A0A096NJW5_PAPAN Loading...

CDC42 effector protein 1

AlphaFold DB , UniProt , Accession A0A096NJW5, Species PAPAN (Papio anubis, Olive baboon), Gene CDC42EP1, Length 398 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
1M51.8Low52.6Low234 Ų234116.2 Ų116.2100%1.15383%0.834SS**  0130.40-78.2-79.3111.400107.5
2P54.1Low52.9Low124 Ų124117.7 Ų117.781%0.80583%0.833SS**  cis-109.3-173.6-15.938.6-25.5000112.1
3G49.8Very low53Low65 Ų65121.5 Ų121.567%0.6783%0.832SS**  trans-81.8-171.8165.300000112.5
4P57.6Low53.3Low134 Ų134120.9 Ų120.987%0.8783%0.829SS**  -142.9173.583.739.1-24.2000116.8
5Q55.4Low53.6Low196 Ų196123.9 Ų123.992%0.91683%0.832SS**  trans-62.4154.9177.1-62.9139.541.700113.6
6G48.1Very low53.3Low77 Ų77119.7 Ų119.779%0.79482%0.816SS**  trans-16580.2168.500000110.7G8G6-G8 PolarHBondContact O-N 3.39Å
7G50.2Low53.8Low83 Ų83124.6 Ų124.686%0.85682%0.82SS**  trans-69.9114.8-177.800000112.2G9G7-G9 VanDerWaalsContact C-N 3.33Å; G7-G9 PolarHBondContact O-N 3.36Å
8G48.8Very low54Low84 Ų84127 Ų12787%0.86682%0.824SS**  trans-71.585.5169.800000111G6G6-G8 PolarHBondContact O-N 3.39Å
9G48.9Very low54.1Low70 Ų70125.6 Ų125.672%0.72282%0.817SS**  trans-64.2139175.900000112G7G7-G9 VanDerWaalsContact C-N 3.33Å; G7-G9 PolarHBondContact O-N 3.36Å
10A58.5Low54.2Low84 Ų84125.1 Ų125.169%0.69481%0.813SS**  trans-61.7148170.600000110.7T12A10-T12 PolarHBondContact O-N 3.46Å
11P55.5Low54.4Low127 Ų127125.9 Ų125.983%0.82582%0.816SS**  trans-69.294.8178.828.8-34.7000110.7M13P11-M13 PolarHBondContact O-N 3.4Å
12T56.2Low54.4Low134 Ų134120.3 Ų120.382%0.82280%0.795SS**  trans-67.3101.6169.255.90000109A10 S14A10-T12 PolarHBondContact O-N 3.46Å; T12-S14 PolarHBondContact O-N 3.34Å
13M54.6Low54.4Low168 Ų168125.5 Ų125.583%0.82880%0.798SS**  trans-64111.6172.8-71.5-122.565.300109.2P11 L15P11-M13 PolarHBondContact O-N 3.4Å; M13-L15 PolarHBondContact O-N 3.44Å
14S56.1Low54.1Low113 Ų113125 Ų12579%0.7979%0.793SS**  trans-62.8103.3171.8-179.10000108.8T12 G16T12-S14 PolarHBondContact O-N 3.34Å; S14-G16 VanDerWaalsContact C-N 3.31Å; S14-G16 PolarHBondContact O-N 3.09Å
15L58.5Low54.1Low165 Ų165123.4 Ų123.486%0.86479%0.785SS**  trans-67.296.4166.5-74.4172.9000107.5M13 K17M13-L15 PolarHBondContact O-N 3.44Å; L15-K17 PolarHBondContact O-N 3.28Å
16G49.2Very low53.8Low57 Ų57117.8 Ų117.859%0.58877%0.767SS**  trans-51.4129.2175.800000110S14 L18S14-G16 VanDerWaalsContact C-N 3.31Å; S14-G16 PolarHBondContact O-N 3.09Å; G16-L18 PolarHBondContact O-N 3.4Å
17K61.5Low54.3Low203 Ų203119.5 Ų119.588%0.88377%0.767SS**  trans-57.8106.7178.3-66.4172.8179.3175.70108.6L15 S19L15-K17 PolarHBondContact O-N 3.28Å; K17-S19 PolarHBondContact O-N 3.4Å
18L56.6Low54.7Low168 Ų168121.8 Ų121.888%0.8876%0.756SS**  trans-65.6104.6166.8-67.8177.4000107.2G16G16-L18 PolarHBondContact O-N 3.4Å
19S56.3Low55Low100 Ų100120.8 Ų120.870%0.69975%0.746SS**  trans-52128.6167.8-57.60000108.3K17 V21K17-S19 PolarHBondContact O-N 3.4Å; S19-V21 PolarHBondContact O-N 3.37Å
20P55.8Low55.6Low115 Ų115127.4 Ų127.475%0.74775%0.754SS**  trans-57.9117.6173.8-21.832.5000108.4V22P20-V22 HydrophobicContact CB-CG2 4.4Å; P20-V22 PolarHBondContact O-N 3.05Å
21V59Low56Low143 Ų143131.6 Ų131.687%0.86775%0.752SS**  trans-71.782.5169.41780000106.6S19 W23S19-V21 PolarHBondContact O-N 3.37Å; V21-W23 PolarHBondContact O-N 3.34Å
22V52.5Low56.7Low116 Ų116136 Ų13670%0.70375%0.752SS**  trans-64.7118.2168176.70000106.2P20 G24P20-V22 HydrophobicContact CB-CG2 4.4Å; P20-V22 PolarHBondContact O-N 3.05Å; V22-G24 PolarHBondContact O-N 3.14Å
23W54Low57.8Low234 Ų234135.9 Ų135.989%0.88675%0.746SS**  trans-68.875.8165.9-174.1-89000108.5V21 S25V21-W23 PolarHBondContact O-N 3.34Å; W23-S25 PolarHBondContact O-N 2.86Å
24G42.5Very low58.9Low54 Ų54131 Ų13156%0.55773%0.725SS**  trans-67.2100.617100000107.7V22 S26V22-G24 PolarHBondContact O-N 3.14Å; G24-S26 PolarHBondContact O-N 2.98Å
25S57.1Low59.8Low101 Ų101129.2 Ų129.271%0.70672%0.718SS**  trans-62.387.3165.4-171.80000107.8W23 S27W23-S25 PolarHBondContact O-N 2.86Å; S25-S27 VanDerWaalsContact C-N 3.33Å; S25-S27 PolarHBondContact O-N 3.34Å
26S49.5Very low60.6Low77 Ų77128.8 Ų128.854%0.53872%0.716SS.*  trans-7689.1-173-1690000108.4G24 Q28G24-S26 PolarHBondContact O-N 2.98Å; S26-Q28 PolarHBondContact O-N 2.78Å; S26-Q28 WeakPolarHBondContact OG-CG 3.37Å
27S59.6Low62.4Low114 Ų114131.8 Ų131.880%0.79772%0.717SS**  trans-68.347.9171.6500000112.1S25 G29S25-S27 VanDerWaalsContact C-N 3.33Å; S25-S27 PolarHBondContact O-N 3.34Å; S27-G29 PolarHBondContact O-N 3.3Å
28Q57.4Low63.2Low131 Ų131127.6 Ų127.661%0.61270%0.703SS**  trans-65.6103.4164.8-74.7-66.4-17.800107.9S26 K30S26-Q28 PolarHBondContact O-N 2.78Å; S26-Q28 WeakPolarHBondContact OG-CG 3.37Å; Q28-K30 PolarHBondContact O-N 3.16Å
29G55Low64.3Low63 Ų63123 Ų12365%0.64968%0.684SS**THydrogen-bonded Turntrans-55.2133.3-167.100000112.7S27 R31S27-G29 PolarHBondContact O-N 3.3Å; G29-R31 VanDerWaalsContact C-N 3.31Å; G29-R31 PolarHBondContact O-N 3.17Å; G29-R31 VanDerWaalsContact O-N 3.09Å
30K62.1Low65.4Low209 Ų209123.1 Ų123.191%0.90968%0.683SS**THydrogen-bonded Turntrans46.748.7162.1-56.5171.8-179.5179.60113.6Q28 R32Q28-K30 PolarHBondContact O-N 3.16Å; K30-R32 PolarHBondContact O-N 3.33Å
31R66.6Low66.2Low172 Ų172123.3 Ų123.365%0.64968%0.684SS**  trans-62.592162.4-80-171.5-79.4168.7-5.8108G29 L33G29-R31 VanDerWaalsContact C-N 3.31Å; G29-R31 PolarHBondContact O-N 3.17Å; G29-R31 VanDerWaalsContact O-N 3.09Å; R31-L33 PolarHBondContact O-N 2.98Å
32R70.9Confident67Low219 Ų219122.5 Ų122.583%0.82667%0.674SS**  trans-57.3107-178.5-179.4173.4172-123.66108K30 T34K30-R32 PolarHBondContact O-N 3.33Å; R32-T34 PolarHBondContact O-N 3.43Å; R32-T34 VanDerWaalsContact O-N 3.09Å
33L79.7Confident67.8Low131 Ų131120.4 Ų120.469%0.68668%0.676SS**  trans-56.7114.8-179.6-62.1172.4000108.4R31 M37R31-L33 PolarHBondContact O-N 2.98Å; L33-M37 HydrophobicContact CD2-CE 4.02Å
34T76.8Confident68.6Low65 Ų65114.2 Ų114.240%0.39966%0.661SS.*  trans-84.2152.9170.255.20000109R32 D36 M37R32-T34 PolarHBondContact O-N 3.43Å; R32-T34 VanDerWaalsContact O-N 3.09Å; T34-D36 PolarHBondContact O-N 2.84Å; T34-D36 VanDerWaalsContact O-N 3.17Å; T34-M37 WeakPolarHBondContact O-CB 3.36Å; T34-M37 PolarHBondContact O-N 3.12Å; T34-M37 WeakPolarHBondContact OG1-CG 3.39Å
35A74.3Confident69.2Low77 Ų77119.1 Ų119.164%0.63667%0.667SS**G310 helixtrans-56.2-34.7-17900000112.1M37 I38A35-M37 PolarHBondContact O-N 3.01Å; A35-I38 WeakPolarHBondContact O-CB 3.26Å; A35-I38 PolarHBondContact O-N 3.32Å
36D76.2Confident69.5Low155 Ų155123.9 Ų123.983%0.82967%0.669SS**G310 helixtrans-68.4-14.2179.2-40.6-46.7000113.9T34 I38T34-D36 PolarHBondContact O-N 2.84Å; T34-D36 VanDerWaalsContact O-N 3.17Å; D36-I38 VanDerWaalsContact C-N 3.35Å
37M86.8Confident70.3Confident120 Ų120128.5 Ų128.559%0.59168%0.682SS**G310 helixtrans-85.1-9.9170.9-67176.457.900112.8L33 T34 A35L33-M37 HydrophobicContact CD2-CE 4.02Å; T34-M37 WeakPolarHBondContact O-CB 3.36Å; T34-M37 PolarHBondContact O-N 3.12Å; T34-M37 WeakPolarHBondContact OG1-CG 3.39Å; A35-M37 PolarHBondContact O-N 3.01Å
38I78.9Confident70.5Confident116 Ų116129 Ų12960%0.59568%0.681SS**SBendtrans-97.1111.6174.1-54.2176.1000106.4A35 D36A35-I38 WeakPolarHBondContact O-CB 3.26Å; A35-I38 PolarHBondContact O-N 3.32Å; D36-I38 VanDerWaalsContact C-N 3.35Å
39S79.9Confident70.7Confident70 Ų70130.3 Ų130.349%0.4969%0.689SS.*  trans-57.8143.8175.5540000110.5
40P77.9Confident70.8Confident104 Ų104130.7 Ų130.768%0.67567%0.673SS**  trans-49.9151.9164.6-2433.7000110.6L42P40-L42 PolarHBondContact O-N 3.03Å
41P74.2Confident70.8Confident119 Ų119125.3 Ų125.377%0.77366%0.658SS**  trans-55115.1-179.322.8-33.4000110G43P41-G43 PolarHBondContact O-N 2.95Å
42L75.8Confident70.3Confident125 Ų125119.2 Ų119.265%0.65465%0.649SS**  trans-69.16.7-167.4-77.7153.2000114.4P40 D44P40-L42 PolarHBondContact O-N 3.03Å; L42-D44 WeakPolarHBondContact CB-OD1 3.48Å; L42-D44 PolarHBondContact O-N 2.93Å; L42-D44 VanDerWaalsContact O-N 3.09Å
43G68.9Low69.6Low72 Ų72121.6 Ų121.674%0.74266%0.658SS**SBendtrans67.30-175.400000114.5P41P41-G43 PolarHBondContact O-N 2.95Å
44D70.3Confident68.8Low104 Ų104119.1 Ų119.156%0.55666%0.664SS**  trans-92-8.9-174.471.6-26.8000113.8L42 R46L42-D44 WeakPolarHBondContact CB-OD1 3.48Å; L42-D44 PolarHBondContact O-N 2.93Å; L42-D44 VanDerWaalsContact O-N 3.09Å; D44-R46 PolarHBondContact O-N 2.9Å
45F56.2Low68.2Low158 Ų158118.4 Ų118.469%0.69367%0.67SS**  trans-6762.4169.2-74-80.5000112.4H47F45-H47 PolarHBondContact O-N 2.78Å
46R62.9Low67.6Low201 Ų201119.6 Ų119.676%0.75867%0.665SS**  trans-76.7102163.5-51.2-173.581.1-109.31.7106.1D44 T48D44-R46 PolarHBondContact O-N 2.9Å; R46-T48 VanDerWaalsContact C-N 3.3Å; R46-T48 PolarHBondContact O-N 3.34Å
47H65.2Low66.9Low173 Ų173117.1 Ų117.180%0.80166%0.655SS**  trans-60.593.2171.2-68.3-67.1000109.6F45F45-H47 PolarHBondContact O-N 2.78Å
48T64.6Low65.3Low125 Ų125119.3 Ų119.377%0.76766%0.662SS**  trans-77.6-13173.751.30000112.2R46 H50R46-T48 VanDerWaalsContact C-N 3.3Å; R46-T48 PolarHBondContact O-N 3.34Å; T48-H50 PolarHBondContact O-N 3.4Å
49M61.4Low64.6Low159 Ų159116.5 Ų116.578%0.78366%0.662SS**  trans-76.966.3174.4-164.4164.7-69.200110.9V51M49-V51 HydrophobicContact CG-CG2 3.92Å; M49-V51 PolarHBondContact O-N 2.86Å
50H57.7Low63.7Low71 Ų71118.5 Ų118.533%0.32967%0.667SS.*  trans-66.5107.8158.4165.450.7000108.1T48 G52 G54 G55 D56T48-H50 PolarHBondContact O-N 3.4Å; H50-G52 PolarHBondContact CD2-O 3.44Å; H50-G52 PolarHBondContact CE1-N 2.92Å; H50-G52 VanDerWaalsContact NE2-CA 3.27Å; H50-G52 WeakPolarHBondContact NE2-CA 3.41Å; H50-G52 PolarHBondContact NE2-N 2.97Å; H50-G52 PolarHBondContact NE2-O 2.85Å; H50-G52 PolarHBondContact O-N 3.11Å; H50-G52 VanDerWaalsContact O-N 3.15Å; H50-G54 PolarHBondContact NE2-N 3.42Å; H50-G55 WeakPolarHBondContact CE1-CA 3.3Å; H50-G55 PolarHBondContact CE1-N 2.99Å; H50-G55 PolarHBondContact NE2-N 3.27Å; H50-D56 PolarHBondContact CE1-N 3.33Å; H50-D56 PolarHBondContact CE1-O 3.31Å
51V60.7Low62.8Low95 Ų95117.3 Ų117.358%0.57666%0.658SS**  trans-84.884.6177.7-176.50000109.5M49M49-V51 HydrophobicContact CG-CG2 3.92Å; M49-V51 PolarHBondContact O-N 2.86Å
52G56.6Low62.3Low45 Ų45114 Ų11446%0.46464%0.638SS.*SBendtrans170.9177176.800000111.2H50H50-G52 PolarHBondContact CD2-O 3.44Å; H50-G52 PolarHBondContact CE1-N 2.92Å; H50-G52 VanDerWaalsContact NE2-CA 3.27Å; H50-G52 WeakPolarHBondContact NE2-CA 3.41Å; H50-G52 PolarHBondContact NE2-N 2.97Å; H50-G52 PolarHBondContact NE2-O 2.85Å; H50-G52 PolarHBondContact O-N 3.11Å; H50-G52 VanDerWaalsContact O-N 3.15Å
53R57.6Low61.4Low268 Ų268114.8 Ų114.8100%1.01164%0.636SS**SBendtrans-105.662174.1-164.5-179.31801670.7110.5
54G63Low60.9Low79 Ų79117.4 Ų117.481%0.81463%0.632SS**SBendtrans144.87.9166.800000119.1H50H50-G54 PolarHBondContact NE2-N 3.42Å
55G62.3Low60.7Low51 Ų51116.8 Ų116.853%0.52664%0.636SS.*SBendtrans130.5-1717400000115.4H50 V57H50-G55 WeakPolarHBondContact CE1-CA 3.3Å; H50-G55 PolarHBondContact CE1-N 2.99Å; H50-G55 PolarHBondContact NE2-N 3.27Å; G55-V57 PolarHBondContact O-N 3.2Å
56D63.1Low60.5Low101 Ų101115.5 Ų115.554%0.5464%0.636SS.*  trans-78113.7-178.3-165-3.1000113.9H50 F58H50-D56 PolarHBondContact CE1-N 3.33Å; H50-D56 PolarHBondContact CE1-O 3.31Å; D56-F58 PolarHBondContact O-N 3.35Å; D56-F58 VanDerWaalsContact O-N 3.16Å
57V61.9Low60Low103 Ų103114.8 Ų114.862%0.62464%0.642SS**SBendtrans-69.3-11.1-170.7171.60000113.5G55G55-V57 PolarHBondContact O-N 3.2Å
58F52Low59.2Low166 Ų166110.2 Ų110.273%0.72864%0.641SS**SBendtrans-119.5135.5175.7-73.1-90.1000111.6D56 D60D56-F58 PolarHBondContact O-N 3.35Å; D56-F58 VanDerWaalsContact O-N 3.16Å; F58-D60 PolarHBondContact O-N 3.31Å
59G63.5Low58.1Low57 Ų57107.8 Ų107.859%0.58864%0.641SS**  trans-55.9123.5-17200000113.8T61G59-T61 PolarHBondContact O-N 2.94Å
60D61.9Low57.5Low113 Ų113106.6 Ų106.660%0.60465%0.648SS**  trans9.398.1164.2-169.119000116.7F58 S62F58-D60 PolarHBondContact O-N 3.31Å; D60-S62 PolarHBondContact O-N 3.35Å; D60-S62 VanDerWaalsContact O-N 3.16Å; D60-S62 WeakPolarHBondContact OD1-CB 3.1Å; D60-S62 PolarHBondContact OD1-N 2.98Å; D60-S62 VanDerWaalsContact OD1-N 3.08Å; D60-S62 PolarHBondContact OD1-OG 3.39Å; D60-S62 WeakPolarHBondContact OD2-CB 3.4Å; D60-S62 PolarHBondContact OD2-OG 3.42Å
61T60Low56.7Low78 Ų78108.2 Ų108.248%0.47967%0.667SS.*G310 helixtrans-78.817.3173.8560000113.6G59 F63 L64G59-T61 PolarHBondContact O-N 2.94Å; T61-F63 HydrophobicContact CG2-CE1 4.33Å; T61-F63 PolarHBondContact O-N 2.9Å; T61-L64 WeakPolarHBondContact O-CB 3.26Å; T61-L64 PolarHBondContact O-N 2.97Å
62S62Low56.2Low51 Ų51115.7 Ų115.736%0.35769%0.685SS.*G310 helixtrans-52.6-24.7175.860.50000114.4D60 L64 S65D60-S62 PolarHBondContact O-N 3.35Å; D60-S62 VanDerWaalsContact O-N 3.16Å; D60-S62 WeakPolarHBondContact OD1-CB 3.1Å; D60-S62 PolarHBondContact OD1-N 2.98Å; D60-S62 VanDerWaalsContact OD1-N 3.08Å; D60-S62 PolarHBondContact OD1-OG 3.39Å; D60-S62 WeakPolarHBondContact OD2-CB 3.4Å; D60-S62 PolarHBondContact OD2-OG 3.42Å; S62-L64 PolarHBondContact O-N 3.48Å; S62-S65 WeakPolarHBondContact O-CA 3.42Å; S62-S65 WeakPolarHBondContact O-CB 3.27Å; S62-S65 PolarHBondContact O-N 2.85Å
63F58.3Low55.9Low140 Ų140116.2 Ų116.261%0.61469%0.691SS**G310 helixtrans-62.2-23171.866.9-92.8000113.9T61T61-F63 HydrophobicContact CG2-CE1 4.33Å; T61-F63 PolarHBondContact O-N 2.9Å
64L58.6Low55.1Low127 Ų127109.8 Ų109.867%0.66568%0.682SS**G310 helixtrans-79.7-20.8170.3-60.4-179.6000112.8T61 S62T61-L64 WeakPolarHBondContact O-CB 3.26Å; T61-L64 PolarHBondContact O-N 2.97Å; S62-L64 PolarHBondContact O-N 3.48Å
65S64.7Low54.2Low92 Ų92115.4 Ų115.464%0.64369%0.686SS**THydrogen-bonded Turntrans-76-27.8-176.3-163.20000112.9S62 H67S62-S65 WeakPolarHBondContact O-CA 3.42Å; S62-S65 WeakPolarHBondContact O-CB 3.27Å; S62-S65 PolarHBondContact O-N 2.85Å; S65-H67 PolarHBondContact O-N 3.18Å
66N53.6Low53.4Low130 Ų130123.1 Ų123.170%0.69570%0.7SS**THydrogen-bonded Turntrans-99.522.7-164.5-72-8.2000115.6
67H51.1Low52.8Low187 Ų187121 Ų12187%0.86669%0.692SS**SBendtrans-110.760165.2-72.6-36.9000113.1S65S65-H67 PolarHBondContact O-N 3.18Å
68G48.7Very low52.5Low77 Ų77121.2 Ų121.279%0.79470%0.696SS**SBendtrans102.8101.8144.600000117
69G40.7Very low52.7Low73 Ų73120.2 Ų120.275%0.75369%0.687SS**  trans126.298.2144.500000115.9S71G69-S71 PolarHBondContact O-N 2.95Å; G69-S71 VanDerWaalsContact O-N 3.14Å
70S50.6Low52.7Low135 Ų135121 Ų12194%0.94468%0.678SS**  trans-52.2115.1159.1-61.20000110.9
71S40.2Very low53.1Low104 Ų104122 Ų12273%0.72768%0.677SS**  trans-13897.7163.4-172.30000109.7G69 G73G69-S71 PolarHBondContact O-N 2.95Å; G69-S71 VanDerWaalsContact O-N 3.14Å; S71-G73 PolarHBondContact O-N 3.09Å
72R50.8Low53.5Low252 Ų252122 Ų12295%0.95167%0.674SS**  trans-54.8127.7157.3-83.3155.150.8-175.4-4.2107.9
73G49.3Very low53.7Low57 Ų57120.5 Ų120.559%0.58867%0.665SS**SBendtrans112127165.200000115.7S71S71-G73 PolarHBondContact O-N 3.09Å
74T41.5Very low54.2Low133 Ų133119.4 Ų119.482%0.81666%0.66SS**  trans68.7113.3154.4-44.20000117.6R76T74-R76 PolarHBondContact O-N 3.27Å
75H42.6Very low54.6Low196 Ų196119.1 Ų119.191%0.90765%0.653SS**  trans-31.990.3168-58.3-98.1000114.9S77H75-S77 PolarHBondContact O-N 3.48Å
76R45.5Very low54.8Low214 Ų214118.3 Ų118.381%0.80864%0.641SS**  trans-8997.7168.1-165177.7-81.3-174.6-5.9108.9T74T74-R76 PolarHBondContact O-N 3.27Å
77S52.3Low55.3Low55 Ų55117 Ų11739%0.38563%0.631SS.*  trans-48.1143.5-177.4-177.60000113.7H75 R79H75-S77 PolarHBondContact O-N 3.48Å; S77-R79 PolarHBondContact O-N 3.2Å; S77-R79 WeakPolarHBondContact OG-CG 3.3Å
78P55.3Low55.7Low108 Ų108114 Ų11470%0.70162%0.62SS**G310 helixtrans-59.3-12.3177.923-34.3000114.9N80 F81P78-N80 PolarHBondContact O-N 2.99Å; P78-F81 PolarHBondContact O-N 3.32Å
79R55.8Low56.1Low145 Ų145115.6 Ų115.655%0.54762%0.615SS.*G310 helixtrans-44.9-9.6169.7-74.7176.6124.293.18.9116.9S77 S208S77-R79 PolarHBondContact O-N 3.2Å; S77-R79 WeakPolarHBondContact OG-CG 3.3Å; R79-S208 PolarHBondContact NH2-OG 3.43Å
80N64.3Low57Low74 Ų74118.8 Ų118.840%0.39660%0.604SS.*G310 helixtrans-100.8-12.6178.7-75.6-89.3000113.4P78 K84P78-N80 PolarHBondContact O-N 2.99Å; N80-K84 VanDerWaalsContact O-CB 3.3Å; N80-K84 WeakPolarHBondContact O-CB 3.45Å; N80-K84 VanDerWaalsContact O-CD 3.26Å; N80-K84 WeakPolarHBondContact O-CD 3.16Å; N80-K84 WeakPolarHBondContact O-CG 3.46Å; N80-K84 PolarHBondContact O-N 3.19Å
81F70.3Confident57.1Low135 Ų135122.9 Ų122.959%0.59260%0.599SS**Hα-helixtrans-80.2-53.6-174.8-179.8-102.4000112P78 K84 K85P78-F81 PolarHBondContact O-N 3.32Å; F81-K84 PolarHBondContact O-N 2.7Å; F81-K85 HydrophobicContact CD1-CG 4.47Å; F81-K85 HydrophobicContact CE1-CG 4.14Å; F81-K85 HydrophobicContact CE2-CD 4.45Å; F81-K85 HydrophobicContact CE2-CG 4.21Å; F81-K85 HydrophobicContact CZ-CD 4.25Å; F81-K85 HydrophobicContact CZ-CG 4.01Å; F81-K85 WeakPolarHBondContact O-CG 3.23Å; F81-K85 PolarHBondContact O-N 3.47Å
82L68.3Low57.6Low76 Ų76124 Ų12440%0.39860%0.601SS.*Hα-helixtrans-68-42.8-178.9-52.9172.9000110.5K84 K85 L86 L206 E209L82-K84 VanDerWaalsContact C-N 3.33Å; L82-K84 PolarHBondContact O-N 3.31Å; L82-K85 PolarHBondContact O-N 3.46Å; L82-L86 WeakPolarHBondContact O-CB 3.12Å; L82-L86 WeakPolarHBondContact O-CG 3.26Å; L82-L86 PolarHBondContact O-N 3.45Å; L82-L206 HydrophobicContact CD1-CD2 4.1Å; L82-E209 WeakPolarHBondContact CB-OE1 3.37Å
83A66.1Low57.7Low20 Ų20115.3 Ų115.317%0.16559%0.59CS.*Hα-helixtrans-51.7-47.2171.900000112.9Q87 V213A83-Q87 WeakPolarHBondContact O-CB 3.39Å; A83-Q87 VanDerWaalsContact O-CG 3.27Å; A83-Q87 WeakPolarHBondContact O-CG 3.34Å; A83-Q87 PolarHBondContact O-N 3.29Å; A83-V213 HydrophobicContact CB-CG2 4.12Å
84K67.3Low57.4Low118 Ų118116.4 Ų116.451%0.51359%0.593SS.*Hα-helixtrans-68.6-40.3177-75.4174.9-174.2-177.60113N80 F81 L82 Q87 L88N80-K84 VanDerWaalsContact O-CB 3.3Å; N80-K84 WeakPolarHBondContact O-CB 3.45Å; N80-K84 VanDerWaalsContact O-CD 3.26Å; N80-K84 WeakPolarHBondContact O-CD 3.16Å; N80-K84 WeakPolarHBondContact O-CG 3.46Å; N80-K84 PolarHBondContact O-N 3.19Å; F81-K84 PolarHBondContact O-N 2.7Å; L82-K84 VanDerWaalsContact C-N 3.33Å; L82-K84 PolarHBondContact O-N 3.31Å; K84-Q87 PolarHBondContact O-N 3.2Å; K84-L88 PolarHBondContact O-N 3.48Å
85K66.9Low57.8Low120 Ų120115.6 Ų115.652%0.52259%0.591SS.*Hα-helixtrans-64.2-42.1177.5-71.7-78.9-73.6-174.20111.3F81 L82 L88 V89F81-K85 HydrophobicContact CD1-CG 4.47Å; F81-K85 HydrophobicContact CE1-CG 4.14Å; F81-K85 HydrophobicContact CE2-CD 4.45Å; F81-K85 HydrophobicContact CE2-CG 4.21Å; F81-K85 HydrophobicContact CZ-CD 4.25Å; F81-K85 HydrophobicContact CZ-CG 4.01Å; F81-K85 WeakPolarHBondContact O-CG 3.23Å; F81-K85 PolarHBondContact O-N 3.47Å; L82-K85 PolarHBondContact O-N 3.46Å; K85-L88 WeakPolarHBondContact O-CB 3.41Å; K85-L88 PolarHBondContact O-N 3.3Å; K85-V89 WeakPolarHBondContact O-CG2 3.34Å; K85-V89 PolarHBondContact O-N 2.84Å; K85-V89 VanDerWaalsContact O-N 3.09Å
86L68.7Low58.1Low76 Ų76112 Ų11240%0.39858%0.584SS.*Hα-helixtrans-67.8-38.9175.7-69.2171.2000112.2L82 L88 V89 R90 V213L82-L86 WeakPolarHBondContact O-CB 3.12Å; L82-L86 WeakPolarHBondContact O-CG 3.26Å; L82-L86 PolarHBondContact O-N 3.45Å; L86-L88 VanDerWaalsContact C-N 3.31Å; L86-L88 PolarHBondContact O-N 3.03Å; L86-V89 PolarHBondContact O-N 2.84Å; L86-R90 WeakPolarHBondContact O-CG 3.46Å; L86-R90 PolarHBondContact O-N 3.21Å; L86-V213 HydrophobicContact CD1-CG1 3.97Å
87Q65Low58.3Low102 Ų102114 Ų11448%0.47759%0.592SS.*Hα-helixtrans-62.4-37.6171.1-76.8174.9-200112.3A83 K84 R90 R91A83-Q87 WeakPolarHBondContact O-CB 3.39Å; A83-Q87 VanDerWaalsContact O-CG 3.27Å; A83-Q87 WeakPolarHBondContact O-CG 3.34Å; A83-Q87 PolarHBondContact O-N 3.29Å; K84-Q87 PolarHBondContact O-N 3.2Å; Q87-R90 PolarHBondContact O-N 3.35Å; Q87-R91 WeakPolarHBondContact O-CB 3.48Å; Q87-R91 PolarHBondContact O-N 3Å
88L59.9Low58Low124 Ų124122.9 Ų122.965%0.64962%0.617SS**Hα-helixtrans-62.1-44.8175.2-145.489000111.2K84 K85 L86 R91 V92K84-L88 PolarHBondContact O-N 3.48Å; K85-L88 WeakPolarHBondContact O-CB 3.41Å; K85-L88 PolarHBondContact O-N 3.3Å; L86-L88 VanDerWaalsContact C-N 3.31Å; L86-L88 PolarHBondContact O-N 3.03Å; L88-R91 PolarHBondContact O-N 3.41Å; L88-V92 PolarHBondContact O-N 2.85Å
89V57.8Low57.2Low111 Ų111126.9 Ų126.967%0.67363%0.629SS**Hα-helixtrans-62.7-42.3176.8173.10000111.5K85 L86 R91K85-V89 WeakPolarHBondContact O-CG2 3.34Å; K85-V89 PolarHBondContact O-N 2.84Å; K85-V89 VanDerWaalsContact O-N 3.09Å; L86-V89 PolarHBondContact O-N 2.84Å; V89-R91 VanDerWaalsContact C-N 3.32Å; V89-R91 PolarHBondContact O-N 2.79Å
90R57.9Low56.5Low140 Ų140125 Ų12553%0.52864%0.644SS.*Hα-helixtrans-66.3-30174.5-65.6-171.6-150.7165.52.9113.2L86 Q87 V92 G93 V213L86-R90 WeakPolarHBondContact O-CG 3.46Å; L86-R90 PolarHBondContact O-N 3.21Å; Q87-R90 PolarHBondContact O-N 3.35Å; R90-V92 VanDerWaalsContact C-N 3.34Å; R90-V92 PolarHBondContact O-N 2.92Å; R90-G93 PolarHBondContact O-N 3.26Å; R90-V213 PolarHBondContact NH2-O 3.46Å
91R54.1Low55.5Low220 Ų220126.7 Ų126.783%0.8366%0.661SS**Hα-helixtrans-78-9.8-178.8-108.1-175.7-178.3170.32.3115.5Q87 L88 V89 G93Q87-R91 WeakPolarHBondContact O-CB 3.48Å; Q87-R91 PolarHBondContact O-N 3Å; L88-R91 PolarHBondContact O-N 3.41Å; V89-R91 VanDerWaalsContact C-N 3.32Å; V89-R91 PolarHBondContact O-N 2.79Å; R91-G93 PolarHBondContact O-N 2.86Å
92V50.3Low54.9Low127 Ų127125.6 Ų125.677%0.7767%0.668SS**THydrogen-bonded Turntrans-72.5-7.1172.6176.70000111.8L88 R90L88-V92 PolarHBondContact O-N 2.85Å; R90-V92 VanDerWaalsContact C-N 3.34Å; R90-V92 PolarHBondContact O-N 2.92Å
93G52.5Low54.1Low70 Ų70128.1 Ų128.172%0.72269%0.689SS**THydrogen-bonded Turntrans-86.61.1-176.500000118.3R90 R91R90-G93 PolarHBondContact O-N 3.26Å; R91-G93 PolarHBondContact O-N 2.86Å
94A43.2Very low53.6Low80 Ų80131.2 Ų131.266%0.66172%0.715SS**  trans-157.8106.3178.400000114.6
95P49.1Very low53.1Low117 Ų117131.5 Ų131.576%0.7673%0.729SS**  trans-77.2142.1160.832-31.9000110.6R97P95-R97 PolarHBondContact O-N 3.45Å
96P49.7Very low52.5Low119 Ų119130.9 Ų130.977%0.77374%0.739SS**  trans-66.9130.9171.828.1-33.1000109.8R98P96-R98 PolarHBondContact O-N 3.29Å
97R50.7Low52.4Low258 Ų258133.1 Ų133.197%0.97476%0.758SS**  trans-58.4104.7172.6-77-176.8173.2128.1-3.6110.1P95P95-R97 PolarHBondContact O-N 3.45Å
98R44.1Very low52.2Low241 Ų241132.5 Ų132.591%0.90977%0.771SS**  trans-108.5148.3157.4-95-173.8179.5-176.21.2109.4P96P96-R98 PolarHBondContact O-N 3.29Å
99M39Very low52.4Low192 Ų192132.3 Ų132.395%0.94678%0.777SS**  trans-64.7154.2-166.2-66-61.9-175.400113.2
100A42.5Very low52.9Low106 Ų106132.9 Ų132.988%0.87678%0.783SS**  trans-63145.3-174.200000113.6
101S41.9Very low53.1Low108 Ų108130.7 Ų130.776%0.75580%0.795SS**  trans-128.2147.1159.5-170.50000107.7
102P58.9Low53.5Low113 Ų113128 Ų12873%0.73480%0.795SS**  trans-63153.9-174.2-22.634.5000113.6A104P102-A104 PolarHBondContact O-N 2.93Å
103P49.7Very low53.5Low129 Ų129125.8 Ų125.884%0.83879%0.785SS**  trans-71.6112.8-179.629.3-33.9000111.1
104A56.2Low53.8Low85 Ų85128.4 Ų128.470%0.70279%0.789SS**PPolyproline II helixtrans-67.8144.9161.600000109.6P102 S106P102-A104 PolarHBondContact O-N 2.93Å; A104-S106 PolarHBondContact O-N 2.86Å
105P56.4Low54.6Low124 Ų124132 Ų13281%0.80580%0.796SS**PPolyproline II helixtrans-61.9131.9175.926.5-33.8000110
106S54.3Low55Low106 Ų106132 Ų13274%0.74179%0.788SS**PPolyproline II helixtrans-59.6139-179.355.10000111.5A104A104-S106 PolarHBondContact O-N 2.86Å
107P66.5Low55.5Low124 Ų124135.9 Ų135.981%0.80579%0.793SS**PPolyproline II helixtrans-59.1143.517027-34.1000110.1
108A62.6Low55.9Low89 Ų89131.1 Ų131.174%0.73679%0.787SS**PPolyproline II helixtrans-58.6146.9-179.200000111.5
109P63.9Low56.7Low119 Ų119122.8 Ų122.877%0.77377%0.77SS**PPolyproline II helixtrans-60.8143.9178.326.2-34.5000110.8
110P67.8Low57.9Low123 Ų123121.5 Ų121.580%0.79977%0.765SS**PPolyproline II helixtrans-60.7145.9179.626.1-34.4000110.8I112P110-I112 PolarHBondContact O-N 3.16Å
111A62Low58.7Low94 Ų94121.2 Ų121.278%0.77776%0.757SS**PPolyproline II helixtrans-55.1134.1179.800000111S113A111-S113 PolarHBondContact O-N 3.3Å; A111-S113 VanDerWaalsContact O-N 3.08Å
112I61.9Low59.8Low165 Ų165123.4 Ų123.485%0.84676%0.759SS**  trans-57.2115.8-178.6-61.7169.8000109P110P110-I112 PolarHBondContact O-N 3.16Å
113S51.2Low60Low80 Ų80123.8 Ų123.856%0.55976%0.761SS**  trans-58.1128.3-175.9-57.70000111.2A111 I115 I116A111-S113 PolarHBondContact O-N 3.3Å; A111-S113 VanDerWaalsContact O-N 3.08Å; S113-I115 PolarHBondContact O-N 3.01Å; S113-I116 PolarHBondContact O-N 3.39Å
114P57.8Low60.5Low124 Ų124125.8 Ų125.881%0.80576%0.76SS**THydrogen-bonded Turntrans-59.7-11.3-176.9-26.935000116
115I59.9Low60.5Low157 Ų157127.9 Ų127.981%0.80576%0.758SS**THydrogen-bonded Turntrans-85.6-15.6-168.6-60.4173.3000112.6S113S113-I115 PolarHBondContact O-N 3.01Å
116I58.3Low60.6Low116 Ų116127.5 Ų127.560%0.59575%0.749SS**  trans-123.762.2-178.3-39.6-179.1000111.8S113 N118 A119S113-I116 PolarHBondContact O-N 3.39Å; I116-N118 PolarHBondContact O-N 3.49Å; I116-A119 HydrophobicContact CG2-CB 3.57Å
117K60.5Low60.8Low201 Ų201129.3 Ų129.387%0.87475%0.746SS**THydrogen-bonded Turntrans-74.2-6177.7-156172.61791800114.5
118N57.8Low60.3Low157 Ų157126.9 Ų126.984%0.8474%0.737SS**THydrogen-bonded Turntrans-11510179.8-81.8-7.7000114.2I116 I120I116-N118 PolarHBondContact O-N 3.49Å; N118-I120 PolarHBondContact O-N 3.19Å; N118-I120 VanDerWaalsContact O-N 3.14Å
119A62.6Low60.1Low67 Ų67124.6 Ų124.655%0.55472%0.718SS**  trans-70.5110.1165.200000108.3I116 S121I116-A119 HydrophobicContact CG2-CB 3.57Å; A119-S121 PolarHBondContact O-N 3.14Å
120I63.3Low59.7Low165 Ų165125.6 Ų125.685%0.84671%0.707SS**  trans-58.4111.5165.8-58.5172.3000106.2N118 L122N118-I120 PolarHBondContact O-N 3.19Å; N118-I120 VanDerWaalsContact O-N 3.14Å; I120-L122 PolarHBondContact O-N 2.67Å
121S60.4Low59.2Low100 Ų100124.6 Ų124.670%0.69970%0.695SS**PPolyproline II helixtrans-56123.6177.353.60000109.1A119A119-S121 PolarHBondContact O-N 3.14Å
122L64.3Low59Low154 Ų154123.9 Ų123.981%0.80669%0.685SS**PPolyproline II helixtrans-53.3140.5168.7-66.8173.9000108.5I120 Q124I120-L122 PolarHBondContact O-N 2.67Å; L122-Q124 PolarHBondContact O-N 3.08Å; L122-Q124 VanDerWaalsContact O-N 3.08Å
123P61.8Low58.8Low120 Ų120121.7 Ų121.778%0.77967%0.674SS**PPolyproline II helixtrans-56.1121.6177.123.5-33000108.7L125P123-L125 PolarHBondContact O-N 3.18Å
124Q60.8Low59.2Low172 Ų172122.8 Ų122.880%0.80468%0.677SS**  trans-62.8111.7-177.9-69.5-177.35.600108.9L122 N126L122-Q124 PolarHBondContact O-N 3.08Å; L122-Q124 VanDerWaalsContact O-N 3.08Å; Q124-N126 PolarHBondContact O-N 3.45Å
125L56.6Low59.3Low129 Ų129123 Ų12368%0.67568%0.675SS**  trans-72.896.6173.8-173.968.9000108.1P123 Q127P123-L125 PolarHBondContact O-N 3.18Å; L125-Q127 PolarHBondContact O-N 3.16Å
126N58.9Low58.7Low115 Ų115117.2 Ų117.262%0.61566%0.655SS**  trans-54.8130.2177.3-78.8-40.3000110.5Q124 A128 A129Q124-N126 PolarHBondContact O-N 3.45Å; N126-A128 PolarHBondContact O-N 3.27Å; N126-A128 VanDerWaalsContact O-N 3.1Å; N126-A129 VanDerWaalsContact O-CB 3.31Å; N126-A129 WeakPolarHBondContact O-CB 3.39Å; N126-A129 PolarHBondContact O-N 3.16Å
127Q57.5Low58.4Low144 Ų144120.7 Ų120.767%0.67367%0.666SS**Hα-helixtrans-53.1-37.1-177.2-159.469.34800112.5L125 A129 Y130 D131L125-Q127 PolarHBondContact O-N 3.16Å; Q127-A129 PolarHBondContact O-N 3.2Å; Q127-Y130 WeakPolarHBondContact O-CB 3.38Å; Q127-Y130 PolarHBondContact O-N 3.23Å; Q127-D131 PolarHBondContact O-N 3.41Å
128A57.3Low57.8Low74 Ų74118.4 Ų118.461%0.61266%0.662SS**Hα-helixtrans-62.7-23.1176.800000114.6N126 S132N126-A128 PolarHBondContact O-N 3.27Å; N126-A128 VanDerWaalsContact O-N 3.1Å; A128-S132 WeakPolarHBondContact O-CB 3.12Å; A128-S132 PolarHBondContact O-N 3.5Å
129A57.8Low57.2Low41 Ų41115.8 Ų115.834%0.33966%0.656SS.*Hα-helixtrans-73.6-31.5173.700000111.6N126 Q127 L133N126-A129 VanDerWaalsContact O-CB 3.31Å; N126-A129 WeakPolarHBondContact O-CB 3.39Å; N126-A129 PolarHBondContact O-N 3.16Å; Q127-A129 PolarHBondContact O-N 3.2Å; A129-L133 VanDerWaalsContact O-CG 3.29Å; A129-L133 WeakPolarHBondContact O-CG 3.37Å; A129-L133 PolarHBondContact O-N 3.32Å
130Y55.7Low56.2Low139 Ų139122.1 Ų122.155%0.54567%0.672SS.*Hα-helixtrans-69.6-46.4177.4-159.8-92.6000111.1Q127 S132 L133 V134Q127-Y130 WeakPolarHBondContact O-CB 3.38Å; Q127-Y130 PolarHBondContact O-N 3.23Å; Y130-S132 VanDerWaalsContact C-N 3.26Å; Y130-S132 PolarHBondContact O-N 3.12Å; Y130-L133 PolarHBondContact O-N 3.28Å; Y130-L133 VanDerWaalsContact O-N 3.12Å; Y130-V134 HydrophobicContact CE1-CG1 4.4Å; Y130-V134 PolarHBondContact O-N 2.86Å
131D56.7Low55.3Low102 Ų102122 Ų12255%0.54567%0.672SS.*Hα-helixtrans-63.2-33.3176.4-66.5-15.7000112.1Q127 V134Q127-D131 PolarHBondContact O-N 3.41Å; D131-V134 VanDerWaalsContact O-CG2 3.29Å; D131-V134 WeakPolarHBondContact O-CG2 3.17Å
132S58.8Low54.1Low80 Ų80120 Ų12056%0.55967%0.669SS**Hα-helixtrans-73.2-31.5174.4-160.90000112.9A128 Y130 G136A128-S132 WeakPolarHBondContact O-CB 3.12Å; A128-S132 PolarHBondContact O-N 3.5Å; Y130-S132 VanDerWaalsContact C-N 3.26Å; Y130-S132 PolarHBondContact O-N 3.12Å; S132-G136 WeakPolarHBondContact O-CA 3.49Å; S132-G136 PolarHBondContact O-N 3.15Å
133L57.3Low52.6Low118 Ų118118.5 Ų118.562%0.61867%0.671SS**Hα-helixtrans-75.2-25.2177.2-76.2168.3000113.8A129 Y130A129-L133 VanDerWaalsContact O-CG 3.29Å; A129-L133 WeakPolarHBondContact O-CG 3.37Å; A129-L133 PolarHBondContact O-N 3.32Å; Y130-L133 PolarHBondContact O-N 3.28Å; Y130-L133 VanDerWaalsContact O-N 3.12Å
134V60.1Low51.8Low103 Ų103118.6 Ų118.662%0.62467%0.671SS**THydrogen-bonded Turntrans-83-10.5176.3-62.50000114Y130 D131Y130-V134 HydrophobicContact CE1-CG1 4.4Å; Y130-V134 PolarHBondContact O-N 2.86Å; D131-V134 VanDerWaalsContact O-CG2 3.29Å; D131-V134 WeakPolarHBondContact O-CG2 3.17Å
135V59.4Low50.7Low128 Ų128116.1 Ų116.178%0.77667%0.673SS**THydrogen-bonded Turntrans-119.6-21.4175.7-179.40000112.5K137V135-K137 PolarHBondContact O-N 3.34Å
136G46.3Very low49.9Very low36 Ų36115.4 Ų115.437%0.37168%0.679SS.*  trans-81.390.3-175.600000114.1S132 L138S132-G136 WeakPolarHBondContact O-CA 3.49Å; S132-G136 PolarHBondContact O-N 3.15Å; G136-L138 PolarHBondContact O-N 3.22Å; G136-L138 VanDerWaalsContact O-N 3.14Å
137K52.4Low48.9Very low189 Ų189115 Ų11582%0.82269%0.685SS**  trans-40.3114.6161.6178.7179.4174.5-175.80111.1V135 S139V135-K137 PolarHBondContact O-N 3.34Å; K137-S139 PolarHBondContact O-N 3.37Å
138L49.1Very low48.6Very low153 Ų153114.4 Ų114.480%0.80169%0.691SS**  trans-64.387.8-177.7-71.1171.1000112.3G136 F140G136-L138 PolarHBondContact O-N 3.22Å; G136-L138 VanDerWaalsContact O-N 3.14Å; L138-F140 PolarHBondContact O-N 3.25Å
139S44.7Very low47.6Very low103 Ų103117.8 Ų117.872%0.7270%0.699SS**  trans-88.594.5165.4-63.90000109.3K137K137-S139 PolarHBondContact O-N 3.37Å
140F40.9Very low47.4Very low200 Ų200119.3 Ų119.388%0.87772%0.719SS**  trans-89.8103.9161.7-117.1-90000107.6L138L138-F140 PolarHBondContact O-N 3.25Å
141D44.2Very low47.1Very low161 Ų161121.7 Ų121.786%0.86174%0.735SS**  trans-118142.2164.8-164.92.4000107.9
142G34.9Very low46.3Very low60 Ų60122.3 Ų122.362%0.61975%0.747SS**  trans119.672.5-171.700000114.8
143S34.6Very low45.9Very low122 Ų122124 Ų12485%0.85376%0.759SS**PPolyproline II helixtrans-86.9134.4155.4-63.50000109.9
144P44.5Very low45.3Very low122 Ų122128.2 Ų128.279%0.79277%0.768SS**PPolyproline II helixtrans-91.2142.3152.932.4-28000110.6
145S37.2Very low44.6Very low119 Ų119126.8 Ų126.883%0.83277%0.774SS**PPolyproline II helixtrans-51.5136.2-173.7-30.50000114.3S147S145-S147 PolarHBondContact O-N 3.21Å; S145-S147 VanDerWaalsContact O-N 3.07Å
146S39.3Very low44.2Very low114 Ų114129 Ų12980%0.79778%0.781SS**  trans-66.9103.5165.753.90000110.3T148S146-T148 PolarHBondContact O-N 3.12Å
147S38.6Very low44.5Very low106 Ų106134.9 Ų134.974%0.74180%0.804SS**  trans-68121.5171.3-1690000110.1S145 D149S145-S147 PolarHBondContact O-N 3.21Å; S145-S147 VanDerWaalsContact O-N 3.07Å; S147-D149 VanDerWaalsContact C-N 3.34Å; S147-D149 PolarHBondContact O-N 3.04Å; S147-D149 VanDerWaalsContact O-N 3.16Å
148T50.8Low44.1Very low133 Ų133130.9 Ų130.982%0.81680%0.8SS**  trans-85.175174.953.80000110.2S146S146-T148 PolarHBondContact O-N 3.12Å
149D35.7Very low44.4Very low144 Ų144127.6 Ų127.677%0.7780%0.802SS**  trans-134.6105.9166.8-103.5-37000110.7S147 H151S147-D149 VanDerWaalsContact C-N 3.34Å; S147-D149 PolarHBondContact O-N 3.04Å; S147-D149 VanDerWaalsContact O-N 3.16Å; D149-H151 VanDerWaalsContact C-N 3.3Å; D149-H151 PolarHBondContact O-N 3.35Å
150G54Low44.3Very low73 Ų73131.3 Ų131.375%0.75381%0.806SS**  trans-82.162.4-17600000113.3
151H48.8Very low44.5Very low190 Ų190128.1 Ų128.188%0.8881%0.807SS**  trans-155.878.9164-86.9-62000111.6D149D149-H151 VanDerWaalsContact C-N 3.3Å; D149-H151 PolarHBondContact O-N 3.35Å
152S41.1Very low45Very low114 Ų114126.4 Ų126.480%0.79780%0.802SS**  trans-101.196.8165.1-165.80000109.9Y154S152-Y154 PolarHBondContact O-N 3.19Å
153S49.3Very low45.6Very low117 Ų117131.3 Ų131.382%0.81881%0.812SS**  trans-65.4109.5164.2-179.50000108.1G155S153-G155 PolarHBondContact O-N 3.14Å
154Y46.3Very low46Very low205 Ų205130.9 Ų130.980%0.80481%0.809SS**  trans-70.7114.7178.451.1-90.2000109.6S152S152-Y154 PolarHBondContact O-N 3.19Å
155G44.4Very low46.1Very low73 Ų73136.4 Ų136.475%0.75382%0.815SS**  trans-65.6133.2177.400000111.8S153 D157S153-G155 PolarHBondContact O-N 3.14Å; G155-D157 PolarHBondContact O-N 2.73Å
156L52Low46Very low176 Ų176138.4 Ų138.492%0.92182%0.815SS**SBendtrans-77.190.1171.4-72162.1000110.1
157D50.9Low46.1Very low159 Ų159138.3 Ų138.385%0.8581%0.812SS**  trans-161.673.7150.8-165.619.9000112.6G155G155-D157 PolarHBondContact O-N 2.73Å
158S45.7Very low46.1Very low105 Ų105144.6 Ų144.673%0.73482%0.819SS**  trans-161.3114160.8-156.20000111.6F160S158-F160 PolarHBondContact O-N 3.17Å
159G54.5Low45.4Very low83 Ų83143.4 Ų143.486%0.85682%0.817SS**  trans-75.538.9-175.600000116
160F41.6Very low45.3Very low182 Ų182145.1 Ų145.180%0.79882%0.82SS**  trans-106.7106174.8-100.1-88.5000111.6S158 T162S158-F160 PolarHBondContact O-N 3.17Å; F160-T162 PolarHBondContact O-N 3.49Å
161C46.5Very low44.7Very low133 Ų133150.6 Ų150.690%0.89982%0.823SS**  trans-67.393.9173.1-58.80000110.6
162T54.4Low44Very low125 Ų125146.7 Ų146.777%0.76782%0.815SS**  trans-75.3143.9168.454.50000110.4F160 S164F160-T162 PolarHBondContact O-N 3.49Å; T162-S164 PolarHBondContact O-N 2.84Å
163I47.7Very low43.7Very low162 Ų162148.7 Ų148.783%0.83181%0.811SS**  trans-54.8128.3-175.5-61.1168.4000110R165I163-R165 PolarHBondContact O-N 3.1Å
164S42.5Very low42.8Very low113 Ų113150.5 Ų150.579%0.7981%0.812SS**  trans-54.4108.5-179.6-530000111.3T162 L166T162-S164 PolarHBondContact O-N 2.84Å; S164-L166 PolarHBondContact O-N 3.15Å; S164-L166 VanDerWaalsContact O-N 3.1Å
165R47.2Very low42.5Very low238 Ų238150 Ų15090%0.89881%0.808SS**  trans-67.7108.3167.6-71.1-171.8175.7-156.1-0.5107.9I163I163-R165 PolarHBondContact O-N 3.1Å
166L35.6Very low42.3Very low162 Ų162154.3 Ų154.385%0.84881%0.814SS**PPolyproline II helixtrans-54.1124173.1-173.572.7000108.8S164 R168S164-L166 PolarHBondContact O-N 3.15Å; S164-L166 VanDerWaalsContact O-N 3.1Å; L166-R168 PolarHBondContact O-N 2.78Å
167P40Very low41.6Very low112 Ų112157 Ų15773%0.72781%0.812SS**PPolyproline II helixtrans-61125175.623.7-32.1000109S169P167-S169 PolarHBondContact O-N 2.72Å
168R39.6Very low40.8Very low238 Ų238157.3 Ų157.390%0.89881%0.813SS**PPolyproline II helixtrans-53.8120.8175.3178.6-177.1-179.2104.9-4.1108.4L166 E170L166-R168 PolarHBondContact O-N 2.78Å; R168-E170 PolarHBondContact O-N 3.09Å
169S36.3Very low40.2Very low108 Ų108155.9 Ų155.976%0.75582%0.815SS**  trans-58.1111.6175.4175.40000109.6P167 K171P167-S169 PolarHBondContact O-N 2.72Å; S169-K171 PolarHBondContact O-N 3.25Å
170E32.5Very low39.1Very low180 Ų180157.9 Ų157.984%0.84182%0.816SS**  trans-72.2114.6167.2-171.7177.3152.100107.7R168R168-E170 PolarHBondContact O-N 3.09Å
171K41Very low38.6Very low187 Ų187158.6 Ų158.681%0.81382%0.819SS**PPolyproline II helixtrans-101.2120.6171.5-171.183.2176.6-173.80106.4S169S169-K171 PolarHBondContact O-N 3.25Å
172P34.5Very low38.8Very low109 Ų109158 Ų15871%0.70881%0.814SS**PPolyproline II helixtrans-65.2148-172.424.8-33.7000112.1D174P172-D174 PolarHBondContact O-N 3.34Å
173H34.6Very low37.8Very low155 Ų155158 Ų15872%0.71882%0.819SS**PPolyproline II helixtrans-53.5117.6176.4-150-41.8000110.7R175H173-R175 WeakPolarHBondContact CE1-CG 3.27Å; H173-R175 WeakPolarHBondContact ND1-CG 3.29Å
174D30.8Very low37.2Very low156 Ų156158.8 Ų158.883%0.83482%0.819SS**PPolyproline II helixtrans-97.5118.6153.7-153.4-5.9000106.1P172P172-D174 PolarHBondContact O-N 3.34Å
175R39.9Very low37.7Very low193 Ų193158.8 Ų158.873%0.72882%0.816SS**PPolyproline II helixtrans-92.4119.5174.5-87.2-167.7178.6-165.81.7106.8H173H173-R175 WeakPolarHBondContact CE1-CG 3.27Å; H173-R175 WeakPolarHBondContact ND1-CG 3.29Å
176D39.9Very low37Very low165 Ų165150.8 Ų150.888%0.88281%0.808SS**  -167.8152.2129.4-97-26.4000112.6
177R36.9Very low37.7Very low233 Ų233149.5 Ų149.588%0.87980%0.801SS**  trans86.278.6159.4-134163-166.4144.12.3120
178D35.6Very low37.7Very low164 Ų164155.1 Ų155.188%0.87781%0.808SS**  trans19.6128.5134-52.5-54.2000121
179G33.1Very low38Very low75 Ų75153.5 Ų153.577%0.77380%0.802SS**  trans166.993.5157.900000118.6
180S31.8Very low38.7Very low125 Ų125154 Ų15487%0.87481%0.805SS**  trans65.4125.4154.6-157.40000121.6
181F30.4Very low39.3Very low197 Ų197152 Ų15286%0.86480%0.801SS**  trans-82.6-169.5164.6-62.7-87.7000111.9
182P50.5Low39.4Very low120 Ų120147.1 Ų147.178%0.77979%0.79SS**  -132166.6-59.236.2-21.7000113.5
183S33Very low40.1Very low126 Ų126149.7 Ų149.788%0.88180%0.797SS**  trans-159.4142.7156.156.30000116.6
184E36.2Very low40.9Very low179 Ų179149.8 Ų149.884%0.83680%0.802SS**  trans-50.3169.1178.1-90.1-84.3100.900118.5G186E184-G186 PolarHBondContact O-N 3.05Å
185P51.5Low41.6Very low112 Ų112146.9 Ų146.973%0.72779%0.793SS**  trans-81.2119.7-162.832.5-35.3000114.7
186G34.4Very low41.9Very low70 Ų70145.7 Ų145.772%0.72279%0.794SS**  trans-97.6111175.600000113.8E184 R188E184-G186 PolarHBondContact O-N 3.05Å; G186-R188 PolarHBondContact O-N 2.87Å; G186-R188 VanDerWaalsContact O-N 3.12Å
187L49.9Very low42.3Very low135 Ų135147.8 Ų147.871%0.70779%0.79SS**  trans-65.7108.2172.6-167.6110.9000111.2R189L187-R189 HydrophobicContact CD2-CG 4.41Å
188R40.6Very low43.2Very low230 Ų230143.7 Ų143.787%0.86878%0.784SS**  trans-118.496.4164.3-73.5-62.793.7142.65.8110.1G186G186-R188 PolarHBondContact O-N 2.87Å; G186-R188 VanDerWaalsContact O-N 3.12Å
189R45.6Very low43.8Very low205 Ų205142.4 Ų142.477%0.77478%0.777SS**  trans-84.3153.5158.8-69.3179.5167.1-179.9-4108.9L187L187-R189 HydrophobicContact CD2-CG 4.41Å
190S49.6Very low44.8Very low118 Ų118144.9 Ų144.983%0.82577%0.772SS**  trans94.852.1147-49.20000121.1
191D45.3Very low46Very low139 Ų139146.6 Ų146.674%0.74377%0.771SS**  trans-157.381.4163.647.2-35.5000114.8
192S44.4Very low47.7Very low84 Ų84139.8 Ų139.859%0.58774%0.744SS**  trans-178.281.7142.8-86.50000113L194 S195S192-L194 PolarHBondContact O-N 3.1Å; S192-S195 PolarHBondContact O-OG 3.37Å
193L49.3Very low49Very low162 Ų162135.6 Ų135.685%0.84872%0.723SS**THydrogen-bonded Turntrans-81.222.7157.3-71.8175.7000112.2
194L50.5Low50.7Low158 Ų158135.1 Ų135.183%0.82772%0.716SS**THydrogen-bonded Turntrans-115.32.7178-65.5171.3000112.3S192 F196S192-L194 PolarHBondContact O-N 3.1Å; L194-F196 VanDerWaalsContact C-N 3.27Å; L194-F196 PolarHBondContact O-N 3.24Å
195S45.3Very low52.3Low94 Ų94131 Ų13166%0.65771%0.707SS**  trans-82.91.7175.960.40000114S192 R197S192-S195 PolarHBondContact O-OG 3.37Å; S195-R197 PolarHBondContact O-N 3.11Å
196F45.7Very low53.4Low169 Ų169129.5 Ų129.574%0.74169%0.693SS**SBendtrans-70.168.2151.2-63.4-69.2000108.8L194 L198L194-F196 VanDerWaalsContact C-N 3.27Å; L194-F196 PolarHBondContact O-N 3.24Å; F196-L198 PolarHBondContact O-N 3.1Å
197R49.8Very low55.7Low209 Ų209129.3 Ų129.379%0.78968%0.675SS**  trans-57.6123.5173.2-158.9180-165.9174.91.8106.8S195 D199S195-R197 PolarHBondContact O-N 3.11Å; R197-D199 PolarHBondContact O-N 3.2Å
198L54.3Low56.9Low147 Ų147125.4 Ų125.477%0.7766%0.659SS**SBendtrans-75.449.3-168.1-69.4160.5000112.7F196 L200F196-L198 PolarHBondContact O-N 3.1Å; L198-L200 PolarHBondContact O-N 3.19Å
199D49Very low58.7Low136 Ų136116 Ų11673%0.72763%0.625SS**  trans-83.619.5169.5-63.6-35.7000111.4R197 D201R197-D199 PolarHBondContact O-N 3.2Å; D199-D201 PolarHBondContact O-N 2.97Å
200L54.6Low60.4Low128 Ų128109.8 Ų109.867%0.6761%0.607SS**SBendtrans-83.899.3160.5-169.969.2000106.6L198 L202L198-L200 PolarHBondContact O-N 3.19Å; L200-L202 HydrophobicContact CD2-CD1 4.02Å; L200-L202 HydrophobicContact CD2-CG 4.21Å; L200-L202 HydrophobicContact CG-CD1 4.42Å; L200-L202 HydrophobicContact CG-CG 4.18Å; L200-L202 PolarHBondContact O-N 3.44Å
201D55.7Low61.9Low160 Ų160108.8 Ų108.886%0.85659%0.592SS**  trans-68.167.8-174.8-168.919.8000112.4D199 G203D199-D201 PolarHBondContact O-N 2.97Å; D201-G203 PolarHBondContact O-N 3.3Å
202L66.6Low63.3Low54 Ų54104.1 Ų104.128%0.28358%0.576SS.*  trans-75.898169.2-70.2165.8000106.5L200 L206 L207L200-L202 HydrophobicContact CD2-CD1 4.02Å; L200-L202 HydrophobicContact CD2-CG 4.21Å; L200-L202 HydrophobicContact CG-CD1 4.42Å; L200-L202 HydrophobicContact CG-CG 4.18Å; L200-L202 PolarHBondContact O-N 3.44Å; L202-L206 HydrophobicContact CB-CB 4.28Å; L202-L206 HydrophobicContact CD2-CB 4.23Å; L202-L206 HydrophobicContact CD2-CD1 3.91Å; L202-L207 HydrophobicContact CB-CD2 3.98Å; L202-L207 HydrophobicContact CB-CG 3.88Å; L202-L207 HydrophobicContact CD1-CD2 4.18Å; L202-L207 WeakPolarHBondContact O-CD1 3.38Å; L202-L207 VanDerWaalsContact O-CG 3.23Å; L202-L207 WeakPolarHBondContact O-CG 3.29Å
203G77.3Confident64.8Low33 Ų33100.9 Ų100.934%0.3455%0.553SS.*  trans-49.7154.7178.100000112.8D201 S205 L206D201-G203 PolarHBondContact O-N 3.3Å; G203-S205 PolarHBondContact O-N 3.49Å; G203-L206 PolarHBondContact O-N 3.46Å
204P69.8Low65.9Low115 Ų11599.6 Ų99.675%0.74754%0.544SS*.Hα-helixtrans-53-27.7-161.816.7-31.9000115.3S208P204-S208 WeakPolarHBondContact O-CB 3.17Å; P204-S208 PolarHBondContact O-N 2.98Å; P204-S208 VanDerWaalsContact O-N 3.11Å
205S69.8Low66.9Low92 Ų9296.6 Ų96.664%0.64354%0.536SS*.Hα-helixtrans-56.3-47.4172.1-58.40000113.6G203 S208 E209G203-S205 PolarHBondContact O-N 3.49Å; S205-S208 PolarHBondContact O-OG 3.19Å; S205-E209 PolarHBondContact O-N 2.89Å
206L73.7Confident67.5Low82 Ų8296.3 Ų96.343%0.42953%0.527SS..Hα-helixtrans-78.7-38.7-174.7-75.2167.4000112.4L82 L202 G203 S208 E209 L210L82-L206 HydrophobicContact CD1-CD2 4.1Å; L202-L206 HydrophobicContact CB-CB 4.28Å; L202-L206 HydrophobicContact CD2-CB 4.23Å; L202-L206 HydrophobicContact CD2-CD1 3.91Å; G203-L206 PolarHBondContact O-N 3.46Å; L206-S208 VanDerWaalsContact C-N 3.29Å; L206-S208 PolarHBondContact O-N 3.08Å; L206-E209 PolarHBondContact O-N 3.02Å; L206-L210 PolarHBondContact O-N 3.49Å
207L83.1Confident68Low65 Ų6594.1 Ų94.134%0.3453%0.53SS..Hα-helixtrans-60.6-40.6172.2-70.3172.5000111.1L202 E209 L210 L211L202-L207 HydrophobicContact CB-CD2 3.98Å; L202-L207 HydrophobicContact CB-CG 3.88Å; L202-L207 HydrophobicContact CD1-CD2 4.18Å; L202-L207 WeakPolarHBondContact O-CD1 3.38Å; L202-L207 VanDerWaalsContact O-CG 3.23Å; L202-L207 WeakPolarHBondContact O-CG 3.29Å; L207-E209 VanDerWaalsContact C-N 3.26Å; L207-E209 PolarHBondContact O-N 3.08Å; L207-L210 PolarHBondContact O-N 3.27Å; L207-L211 HydrophobicContact CB-CD1 4.37Å; L207-L211 WeakPolarHBondContact O-CD1 3.43Å; L207-L211 PolarHBondContact O-N 2.98Å
208S74.3Confident67.5Low53 Ų5392.9 Ų92.937%0.37153%0.533SS..Hα-helixtrans-62.2-31.9176.980.30000113.6R79 P204 S205 L206 G212R79-S208 PolarHBondContact NH2-OG 3.43Å; P204-S208 WeakPolarHBondContact O-CB 3.17Å; P204-S208 PolarHBondContact O-N 2.98Å; P204-S208 VanDerWaalsContact O-N 3.11Å; S205-S208 PolarHBondContact O-OG 3.19Å; L206-S208 VanDerWaalsContact C-N 3.29Å; L206-S208 PolarHBondContact O-N 3.08Å; S208-G212 PolarHBondContact O-N 3.39Å; S208-G212 VanDerWaalsContact O-N 3.16Å
209E78.4Confident66.9Low32 Ų3290 Ų9015%0.1553%0.53CS..Hα-helixtrans-75.6-43.7175.4-175.8165.9-176.200111.3L82 S205 L206 L207 G212 V213L82-E209 WeakPolarHBondContact CB-OE1 3.37Å; S205-E209 PolarHBondContact O-N 2.89Å; L206-E209 PolarHBondContact O-N 3.02Å; L207-E209 VanDerWaalsContact C-N 3.26Å; L207-E209 PolarHBondContact O-N 3.08Å; E209-G212 PolarHBondContact O-N 3Å; E209-V213 WeakPolarHBondContact O-CB 3.31Å; E209-V213 VanDerWaalsContact O-CG2 3.3Å; E209-V213 WeakPolarHBondContact O-CG2 3.29Å; E209-V213 PolarHBondContact O-N 2.88Å
210L82.4Confident66.8Low75 Ų7589.2 Ų89.239%0.39353%0.533SS..Hα-helixtrans-61.7-50.6177.4-176.563.6000111.7L206 L207 G212 V213 M214L206-L210 PolarHBondContact O-N 3.49Å; L207-L210 PolarHBondContact O-N 3.27Å; L210-G212 VanDerWaalsContact C-N 3.33Å; L210-G212 PolarHBondContact O-N 3.46Å; L210-V213 PolarHBondContact O-N 3Å; L210-V213 VanDerWaalsContact O-N 3.17Å; L210-M214 HydrophobicContact CD1-SD 4.45Å; L210-M214 HydrophobicContact CG-SD 3.98Å; L210-M214 VanDerWaalsContact O-CG 3.26Å; L210-M214 WeakPolarHBondContact O-CG 3.5Å; L210-M214 PolarHBondContact O-N 3.01Å
211L79.8Confident65.9Low98 Ų9887.7 Ų87.751%0.51354%0.538SS..Hα-helixtrans-60.8-42176.7-85.283.7000111.2L207 V213 M214 S215L207-L211 HydrophobicContact CB-CD1 4.37Å; L207-L211 WeakPolarHBondContact O-CD1 3.43Å; L207-L211 PolarHBondContact O-N 2.98Å; L211-V213 VanDerWaalsContact C-N 3.29Å; L211-V213 PolarHBondContact O-N 3.31Å; L211-M214 WeakPolarHBondContact O-CB 3.35Å; L211-M214 PolarHBondContact O-N 3.32Å; L211-M214 VanDerWaalsContact O-N 3.12Å; L211-S215 WeakPolarHBondContact O-CB 3.49Å; L211-S215 PolarHBondContact O-N 3.45Å; L211-S215 PolarHBondContact O-OG 3.01Å
212G75.8Confident65.2Low41 Ų4184.6 Ų84.642%0.42354%0.535SS..Hα-helixtrans-60.6-35.4175.700000113.9S208 E209 L210S208-G212 PolarHBondContact O-N 3.39Å; S208-G212 VanDerWaalsContact O-N 3.16Å; E209-G212 PolarHBondContact O-N 3Å; L210-G212 VanDerWaalsContact C-N 3.33Å; L210-G212 PolarHBondContact O-N 3.46Å
213V75.9Confident63.7Low16 Ų1691 Ų9110%0.09756%0.564CS.*Hα-helixtrans-76.9-21.6177167.60000112.9A83 L86 R90 E209 L210 L211A83-V213 HydrophobicContact CB-CG2 4.12Å; L86-V213 HydrophobicContact CD1-CG1 3.97Å; R90-V213 PolarHBondContact NH2-O 3.46Å; E209-V213 WeakPolarHBondContact O-CB 3.31Å; E209-V213 VanDerWaalsContact O-CG2 3.3Å; E209-V213 WeakPolarHBondContact O-CG2 3.29Å; E209-V213 PolarHBondContact O-N 2.88Å; L210-V213 PolarHBondContact O-N 3Å; L210-V213 VanDerWaalsContact O-N 3.17Å; L211-V213 VanDerWaalsContact C-N 3.29Å; L211-V213 PolarHBondContact O-N 3.31Å
214M72.9Confident61.8Low135 Ų13595.7 Ų95.767%0.66559%0.586SS**Hα-helixtrans-83.5-33171-65.6164.8121.900112.2L210 L211 L216L210-M214 HydrophobicContact CD1-SD 4.45Å; L210-M214 HydrophobicContact CG-SD 3.98Å; L210-M214 VanDerWaalsContact O-CG 3.26Å; L210-M214 WeakPolarHBondContact O-CG 3.5Å; L210-M214 PolarHBondContact O-N 3.01Å; L211-M214 WeakPolarHBondContact O-CB 3.35Å; L211-M214 PolarHBondContact O-N 3.32Å; L211-M214 VanDerWaalsContact O-N 3.12Å; M214-L216 PolarHBondContact O-N 3.14Å
215S69.9Low60.4Low94 Ų9495.8 Ų95.866%0.65759%0.586SS**SBendtrans-82.813.2-179.7-58.50000114.6L211 P217L211-S215 WeakPolarHBondContact O-CB 3.49Å; L211-S215 PolarHBondContact O-N 3.45Å; L211-S215 PolarHBondContact O-OG 3.01Å; S215-P217 VanDerWaalsContact O-CD 3.26Å; S215-P217 WeakPolarHBondContact O-CD 3.44Å
216L58.8Low59Low89 Ų8995.9 Ų95.947%0.46659%0.593SS.*  trans-71.5114.9169.2-77.6164.5000109M214 E218M214-L216 PolarHBondContact O-N 3.14Å; L216-E218 PolarHBondContact O-N 2.94Å
217P55.8Low57.6Low123 Ų12397.8 Ų97.880%0.79961%0.61SS**  trans-67.9128.7175.427.8-33.2000110.5S215S215-P217 VanDerWaalsContact O-CD 3.26Å; S215-P217 WeakPolarHBondContact O-CD 3.44Å
218E39.7Very low55.8Low182 Ų18299.8 Ų99.885%0.8564%0.636SS**  trans-67.6139.4170.4-166.478.4173.400109.6L216L216-E218 PolarHBondContact O-N 2.94Å
219A41.5Very low54.1Low87 Ų87101.7 Ų101.772%0.71966%0.655SS**  trans-54.2174.6-171.900000115.9
220P46.7Very low52.8Low120 Ų120107.7 Ų107.778%0.77969%0.688SS**  cis-149.5175.726.543.7-21.8000120.3
221A35.3Very low51.3Low95 Ų95109.4 Ų109.479%0.78570%0.704SS**  trans36.2133.8147.200000123.7
222A41.8Very low50Low95 Ų95110.8 Ų110.879%0.78572%0.718SS**  trans64.7100.1152.900000119
223E35.4Very low48.8Very low190 Ų190113 Ų11389%0.88873%0.733SS**  -177.2156.489.8-90.9-158.7139.500111.2
224T37.1Very low47.6Very low131 Ų131118.2 Ų118.280%0.80477%0.767SS**  trans-78.1131.7173.8-39.60000109.6
225P39.3Very low46.4Very low116 Ų116116.7 Ų116.775%0.75378%0.775SS**  -135.2139.5115.535-25.6000111.8P227P225-P227 WeakPolarHBondContact O-CD 3.48Å
226A40.9Very low45.5Very low94 Ų94116.4 Ų116.478%0.77778%0.779SS**PPolyproline II helixtrans-79.3127177.400000111.3
227P43.7Very low45.3Very low123 Ų123119.1 Ų119.180%0.79979%0.794SS**PPolyproline II helixtrans-93119.3159.932-23.6000109.4P225P225-P227 WeakPolarHBondContact O-CD 3.48Å
228A45.7Very low45.3Very low106 Ų106118.8 Ų118.888%0.87679%0.792SS**PPolyproline II helixtrans-77.7121.2173.800000110.9
229A39.4Very low46.3Very low93 Ų93116 Ų11677%0.76979%0.79SS**  trans-171.9119.9146.900000109.1
230N50.5Low47.1Very low159 Ų159116.2 Ų116.285%0.8579%0.791SS**PPolyproline II helixtrans-64.1132.8171.6-66.6-55.7000109.4
231P51.8Low47.6Very low111 Ų111116.3 Ų116.372%0.72179%0.792SS**PPolyproline II helixtrans-61.9142.2163.528.4-33.1000108.7A233P231-A233 PolarHBondContact O-N 3.36Å
232P52.6Low48.6Very low126 Ų126116.4 Ų116.482%0.81879%0.793SS**PPolyproline II helixtrans-60.2135.8176.825.6-33.4000109.6
233A50Low49.2Very low89 Ų89116 Ų11674%0.73679%0.789SS**PPolyproline II helixtrans-57.9138.6-179.400000110.5P231 A235P231-A233 PolarHBondContact O-N 3.36Å; A233-A235 PolarHBondContact O-N 3.35Å
234P50.3Low50.3Low125 Ų125113.8 Ų113.881%0.81278%0.783SS**PPolyproline II helixtrans-59.4133.4174.925.7-33.3000109.3A236P234-A236 PolarHBondContact O-N 3.07Å
235A47.2Very low51.2Low102 Ų102113 Ų11384%0.84378%0.781SS**PPolyproline II helixtrans-54.3137.7-174.900000111.6A233 N237A233-A235 PolarHBondContact O-N 3.35Å; A235-N237 PolarHBondContact O-N 2.88Å
236A51.3Low52.5Low89 Ų89113.3 Ų113.374%0.73678%0.783SS**SBendtrans-63128.7-173.800000112P234P234-A236 PolarHBondContact O-N 3.07Å
237N55.5Low53.5Low145 Ų145113.1 Ų113.178%0.77578%0.781SS**  trans59.3115162.7-55.4-33.6000117.2A235A235-N237 PolarHBondContact O-N 2.88Å
238P54.7Low54.1Low116 Ų116113 Ų11375%0.75378%0.781SS**PPolyproline II helixtrans-60.8150.3158.129.5-33.9000109.5A240P238-A240 PolarHBondContact O-N 3.17Å
239P62.2Low54.9Low125 Ų125112.3 Ų112.381%0.81277%0.774SS**PPolyproline II helixtrans-57.6139.3176.425-33.9000110.1
240A58.2Low55.7Low90 Ų90112.4 Ų112.474%0.74478%0.775SS**PPolyproline II helixtrans-56.5137.9-178.800000110.6P238 A242P238-A240 PolarHBondContact O-N 3.17Å; A240-A242 PolarHBondContact O-N 3.31Å
241P55.8Low56.2Low122 Ų122111.5 Ų111.579%0.79277%0.77SS**PPolyproline II helixtrans-59.1137.1174.526.3-33.7000109.1A243P241-A243 PolarHBondContact O-N 3.32Å; P241-A243 VanDerWaalsContact O-N 3.09Å
242A56.3Low56.6Low97 Ų97111.5 Ų111.580%0.80277%0.77SS**PPolyproline II helixtrans-53.5119.5-177.200000110.4A240 N244A240-A242 PolarHBondContact O-N 3.31Å; A242-N244 PolarHBondContact O-N 3.22Å
243A54.6Low57.2Low86 Ų86111.4 Ų111.471%0.71177%0.77SS**SBendtrans-66.5124178.800000109.4P241P241-A243 PolarHBondContact O-N 3.32Å; P241-A243 VanDerWaalsContact O-N 3.09Å
244N58.3Low57.9Low144 Ų144111.3 Ų111.377%0.7777%0.769SS**  trans78.9109.8179.2-45.2-49.3000115.3A242A242-N244 PolarHBondContact O-N 3.22Å
245P57.3Low58.2Low116 Ų116111 Ų11175%0.75377%0.767SS**PPolyproline II helixtrans-60.9151.8152.729.7-34.2000109.3A247P245-A247 PolarHBondContact O-N 2.95Å
246P66.1Low58.9Low122 Ų122110.4 Ų110.479%0.79276%0.762SS**PPolyproline II helixtrans-57.6137.4173.725.2-33.6000109.8
247A61.6Low59.2Low89 Ų89110.7 Ų110.774%0.73677%0.765SS**PPolyproline II helixtrans-56.4138.9-179.500000110.5P245 A249P245-A247 PolarHBondContact O-N 2.95Å; A247-A249 PolarHBondContact O-N 3.21Å
248P57.6Low59.5Low122 Ų122110.3 Ų110.379%0.79276%0.763SS**PPolyproline II helixtrans-58.5135.7175.625.6-33.6000109.3A250P248-A250 PolarHBondContact O-N 3.17Å
249A60.6Low59.7Low90 Ų90110 Ų11074%0.74476%0.761SS**PPolyproline II helixtrans-55.4117-178.500000109.9A247 N251A247-A249 PolarHBondContact O-N 3.21Å; A249-N251 PolarHBondContact O-N 3.33Å
250A56.8Low59.8Low95 Ų95110.2 Ų110.279%0.78576%0.762SS**SBendtrans-66.9-3.9-16600000115.1P248P248-A250 PolarHBondContact O-N 3.17Å
251N61.3Low60Low140 Ų140108.8 Ų108.875%0.74976%0.756SS**  trans-140.8113.3172.9-69.5-67.7000109.6A249A249-N251 PolarHBondContact O-N 3.33Å
252P59.9Low60.1Low111 Ų111109.1 Ų109.172%0.72176%0.758SS**PPolyproline II helixtrans-62145.1155.629-32.7000108.5A254P252-A254 PolarHBondContact O-N 3.19Å
253P66.6Low60.2Low124 Ų124109.2 Ų109.281%0.80576%0.759SS**PPolyproline II helixtrans-58.2134.9172.825.4-33.2000109.2
254A62.9Low60.3Low88 Ų88109.5 Ų109.573%0.72776%0.761SS**PPolyproline II helixtrans-55.8139.5-179.400000110.4P252 A256P252-A254 PolarHBondContact O-N 3.19Å; A254-A256 PolarHBondContact O-N 2.92Å
255P58.2Low60.3Low119 Ų119109.5 Ų109.577%0.77376%0.761SS**PPolyproline II helixtrans-57.5135.2175.825.3-33.6000109.1A257P255-A257 PolarHBondContact O-N 3.12Å
256A61.1Low60.4Low89 Ų89109.5 Ų109.574%0.73676%0.761SS**  trans-55.2114.6-179.200000109.6A254 N258A254-A256 PolarHBondContact O-N 2.92Å; A256-N258 PolarHBondContact O-N 3.35Å
257A58Low60.3Low95 Ų95109.7 Ų109.779%0.78576%0.762SS**SBendtrans-65.4-8.2-165.600000114.7P255P255-A257 PolarHBondContact O-N 3.12Å
258N61.3Low60.3Low137 Ų137109.8 Ų109.873%0.73376%0.763SS**  trans-141.1117.8171.2-65.6-74.3000109.3A256A256-N258 PolarHBondContact O-N 3.35Å
259P59.3Low60.1Low110 Ų110109.2 Ų109.271%0.71476%0.759SS**PPolyproline II helixtrans-62.4147.6155.929.3-32.8000108.6G261P259-G261 PolarHBondContact O-N 3.29Å
260P64.3Low59.9Low129 Ų129109.5 Ų109.584%0.83876%0.761SS**PPolyproline II helixtrans-57.4131.2171.224.9-32.6000109.1
261G61.6Low59.5Low60 Ų60111.2 Ų111.262%0.61976%0.762SS**PPolyproline II helixtrans-58.3154.8-179.800000111.9P259 A263P259-G261 PolarHBondContact O-N 3.29Å; G261-A263 PolarHBondContact O-N 3.34Å
262P57.8Low59.1Low129 Ų129110.1 Ų110.184%0.83876%0.761SS**PPolyproline II helixtrans-56133.5179.424.7-34000110.1A264P262-A264 PolarHBondContact O-N 3.02Å; P262-A264 VanDerWaalsContact O-N 3.15Å
263A59.1Low58.9Low98 Ų98110.1 Ų110.181%0.8176%0.761SS**PPolyproline II helixtrans-55.5121.8179.900000110G261 N265G261-A263 PolarHBondContact O-N 3.34Å; A263-N265 PolarHBondContact O-N 3.47Å; A263-N265 VanDerWaalsContact O-N 3.1Å
264A56.9Low58.4Low92 Ų92110.1 Ų110.176%0.7676%0.761SS**SBendtrans-66.9113.1-178.300000110.1P262P262-A264 PolarHBondContact O-N 3.02Å; P262-A264 VanDerWaalsContact O-N 3.15Å
265N58.5Low58Low144 Ų144110.1 Ų110.177%0.7776%0.761SS**  trans68.3116.7174.7-53.3-38.9000116.2A263A263-N265 PolarHBondContact O-N 3.47Å; A263-N265 VanDerWaalsContact O-N 3.1Å
266P59.3Low57.6Low116 Ų116110.4 Ų110.475%0.75376%0.763SS**PPolyproline II helixtrans-63150.8153.830.3-33.5000109.5A268P266-A268 PolarHBondContact O-N 3.16Å
267P62.8Low57Low127 Ų127111 Ų11183%0.82577%0.768SS**PPolyproline II helixtrans-59.7140.1174.126-33.8000110.3
268A61.6Low56.7Low90 Ų90110.5 Ų110.574%0.74476%0.764SS**PPolyproline II helixtrans-59.4141.5-17900000111.2P266 A270P266-A268 PolarHBondContact O-N 3.16Å; A268-A270 PolarHBondContact O-N 3.1Å
269P54.3Low56.3Low111 Ų111111 Ų11172%0.72177%0.766SS**PPolyproline II helixtrans-61.613717526.9-34.1000109.9T271P269-T271 PolarHBondContact O-N 2.98Å
270A55.4Low55.9Low95 Ų95111.5 Ų111.579%0.78577%0.769SS**  trans-65106.1179.600000110.6A268 T272A268-A270 PolarHBondContact O-N 3.1Å; A270-T272 PolarHBondContact O-N 3.09Å
271T50.2Low55.4Low131 Ų131111.3 Ų111.380%0.80477%0.768SS**  trans-79.430.8-175.955.90000113.9P269P269-T271 PolarHBondContact O-N 2.98Å
272T52.9Low54.7Low117 Ų117112.9 Ų112.972%0.71878%0.775SS**  trans-135.2103.7-178.3-11.40000109.8A270A270-T272 PolarHBondContact O-N 3.09Å
273P53.9Low54Low112 Ų112112.8 Ų112.873%0.72778%0.775SS**PPolyproline II helixtrans-64.6141.816628.5-32.9000109
274P57.7Low53Low123 Ų123112.8 Ų112.880%0.79978%0.775SS**PPolyproline II helixtrans-61.4139.7172.226.7-33.4000109.7
275A53.2Low52.2Low89 Ų89115.1 Ų115.174%0.73678%0.78SS**PPolyproline II helixtrans-59.5141.9178.900000110.8A277A275-A277 PolarHBondContact O-N 3.46Å
276P50.6Low51.1Low124 Ų124113.6 Ų113.681%0.80578%0.781SS**PPolyproline II helixtrans-61.9130.5177.526.1-33.7000110A278P276-A278 PolarHBondContact O-N 3.18Å
277A48.6Very low50.1Low103 Ų103113.5 Ų113.585%0.85178%0.782SS**PPolyproline II helixtrans-62.1119.2177.600000110.1A275A275-A277 PolarHBondContact O-N 3.46Å
278A52.4Low49Very low83 Ų83113.1 Ų113.169%0.68678%0.778SS**SBendtrans-70.6134.3172.300000110.1P276P276-A278 PolarHBondContact O-N 3.18Å
279N52.2Low47.9Very low147 Ų147114.8 Ų114.879%0.78678%0.782SS**  trans80105.3173.7-46.5-45.5000116.6
280P51Low47Very low121 Ų121117.6 Ų117.679%0.78678%0.784SS**PPolyproline II helixtrans-69.8147.115331.6-33000110.1
281P53.7Low46.1Very low125 Ų125116.3 Ų116.381%0.81278%0.78SS**PPolyproline II helixtrans-66.7145.8171.828.5-33.8000111
282A46.8Very low45.4Very low93 Ų93118.3 Ų118.377%0.76978%0.781SS**PPolyproline II helixtrans-63145.1179.500000111.9A284A282-A284 PolarHBondContact O-N 3.21Å
283P42.3Very low44.5Very low127 Ų127118.5 Ų118.583%0.82579%0.785SS**PPolyproline II helixtrans-66127.2179.227.1-33.8000110.9
284A38.5Very low44.4Very low98 Ų98118.4 Ų118.481%0.8178%0.784SS**PPolyproline II helixtrans-63.4135.2173.600000110.6A282 S286A282-A284 PolarHBondContact O-N 3.21Å; A284-S286 PolarHBondContact O-N 3.23Å
285T40.3Very low43.5Very low141 Ų141120.7 Ų120.787%0.86579%0.79SS**PPolyproline II helixtrans-60.3123.4175.247.70000110.3S287T285-S287 PolarHBondContact O-N 3.04Å
286S36.4Very low42.6Very low113 Ų113120.2 Ų120.279%0.7979%0.793SS**PPolyproline II helixtrans-60.4125-176.749.70000112.2A284 T288A284-S286 PolarHBondContact O-N 3.23Å; S286-T288 PolarHBondContact O-N 3.04Å
287S36.7Very low41.8Very low113 Ų113120.8 Ų120.879%0.7979%0.794SS**PPolyproline II helixtrans-61.3129.5167.451.10000110.6T285T285-S287 PolarHBondContact O-N 3.04Å
288T39.6Very low41.3Very low119 Ų119122.4 Ų122.473%0.7379%0.794SS**PPolyproline II helixtrans-65.1130.1175.7390000111.7S286 H290S286-T288 PolarHBondContact O-N 3.04Å; T288-H290 PolarHBondContact O-N 2.78Å
289P38.8Very low40.6Very low126 Ų126123.1 Ų123.182%0.81880%0.8SS**  trans-77.8113166.730.2-30000109G291P289-G291 VanDerWaalsContact C-N 3.31Å; P289-G291 PolarHBondContact O-N 2.96Å
290H36.8Very low39.7Very low169 Ų169119.3 Ų119.378%0.78280%0.796SS**  trans-69.386.5172.3-106.7-73.6000110.5T288 H292T288-H290 PolarHBondContact O-N 2.78Å; H290-H292 PolarHBondContact O-N 3.28Å
291G35.1Very low39Very low68 Ų68122.1 Ų122.170%0.70180%0.803SS**  trans-72.698.3167.900000110.7P289 C293P289-G291 VanDerWaalsContact C-N 3.31Å; P289-G291 PolarHBondContact O-N 2.96Å; G291-C293 PolarHBondContact O-N 2.88Å
292H35Very low37.9Very low174 Ų174119.3 Ų119.381%0.80680%0.796SS**  trans-76.5106.7170-102.6-73.8000110.4H290 P294H290-H292 PolarHBondContact O-N 3.28Å; H292-P294 WeakPolarHBondContact O-CD 3.41Å
293C34.9Very low38.1Very low121 Ų121120.7 Ų120.782%0.81880%0.798SS**  trans-100.7110.5164.8-63.40000109.2G291G291-C293 PolarHBondContact O-N 2.88Å
294P52.8Low37.9Very low109 Ų109121.4 Ų121.471%0.70880%0.799SS**  trans-86.5118.716832.2-28.3000109.7H292H292-P294 WeakPolarHBondContact O-CD 3.41Å
295N37.3Very low37.7Very low172 Ų172120.9 Ų120.992%0.9280%0.795SS**  trans153.9115.2149.2-79.6-25.5000109.8
296G35.2Very low37.4Very low78 Ų78122.9 Ų122.980%0.80480%0.795SS**  trans169.359.6-177.300000116.7
297V34.5Very low37.1Very low136 Ų136123.4 Ų123.482%0.82479%0.792SS**  trans22115.6152.7-170.20000120.1
298T37.8Very low36.9Very low138 Ų138127.5 Ų127.585%0.84780%0.796SS**  trans-1.7111.7146.1-40.10000120.4
299A36.2Very low36.4Very low97 Ų97125.8 Ų125.880%0.80279%0.794SS**  trans-163.3132.2131.900000106.8
300G34.3Very low36.3Very low68 Ų68125.1 Ų125.170%0.70179%0.792SS**  cis104.695.724.800000108.6
301L35.2Very low36.9Very low180 Ų180122.7 Ų122.794%0.94279%0.791SS**  trans133115.9166.5-73.7172.7000113.2
302G31.1Very low36.9Very low65 Ų65126.5 Ų126.567%0.6780%0.801SS**  trans-116.5-150.5143.700000107.6
303P51.9Low36.8Very low123 Ų123122 Ų12280%0.79980%0.801SS**  cis-135153.4-27.138.6-23.9000113.2
304V37Very low36.5Very low141 Ų141120 Ų12086%0.85580%0.801SS**  trans-149.8124.9158.3179.60000106.5
305A34.7Very low35.4Very low87 Ų87118.5 Ų118.572%0.71981%0.806SS**  cis94.379.623.700000115.9
306E34.2Very low36.1Very low184 Ų184115.9 Ų115.986%0.8680%0.798SS**  trans-155.3130.6154.4-109.4179.614500106.8
307V30.8Very low36.2Very low123 Ų123124.1 Ų124.175%0.74581%0.805SS**  cis60.4118.641.2-179.70000109.4
308K32Very low36.1Very low200 Ų200121 Ų12187%0.8780%0.801SS**  cis-157.9176.214.6-130.8179.8-177.8179.90106.9
309A29.8Very low36.7Very low82 Ų82120.5 Ų120.568%0.67880%0.8SS**  cis-159.3170.3-1.400000110.2
310S35.3Very low36.7Very low112 Ų112121 Ų12178%0.78380%0.804SS**  trans-105166.3148.8-45.30000108.5
311P49.4Very low36.6Very low118 Ų118121.4 Ų121.477%0.76681%0.808SS**  -160.4172.382.742.9-22.6000119.1
312V34.7Very low37.5Very low148 Ų148118.9 Ų118.990%0.89780%0.802SS**  trans98.1136.1134.3112.10000122.4
313G33.8Very low37.7Very low80 Ų80120.1 Ų120.183%0.82581%0.806SS**  trans91.9124.7164.700000115.5
314G29.6Very low37Very low78 Ų78122.3 Ų122.380%0.80481%0.81SS**  cis173.3142.9-5.600000109.1
315G29.3Very low36.8Very low79 Ų79118.3 Ų118.381%0.81480%0.798SS**  trans-88-152.8-179.100000114
316P51.5Low37.2Very low117 Ų117126.2 Ų126.276%0.7681%0.809SS**  cis-146.9179.7-544-25.8000117.3
317R37Very low37.4Very low250 Ų250124.9 Ų124.994%0.94380%0.802SS**  trans61.8149.2160.7-69.2171.5165.5-177.9-6117.8
318G33.3Very low37.6Very low71 Ų71129.9 Ų129.973%0.73281%0.808SS**  cis140.817912.700000108.5
319P50.5Low37.8Very low128 Ų128123.6 Ų123.683%0.83180%0.8SS**  cis-138.7175.3-31.943.2-25.8000116.4
320A35.9Very low38.1Very low108 Ų108124.4 Ų124.489%0.89381%0.806SS**  trans52138.1142.900000126.4
321G32.3Very low37.9Very low76 Ų76122.6 Ų122.678%0.78481%0.806SS**  trans178.5135.4159.500000114.5
322P54.4Low37.2Very low127 Ų127129.2 Ų129.283%0.82582%0.816SS**  trans-135.7175.9-159.143.7-27.4000119.9
323A35.2Very low37.1Very low90 Ų90126 Ų12674%0.74481%0.813SS**  trans68.9162.615700000117.9
324L36.8Very low37Very low169 Ų169126.2 Ų126.289%0.88582%0.815SS**  cis-134.5179.9-2.2-74.287.5000108.5
325G33.6Very low37.3Very low58 Ų58126.1 Ų126.160%0.59881%0.814SS**  cis136.9109.8-14.200000116.8
326R42.9Very low37.7Very low252 Ų252134 Ų13495%0.95182%0.819SS**  trans75.4161.9169.2-39.8-175.5-167.2-76.9-1.4115.7
327H37.6Very low37Very low156 Ų156137.2 Ų137.272%0.72282%0.823SS**  cis-155.9162.85.4106.6-30.4000113.5
328W35.4Very low36.7Very low229 Ų229136 Ų13687%0.86782%0.82SS**  trans28145.1149.2-107.4-96.1000122.3
329G35.9Very low37.5Very low67 Ų67137.9 Ų137.969%0.69182%0.819SS**  cis169.4179.6-1.800000115.7
330A36.3Very low37Very low99 Ų99139.3 Ų139.382%0.81882%0.815SS**  trans3.2139.4174.300000123.9
331G30.3Very low37Very low75 Ų75142.6 Ų142.677%0.77381%0.814SS**  trans-168.283.6168.300000115
332W35.2Very low37.2Very low256 Ų256144.8 Ų144.897%0.9781%0.808SS**  trans-15.9142.7157.1-49.758.3000115.7
333G31.8Very low36.6Very low81 Ų81143.7 Ų143.784%0.83581%0.81SS**  cis165.4-177.16.700000109.5
334G33.3Very low36.7Very low85 Ų85150.1 Ų150.188%0.87682%0.815SS**  trans121.494.2173.500000114
335G35.5Very low36.6Very low75 Ų75150.9 Ų150.977%0.77381%0.814SS**  trans-88.3167.4-177.400000114.7
336R36.5Very low36.7Very low246 Ų246156.4 Ų156.493%0.92882%0.824SS**  trans-149.5126.9145.4-113.2-176.5-78.9-99.55.6108.3
337H36.9Very low36.3Very low183 Ų183155.2 Ų155.285%0.84782%0.819SS**  trans-70.2143.4170.3-68.3-107000109.6
338Y31.6Very low36.2Very low226 Ų226154.3 Ų154.389%0.88683%0.825SS**  -163.4151.2120.6-110.6-89.4000107
339P49.6Very low36.1Very low109 Ų109151.6 Ų151.671%0.70882%0.822SS**  trans-98.4172.9-164.237.9-30.2000113.7
340E39.3Very low36.4Very low158 Ų158155 Ų15574%0.73883%0.829SS**  trans13.9132.5139.3-138.875.5-163.100118.2
341M36.2Very low36.3Very low178 Ų178157.7 Ų157.788%0.87783%0.828SS**  -170.9133.7121.2-91.8-84.8137.900110.3
342D37.7Very low36.8Very low121 Ų121159.4 Ų159.465%0.64783%0.826SS**  trans-40.7139.2-173.8-80.1-46.4000117.9R344D342-R344 HydrophobicContact CB-CG 4.48Å; D342-R344 PolarHBondContact O-N 3.06Å
343A40.1Very low36.8Very low105 Ų105156.7 Ų156.787%0.86882%0.824SS**  trans-72.4104.7156.500000110.3
344R37.7Very low36.7Very low224 Ų224157.3 Ų157.385%0.84582%0.822SS**  trans-105.899.9163.5-73.7-163.1174.2-94.1-7.7111.3D342 E346D342-R344 HydrophobicContact CB-CG 4.48Å; D342-R344 PolarHBondContact O-N 3.06Å; R344-E346 PolarHBondContact O-N 2.99Å
345Q36.1Very low36.8Very low185 Ų185164.1 Ų164.186%0.86482%0.821SS**  trans-69.2106.2168.5-179.4134.120.300110.1
346E33.9Very low36.6Very low174 Ų174164.5 Ų164.581%0.81382%0.816SS**  trans-80.6133.7166.9-166.4171.317400110.1R344R344-E346 PolarHBondContact O-N 2.99Å
347R35.8Very low36.6Very low227 Ų227157 Ų15786%0.85780%0.802SS**  trans-88.1112.1175.9-67.9176.6169.8-169.4-3.9108.2E349R347-E349 PolarHBondContact O-N 2.93Å; R347-E349 VanDerWaalsContact O-N 3.11Å
348V34.3Very low36.4Very low138 Ų138160.2 Ų160.284%0.83681%0.806SS**  trans-75.2102.6162.6178.60000107.7V350V348-V350 PolarHBondContact O-N 2.93Å
349E34.5Very low36.6Very low172 Ų172156.8 Ų156.880%0.80480%0.799SS**  trans-71.9120.1-178.6-167.8162.1-144.600110.3R347 L351R347-E349 PolarHBondContact O-N 2.93Å; R347-E349 VanDerWaalsContact O-N 3.11Å; E349-L351 PolarHBondContact O-N 3.3Å
350V42.4Very low35.9Very low139 Ų139157.2 Ų157.284%0.84280%0.804SS**  trans-76.5107.8173.1173.20000108.3V348V348-V350 PolarHBondContact O-N 2.93Å
351L34.4Very low35.7Very low154 Ų154156.8 Ų156.881%0.80681%0.806SS**  trans-111.8126.9168.9-160.372.9000110E349E349-L351 PolarHBondContact O-N 3.3Å
352P40.3Very low35.8Very low111 Ų111156.3 Ų156.372%0.72181%0.807SS**PPolyproline II helixtrans-75.9129.3-175.229.8-34.3000111.5
353Q33.9Very low36Very low199 Ų199158.4 Ų158.493%0.9381%0.813SS**PPolyproline II helixtrans-73.8133.7178.3-157.4170.626.100111
354A30.8Very low36.1Very low95 Ų95159.6 Ų159.679%0.78580%0.801SS**PPolyproline II helixtrans-65.5133-169.900000113.3A356A354-A356 PolarHBondContact O-N 2.8Å; A354-A356 VanDerWaalsContact O-N 3.12Å
355R35.5Very low35.8Very low228 Ų228160.7 Ų160.786%0.8681%0.805SS**  trans-75.392.8172.5-178.2178.2177.8-176.2-3.6110S357R355-S357 PolarHBondContact O-N 3.01Å
356A31.9Very low35.7Very low82 Ų82161.1 Ų161.168%0.67880%0.799SS**  trans-73.3120.416700000109.7A354A354-A356 PolarHBondContact O-N 2.8Å; A354-A356 VanDerWaalsContact O-N 3.12Å
357S36.4Very low36.1Very low89 Ų89156.7 Ų156.762%0.62279%0.791SS**  trans-80.9125.3-178.6-172.90000111.1R355R355-S357 PolarHBondContact O-N 3.01Å
358W32.6Very low36.3Very low250 Ų250151.7 Ų151.795%0.94779%0.789SS**  trans-124.878.6163.3-68.8108.5000108.5
359E36.1Very low36.4Very low155 Ų155153.6 Ų153.672%0.72479%0.788SS**  trans-119.8139.1167.1-77.2-176.567.500109
360S35Very low36.8Very low117 Ų117148.8 Ų148.882%0.81878%0.778SS**  trans78.698.1170.5-150.30000118.2
361L34.3Very low36.7Very low149 Ų149150.8 Ų150.878%0.7878%0.778SS**  -165.187.2101.7-147.5106.6000111.8
362D37.4Very low36.7Very low168 Ų168149.1 Ų149.190%0.89878%0.779SS**  trans-114.977169.7-82.8-53.6000109.4E364D362-E364 PolarHBondContact O-N 3.02Å
363E43.4Very low37Very low166 Ų166155.7 Ų155.778%0.77679%0.79SS**  trans-82.1106.6179.6-160.272.4-177.500111.1
364E42.3Very low37.4Very low129 Ų129152.3 Ų152.360%0.60378%0.783SS**  trans44.578.8151.8-159.8172.1-153.300119.4D362 R366D362-E364 PolarHBondContact O-N 3.02Å; E364-R366 HydrophobicContact CG-CB 4.29Å; E364-R366 HydrophobicContact CG-CG 3.62Å; E364-R366 PolarHBondContact O-N 2.75Å; E364-R366 WeakPolarHBondContact OE1-CG 3.44Å; E364-R366 IonicContact OE1-NE 3.27Å; E364-R366 PolarHBondContact OE1-NE 3Å
365W29.7Very low38Very low247 Ų247153.7 Ų153.794%0.93678%0.784SS**  trans-83.984.1151.9-167.2-97.9000111.4A367W365-A367 PolarHBondContact O-N 3.26Å
366R34.8Very low38.5Very low195 Ų195149.1 Ų149.174%0.73678%0.781SS**PPolyproline II helixtrans-65.5124.6171.4-95.7-87-162143.76.1111.4E364E364-R366 HydrophobicContact CG-CB 4.29Å; E364-R366 HydrophobicContact CG-CG 3.62Å; E364-R366 PolarHBondContact O-N 2.75Å; E364-R366 WeakPolarHBondContact OE1-CG 3.44Å; E364-R366 IonicContact OE1-NE 3.27Å; E364-R366 PolarHBondContact OE1-NE 3Å
367A42.2Very low38.9Very low80 Ų80150.8 Ų150.866%0.66179%0.785SS**PPolyproline II helixtrans-65.7137.7171.400000111.8W365 Q369W365-A367 PolarHBondContact O-N 3.26Å; A367-Q369 PolarHBondContact O-N 3.37Å
368P39.8Very low39.7Very low123 Ų123151.9 Ų151.980%0.79979%0.792SS**PPolyproline II helixtrans-75.2121.4173.628.1-30.1000110.8
369Q37.1Very low40.6Very low177 Ų177146.3 Ų146.383%0.82779%0.786SS**PPolyproline II helixtrans-62.8148167-83.8-80.711.300110.6A367A367-Q369 PolarHBondContact O-N 3.37Å
370A42.4Very low40.9Very low72 Ų72146 Ų14660%0.59579%0.794SS**PPolyproline II helixtrans-66.3145167.900000110.2
371H40.8Very low41.4Very low180 Ų180148.7 Ų148.783%0.83379%0.794SS**  trans15895.2140-75.9-11.8000111.4
372S33.2Very low41.9Very low119 Ų119146.4 Ų146.483%0.83280%0.796SS**  trans-174.1131.613833.70000110.1
373R48.4Very low42.1Very low250 Ų250144.8 Ų144.894%0.94379%0.788SS**  trans-76.9134168.3-85.4172.8159.1179.1-6.7108.8
374T40.7Very low42.1Very low127 Ų127143.1 Ų143.178%0.77979%0.789SS**  trans-130.1152.3155.146.60000109.3
375P43.6Very low42Very low124 Ų124145.9 Ų145.981%0.80580%0.8SS**PPolyproline II helixtrans-83.6142.2-166.4-0.818.8000112.1
376V45.8Very low42.7Very low132 Ų132142.9 Ų142.980%0.880%0.796SS**PPolyproline II helixtrans-77.9128.3172-179.30000109.5S378V376-S378 PolarHBondContact O-N 3.38Å
377P41.8Very low42.9Very low118 Ų118143.4 Ų143.477%0.76680%0.804SS**PPolyproline II helixtrans-72.7118.5169.829.2-32.3000110.3T379P377-T379 PolarHBondContact O-N 2.74Å
378S53.2Low43Very low111 Ų111144 Ų14478%0.77681%0.809SS**  trans-91.882.7-177.359.20000112.7V376V376-S378 PolarHBondContact O-N 3.38Å
379T51.1Low43.5Very low133 Ų133146.1 Ų146.182%0.81681%0.813SS**  trans-159.589.2163.436.10000112.9P377P377-T379 PolarHBondContact O-N 2.74Å
380V41.1Very low44.2Very low148 Ų148142 Ų14290%0.89781%0.81SS**  trans-136.3121.9146.3-178.70000107.2
381Q45.6Very low44.8Very low175 Ų175147.1 Ų147.182%0.81882%0.821SS**  trans-68.3134.5177.5-70165.8-57.200109.9N383Q381-N383 PolarHBondContact O-N 2.92Å; Q381-N383 VanDerWaalsContact O-N 3.1Å
382A45.3Very low45.4Very low100 Ų100147.5 Ų147.583%0.82682%0.824SS**  trans-75.394.616700000109T384A382-T384 PolarHBondContact O-N 2.79Å
383N42.2Very low46.5Very low135 Ų135149.1 Ų149.172%0.72282%0.823SS**  trans-76.1101.8164.1-92.72.6000108.8Q381 F385Q381-N383 PolarHBondContact O-N 2.92Å; Q381-N383 VanDerWaalsContact O-N 3.1Å; N383-F385 PolarHBondContact O-N 3.09Å
384T42.3Very low47Very low130 Ų130144.4 Ų144.480%0.79882%0.816SS**  trans-54.4121.7158.1-670000108.6A382 E386A382-T384 PolarHBondContact O-N 2.79Å; T384-E386 PolarHBondContact O-N 3.44Å
385F41.1Very low47.9Very low188 Ų188145.1 Ų145.183%0.82581%0.811SS**  trans-81.4110.6165.3-89.3-94.5000108.5N383N383-F385 PolarHBondContact O-N 3.09Å
386E44.1Very low48.3Very low183 Ų183145.9 Ų145.986%0.85581%0.813SS**  trans-83126.6168.4-167.3167.4-141.800108.2T384 A388T384-E386 PolarHBondContact O-N 3.44Å; E386-A388 PolarHBondContact O-N 3.47Å
387F39.1Very low48.7Very low206 Ų206147 Ų14790%0.90481%0.807SS**  trans-79.5115173.1-92.5-101000108.6
388A44.1Very low49.2Very low93 Ų93151.4 Ų151.477%0.76983%0.832SS**  trans-89.3109.9164.300000108.7E386E386-A388 PolarHBondContact O-N 3.47Å
389D50.5Low49Very low167 Ų167153.5 Ų153.589%0.89383%0.834SS**  trans-66.5131.3158.9-99.2-33.3000108.4
390A51.3Low48.9Very low92 Ų92154.5 Ų154.576%0.7684%0.835SS**  trans-13299.1169.600000107.7
391E55.2Low49.3Very low178 Ų178154.9 Ų154.983%0.83283%0.832SS**  trans-73.1127.9163.4-68.4-163.4142.300109
392E54.2Low49.5Very low189 Ų189153.7 Ų153.788%0.88383%0.833SS**  trans-113.591.1158.5-79.7-173.614300107.9D394E392-D394 PolarHBondContact O-N 3.24Å
393D54.6Low49.8Very low152 Ų152157.1 Ų157.181%0.81383%0.833SS**  trans-71.3109.7158.5-102-29.5000108.2
394D59Low50.3Low151 Ų151158.5 Ų158.581%0.80784%0.841SS**  trans-104.696.9170.8-125.1-25000110.1E392 V396E392-D394 PolarHBondContact O-N 3.24Å; D394-V396 PolarHBondContact O-N 3.33Å
395E59.8Low50.8Low142 Ų142160.6 Ų160.666%0.66484%0.844SS**  trans-72.2103.4-175.4-170.5-164.6168.100111.2K397E395-K397 PolarHBondContact O-N 3.04Å; E395-K397 WeakPolarHBondContact OE1-CE 3.1Å; E395-K397 IonicContact OE1-NZ 2.84Å; E395-K397 PolarHBondContact OE1-NZ 3.42Å; E395-K397 IonicContact OE2-NZ 2.84Å; E395-K397 PolarHBondContact OE2-NZ 3.27Å
396V51.9Low51.6Low141 Ų141158.5 Ų158.586%0.85585%0.845SS**  trans-71.796.9176.9-163.50000110.5D394D394-V396 PolarHBondContact O-N 3.33Å
397K55.1Low52.2Low154 Ų154156.4 Ų156.467%0.6784%0.844SS**  trans-77.4142.6174.9-100.1175.2179.8106.20113E395E395-K397 PolarHBondContact O-N 3.04Å; E395-K397 WeakPolarHBondContact OE1-CE 3.1Å; E395-K397 IonicContact OE1-NZ 2.84Å; E395-K397 PolarHBondContact OE1-NZ 3.42Å; E395-K397 IonicContact OE2-NZ 2.84Å; E395-K397 PolarHBondContact OE2-NZ 3.27Å
398V51.6Low53.4Low212 Ų212151.9 Ų151.9100%1.28584%0.839SS**  trans-71.10-164.5-156.50000113.9

Retrieved 398 of 398 residues in 497.2 ms (Link to these results)