.55Å; F325-L329 HydrophobicContact CE1-CG 4.47Å; F325-L329 HydrophobicContact CE2-CD1 4.16Å; F325-L329 HydrophobicContact CE2-CG 4.44Å; F325-L329 HydrophobicContact CZ-CD1 3.57Å; F325-L329 HydrophobicContact CZ-CG 4.32Å; F325-L329 WeakPolarHBondContact O-CG 3.43Å; F325-L329 PolarHBondContact O-N 3.03Å; G326-L329 PolarHBondContact O-N 3.19Å; L329-L331 PolarHBondContact O-N 3.5Å; L329-L332 WeakPolarHBondContact O-CB 3.49Å; L329-L332 PolarHBondContact O-N 2.92Å; L329-L332 VanDerWaalsContact O-N 3.15Å
330L98.3Very high93.6Very high123 Ų12363.1 Ų63.164%0.64433%0.325SS*.THydrogen-bonded Turntrans-70.9-7.6176.7-73.6171000113.5G326 E327 L328 P333G326-L330 WeakPolarHBondContact O-CB 3.41Å; G326-L330 VanDerWaalsContact O-CG 3.23Å; G326-L330 WeakPolarHBondContact O-CG 3.3Å; G326-L330 PolarHBondContact O-N 3.42Å; E327-L330 PolarHBondContact O-N 3.12Å; L328-L330 VanDerWaalsContact C-N 3.32Å; L328-L330 PolarHBondContact O-N 3.05Å; L330-P333 WeakPolarHBondContact O-CD 3.31Å
331L98.3Very high95Very high17 Ų1758.8 Ų58.89%0.08930%0.3CS..Hα-helixtrans-73.4-26.8169.2-58.6171.7000112.4P266 F267 L270 I272 L328 L329 T334 L335P266-L331 HydrophobicContact CB-CD2 3.67Å; P266-L331 HydrophobicContact CG-CD2 4.47Å; F267-L331 HydrophobicContact CD2-CD1 4.11Å; F267-L331 HydrophobicContact CE2-CD1 3.79Å; L270-L331 HydrophobicContact CD1-CD1 4.18Å; I272-L331 HydrophobicContact CD1-CD1 3.59Å; L328-L331 HydrophobicContact CD2-CD1 4.46Å; L328-L331 WeakPolarHBondContact O-CB 3.37Å; L328-L331 PolarHBondContact O-N 3.5Å; L329-L331 PolarHBondContact O-N 3.5Å; L331-T334 PolarHBondContact O-N 2.87Å; L331-L335 WeakPolarHBondContact O-CB 3.36Å; L331-L335 PolarHBondContact O-N 3.3Å
332L98.4Very high96.2Very high43 Ų4358.1 Ų58.123%0.22529%0.294CS..Hα-helixtrans-63.9-45.5-174.5-85.955.3000113.2L280 I283 I284 L329 T334 L335 Q336L280-L332 HydrophobicContact CD2-CD1 3.81Å; I283-L332 HydrophobicContact CG2-CD2 3.98Å; I284-L332 HydrophobicContact CD1-CD1 4.41Å; I284-L332 HydrophobicContact CD1-CG 4.3Å; I284-L332 HydrophobicContact CG1-CD2 4.21Å; I284-L332 HydrophobicContact CG1-CG 4.03Å; L329-L332 WeakPolarHBondContact O-CB 3.49Å; L329-L332 PolarHBondContact O-N 2.92Å; L329-L332 VanDerWaalsContact O-N 3.15Å; L332-T334 VanDerWaalsContact C-N 3.32Å; L332-T334 PolarHBondContact O-N 3.18Å; L332-L335 WeakPolarHBondContact O-CB 3.47Å; L332-L335 PolarHBondContact O-N 3.37Å; L332-Q336 WeakPolarHBondContact O-CB 3.2Å; L332-Q336 PolarHBondContact O-N 3.41Å
333P98.6Very high96.8Very high76 Ų7647.4 Ų47.449%0.49426%0.255SS..Hα-helixtrans-59.4-41.5176.1-25.935000113.1L330 Q336 S337L330-P333 WeakPolarHBondContact O-CD 3.31Å; P333-Q336 PolarHBondContact O-N 3.43Å; P333-S337 WeakPolarHBondContact O-CB 3.25Å; P333-S337 PolarHBondContact O-N 3.2Å
334T98.6Very high97.1Very high40 Ų4050 Ų5025%0.24526%0.256CS..Hα-helixtrans-64.1-47.2176.5-60.40000111E262 L263 L331 L332 Q336 S337 I338E262-T334 HydrophobicContact CB-CG2 3.56Å; L263-T334 HydrophobicContact CD2-CG2 4.01Å; L331-T334 PolarHBondContact O-N 2.87Å; L332-T334 VanDerWaalsContact C-N 3.32Å; L332-T334 PolarHBondContact O-N 3.18Å; T334-Q336 VanDerWaalsContact C-N 3.29Å; T334-Q336 PolarHBondContact O-N 2.7Å; T334-S337 WeakPolarHBondContact O-CB 3.25Å; T334-S337 PolarHBondContact O-N 2.9Å; T334-S337 VanDerWaalsContact O-N 3.17Å; T334-I338 HydrophobicContact CG2-CD1 3.83Å; T334-I338 WeakPolarHBondContact O-CG1 3.48Å; T334-I338 PolarHBondContact O-N 2.92Å
335L98.8Very high97.1Very high4 Ų450.2 Ų50.22%0.02126%0.258CS..Hα-helixtrans-56.5-43.9175.8177.664.2000112E217 L220 L221 L263 I284 L331 L332 T339E217-L335 HydrophobicContact CB-CD2 3.92Å; E217-L335 HydrophobicContact CB-CG 4.02Å; E217-L335 HydrophobicContact CG-CD2 4.41Å; E217-L335 HydrophobicContact CG-CG 4.15Å; L220-L335 HydrophobicContact CB-CD1 3.53Å; L220-L335 HydrophobicContact CD2-CD1 4.4Å; L221-L335 HydrophobicContact CB-CD2 4.21Å; L221-L335 HydrophobicContact CD1-CD2 4.17Å; L263-L335 HydrophobicContact CD1-CD1 3.79Å; L263-L335 HydrophobicContact CD2-CB 4.16Å; I284-L335 HydrophobicContact CD1-CD2 3.54Å; L331-L335 WeakPolarHBondContact O-CB 3.36Å; L331-L335 PolarHBondContact O-N 3.3Å; L332-L335 WeakPolarHBondContact O-CB 3.47Å; L332-L335 PolarHBondContact O-N 3.37Å; L335-T339 WeakPolarHBondContact O-CB 3.5Å; L335-T339 PolarHBondContact O-N 3.46Å; L335-T339 PolarHBondContact O-OG1 3.29Å
336Q98.3Very high97Very high84 Ų8448 Ų4839%0.39325%0.248SC..Hα-helixtrans-64.1-47.3176.7-167.3179.227.700110.8L332 P333 T334 I338 T339 W340L332-Q336 WeakPolarHBondContact O-CB 3.2Å; L332-Q336 PolarHBondContact O-N 3.41Å; P333-Q336 PolarHBondContact O-N 3.43Å; T334-Q336 VanDerWaalsContact C-N 3.29Å; T334-Q336 PolarHBondContact O-N 2.7Å; Q336-I338 VanDerWaalsContact C-N 3.34Å; Q336-I338 PolarHBondContact O-N 3.46Å; Q336-T339 WeakPolarHBondContact O-CB 3.41Å; Q336-T339 PolarHBondContact O-N 3.04Å; Q336-W340 PolarHBondContact O-N 3.47Å
337S98.6Very high96.8Very high55 Ų5551.3 Ų51.339%0.38526%0.255SS..Hα-helixtrans-55.7-45.7178174.60000112.7R258 P333 T334 Q341R258-S337 PolarHBondContact NH1-OG 3.42Å; R258-S337 PolarHBondContact NH2-OG 3.23Å; P333-S337 WeakPolarHBondContact O-CB 3.25Å; P333-S337 PolarHBondContact O-N 3.2Å; T334-S337 WeakPolarHBondContact O-CB 3.25Å; T334-S337 PolarHBondContact O-N 2.9Å; T334-S337 VanDerWaalsContact O-N 3.17Å; S337-Q341 PolarHBondContact O-N 2.95Å
338I98.5Very high96.6Very high0 Ų050.8 Ų50.80%025%0.252CS..Hα-helixtrans-71.5-37.7-179.6-57.7165.5000110.4L220 V255 R258 I259 E262 L263 T334 Q336 W340 Q341 M342L220-I338 HydrophobicContact CD2-CB 3.91Å; L220-I338 HydrophobicContact CD2-CG2 3.58Å; V255-I338 HydrophobicContact CG1-CG2 4.02Å; R258-I338 HydrophobicContact CB-CD1 4.16Å; R258-I338 HydrophobicContact CB-CG1 4.12Å; R258-I338 HydrophobicContact CB-CG2 4.31Å; I259-I338 HydrophobicContact CG1-CG2 3.75Å; E262-I338 HydrophobicContact CB-CD1 4.09Å; L263-I338 HydrophobicContact CD1-CD1 3.81Å; L263-I338 HydrophobicContact CD2-CD1 4.39Å; L263-I338 HydrophobicContact CG-CD1 3.76Å; T334-I338 HydrophobicContact CG2-CD1 3.83Å; T334-I338 WeakPolarHBondContact O-CG1 3.48Å; T334-I338 PolarHBondContact O-N 2.92Å; Q336-I338 VanDerWaalsContact C-N 3.34Å; Q336-I338 PolarHBondContact O-N 3.46Å; I338-W340 PolarHBondContact O-N 3.24Å; I338-Q341 PolarHBondContact O-N 2.95Å; I338-M342 PolarHBondContact O-N 3.28Å
339T98.4Very high96.2Very high2 Ų251.3 Ų51.31%0.01225%0.254CS..Hα-helixtrans-58.5-45.3174.7-61.20000111.8E217 L335 Q336 Q341 M342 I343E217-T339 WeakPolarHBondContact CA-OG1 3.3Å; E217-T339 HydrophobicContact CG-CG2 4.27Å; L335-T339 WeakPolarHBondContact O-CB 3.5Å; L335-T339 PolarHBondContact O-N 3.46Å; L335-T339 PolarHBondContact O-OG1 3.29Å; Q336-T339 WeakPolarHBondContact O-CB 3.41Å; Q336-T339 PolarHBondContact O-N 3.04Å; T339-Q341 VanDerWaalsContact C-N 3.34Å; T339-Q341 PolarHBondContact O-N 3Å; T339-M342 HydrophobicContact CG2-CE 4.44Å; T339-M342 WeakPolarHBondContact O-CB 3.46Å; T339-M342 PolarHBondContact O-N 3.06Å; T339-I343 HydrophobicContact CG2-CD1 3.8Å; T339-I343 HydrophobicContact CG2-CG1 4.32Å; T339-I343 WeakPolarHBondContact O-CG1 3.16Å; T339-I343 PolarHBondContact O-N 3.19Å
340W96.8Very high95.9Very high170 Ų17053.9 Ų53.964%0.64426%0.263SS*.Hα-helixtrans-58.5-46.5176.2-81.7106.8000112.1Q336 I338 M342 I343 E344Q336-W340 PolarHBondContact O-N 3.47Å; I338-W340 PolarHBondContact O-N 3.24Å; W340-M342 VanDerWaalsContact C-N 3.33Å; W340-M342 PolarHBondContact O-N 3.21Å; W340-I343 PolarHBondContact O-N 3.4Å; W340-E344 PolarHBondContact O-N 3.5Å
341Q97.3Very high95.5Very high44 Ų4454.4 Ų54.421%0.20627%0.266CS..Hα-helixtrans-62.1-41.5176.4-170.2-179.9-4.900111.3V255 S337 I338 T339 E344 Q345V255-Q341 HydrophobicContact CG2-CG 4.1Å; S337-Q341 PolarHBondContact O-N 2.95Å; I338-Q341 PolarHBondContact O-N 2.95Å; T339-Q341 VanDerWaalsContact C-N 3.34Å; T339-Q341 PolarHBondContact O-N 3Å; Q341-E344 PolarHBondContact O-N 2.93Å; Q341-Q345 WeakPolarHBondContact O-CG 3.43Å; Q341-Q345 PolarHBondContact O-N 3.45Å
342M96.8Very high95.1Very high10 Ų1060.1 Ų60.15%0.04929%0.29CS..Hα-helixtrans-59.5-49.7174.9-177-167.659.400111.4M182 L220 M252 V255 I338 T339 W340 E344 Q345 I346M182-M342 HydrophobicContact CE-CE 3.71Å; M182-M342 HydrophobicContact CE-SD 3.62Å; M182-M342 HydrophobicContact SD-SD 4.44Å; L220-M342 HydrophobicContact CD1-CE 3.64Å; L220-M342 HydrophobicContact CD1-SD 3.27Å; L220-M342 WeakPolarHBondContact CD1-SD 3.42Å; M252-M342 HydrophobicContact CE-CG 4.47Å; V255-M342 HydrophobicContact CG1-CB 3.86Å; V255-M342 HydrophobicContact CG1-CG 4.29Å; I338-M342 PolarHBondContact O-N 3.28Å; T339-M342 HydrophobicContact CG2-CE 4.44Å; T339-M342 WeakPolarHBondContact O-CB 3.46Å; T339-M342 PolarHBondContact O-N 3.06Å; W340-M342 VanDerWaalsContact C-N 3.33Å; W340-M342 PolarHBondContact O-N 3.21Å; M342-E344 VanDerWaalsContact C-N 3.29Å; M342-E344 PolarHBondContact O-N 3.25Å; M342-Q345 PolarHBondContact O-N 3.12Å; M342-I346 HydrophobicContact CE-CD1 4.41Å; M342-I346 HydrophobicContact CG-CD1 3.8Å; M342-I346 HydrophobicContact CG-CG1 4.41Å; M342-I346 WeakPolarHBondContact O-CG1 3.11Å; M342-I346 PolarHBondContact O-N 2.88Å; M342-I346 HydrophobicContact SD-CD1 4.16Å
343I95.4Very high94.6Very high23 Ų2361 Ų6112%0.11831%0.31CS..Hα-helixtrans-59.3-43.7-179.5-71.3170.8000110.2T339 W340 Q345 I346 Q347 L366T339-I343 HydrophobicContact CG2-CD1 3.8Å; T339-I343 HydrophobicContact CG2-CG1 4.32Å; T339-I343 WeakPolarHBondContact O-CG1 3.16Å; T339-I343 PolarHBondContact O-N 3.19Å; W340-I343 PolarHBondContact O-N 3.4Å; I343-Q345 PolarHBondContact O-N 3.2Å; I343-I346 PolarHBondContact O-N 3.08Å; I343-Q347 WeakPolarHBondContact O-CG 3.41Å; I343-Q347 PolarHBondContact O-N 2.78Å; I343-L366 HydrophobicContact CG2-CD2 4.01Å
344E94.1Very high93.9Very high101 Ų10163.2 Ų63.247%0.47232%0.315SS..Hα-helixtrans-58-47.2175.4-178.5179.9-149.300111.8W340 Q341 M342 I346 Q347 F348W340-E344 PolarHBondContact O-N 3.5Å; Q341-E344 PolarHBondContact O-N 2.93Å; M342-E344 VanDerWaalsContact C-N 3.29Å; M342-E344 PolarHBondContact O-N 3.25Å; E344-I346 VanDerWaalsContact C-N 3.34Å; E344-I346 PolarHBondContact O-N 3.29Å; E344-Q347 WeakPolarHBondContact O-CB 3.28Å; E344-Q347 PolarHBondContact O-N 2.93Å; E344-F348 HydrophobicContact CG-CD2 4.08Å; E344-F348 HydrophobicContact CG-CE2 3.71Å; E344-F348 VanDerWaalsContact O-CD2 3.24Å; E344-F348 WeakPolarHBondContact O-CD2 3.08Å; E344-F348 PolarHBondContact O-N 2.96Å; E344-F348 VanDerWaalsContact O-N 3.08Å
345Q92.6Very high93.3Very high35 Ų3562 Ų6216%0.16431%0.309CS..Hα-helixtrans-63.7-38.5177.6-63.9-50.2-6000112.4M252 V255 Q341 M342 I343 Q347 F348 I349M252-Q345 HydrophobicContact CG-CB 4.35Å; M252-Q345 HydrophobicContact SD-CB 3.25Å; M252-Q345 WeakPolarHBondContact SD-CB 3.41Å; M252-Q345 HydrophobicContact SD-CG 4Å; V255-Q345 HydrophobicContact CG2-CG 3.98Å; Q341-Q345 WeakPolarHBondContact O-CG 3.43Å; Q341-Q345 PolarHBondContact O-N 3.45Å; M342-Q345 PolarHBondContact O-N 3.12Å; I343-Q345 PolarHBondContact O-N 3.2Å; Q345-Q347 VanDerWaalsContact C-N 3.33Å; Q345-Q347 PolarHBondContact O-N 3.41Å; Q345-F348 PolarHBondContact O-N 2.89Å; Q345-I349 WeakPolarHBondContact O-CG1 3.29Å; Q345-I349 PolarHBondContact O-N 3.32Å
346I92.6Very high92.8Very high3 Ų371.3 Ų71.32%0.01535%0.35CS..Hα-helixtrans-65.5-37.5176-66.2169.8000111M182 M342 I343 E344 F348 I349 K350 I357 L366M182-I346 HydrophobicContact CE-CD1 3.47Å; M182-I346 VanDerWaalsContact CE-CD1 3.47Å; M182-I346 HydrophobicContact SD-CD1 3.73Å; M342-I346 HydrophobicContact CE-CD1 4.41Å; M342-I346 HydrophobicContact CG-CD1 3.8Å; M342-I346 HydrophobicContact CG-CG1 4.41Å; M342-I346 WeakPolarHBondContact O-CG1 3.11Å; M342-I346 PolarHBondContact O-N 2.88Å; M342-I346 HydrophobicContact SD-CD1 4.16Å; I343-I346 PolarHBondContact O-N 3.08Å; E344-I346 VanDerWaalsContact C-N 3.34Å; E344-I346 PolarHBondContact O-N 3.29Å; I346-F348 VanDerWaalsContact C-N 3.33Å; I346-F348 PolarHBondContact O-N 2.92Å; I346-I349 PolarHBondContact O-N 2.73Å; I346-K350 WeakPolarHBondContact O-CB 3.44Å; I346-K350 PolarHBondContact O-N 3.43Å; I346-I357 HydrophobicContact CG2-CD1 4.02Å; I346-L366 HydrophobicContact CB-CD2 4.36Å; I346-L366 HydrophobicContact CG2-CD1 4.08Å; I346-L366 HydrophobicContact CG2-CD2 3.96Å; I346-L366 HydrophobicContact CG2-CG 4.44Å
347Q92.3Very high92.4Very high101 Ų10168.2 Ų68.247%0.47234%0.336SS..Hα-helixtrans-61.6-41.8173.7-71.1178.318.300111.6I343 E344 Q345 K350 L351 L366I343-Q347 WeakPolarHBondContact O-CG 3.41Å; I343-Q347 PolarHBondContact O-N 2.78Å; E344-Q347 WeakPolarHBondContact O-CB 3.28Å; E344-Q347 PolarHBondContact O-N 2.93Å; Q345-Q347 VanDerWaalsContact C-N 3.33Å; Q345-Q347 PolarHBondContact O-N 3.41Å; Q347-K350 PolarHBondContact O-N 3.42Å; Q347-L351 WeakPolarHBondContact O-CB 3.25Å; Q347-L351 PolarHBondContact O-N 3.19Å; Q347-L366 HydrophobicContact CG-CD2 3.79Å
348F91.5Very high92.1Very high91 Ų9168 Ų6840%0.39933%0.33SS..Hα-helixtrans-63.4-46.2174.2-78.2-63.4000112.3E344 Q345 I346 K350 L351 F352E344-F348 HydrophobicContact CG-CD2 4.08Å; E344-F348 HydrophobicContact CG-CE2 3.71Å; E344-F348 VanDerWaalsContact O-CD2 3.24Å; E344-F348 WeakPolarHBondContact O-CD2 3.08Å; E344-F348 PolarHBondContact O-N 2.96Å; E344-F348 VanDerWaalsContact O-N 3.08Å; Q345-F348 PolarHBondContact O-N 2.89Å; I346-F348 VanDerWaalsContact C-N 3.33Å; I346-F348 PolarHBondContact O-N 2.92Å; F348-K350 PolarHBondContact O-N 3.46Å; F348-L351 PolarHBondContact O-N 3.2Å; F348-L351 VanDerWaalsContact O-N 3.12Å; F348-F352 HydrophobicContact CB-CD2 4.47Å; F348-F352 HydrophobicContact CD1-CD2 4.46Å; F348-F352 AromaticContact CD1-CE2 3.85Å; F348-F352 HydrophobicContact CD1-CE2 3.85Å; F348-F352 VanDerWaalsContact O-CD2 3.25Å; F348-F352 WeakPolarHBondContact O-CD2 3.49Å; F348-F352 PolarHBondContact O-N 3.48Å
349I88.8Confident91.8Very high10 Ų1073.9 Ų73.95%0.05136%0.362CS..Hα-helixtrans-55.3-44176.1-73.9164.5000110.7I175 M252 Q345 I346 G353 M354 A355I175-I349 HydrophobicContact CD1-CD1 4.5Å; I175-I349 HydrophobicContact CG2-CD1 3.89Å; I175-I349 HydrophobicContact CG2-CG1 4.5Å; I175-I349 HydrophobicContact CG2-CG2 3.93Å; M252-I349 HydrophobicContact CG-CD1 3.64Å; M252-I349 HydrophobicContact SD-CD1 3.99Å; Q345-I349 WeakPolarHBondContact O-CG1 3.29Å; Q345-I349 PolarHBondContact O-N 3.32Å; I346-I349 PolarHBondContact O-N 2.73Å; I349-G353 PolarHBondContact O-N 3.46Å; I349-M354 HydrophobicContact CG2-CB 4.08Å; I349-M354 PolarHBondContact O-N 3.38Å; I349-A355 HydrophobicContact CG2-CB 3.75Å
350K90.2Very high91.6Very high100 Ų10075.5 Ų75.544%0.43537%0.37SS..Hα-helixtrans-63.3-48.4175.8-173.6-177173.3-177.50111.7I346 Q347 F348 F352 G353 I357 L366I346-K350 WeakPolarHBondContact O-CB 3.44Å; I346-K350 PolarHBondContact O-N 3.43Å; Q347-K350 PolarHBondContact O-N 3.42Å; F348-K350 PolarHBondContact O-N 3.46Å; K350-F352 VanDerWaalsContact C-N 3.34Å; K350-F352 PolarHBondContact O-N 3.33Å; K350-G353 PolarHBondContact O-N 2.86Å; K350-G353 VanDerWaalsContact O-N 3.15Å; K350-I357 HydrophobicContact CB-CG1 3.78Å; K350-I357 HydrophobicContact CD-CG1 4.26Å; K350-I357 HydrophobicContact CG-CG1 3.92Å; K350-L366 HydrophobicContact CD-CD1 4Å
351L91.2Very high91.4Very high133 Ų13367.5 Ų67.570%0.69634%0.34SS*.Hα-helixtrans-62.9-39.6-175.2-177.663.3000112.3Q347 F348 G353Q347-L351 WeakPolarHBondContact O-CB 3.25Å; Q347-L351 PolarHBondContact O-N 3.19Å; F348-L351 PolarHBondContact O-N 3.2Å; F348-L351 VanDerWaalsContact O-N 3.12Å; L351-G353 VanDerWaalsContact C-N 3.31Å
352F89.9Confident91.2Very high137 Ų13767 Ų6760%0.60134%0.338SS*.THydrogen-bonded Turntrans-86.51.2178-69.3-69.6000113.8F348 K350 M354F348-F352 HydrophobicContact CB-CD2 4.47Å; F348-F352 HydrophobicContact CD1-CD2 4.46Å; F348-F352 AromaticContact CD1-CE2 3.85Å; F348-F352 HydrophobicContact CD1-CE2 3.85Å; F348-F352 VanDerWaalsContact O-CD2 3.25Å; F348-F352 WeakPolarHBondContact O-CD2 3.49Å; F348-F352 PolarHBondContact O-N 3.48Å; K350-F352 VanDerWaalsContact C-N 3.34Å; K350-F352 PolarHBondContact O-N 3.33Å; F352-M354 VanDerWaalsContact C-N 3.25Å; F352-M354 HydrophobicContact CB-CE 3.95Å; F352-M354 HydrophobicContact CB-CG 4.05Å; F352-M354 HydrophobicContact CG-CE 4.37Å; F352-M354 PolarHBondContact O-N 2.94Å
353G86.6Confident90.9Very high62 Ų6271 Ų7164%0.63936%0.356SS*.THydrogen-bonded Turntrans65.726.1178.500000114I349 K350 L351 A355I349-G353 PolarHBondContact O-N 3.46Å; K350-G353 PolarHBondContact O-N 2.86Å; K350-G353 VanDerWaalsContact O-N 3.15Å; L351-G353 VanDerWaalsContact C-N 3.31Å; G353-A355 VanDerWaalsContact C-N 3.33Å
354M85.5Confident90.9Very high122 Ų12270.7 Ų70.760%0.60135%0.354SS*.SBendtrans-72.2-27.7-178.1-65.8-176.8-178.600112.5I349 F352I349-M354 HydrophobicContact CG2-CB 4.08Å; I349-M354 PolarHBondContact O-N 3.38Å; F352-M354 VanDerWaalsContact C-N 3.25Å; F352-M354 HydrophobicContact CB-CE 3.95Å; F352-M354 HydrophobicContact CB-CG 4.05Å; F352-M354 HydrophobicContact CG-CE 4.37Å; F352-M354 PolarHBondContact O-N 2.94Å
355A85.7Confident90.7Very high15 Ų1566.6 Ų66.612%0.12434%0.336CS..SBendtrans-148.9151.4173.100000110.8I175 I349 G353 I357I175-A355 HydrophobicContact CG2-CB 3.85Å; I349-A355 HydrophobicContact CG2-CB 3.75Å; G353-A355 VanDerWaalsContact C-N 3.33Å; A355-I357 PolarHBondContact O-N 2.98Å
356K87.4Confident90.5Very high199 Ų19966.3 Ų66.387%0.86534%0.335SS*.  trans-79.6114.5174-174.7-178177.2-175.40109.5
357I90.1Very high89.9Confident19 Ų1967.9 Ų67.910%0.09735%0.352CS..  trans-81.6126.5174.3-53.3-52.8000109.5I346 K350 A355 L361 L366I346-I357 HydrophobicContact CG2-CD1 4.02Å; K350-I357 HydrophobicContact CB-CG1 3.78Å; K350-I357 HydrophobicContact CD-CG1 4.26Å; K350-I357 HydrophobicContact CG-CG1 3.92Å; A355-I357 PolarHBondContact O-N 2.98Å; I357-L361 HydrophobicContact CG2-CB 3.66Å; I357-L361 HydrophobicContact CG2-CD2 4.33Å; I357-L366 HydrophobicContact CG2-CD1 4.08Å
358D92.9Very high88.8Confident51 Ų5165.8 Ų65.827%0.27336%0.358SS..  trans-68.9152.2176.7-169.3-91.1000111.5K183 L360 L361 Q362K183-D358 HydrophobicContact CD-CB 3.97Å; K183-D358 VanDerWaalsContact CE-CG 3.47Å; K183-D358 WeakPolarHBondContact CE-OD1 2.96Å; K183-D358 VanDerWaalsContact CE-OD2 3.28Å; K183-D358 WeakPolarHBondContact CE-OD2 3.46Å; K183-D358 HydrophobicContact CG-CB 4.43Å; K183-D358 IonicContact NZ-OD1 2.87Å; K183-D358 IonicContact NZ-OD2 2.7Å; K183-D358 PolarHBondContact NZ-OD2 2.74Å; D358-L360 PolarHBondContact O-N 3.45Å; D358-L360 WeakPolarHBondContact OD1-CB 3.16Å; D358-L360 PolarHBondContact OD1-N 2.89Å; D358-L361 HydrophobicContact CB-CD1 4.17Å; D358-L361 PolarHBondContact O-N 3.22Å; D358-L361 VanDerWaalsContact O-N 3.15Å; D358-Q362 PolarHBondContact O-N 2.8Å
359N92.4Very high86.6Confident124 Ų12466.2 Ų66.266%0.66337%0.372SS*.Hα-helixtrans-59.2-34.8-179.7-66-17.9000112Q362 E363N359-Q362 WeakPolarHBondContact O-CB 3.48Å; N359-Q362 PolarHBondContact O-N 3.03Å; N359-E363 WeakPolarHBondContact O-CG 3.44Å; N359-E363 PolarHBondContact O-N 3.46Å
360L92.7Very high84.2Confident36 Ų3671.1 Ų71.119%0.18841%0.414CS..Hα-helixtrans-64.6-44.8177.5-174.165.7000111.7K183 L186 L187 D358 Q362 E363 M364K183-L360 HydrophobicContact CG-CD2 4.34Å; L186-L360 HydrophobicContact CB-CD2 3.88Å; L186-L360 HydrophobicContact CB-CG 4.33Å; L186-L360 HydrophobicContact CD1-CG 4.27Å; L187-L360 HydrophobicContact CD2-CD2 3.63Å; L187-L360 HydrophobicContact CG-CD2 3.77Å; D358-L360 PolarHBondContact O-N 3.45Å; D358-L360 WeakPolarHBondContact OD1-CB 3.16Å; D358-L360 PolarHBondContact OD1-N 2.89Å; L360-Q362 VanDerWaalsContact C-N 3.27Å; L360-Q362 PolarHBondContact O-N 3.37Å; L360-E363 PolarHBondContact O-N 2.78Å; L360-M364 HydrophobicContact CD1-CG 4.07Å; L360-M364 HydrophobicContact CD1-SD 3.53Å; L360-M364 VanDerWaalsContact CD1-SD 3.53Å; L360-M364 HydrophobicContact CG-SD 3.98Å; L360-M364 WeakPolarHBondContact O-CB 3.16Å; L360-M364 WeakPolarHBondContact O-CG 3.35Å; L360-M364 PolarHBondContact O-N 3.49Å
361L92.3Very high81.5Confident1 Ų170.9 Ų70.91%0.00543%0.425CS..Hα-helixtrans-62-40.4174.6-87.271.4000110.6C179 M182 K183 L186 I357 D358 L365 L366C179-L361 HydrophobicContact CB-CD2 4.33Å; M182-L361 HydrophobicContact CB-CD2 4.1Å; M182-L361 HydrophobicContact CB-CG 4.44Å; K183-L361 HydrophobicContact CB-CD1 3.45Å; K183-L361 VanDerWaalsContact CB-CD1 3.45Å; K183-L361 HydrophobicContact CG-CD1 4.04Å; L186-L361 HydrophobicContact CD1-CD1 4.07Å; L186-L361 HydrophobicContact CD1-CG 4.18Å; I357-L361 HydrophobicContact CG2-CB 3.66Å; I357-L361 HydrophobicContact CG2-CD2 4.33Å; D358-L361 HydrophobicContact CB-CD1 4.17Å; D358-L361 PolarHBondContact O-N 3.22Å; D358-L361 VanDerWaalsContact O-N 3.15Å; L361-L365 HydrophobicContact CB-CD1 4.26Å; L361-L365 HydrophobicContact CD2-CD1 4.48Å; L361-L365 HydrophobicContact CG-CD1 3.93Å; L361-L365 VanDerWaalsContact O-CB 3.29Å; L361-L365 WeakPolarHBondContact O-CB 3.32Å; L361-L365 PolarHBondContact O-N 3.09Å; L361-L366 PolarHBondContact O-N 2.95Å
362Q93.1Very high78.9Confident35 Ų3572.4 Ų72.416%0.16443%0.434CS..Hα-helixtrans-58.6-52.7176.9-179.458.946.100110.8D358 N359 L360 L366 G367D358-Q362 PolarHBondContact O-N 2.8Å; N359-Q362 WeakPolarHBondContact O-CB 3.48Å; N359-Q362 PolarHBondContact O-N 3.03Å; L360-Q362 VanDerWaalsContact C-N 3.27Å; L360-Q362 PolarHBondContact O-N 3.37Å; Q362-L366 CarbonylContact O-C 3.45Å; Q362-L366 PolarHBondContact O-N 2.95Å; Q362-G367 PolarHBondContact NE2-O 3.25Å; Q362-G367 CarbonylContact O-C 3.52Å; Q362-G367 PolarHBondContact O-N 2.98Å; Q362-G367 VanDerWaalsContact O-N 3.08Å
363E92.4Very high75.9Confident93 Ų9369.1 Ų69.144%0.43543%0.432SS..Hα-helixtrans-68.1-36.3-175.4-72.8-175.8-153.900113.6R212 N359 L360R212-E363 IonicContact NH2-OE2 3.48Å; R212-E363 PolarHBondContact NH2-OE2 2.88Å; N359-E363 WeakPolarHBondContact O-CG 3.44Å; N359-E363 PolarHBondContact O-N 3.46Å; L360-E363 PolarHBondContact O-N 2.78Å
364M93.7Very high73.4Confident17 Ų1771.5 Ų71.58%0.08444%0.436CS..Hα-helixtrans-94.4-28.3-173.6-63.5-172.372.200114.3L186 L189 L211 A215 L360L186-M364 HydrophobicContact CB-SD 4.11Å; L186-M364 HydrophobicContact CD1-CB 4.1Å; L186-M364 HydrophobicContact CD1-SD 4.25Å; L186-M364 HydrophobicContact CD2-CB 4.34Å; L186-M364 HydrophobicContact CD2-CE 4.04Å; L186-M364 HydrophobicContact CD2-SD 4.15Å; L186-M364 HydrophobicContact CG-SD 4.4Å; L189-M364 HydrophobicContact CD2-CE 4.41Å; L211-M364 HydrophobicContact CB-CE 4.09Å; L211-M364 WeakPolarHBondContact O-CE 3.5Å; A215-M364 HydrophobicContact CB-CB 4.05Å; A215-M364 HydrophobicContact CB-CE 4.31Å; A215-M364 WeakPolarHBondContact CB-O 3.24Å; L360-M364 HydrophobicContact CD1-CG 4.07Å; L360-M364 HydrophobicContact CD1-SD 3.53Å; L360-M364 VanDerWaalsContact CD1-SD 3.53Å; L360-M364 HydrophobicContact CG-SD 3.98Å; L360-M364 WeakPolarHBondContact O-CB 3.16Å; L360-M364 WeakPolarHBondContact O-CG 3.35Å; L360-M364 PolarHBondContact O-N 3.49Å
365L90.4Very high70.8Confident15 Ų1573.8 Ų73.88%0.07945%0.445CS..Hα-helixtrans-112.5-41.9-175.6-66.9160.9000113.6M182 L186 A215 G216 L219 L361M182-L365 HydrophobicContact CE-CD1 3.53Å; L186-L365 HydrophobicContact CD1-CD1 4.06Å; L186-L365 HydrophobicContact CD1-CG 4.38Å; A215-L365 HydrophobicContact CB-CD2 4.09Å; G216-L365 VanDerWaalsContact N-CD2 3.33Å; L219-L365 HydrophobicContact CD1-CD1 3.86Å; L219-L365 HydrophobicContact CD1-CD2 4Å; L219-L365 HydrophobicContact CD1-CG 4.44Å; L361-L365 HydrophobicContact CB-CD1 4.26Å; L361-L365 HydrophobicContact CD2-CD1 4.48Å; L361-L365 HydrophobicContact CG-CD1 3.93Å; L361-L365 VanDerWaalsContact O-CB 3.29Å; L361-L365 WeakPolarHBondContact O-CB 3.32Å; L361-L365 PolarHBondContact O-N 3.09Å
366L88.7Confident68.1Low29 Ų2978.9 Ų78.915%0.15247%0.474CS..SBendtrans-96.7-1.7-172.8-55-173.5000112.8I343 I346 Q347 K350 I357 L361 Q362I343-L366 HydrophobicContact CG2-CD2 4.01Å; I346-L366 HydrophobicContact CB-CD2 4.36Å; I346-L366 HydrophobicContact CG2-CD1 4.08Å; I346-L366 HydrophobicContact CG2-CD2 3.96Å; I346-L366 HydrophobicContact CG2-CG 4.44Å; Q347-L366 HydrophobicContact CG-CD2 3.79Å; K350-L366 HydrophobicContact CD-CD1 4Å; I357-L366 HydrophobicContact CG2-CD1 4.08Å; L361-L366 PolarHBondContact O-N 2.95Å; Q362-L366 CarbonylContact O-C 3.45Å; Q362-L366 PolarHBondContact O-N 2.95Å
367G80.8Confident65.4Low35 Ų3577.9 Ų77.936%0.36147%0.473SS..  trans80.9157.8-174.800000113.4Q362Q362-G367 PolarHBondContact NE2-O 3.25Å; Q362-G367 CarbonylContact O-C 3.52Å; Q362-G367 PolarHBondContact O-N 2.98Å; Q362-G367 VanDerWaalsContact O-N 3.08Å
368G67.5Low62.5Low58 Ų5885.5 Ų85.560%0.59851%0.508SS*.  trans-61.9140.2171.800000110.8A370G368-A370 PolarHBondContact O-N 3.15Å; G368-A370 VanDerWaalsContact O-N 3.17Å
369S45.8Very low59.7Low100 Ų10088.8 Ų88.870%0.69953%0.531SS*.  trans-54.2124.5165.8490000108.1S371S369-S371 PolarHBondContact O-N 2.95Å
370A38.9Very low56.6Low113 Ų11391 Ų9193%0.93454%0.543SS*.SBendtrans-59.686.4168.400000109.2G368G368-A370 PolarHBondContact O-N 3.15Å; G368-A370 VanDerWaalsContact O-N 3.17Å
371S34.2Very low53.6Low95 Ų9597.8 Ų97.866%0.66457%0.573SS**  trans-116.6-2166.9-169.50000112.1S369 A373S369-S371 PolarHBondContact O-N 2.95Å; S371-A373 VanDerWaalsContact C-N 3.28Å; S371-A373 PolarHBondContact O-N 3.38Å
372D35.2Very low51Low165 Ų165102.5 Ų102.588%0.88260%0.603SS**  trans-89.872.9167.3-70.6-24.7000109.2
373A28.2Very low48.1Very low68 Ų68110 Ų11056%0.56264%0.638SS**  trans-64.4131.1150.700000106.8S371 H375S371-A373 VanDerWaalsContact C-N 3.28Å; S371-A373 PolarHBondContact O-N 3.38Å; A373-H375 PolarHBondContact O-N 3.09Å
374P34.3Very low45.2Very low112 Ų112112.7 Ų112.773%0.72766%0.655SS**  trans-64.8111.6173.826.2-30000107.3T376P374-T376 PolarHBondContact O-N 2.74Å
375H29.4Very low42.1Very low169 Ų169119.1 Ų119.178%0.78269%0.686SS**  trans-63.885.6165-70.8-60.2000108.1A373 H377A373-H375 PolarHBondContact O-N 3.09Å; H375-H377 VanDerWaalsContact C-N 3.29Å; H375-H377 PolarHBondContact O-N 3.31Å
376T30.4Very low39.2Very low122 Ų122125.7 Ų125.775%0.74872%0.716SS**  trans-64.995.8160.946.70000107P374 H378P374-T376 PolarHBondContact O-N 2.74Å; T376-H378 VanDerWaalsContact C-N 3.33Å; T376-H378 PolarHBondContact O-N 3Å
377H30Very low36.2Very low179 Ų179132.2 Ų132.283%0.82975%0.746SS**  trans-62.598.1162.6-80-82.5000108.1H375H375-H377 VanDerWaalsContact C-N 3.29Å; H375-H377 PolarHBondContact O-N 3.31Å
378H30.1Very low33.8Very low179 Ų179137.3 Ų137.383%0.82976%0.76SS**PPolyproline II helixtrans-94.7121.9164-125.622.6000108.2T376T376-H378 VanDerWaalsContact C-N 3.33Å; T376-H378 PolarHBondContact O-N 3Å
379P33Very low32Very low119 Ų119143.3 Ų143.377%0.77378%0.775SS**PPolyproline II helixtrans-74.2131.817628.2-29.4000110
380L27.4Very low31.2Very low172 Ų172142.1 Ų142.190%0.90178%0.779SS**PPolyproline II helixtrans-55.4131.8174.6-72.2150.2000111.8
381H30Very low30.9Very low178 Ų178143 Ų14382%0.82477%0.773SS**  trans-142.8136.1144.1-137.4-90.5000109.9
382P37.3Very low30.7Very low99 Ų99146 Ų14664%0.64378%0.781SS**  trans-94.8138.3-16634.6-28.5000111.6
383H33Very low30.5Very low192 Ų192144 Ų14489%0.88978%0.775SS**  trans-149132.3148.5-96.5-60.2000111.5
384L31.6Very low30.7Very low150 Ų150148.4 Ų148.479%0.78579%0.787SS**  trans-63.4143.1180-68.1130.6000112.8
385M29Very low30.6Very low153 Ų153148.8 Ų148.875%0.75479%0.788SS**  162.7107.2114.8-79.6-89.883.800110.7
386Q28.3Very low30.5Very low152 Ų152145.4 Ų145.471%0.7179%0.788SS**  21.2121.1128.7-161.2151.8-4.800119.1
387E26.8Very low30.3Very low167 Ų167146.5 Ų146.578%0.7879%0.79SS**  179.1132.4111.5-89.5-151.6144.300114.7
388H29.2Very low30.3Very low141 Ų141145 Ų14565%0.65379%0.793SS**  trans37.2116.5143.1-61.8-64000124.8
389M29.9Very low30.2Very low184 Ų184144.9 Ų144.991%0.90680%0.795SS**  35127.8123.5-61-106.111600120.5
390G29.1Very low31.2Very low76 Ų76144.3 Ų144.378%0.78479%0.792SS**  trans175.491158.900000115
391T32.2Very low31.3Very low130 Ų130141.4 Ų141.480%0.79879%0.786SS**  trans-50.5139.2161.3-27.90000111
392N31.2Very low31.2Very low158 Ų158140.6 Ų140.685%0.84578%0.782SS**  trans-172.1128.1135.8-90.8-28.1000113
393V31Very low30.7Very low124 Ų124143.2 Ų143.275%0.75279%0.79SS**  trans-84.6135.2166.3169.40000108.1V395V393-V395 HydrophobicContact CG1-CG2 4.4Å
394I32.4Very low30.4Very low160 Ų160138.5 Ų138.582%0.82178%0.779SS**  trans-136.6119.3158.4-58.6-178.2000109.3
395V32.3Very low30.2Very low121 Ų121139.5 Ų139.573%0.73378%0.784SS**  trans-94.2140165.6173.90000107.7V393V393-V395 HydrophobicContact CG1-CG2 4.4Å
396A26.2Very low30.1Very low97 Ų97135.7 Ų135.780%0.80279%0.785SS**  trans-148.9115157.400000111.8
397N26.6Very low30Very low145 Ų145138.1 Ų138.178%0.77580%0.796SS**  trans-64.9153.2160.2-85.2-16.4000111.1
398T29.5Very low29.9Very low147 Ų147138 Ų13890%0.90280%0.798SS**  -174.7132.4122.722.30000111.7
399M27.5Very low29.8Very low177 Ų177136.4 Ų136.487%0.87280%0.801SS**  trans-103-169171.5-77.3-83.8-169.200108.5
400P55.4Low29.6Very low107 Ų107136.8 Ų136.870%0.69580%0.8SS**  -134-175.5-65.540.1-23.6000111.4
401S27.9Very low29.5Very low111 Ų111144.8 Ų144.878%0.77681%0.807SS**  trans162.9150.9150.640.50000109.5
402H28.2Very low29.5Very low162 Ų162144.1 Ų144.175%0.7581%0.805SS**  cis-169.9160.6-17.9-129.7-92.7000105.4
403L27.1Very low29.6Very low154 Ų154148.1 Ų148.181%0.80681%0.808SS**  trans72.6147.7158.6-61147.1000117.6
404S27Very low29.8Very low93 Ų93148.3 Ų148.365%0.6581%0.812SS**  cis179.5139.8-28.6500000105.5
405N27.8Very low29.7Very low170 Ų170152.7 Ų152.791%0.90982%0.818SS**  trans53.3126.1156.1-89.76.7000121.1
406G25.5Very low29.5Very low74 Ų74150.4 Ų150.476%0.76382%0.819SS**  134117.7124.800000116.1
407Q27.1Very low29.6Very low203 Ų203155.5 Ų155.595%0.94983%0.826SS**  trans96.6125.6144-121.1161.7-16.600119.2
408M25.4Very low29.8Very low165 Ų165153.6 Ų153.681%0.81383%0.831SS**  trans-77.1167.8179.2-62.2172.462.300112.7
409C25.5Very low29.7Very low106 Ų106151.6 Ų151.672%0.71683%0.829SS**  trans85.7110.4153.2-59.90000117.1
410E25.8Very low30.1Very low192 Ų192149.8 Ų149.890%0.89783%0.828SS**  -173.4128.8102.8-99.8179.8161.700111.6
411W26.9Very low29.1Very low245 Ų245150.4 Ų150.493%0.92883%0.832SS**PPolyproline II helixtrans-82.4135.3168.1-81.588.7000109.8
412P32.3Very low29.3Very low116 Ų116154.7 Ų154.775%0.75384%0.84SS**PPolyproline II helixtrans-82.4120165.90.317.6000110.2
413R34.8Very low29.6Very low241 Ų241153.4 Ų153.491%0.90984%0.844SS**PPolyproline II helixtrans-66.3142.4161.9-71-178179.3-167.30.2110.4
414P34Very low29.9Very low128 Ų128152 Ų15283%0.83184%0.844SS**PPolyproline II helixtrans-90.2132.1155-2.822000110.8
415R30.9Very low30.2Very low252 Ų252156.5 Ų156.595%0.95186%0.855SS**PPolyproline II helixtrans-63.4138.4163.8-90.9-178.7177.1-164.5-0.8109.9
416G27.9Very low30.5Very low73 Ų73154 Ų15475%0.75385%0.848SS**PPolyproline II helixtrans-75.9160.4173.100000114
417Q28.8Very low30.8Very low204 Ų204156 Ų15695%0.95385%0.85SS**  trans-144.2138.3149.5-96.2176.919.300108.4
418A29.8Very low31.4Very low105 Ų105152 Ų15287%0.86884%0.841SS**  trans-86.4144.3-174.500000111.7
419A28.9Very low32Very low105 Ų105150.6 Ų150.687%0.86885%0.845SS**  trans-158.8123152.100000109.5
420T34.7Very low32.3Very low139 Ų139151.4 Ų151.485%0.85385%0.852SS**PPolyproline II helixtrans-86.4163.2174.637.80000111.7
421P35.6Very low32.4Very low121 Ų121145.7 Ų145.779%0.78685%0.845SS**PPolyproline II helixtrans-95.1150.3-156.136.3-32.2000114.4
422E31.9Very low32.6Very low200 Ų200140.2 Ų140.294%0.93584%0.844SS**PPolyproline II helixtrans-96.9133.1169-70.4-163.9138.700111.8
423T34Very low32.3Very low135 Ų135138.3 Ų138.383%0.82885%0.845SS**PPolyproline II helixtrans-90.9139.5176.2-18.50000110.1
424P33Very low32Very low126 Ų126132.2 Ų132.282%0.81884%0.839SS**PPolyproline II helixtrans-87138.4176.731.4-30.1000113
425Q33.9Very low31.7Very low187 Ų187134 Ų13487%0.87484%0.837SS**PPolyproline II helixtrans-88.9159.2170.8-90.7-170.9-6000112.8
426P33.8Very low31.5Very low118 Ų118127.9 Ų127.977%0.76683%0.833SS**PPolyproline II helixtrans-94165.6-17437.8-33.1000113.7
427S31.6Very low31.4Very low115 Ų115134 Ų13480%0.80483%0.834SS**  trans-135.7165.3173.3-49.60000109.8
428P39.3Very low31.3Very low118 Ų118134.7 Ų134.777%0.76684%0.835SS**  -105.4-178.9-121.69.616.2000114.1
429P38.4Very low31.2Very low136 Ų136136.8 Ų136.888%0.88383%0.83SS**  trans-86.9141.1-175.834.9-31000112.3
430S32.2Very low31Very low123 Ų123138.8 Ų138.886%0.8683%0.826SS**  trans-129.5116.6165.551.40000109
431G28.2Very low31.1Very low73 Ų73137.9 Ų137.975%0.75382%0.822SS**  trans-106.9147.3166.700000110.8
432S31.1Very low30.6Very low129 Ų129135.9 Ų135.990%0.90282%0.823SS**  157.2135.6121.764.60000113.2
433G26Very low30.4Very low77 Ų77131 Ų13179%0.79482%0.817SS**  trans90.3139.4156.100000116.5
434S28.2Very low30.2Very low112 Ų112132.2 Ų132.278%0.78382%0.817SS**  cis-174.4137.5-1.439.20000108.9
435E27.3Very low29.9Very low165 Ų165132.9 Ų132.977%0.77182%0.819SS**  trans35.7133.7150.5-59.3-172.8134.900123.6
436S27Very low29.7Very low125 Ų125129.8 Ų129.887%0.87481%0.813SS**  -170.4117.9120.6-770000112.1
437Y25.3Very low29.4Very low200 Ų200132.1 Ų132.178%0.78482%0.817SS**  trans-79.7139174-69.8-97.5000111.9
438K27.6Very low29.2Very low220 Ų220133 Ų13396%0.95782%0.817SS**  trans-140.4132.3148.2-81.6-167.6178.7177.80110.7
439L26.6Very low28.9Very low149 Ų149136.2 Ų136.278%0.7882%0.819SS**  trans-101.7136.2-176.1-87.1147.9000111.9
440L24.9Very low28.6Very low147 Ų147135.3 Ų135.377%0.7781%0.814SS**  trans65.6164.2142.4-10176.3000121.5
441P36.4Very low28.7Very low119 Ų119135.6 Ų135.677%0.77381%0.812SS**  cis-141.3162-10.828.4-5.8000118.2
442G26Very low29Very low79 Ų79137.3 Ų137.381%0.81481%0.813SS**  109.4110.2128.100000120
443A27.7Very low29.1Very low97 Ų97136 Ų13680%0.80281%0.81SS**  trans-176.697.3135.900000112.5
444I30.3Very low29.5Very low162 Ų162140 Ų14083%0.83181%0.811SS**  trans27.2111.1137.5-49.1172.5000118.6
445T27Very low29.7Very low139 Ų139140.3 Ų140.385%0.85381%0.811SS**PPolyproline II helixtrans-92.3121.5161.58.10000110.6
446T28.2Very low30Very low123 Ų123141.6 Ų141.676%0.75582%0.816SS**PPolyproline II helixtrans-96.3122.4165.733.10000110.1
447I28.3Very low30.3Very low166 Ų166141.2 Ų141.285%0.85181%0.811SS**PPolyproline II helixtrans-83118.8175.1-65.7167.8000108.1
448V28.3Very low30.7Very low133 Ų133138.5 Ų138.581%0.80682%0.816SS**PPolyproline II helixtrans-96.2125170178.80000109.2
449K31.8Very low31.1Very low187 Ų187135.7 Ų135.781%0.81381%0.81SS**PPolyproline II helixtrans-81.1141.2179.8-150.3176.6-173-179.80109.6
450P32.7Very low31.4Very low117 Ų117134.8 Ų134.876%0.7681%0.81SS**PPolyproline II helixtrans-76.6143.6177.629.5-32000111.5
451P34.7Very low31.8Very low129 Ų129137.8 Ų137.884%0.83882%0.817SS**PPolyproline II helixtrans-77.5144.8178.329.4-31.5000112.7
452S33.4Very low31.7Very low109 Ų109141.3 Ų141.376%0.76282%0.823SS**PPolyproline II helixtrans-65.6150.4179.5460000114.3
453A33.5Very low32.2Very low101 Ų101146.9 Ų146.984%0.83583%0.828SS**PPolyproline II helixtrans-48.2141.5173.200000114.4
454I33.8Very low32.5Very low162 Ų162146.7 Ų146.783%0.83183%0.827SS**  trans-105.2144168.5-64.4176000108.3
455P33.9Very low33.1Very low118 Ų118150.7 Ų150.777%0.76685%0.847SS**PPolyproline II helixtrans-79.9147.8-164.5-6.424.9000113.7
456Q33.5Very low33.4Very low191 Ų191151.3 Ų151.389%0.89385%0.847SS**PPolyproline II helixtrans-69142.1169.2-71.9-175.4-3000111.8
457P33.4Very low33.7Very low117 Ų117152.7 Ų152.776%0.7685%0.851SS**PPolyproline II helixtrans-84.7132.5165.831.6-28.3000111.3
458T33.5Very low34Very low144 Ų144152 Ų15288%0.88385%0.851SS**PPolyproline II helixtrans-65.4120.5172.41.40000110.7
459I36.2Very low34.3Very low161 Ų161153.1 Ų153.183%0.82685%0.854SS**  trans-98.4115.8167.6-63.7176.8000108.5
460T32.8Very low34.4Very low129 Ų129151 Ų15179%0.79186%0.857SS**  trans-64.9130.8169.631.30000111.2Q462T460-Q462 PolarHBondContact O-N 2.96Å
461K33.6Very low34.6Very low211 Ų211153.3 Ų153.392%0.91786%0.863SS**  trans-62.4123.6166.9-74.7-179.9173.3-177.90109.6
462Q33.8Very low34.6Very low193 Ų193155 Ų15590%0.90287%0.865SS**  trans-105.2117.6160.4-113.8172-6.400107.9T460T460-Q462 PolarHBondContact O-N 2.96Å
463E35.1Very low34.6Very low195 Ų195158.5 Ų158.591%0.91187%0.873SS**  trans-72.2135.4162.1-69.9173.5143.800108.8
464A35Very low34.7Very low94 Ų94163.3 Ų163.378%0.77788%0.876SS**  trans-147.6110.3158.900000108.8
465I42.3Very low34.8Very low245 Ų245163.5 Ų163.5100%1.25688%0.88SS**  trans24.50138.5-53.3176.1000117.1

Retrieved 465 of 465 residues in 411.2 ms (Link to these results)