A0A060CWZ9_MAIZE Loading...

AP2-EREBP transcription factor

AlphaFold DB , UniProt , Accession A0A060CWZ9, Species MAIZE (Zea mays, Maize), Gene EREB61, Length 356 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
1M63.4Low56.4Low243 Ų243129.8 Ų129.8100%1.19778%0.777SS**  0135.10-69.7158.5172.900107.1
2A48.9Very low56.7Low93 Ų93128.8 Ų128.877%0.76976%0.763SS**  trans-96.1133.3-17900000110.1
3F49.1Very low56.8Low212 Ų212126.2 Ų126.293%0.9374%0.743SS**  trans-98.796.1168.4-100.4-93.3000108.4
4T54.9Low57.2Low132 Ų132126.6 Ų126.681%0.8173%0.732SS**  trans-83.8106.7161.144.20000107.6
5G53.4Low57.5Low78 Ų78124.9 Ų124.980%0.80472%0.717SS**  trans-76.6140.3173.100000110.9
6D55.3Low57.9Low155 Ų155127.4 Ų127.483%0.82971%0.712SS**  trans-129.3111.1172.1-168.4-5.6000107.2
7A59.5Low58.1Low86 Ų86128.7 Ų128.771%0.71171%0.711SS**  trans-142-3.2-167.400000114
8D60.6Low58.4Low125 Ų125128.8 Ų128.867%0.66871%0.705SS**  trans-100.3-11.2-166.5-65-50.4000114.1
9G59.9Low58.6Low40 Ų40129.6 Ų129.641%0.41271%0.707SS.*Hα-helixtrans-60.7-55.2-174.800000114.5A11 L12 D13G9-A11 PolarHBondContact O-N 3.27Å; G9-A11 VanDerWaalsContact O-N 3.12Å; G9-L12 PolarHBondContact O-N 3.39Å; G9-L12 VanDerWaalsContact O-N 3.1Å; G9-D13 PolarHBondContact O-N 3.33Å
10F55.5Low58.5Low198 Ų198129.6 Ų129.687%0.86871%0.706SS**Hα-helixtrans-62.8-23.6-173.5-72.6-79000114.5
11A59.3Low57.9Low66 Ų66127 Ų12755%0.54571%0.709SS.*Hα-helixtrans-78.3-25.5178.800000113G9 I15G9-A11 PolarHBondContact O-N 3.27Å; G9-A11 VanDerWaalsContact O-N 3.12Å; A11-I15 WeakPolarHBondContact O-CD1 3.35Å; A11-I15 WeakPolarHBondContact O-CG1 3.36Å
12L60Low57.4Low117 Ų117120.2 Ų120.261%0.61369%0.692SS**Hα-helixtrans-88.7-40.2-176.5-72.5176.3000112.9G9 F14 I15 R16G9-L12 PolarHBondContact O-N 3.39Å; G9-L12 VanDerWaalsContact O-N 3.1Å; L12-F14 PolarHBondContact O-N 2.94Å; L12-I15 PolarHBondContact O-N 3.27Å; L12-I15 VanDerWaalsContact O-N 3.17Å; L12-R16 WeakPolarHBondContact O-CB 3.08Å; L12-R16 PolarHBondContact O-N 3.18Å
13D58.4Low57Low95 Ų95119.3 Ų119.351%0.50869%0.691SS.*Hα-helixtrans-67.9-35.1-177.8-77.8-36.9000112.9G9 I15 R16 E17G9-D13 PolarHBondContact O-N 3.33Å; D13-I15 VanDerWaalsContact C-N 3.26Å; D13-I15 PolarHBondContact O-N 3.2Å; D13-R16 WeakPolarHBondContact O-CA 3.45Å; D13-R16 WeakPolarHBondContact O-CB 3.18Å; D13-R16 PolarHBondContact O-N 3.46Å; D13-R16 IonicContact OD1-NH1 2.67Å; D13-E17 PolarHBondContact O-N 3.31Å
14F63.1Low57.2Low133 Ų133115.4 Ų115.458%0.58369%0.689SS**Hα-helixtrans-63.4-30.6173.2-173.6-101.7000113.1L12L12-F14 PolarHBondContact O-N 2.94Å
15I60.5Low56.6Low100 Ų100113.1 Ų113.151%0.51369%0.692SS.*Hα-helixtrans-75.3-37173-63172.5000110A11 L12 D13 L19A11-I15 WeakPolarHBondContact O-CD1 3.35Å; A11-I15 WeakPolarHBondContact O-CG1 3.36Å; L12-I15 PolarHBondContact O-N 3.27Å; L12-I15 VanDerWaalsContact O-N 3.17Å; D13-I15 VanDerWaalsContact C-N 3.26Å; D13-I15 PolarHBondContact O-N 3.2Å; I15-L19 PolarHBondContact O-N 3.45Å; I15-L19 VanDerWaalsContact O-N 3.15Å
16R63.8Low56.3Low166 Ų166112.7 Ų112.763%0.62669%0.688SS**Hα-helixtrans-66.4-43.6-178.9-157.8176.7-172.4-171.30.7112.4L12 D13 H18 L20L12-R16 WeakPolarHBondContact O-CB 3.08Å; L12-R16 PolarHBondContact O-N 3.18Å; D13-R16 WeakPolarHBondContact O-CA 3.45Å; D13-R16 WeakPolarHBondContact O-CB 3.18Å; D13-R16 PolarHBondContact O-N 3.46Å; D13-R16 IonicContact OD1-NH1 2.67Å; R16-H18 VanDerWaalsContact C-N 3.27Å; R16-H18 PolarHBondContact O-N 3.37Å; R16-L20 HydrophobicContact CG-CD1 4.44Å; R16-L20 PolarHBondContact O-N 2.94Å
17E61.6Low56.4Low149 Ų149112.7 Ų112.770%0.69669%0.688SS**Hα-helixtrans-71.3-15.7-178.1-169.2172.4-149.400113.9D13D13-E17 PolarHBondContact O-N 3.31Å
18H63.5Low56.2Low131 Ų131114.5 Ų114.561%0.60669%0.692SS**Hα-helixtrans-118-12.2-176.3-75.38.7000115.4R16R16-H18 VanDerWaalsContact C-N 3.27Å; R16-H18 PolarHBondContact O-N 3.37Å
19L61.9Low55.8Low143 Ų143115.6 Ų115.675%0.74970%0.698SS**Hα-helixtrans-111.7-14.6175.7-104.167.3000114.8I15I15-L19 PolarHBondContact O-N 3.45Å; I15-L19 VanDerWaalsContact O-N 3.15Å
20L57.1Low55.6Low129 Ų129119.3 Ų119.368%0.67572%0.715SS**SBendtrans-117.394.3173.8-72.7165.6000108.4R16 A22R16-L20 HydrophobicContact CG-CD1 4.44Å; R16-L20 PolarHBondContact O-N 2.94Å; L20-A22 PolarHBondContact O-N 3.44Å
21G47.1Very low55.5Low76 Ų76115.8 Ų115.878%0.78471%0.709SS**  trans-58.1133.7-176.100000112.3
22A52.1Low54.5Low100 Ų100120.9 Ų120.983%0.82672%0.721SS**  trans-55.7142.7168.800000109.9L20L20-A22 PolarHBondContact O-N 3.44Å
23G40.4Very low53.6Low74 Ų74121.4 Ų121.476%0.76373%0.733SS**  cis105.424.122.500000112.2G25G23-G25 PolarHBondContact O-N 2.8Å
24C52.5Low53Low131 Ų131122.1 Ų122.189%0.88574%0.741SS**  trans-66111167.6-58.90000109.3
25G42.6Very low52Low83 Ų83121.6 Ų121.686%0.85675%0.749SS**  trans-71.8146.816800000111.4G23G23-G25 PolarHBondContact O-N 2.8Å
26G47Very low51.4Low70 Ų70124.2 Ų124.272%0.72276%0.764SS**  trans-161.7135.6172.100000108.8
27D58.1Low50.7Low155 Ų155123.5 Ų123.583%0.82977%0.771SS**  trans-77.7154.3-162.4-61.9-86.1000114.7D29D27-D29 PolarHBondContact O-N 2.83Å
28P55.1Low50.2Low124 Ų124124.7 Ų124.781%0.80578%0.783SS**  trans-93.691.3-177.335.7-33.5000113.2
29D52.9Low49.9Very low148 Ų148121.4 Ų121.479%0.79178%0.784SS**  trans-89.1124.4171.2-96.3-37.9000112.7D27D27-D29 PolarHBondContact O-N 2.83Å
30P54.2Low49.6Very low118 Ų118122.5 Ų122.577%0.76679%0.791SS**  trans-99.288.5-172.936.6-33.8000113.8
31V53.7Low49.5Very low124 Ų124122.5 Ų122.575%0.75279%0.791SS**  trans-126.377.3176.8-74.20000114.7C33V31-C33 PolarHBondContact O-N 3.46Å
32H39.6Very low49.8Very low173 Ų173126 Ų12680%0.80179%0.791SS**  trans24.883.8134.7-166-66.7000118.3
33C40.8Very low50.6Low127 Ų127126.6 Ų126.686%0.85878%0.784SS**  trans-106.5135.3157.9-76.50000110V31V31-C33 PolarHBondContact O-N 3.46Å
34T45.6Very low51.5Low110 Ų110131 Ų13168%0.67578%0.783SS**  trans-74.6158.3-172.224.30000114
35V41Very low52.2Low123 Ų123130.4 Ų130.475%0.74578%0.777SS**  trans-69.3134.5163.6-77.70000110.8
36D49.6Very low53.5Low154 Ų154133.1 Ų133.182%0.82478%0.777SS**  trans-127.9135.5152.8-78.2-61.6000106.9
37L49.2Very low54.6Low151 Ų151137.1 Ų137.179%0.79178%0.781SS**  trans-131.3100.5-168.7-77.9167.3000109.6
38D50Low55.5Low174 Ų174135 Ų13593%0.9378%0.775SS**  trans-153.6154.8174.3-85.1-54.1000110.4
39G57.3Low56.4Low62 Ų62134 Ų13464%0.63977%0.769SS**  trans108.240.615400000120.7
40D55.2Low57.2Low167 Ų167133 Ų13389%0.89377%0.77SS**  trans59.3169.1134.6-62.3-56000124.2
41D56.2Low57.7Low128 Ų128135.5 Ų135.568%0.68477%0.772SS**  trans65.373.1165.6-148.6-19.3000120T43D41-T43 PolarHBondContact O-N 3.16Å; D41-T43 VanDerWaalsContact OD1-CB 3.29Å; D41-T43 WeakPolarHBondContact OD1-CB 3.23Å; D41-T43 PolarHBondContact OD1-N 3.18Å; D41-T43 VanDerWaalsContact OD1-N 3.08Å; D41-T43 PolarHBondContact OD1-OG1 3.1Å
42I53.7Low58.2Low150 Ų150134.7 Ų134.777%0.76977%0.769SS**  trans-87.363.816049.9168.4000112.3F44I42-F44 HydrophobicContact CD1-CE2 4.16Å; I42-F44 WeakPolarHBondContact O-CD2 3.47Å; I42-F44 PolarHBondContact O-N 3.06Å
43T68.2Low59.1Low112 Ų112135.5 Ų135.569%0.68777%0.773SS**  trans-62.9105.1172.3-78.50000111.7D41D41-T43 PolarHBondContact O-N 3.16Å; D41-T43 VanDerWaalsContact OD1-CB 3.29Å; D41-T43 WeakPolarHBondContact OD1-CB 3.23Å; D41-T43 PolarHBondContact OD1-N 3.18Å; D41-T43 VanDerWaalsContact OD1-N 3.08Å; D41-T43 PolarHBondContact OD1-OG1 3.1Å
44F59.1Low59.9Low168 Ų168139.3 Ų139.374%0.73778%0.776SS**PPolyproline II helixtrans-74.7133.1173.2-76.1-91.6000111.4I42 V46I42-F44 HydrophobicContact CD1-CE2 4.16Å; I42-F44 WeakPolarHBondContact O-CD2 3.47Å; I42-F44 PolarHBondContact O-N 3.06Å; F44-V46 PolarHBondContact O-N 2.87Å
45P67.3Low61Low118 Ų118141.7 Ų141.777%0.76678%0.779SS**PPolyproline II helixtrans-68.9122.3171.328.1-33000110.6L47P45-L47 PolarHBondContact O-N 2.97Å
46V70.6Confident62.4Low139 Ų139141 Ų14184%0.84278%0.777SS**PPolyproline II helixtrans-62.7129.6179.81730000110.9F44F44-V46 PolarHBondContact O-N 2.87Å
47L70.3Confident63.5Low155 Ų155141.9 Ų141.981%0.81278%0.778SS**PPolyproline II helixtrans-67.8136.9173.2-71.3169.3000110.7P45P45-L47 PolarHBondContact O-N 2.97Å
48P75.1Confident64.7Low109 Ų109140.3 Ų140.371%0.70878%0.777SS**PPolyproline II helixtrans-65.4146.5173.128.6-34.4000110.7
49P73.9Confident65.8Low104 Ų104142.2 Ų142.268%0.67578%0.778SS**PPolyproline II helixtrans-65.5150179.727.9-35000111.6Q51P49-Q51 PolarHBondContact O-N 3.08Å
50P71.3Confident66.7Low126 Ų126146.9 Ų146.982%0.81879%0.787SS**PPolyproline II helixtrans-61134.6177.626.3-34.2000110.9
51Q63.9Low67.9Low172 Ų172144.1 Ų144.180%0.80478%0.778SS**PPolyproline II helixtrans-66.3144.1171.4-67.9-68.7-70.100110P49P49-Q51 PolarHBondContact O-N 3.08Å
52P63.6Low69.1Low107 Ų107143.6 Ų143.670%0.69578%0.782SS**PPolyproline II helixtrans-64158.1175.628.4-35000111.7F54P52-F54 PolarHBondContact O-N 3.21Å
53E59.1Low70.5Confident190 Ų190142.1 Ų142.189%0.88878%0.782SS**PPolyproline II helixtrans-62.3126.4-167.8-68.2147.3135.500112.8E55E53-E55 PolarHBondContact O-N 3.07Å; E53-E55 VanDerWaalsContact O-N 3.1Å
54F58.5Low71.2Confident206 Ų206142.2 Ų142.290%0.90479%0.785SS**  trans-76.596172-120.5-88.3000109P52P52-F54 PolarHBondContact O-N 3.21Å
55E67.1Low72.3Confident161 Ų161139.9 Ų139.975%0.75279%0.786SS**  trans-47.1120.7170.1-87.3-70.4164.800110.5E53 M57E53-E55 PolarHBondContact O-N 3.07Å; E53-E55 VanDerWaalsContact O-N 3.1Å; E55-M57 PolarHBondContact O-N 3.27Å
56P71.9Confident72.7Confident109 Ų109139.7 Ų139.771%0.70879%0.785SS**  trans-73.4101.2-174.928.6-33.7000110.1
57M72.2Confident72.6Confident171 Ų171138.2 Ų138.284%0.84278%0.778SS**  trans-51.4129.6176.4-74.4-154.9-67.700110.9E55 F59E55-M57 PolarHBondContact O-N 3.27Å; M57-F59 PolarHBondContact O-N 3.36Å
58P74.7Confident72.5Confident118 Ų118139.9 Ų139.977%0.76678%0.782SS**  trans-64127.5-172.124.4-33.8000110.9L60P58-L60 PolarHBondContact O-N 3.19Å
59F72.7Confident71.5Confident215 Ų215142 Ų14294%0.94378%0.782SS**  trans-60.8107.2177.4-111.1-96.5000110.3M57M57-F59 PolarHBondContact O-N 3.36Å
60L76.8Confident70.6Confident159 Ų159146 Ų14683%0.83279%0.792SS**PPolyproline II helixtrans-65128.2168.6-77.3168000109.2P58P58-L60 PolarHBondContact O-N 3.19Å
61P80.7Confident69.7Low109 Ų109148.5 Ų148.571%0.70879%0.792SS**PPolyproline II helixtrans-67.2147.2176.728.2-34.2000110.7
62P81.2Confident69Low118 Ų118148.9 Ų148.977%0.76679%0.794SS**PPolyproline II helixtrans-65.9147.4178.128.3-34.9000111.4
63P82Confident68.1Low119 Ų119147.1 Ų147.177%0.77380%0.795SS**PPolyproline II helixtrans-66.5149.6177.928.5-35.1000111.8
64P83.7Confident67.5Low114 Ų114149 Ų14974%0.7480%0.796SS**PPolyproline II helixtrans-68.2153.4178.729.2-35.5000112.3
65P81.2Confident67.1Low118 Ų118146.3 Ų146.377%0.76679%0.789SS**PPolyproline II helixtrans-68.3150.4177.329.5-35.4000112.1
66P76.8Confident66.6Low115 Ų115142.1 Ų142.175%0.74779%0.79SS**PPolyproline II helixtrans-68148.9178.128.7-35.2000112.2Q68P66-Q68 PolarHBondContact O-N 3.15Å
67P68.5Low65.8Low108 Ų108143 Ų14370%0.70179%0.793SS**PPolyproline II helixtrans-69.6123.3-175.527.4-34.5000112.3H69P67-H69 PolarHBondContact O-N 3.27Å; P67-H69 PolarHBondContact O-ND1 2.98Å; P67-H69 VanDerWaalsContact O-ND1 3.16Å
68Q68.2Low64.8Low189 Ų189143 Ų14388%0.88380%0.796SS**  trans-63.6114.2175.7-68-178.6-14.300110.5P66 Q70P66-Q68 PolarHBondContact O-N 3.15Å; Q68-Q70 PolarHBondContact O-N 2.94Å
69H54.2Low64.2Low153 Ų153142.2 Ų142.271%0.70879%0.791SS**  trans-75.6121.2170.7-7749.9000109.3P67 H71P67-H69 PolarHBondContact O-N 3.27Å; P67-H69 PolarHBondContact O-ND1 2.98Å; P67-H69 VanDerWaalsContact O-ND1 3.16Å; H69-H71 PolarHBondContact O-N 2.75Å
70Q53.5Low63.2Low189 Ų189138.5 Ų138.588%0.88379%0.786SS**  trans-75.2104.9177.2-65.8179.9-1.700109.3Q68 Q72Q68-Q70 PolarHBondContact O-N 2.94Å; Q70-Q72 PolarHBondContact O-N 3.42Å
71H53Low62Low179 Ų179138.7 Ų138.783%0.82979%0.788SS**  trans-84.5110.4170.7-79.1-64.6000110.6H69 G73H69-H71 PolarHBondContact O-N 2.75Å; H71-G73 PolarHBondContact O-N 2.87Å
72Q49.2Very low60.5Low180 Ų180142.5 Ų142.584%0.84180%0.796SS**PPolyproline II helixtrans-55.7119.1172-16381.47.100110Q70 Y74Q70-Q72 PolarHBondContact O-N 3.42Å; Q72-Y74 PolarHBondContact O-N 2.82Å
73G45Very low59.2Low70 Ų70147.9 Ų147.972%0.72280%0.803SS**PPolyproline II helixtrans-67.8123.9174.400000111H71H71-G73 PolarHBondContact O-N 2.87Å
74Y47.2Very low57.9Low230 Ų230150.4 Ų150.490%0.90281%0.807SS**PPolyproline II helixtrans-81.9147177-138.9-93.2000110.9Q72Q72-Y74 PolarHBondContact O-N 2.82Å
75I49.7Very low56.2Low148 Ų148148.2 Ų148.276%0.75980%0.804SS**PPolyproline II helixtrans-83.2121.7-176.9-55.6170.6000109.2
76G55.8Low54.7Low74 Ų74151 Ų15176%0.76381%0.807SS**PPolyproline II helixtrans-87135.2167.900000110.8
77V56.2Low53.5Low128 Ų128150.2 Ų150.278%0.77680%0.802SS**  trans-111.7130.3179-75.50000110.8
78D49.6Very low52.4Low170 Ų170149.8 Ų149.891%0.90981%0.808SS**  trans-82.8130.1170-92.4-41.2000110.8
79P63.3Low51.5Low101 Ų101144.9 Ų144.966%0.65680%0.799SS**  trans-107.7171.6170.339-31.6000113.2
80T51.1Low51.2Low137 Ų137144.3 Ų144.384%0.8481%0.806SS**  trans61.173.316447.40000117.2
81N52Low51.2Low163 Ų163144 Ų14487%0.87280%0.802SS**  trans-86.6111.4149.8-177.130.5000108.6
82E49.8Very low51.3Low189 Ų189141 Ų14188%0.88380%0.799SS**  trans-170.5110.6166.1-117.2172.7-128.300112.7
83Y52.9Low51.5Low232 Ų232141.9 Ų141.991%0.9180%0.803SS**  trans-151.6152.7155.6-164.5-99.6000110.5
84M54.3Low51.8Low172 Ų172147.3 Ų147.385%0.84781%0.81SS**  trans-98.4153.5-160.4-72-85.7-166.300115.4
85G48.4Very low52.5Low67 Ų67144.8 Ų144.869%0.69181%0.806SS**  trans105.4119.7156.100000114.6
86E49.8Very low53.4Low178 Ų178143.2 Ų143.283%0.83281%0.806SS**  75.3139.457.1-74.9-67.495.100114.3
87P52.6Low54Low97 Ų97144 Ų14463%0.6381%0.805SS**  -135.1-178.9-107.642.3-27.3000116.1
88A45.3Very low54.8Low100 Ų100143.4 Ų143.483%0.82680%0.804SS**  trans56.792.2153.700000118.4
89A48.8Very low56.1Low86 Ų86140.7 Ų140.771%0.71180%0.795SS**  trans-123.5113.1156.200000109.9F91A89-F91 HydrophobicContact CB-CD2 4.44Å; A89-F91 HydrophobicContact CB-CE2 4.46Å
90V48.7Very low56.6Low140 Ų140142.4 Ų142.485%0.84880%0.803SS**  trans-85.2121.1174.11760000108.8
91F51.7Low57.3Low182 Ų182142.3 Ų142.380%0.79880%0.797SS**  trans-131.5146.4166.5-82.9-83.9000110.2A89A89-F91 HydrophobicContact CB-CD2 4.44Å; A89-F91 HydrophobicContact CB-CE2 4.46Å
92P56.1Low58.3Low118 Ų118141.4 Ų141.477%0.76679%0.79SS**  trans-77.9156-16430.8-36.1000114Q94P92-Q94 PolarHBondContact O-N 3.3Å
93E53.4Low59.2Low197 Ų197138.2 Ų138.292%0.92178%0.784SS**  trans-59.9115.4174.8-171.7167.9-158.900111.2
94Q51Low59.9Low184 Ų184136.6 Ų136.686%0.8678%0.782SS**  trans-91.4112.2176.9-176.6175.5-10.300110.1P92P92-Q94 PolarHBondContact O-N 3.3Å
95E61.2Low60Low177 Ų177132.1 Ų132.183%0.82778%0.779SS**PPolyproline II helixtrans-61.8128-178.4-153.6-177.5-167.500111.8
96P68.9Low60.6Low116 Ų116134.3 Ų134.375%0.75378%0.784SS**PPolyproline II helixtrans-75.5133.8174.430.3-33.2000110.7
97A69.3Low61Low91 Ų91135 Ų13575%0.75279%0.787SS**PPolyproline II helixtrans-58143.2-176.400000113
98P73Confident61.3Low115 Ų115136.3 Ų136.375%0.74780%0.796SS**PPolyproline II helixtrans-65.1137.7-173.525.6-35000112.3V100P98-V100 PolarHBondContact O-N 2.82Å
99P75.7Confident61.7Low113 Ų113137.7 Ų137.773%0.73480%0.8SS**PPolyproline II helixtrans-68.3131.6177.728.1-34.1000110.9I101P99-I101 PolarHBondContact O-N 3.28Å; P99-I101 VanDerWaalsContact O-N 3.07Å
100V75.2Confident62.2Low136 Ų136138.8 Ų138.882%0.82480%0.802SS**  trans-71.5102.7175.8178.90000109.6P98 I102P98-V100 PolarHBondContact O-N 2.82Å; V100-I102 PolarHBondContact O-N 3.28Å
101I65.9Low62.7Low136 Ų136137.5 Ų137.570%0.69780%0.797SS**  trans-78.2106.3-179.8-50.8179.7000109.7P99 T103P99-I101 PolarHBondContact O-N 3.28Å; P99-I101 VanDerWaalsContact O-N 3.07Å; I101-T103 HydrophobicContact CG2-CG2 3.82Å; I101-T103 PolarHBondContact O-N 3.4Å; I101-T103 VanDerWaalsContact O-N 3.15Å
102I71.5Confident62.6Low143 Ų143135.1 Ų135.173%0.73380%0.797SS**  trans-79.294.5169.6-57.1178.7000108.3V100 F104V100-I102 PolarHBondContact O-N 3.28Å; I102-F104 HydrophobicContact CG2-CD2 4.38Å; I102-F104 PolarHBondContact O-N 3.24Å; I102-F104 VanDerWaalsContact O-N 3.14Å
103T69.9Low62.8Low123 Ų123139.2 Ų139.276%0.75580%0.803SS**  trans-7794.3178.854.30000111.5I101I101-T103 HydrophobicContact CG2-CG2 3.82Å; I101-T103 PolarHBondContact O-N 3.4Å; I101-T103 VanDerWaalsContact O-N 3.15Å
104F68.1Low63.3Low198 Ų198138 Ų13887%0.86880%0.797SS**  trans-80.2122.2162.8-112-91.1000109.7I102 S106I102-F104 HydrophobicContact CG2-CD2 4.38Å; I102-F104 PolarHBondContact O-N 3.24Å; I102-F104 VanDerWaalsContact O-N 3.14Å; F104-S106 PolarHBondContact O-N 2.8Å
105G55.8Low64.1Low77 Ų77134.6 Ų134.679%0.79479%0.79SS**  trans-88.9103.8-173.100000114
106S60.5Low64.3Low113 Ų113133.7 Ų133.779%0.7979%0.791SS**  trans-161.2155.2147.350.30000110.8F104F104-S106 PolarHBondContact O-N 2.8Å
107E58Low64.1Low192 Ų192134.2 Ų134.290%0.89779%0.792SS**  trans-73.7138.2-161.6-53.7172.4142.300114.6
108P59.5Low64.3Low125 Ų125136.8 Ų136.881%0.81279%0.792SS**  trans-12290.7161.335.2-21.8000112S110P108-S110 PolarHBondContact O-N 3.41Å
109S53.9Low64.3Low129 Ų129135.4 Ų135.490%0.90279%0.79SS**  trans-85.193.3171.2-1740000111.4
110S59.2Low64.3Low110 Ų110136 Ų13677%0.76979%0.791SS**  trans-164.9133.5162.6-163.50000111.6P108P108-S110 PolarHBondContact O-N 3.41Å
111P59.2Low64.4Low112 Ų112134.5 Ų134.573%0.72778%0.784SS**  trans-82.4139.7-174.431.4-34.6000114.5
112V48.7Very low64.8Low133 Ų133134 Ų13481%0.80679%0.789SS**  trans52.794.6147.1-170.80000117.1
113K61.7Low64.6Low204 Ų204138 Ų13889%0.88780%0.796SS**  trans-125.6135.8142.2-71.2-178.8-179.6174.20108.3
114Q63.9Low64.6Low172 Ų172136.6 Ų136.680%0.80479%0.788SS**  trans-67133.2-177-67.7168.5-24.700110.3L116Q114-L116 PolarHBondContact O-N 3.09Å
115P67.8Low64.3Low111 Ų111137.7 Ų137.772%0.72179%0.788SS**  trans-71.5117.1173.928.9-32.5000109.7T117P115-T117 PolarHBondContact O-N 3.08Å
116L65.3Low64.6Low159 Ų159143.4 Ų143.483%0.83279%0.787SS**  trans-76.691.3168.6-68.2171.4000108.4Q114 I118Q114-L116 PolarHBondContact O-N 3.09Å; L116-I118 VanDerWaalsContact C-N 3.32Å; L116-I118 PolarHBondContact O-N 3.14Å
117T64.8Low64Low127 Ų127142 Ų14278%0.77978%0.782SS**  trans-67.587.2176.4-54.20000110.3P115 A119P115-T117 PolarHBondContact O-N 3.08Å; T117-A119 PolarHBondContact O-N 3.15Å
118I72.1Confident63.5Low145 Ų145139.1 Ų139.174%0.74478%0.783SS**  trans-72.293172.4-60.7172.7000107.9L116 V120L116-I118 VanDerWaalsContact C-N 3.32Å; L116-I118 PolarHBondContact O-N 3.14Å; I118-V120 PolarHBondContact O-N 3.19Å; I118-V120 VanDerWaalsContact O-N 3.08Å
119A73.8Confident62.7Low86 Ų86137.2 Ų137.271%0.71178%0.778SS**  trans-65.5105.6170.200000109.2T117T117-A119 PolarHBondContact O-N 3.15Å
120V75.4Confident62.4Low126 Ų126135.9 Ų135.976%0.76478%0.775SS**PPolyproline II helixtrans-67.6122.1172.6-179.80000107.7I118I118-V120 PolarHBondContact O-N 3.19Å; I118-V120 VanDerWaalsContact O-N 3.08Å
121P77.9Confident61.9Low104 Ų104134.6 Ų134.668%0.67577%0.771SS**PPolyproline II helixtrans-63142.8179.426-34000110.1R123P121-R123 PolarHBondContact O-N 2.81Å
122P73.8Confident61.4Low124 Ų124134.5 Ų134.581%0.80578%0.78SS**PPolyproline II helixtrans-59.2134.7177.625.4-33.7000109.7
123R68Low61.9Low229 Ų229134.1 Ų134.186%0.86478%0.778SS**PPolyproline II helixtrans-59.1128175.4-74.2178.6172.2166.1-3.4108.9P121 Y125P121-R123 PolarHBondContact O-N 2.81Å; R123-Y125 PolarHBondContact O-N 2.91Å
124P68.2Low61.9Low93 Ų93128.7 Ų128.760%0.60477%0.771SS**PPolyproline II helixtrans-61.4130.6172.225.6-32.5000108.9Y126P124-Y126 HydrophobicContact CB-CD1 4.43Å; P124-Y126 HydrophobicContact CG-CD1 4.09Å; P124-Y126 HydrophobicContact CG-CE1 3.98Å; P124-Y126 WeakPolarHBondContact O-CD1 3.36Å; P124-Y126 PolarHBondContact O-N 2.73Å
125Y62.3Low61.8Low220 Ų220124 Ų12486%0.86376%0.755SS**  trans-80.860.1-177.356.7-80.7000110.4R123 A127R123-Y125 PolarHBondContact O-N 2.91Å; Y125-A127 PolarHBondContact O-N 3.08Å
126Y62.1Low61.8Low198 Ų198123.1 Ų123.178%0.77675%0.748SS**  trans-58.2112.3166.138-100.6000108.1P124 S128P124-Y126 HydrophobicContact CB-CD1 4.43Å; P124-Y126 HydrophobicContact CG-CD1 4.09Å; P124-Y126 HydrophobicContact CG-CE1 3.98Å; P124-Y126 WeakPolarHBondContact O-CD1 3.36Å; P124-Y126 PolarHBondContact O-N 2.73Å; Y126-S128 PolarHBondContact O-N 3.5Å
127A48.5Very low61.8Low82 Ų82119.2 Ų119.268%0.67874%0.739SS**  trans-63.8134.8-156.500000112Y125 A129Y125-A127 PolarHBondContact O-N 3.08Å; A127-A129 HydrophobicContact CB-CB 4.23Å; A127-A129 PolarHBondContact O-N 3.31Å
128S48.1Very low61.7Low133 Ų133116.8 Ų116.893%0.9373%0.731SS**  trans-74.659.3169610000110.8Y126Y126-S128 PolarHBondContact O-N 3.5Å
129A42.7Very low61Low85 Ų85115.6 Ų115.670%0.70272%0.722SS**  trans-110.228.717900000111.5A127 A131A127-A129 HydrophobicContact CB-CB 4.23Å; A127-A129 PolarHBondContact O-N 3.31Å; A129-A131 PolarHBondContact O-N 3.06Å
130A47Very low60.3Low100 Ų100116.6 Ų116.683%0.82672%0.715SS**  trans-77.595.6169.200000109
131A47.9Very low59.7Low84 Ų84115.7 Ų115.769%0.69471%0.71SS**  trans-57.7139.4169.500000109.9A129 T133A129-A131 PolarHBondContact O-N 3.06Å; A131-T133 VanDerWaalsContact C-N 3.28Å; A131-T133 PolarHBondContact O-N 3.32Å
132A49.3Very low58.7Low110 Ų110112.9 Ų112.991%0.90970%0.696SS**  trans-76.671.3-170.700000113.1
133T60.4Low57.7Low125 Ų125109.6 Ų109.677%0.76768%0.679SS**PPolyproline II helixtrans-84.5119.4160.943.90000109.2A131A131-T133 VanDerWaalsContact C-N 3.28Å; A131-T133 PolarHBondContact O-N 3.32Å
134A61.4Low57Low89 Ų89102.2 Ų102.274%0.73667%0.667SS**PPolyproline II helixtrans-61.7135.2176.900000110.1T136A134-T136 PolarHBondContact O-N 3.46Å
135P60.6Low56.3Low73 Ų73100.7 Ų100.747%0.47466%0.662SS.*PPolyproline II helixtrans-66.2122.3-176.827.4-34.5000109.8L140P135-L140 HydrophobicContact CB-CD2 4.14Å; P135-L140 HydrophobicContact CB-CG 4.14Å; P135-L140 HydrophobicContact CG-CD1 4.5Å; P135-L140 HydrophobicContact CG-CD2 3.95Å; P135-L140 HydrophobicContact CG-CG 4.2Å
136T69.3Low55.9Low94 Ų9496.8 Ų96.858%0.57765%0.652SS**PPolyproline II helixtrans-60.8149.9170.243.50000109.6A134 A138 Q139 L140A134-T136 PolarHBondContact O-N 3.46Å; T136-A138 PolarHBondContact O-N 2.92Å; T136-A138 VanDerWaalsContact O-N 3.08Å; T136-Q139 WeakPolarHBondContact O-CA 3.47Å; T136-Q139 WeakPolarHBondContact O-CB 3.45Å; T136-Q139 PolarHBondContact O-N 2.88Å; T136-L140 PolarHBondContact O-N 3.43Å
137A64.5Low55.4Low77 Ų7791 Ų9164%0.63664%0.644SS**Hα-helixtrans-55.1-34.6-175.600000113Q139 L140 V141A137-Q139 VanDerWaalsContact C-N 3.31Å; A137-Q139 PolarHBondContact O-N 2.94Å; A137-L140 PolarHBondContact O-N 3.34Å; A137-V141 WeakPolarHBondContact O-CG2 3.22Å; A137-V141 PolarHBondContact O-N 2.88Å; A137-V141 VanDerWaalsContact O-N 3.09Å
138A63.3Low55.6Low75 Ų7589.5 Ų89.562%0.6263%0.627SS**Hα-helixtrans-60-36.5172.900000113.1T136 V141 A142T136-A138 PolarHBondContact O-N 2.92Å; T136-A138 VanDerWaalsContact O-N 3.08Å; A138-V141 PolarHBondContact O-N 3.36Å; A138-A142 WeakPolarHBondContact O-CB 3.47Å; A138-A142 PolarHBondContact O-N 2.87Å
139Q56.5Low55.6Low120 Ų12090 Ų9056%0.56161%0.614SS**Hα-helixtrans-77.9-25.6178.9-161.6171.518.600112.8T136 A137 A143T136-Q139 WeakPolarHBondContact O-CA 3.47Å; T136-Q139 WeakPolarHBondContact O-CB 3.45Å; T136-Q139 PolarHBondContact O-N 2.88Å; A137-Q139 VanDerWaalsContact C-N 3.31Å; A137-Q139 PolarHBondContact O-N 2.94Å; Q139-A143 WeakPolarHBondContact O-CB 3.27Å; Q139-A143 PolarHBondContact O-N 2.97Å
140L60.1Low56.2Low107 Ų10793.7 Ų93.756%0.5662%0.622SS**Hα-helixtrans-69.8-38.6167.7-68.9173.1000111.6P135 T136 A137 A144P135-L140 HydrophobicContact CB-CD2 4.14Å; P135-L140 HydrophobicContact CB-CG 4.14Å; P135-L140 HydrophobicContact CG-CD1 4.5Å; P135-L140 HydrophobicContact CG-CD2 3.95Å; P135-L140 HydrophobicContact CG-CG 4.2Å; T136-L140 PolarHBondContact O-N 3.43Å; A137-L140 PolarHBondContact O-N 3.34Å; L140-A144 WeakPolarHBondContact O-CB 3.29Å; L140-A144 PolarHBondContact O-N 3.01Å
141V62.1Low56.4Low108 Ų10891.9 Ų91.966%0.65560%0.596SS**Hα-helixtrans-67.4-41.7172.5175.30000111A137 A138 A144 A145A137-V141 WeakPolarHBondContact O-CG2 3.22Å; A137-V141 PolarHBondContact O-N 2.88Å; A137-V141 VanDerWaalsContact O-N 3.09Å; A138-V141 PolarHBondContact O-N 3.36Å; V141-A144 PolarHBondContact O-N 2.93Å; V141-A145 PolarHBondContact O-N 3.48Å; V141-A145 VanDerWaalsContact O-N 3.08Å
142A56.7Low57Low45 Ų4599.1 Ų99.137%0.37261%0.605SS.*Hα-helixtrans-64.7-44.3174.800000111.7A138 A144 A145 E146A138-A142 WeakPolarHBondContact O-CB 3.47Å; A138-A142 PolarHBondContact O-N 2.87Å; A142-A144 VanDerWaalsContact C-N 3.26Å; A142-A144 PolarHBondContact O-N 3Å; A142-A145 CarbonylContact O-C 3.59Å; A142-A145 VanDerWaalsContact O-C 3.29Å; A142-A145 VanDerWaalsContact O-CA 3.3Å; A142-A145 WeakPolarHBondContact O-CA 3.44Å; A142-A145 WeakPolarHBondContact O-CB 3.3Å; A142-A145 PolarHBondContact O-N 3.35Å; A142-E146 WeakPolarHBondContact O-CB 3.43Å; A142-E146 VanDerWaalsContact O-CG 3.23Å; A142-E146 WeakPolarHBondContact O-CG 3.45Å; A142-E146 PolarHBondContact O-N 2.83Å
143A52.7Low58.7Low54 Ų54102.7 Ų102.745%0.44660%0.6SS.*Hα-helixtrans-62.2-32.5175.200000112.7Q139 A145 E146 A147Q139-A143 WeakPolarHBondContact O-CB 3.27Å; Q139-A143 PolarHBondContact O-N 2.97Å; A143-A145 VanDerWaalsContact C-N 3.27Å; A143-A145 PolarHBondContact O-N 3.29Å; A143-E146 PolarHBondContact O-N 2.79Å; A143-A147 WeakPolarHBondContact O-CB 3.32Å; A143-A147 PolarHBondContact O-N 3Å
144A54Low60.3Low74 Ų74100.4 Ų100.461%0.61258%0.578SS**Hα-helixtrans-71.3-20.9170.500000113.5L140 V141 A142L140-A144 WeakPolarHBondContact O-CB 3.29Å; L140-A144 PolarHBondContact O-N 3.01Å; V141-A144 PolarHBondContact O-N 2.93Å; A142-A144 VanDerWaalsContact C-N 3.26Å; A142-A144 PolarHBondContact O-N 3Å
145A53.8Low61.8Low61 Ų61100.2 Ų100.250%0.50456%0.558SS.*Hα-helixtrans-95.4-11.4173.100000113.9V141 A142 A143 V148V141-A145 PolarHBondContact O-N 3.48Å; V141-A145 VanDerWaalsContact O-N 3.08Å; A142-A145 CarbonylContact O-C 3.59Å; A142-A145 VanDerWaalsContact O-C 3.29Å; A142-A145 VanDerWaalsContact O-CA 3.3Å; A142-A145 WeakPolarHBondContact O-CA 3.44Å; A142-A145 WeakPolarHBondContact O-CB 3.3Å; A142-A145 PolarHBondContact O-N 3.35Å; A143-A145 VanDerWaalsContact C-N 3.27Å; A143-A145 PolarHBondContact O-N 3.29Å; A145-V148 WeakPolarHBondContact O-CB 3.39Å; A145-V148 WeakPolarHBondContact O-CG2 3.47Å
146E52.4Low63.4Low139 Ų13997.8 Ų97.865%0.6555%0.547SS*.Hα-helixtrans-99.6-20.4174.2-65.9-94.4130.700111.2A142 A143 V148 E149A142-E146 WeakPolarHBondContact O-CB 3.43Å; A142-E146 VanDerWaalsContact O-CG 3.23Å; A142-E146 WeakPolarHBondContact O-CG 3.45Å; A142-E146 PolarHBondContact O-N 2.83Å; A143-E146 PolarHBondContact O-N 2.79Å; E146-V148 PolarHBondContact O-N 2.76Å; E146-E149 WeakPolarHBondContact O-CB 3.28Å; E146-E149 WeakPolarHBondContact O-CG 3.43Å; E146-E149 PolarHBondContact O-N 3.17Å
147A51.6Low64.6Low75 Ų7594.5 Ų94.562%0.6253%0.527SS*.THydrogen-bonded Turntrans-66.214.7160.300000113.7A143A143-A147 WeakPolarHBondContact O-CB 3.32Å; A143-A147 PolarHBondContact O-N 3Å
148V54.5Low66Low52 Ų5295.9 Ų95.932%0.31552%0.515SS..THydrogen-bonded Turntrans-91.8-24170.1173.10000110.4A145 E146 F151A145-V148 WeakPolarHBondContact O-CB 3.39Å; A145-V148 WeakPolarHBondContact O-CG2 3.47Å; E146-V148 PolarHBondContact O-N 2.76Å; V148-F151 HydrophobicContact CB-CE1 4.49Å; V148-F151 HydrophobicContact CB-CE2 4.16Å; V148-F151 HydrophobicContact CB-CZ 3.95Å; V148-F151 HydrophobicContact CG1-CD2 4.22Å; V148-F151 HydrophobicContact CG1-CE2 3.54Å; V148-F151 HydrophobicContact CG1-CZ 3.83Å; V148-F151 HydrophobicContact CG2-CE2 4.47Å; V148-F151 HydrophobicContact CG2-CZ 3.92Å; V148-F151 VanDerWaalsContact O-CD2 3.27Å; V148-F151 WeakPolarHBondContact O-CD2 2.98Å; V148-F151 VanDerWaalsContact O-CG 3.29Å; V148-F151 WeakPolarHBondContact O-CG 3.38Å
149E48Very low67.4Low143 Ų14397.6 Ų97.667%0.66851%0.51SS*.THydrogen-bonded Turntrans-63.6144171.5-64.7-62.99900110.7E146 F151E146-E149 WeakPolarHBondContact O-CB 3.28Å; E146-E149 WeakPolarHBondContact O-CG 3.43Å; E146-E149 PolarHBondContact O-N 3.17Å; E149-F151 VanDerWaalsContact C-N 3.31Å; E149-F151 PolarHBondContact O-N 2.84Å
150D53.5Low69.1Low162 Ų16299.4 Ų99.487%0.86651%0.512SS*.THydrogen-bonded Turntrans51.739.8-177.7-87-6.7000115.8R152D150-R152 PolarHBondContact O-N 3.35Å
151F51.3Low70.6Confident63 Ų63100.6 Ų100.628%0.27653%0.526SS..  trans-52.591.9166.2-80.4-34.3000113V148 E149 K153 Y165 P187V148-F151 HydrophobicContact CB-CE1 4.49Å; V148-F151 HydrophobicContact CB-CE2 4.16Å; V148-F151 HydrophobicContact CB-CZ 3.95Å; V148-F151 HydrophobicContact CG1-CD2 4.22Å; V148-F151 HydrophobicContact CG1-CE2 3.54Å; V148-F151 HydrophobicContact CG1-CZ 3.83Å; V148-F151 HydrophobicContact CG2-CE2 4.47Å; V148-F151 HydrophobicContact CG2-CZ 3.92Å; V148-F151 VanDerWaalsContact O-CD2 3.27Å; V148-F151 WeakPolarHBondContact O-CD2 2.98Å; V148-F151 VanDerWaalsContact O-CG 3.29Å; V148-F151 WeakPolarHBondContact O-CG 3.38Å; E149-F151 VanDerWaalsContact C-N 3.31Å; E149-F151 PolarHBondContact O-N 2.84Å; F151-K153 PolarHBondContact O-N 2.96Å; F151-Y165 HydrophobicContact CZ-CE1 4.4Å; F151-P187 HydrophobicContact CE1-CG 4.08Å; F151-P187 HydrophobicContact CZ-CG 4.42Å
152R61.3Low71.9Confident235 Ų235105.6 Ų105.689%0.88753%0.534SS*.  trans-67.475.6152.6-70.1-174.3176.1-155.8-2108.7D150 Y154D150-R152 PolarHBondContact O-N 3.35Å; R152-Y154 PolarHBondContact O-N 3.48Å
153K85.6Confident73.5Confident185 Ų185105.3 Ų105.380%0.80454%0.535SS*.  trans-31.1103.4-175.9-67.2156.3-170.7169.70111.6F151 R155F151-K153 PolarHBondContact O-N 2.96Å; K153-R155 PolarHBondContact O-N 3.4Å
154Y92.5Very high75.4Confident77 Ų77106.5 Ų106.530%0.30253%0.531SS..  trans-53.9137-175.9-65.7-69.4000110.9R152 G156 V157 P187 V188 A191 N209 F210R152-Y154 PolarHBondContact O-N 3.48Å; Y154-G156 PolarHBondContact O-N 2.7Å; Y154-V157 WeakPolarHBondContact O-CB 3.34Å; Y154-V157 PolarHBondContact O-N 3.27Å; Y154-P187 HydrophobicContact CD2-CB 4.02Å; Y154-P187 HydrophobicContact CE2-CB 4.06Å; Y154-P187 HydrophobicContact CE2-CG 4.45Å; Y154-V188 HydrophobicContact CE2-CG2 4.24Å; Y154-A191 HydrophobicContact CD1-CB 4.01Å; Y154-A191 HydrophobicContact CD2-CB 4.04Å; Y154-A191 HydrophobicContact CG-CB 3.63Å; Y154-N209 HydrophobicContact CD1-CB 4.23Å; Y154-F210 HydrophobicContact CD1-CZ 4.2Å; Y154-F210 AromaticContact CE1-CE1 3.89Å; Y154-F210 HydrophobicContact CE1-CE1 3.89Å; Y154-F210 AromaticContact CE1-CZ 3.74Å; Y154-F210 HydrophobicContact CE1-CZ 3.74Å
155R93.5Very high77.4Confident85 Ų85104.3 Ų104.332%0.32151%0.507SS..THydrogen-bonded Turntrans-62130.2-174.2-155.1-178.479.9-124.92.4109.8K153 V157 Y194 I207 N209K153-R155 PolarHBondContact O-N 3.4Å; R155-V157 VanDerWaalsContact C-N 3.28Å; R155-V157 PolarHBondContact O-N 2.77Å; R155-Y194 HydrophobicContact CB-CE1 4.13Å; R155-Y194 HydrophobicContact CG-CE1 4.33Å; R155-Y194 PolarHBondContact NE-OH 3.47Å; R155-Y194 VanDerWaalsContact NH2-CE1 3.29Å; R155-Y194 PolarHBondContact NH2-OH 3.23Å; R155-Y194 WeakPolarHBondContact O-CD1 3.29Å; R155-Y194 WeakPolarHBondContact O-CE1 3.32Å; R155-Y194 VanDerWaalsContact O-CG 3.29Å; R155-I207 PolarHBondContact NH1-O 3.41Å; R155-I207 PolarHBondContact NH2-O 3.25Å; R155-N209 PolarHBondContact N-OD1 3.11Å; R155-N209 PolarHBondContact O-ND2 2.84Å
156G93.5Very high79.4Confident23 Ų23101.6 Ų101.624%0.23748%0.484CS..THydrogen-bonded Turntrans82.7-5.4-177.800000115.4Y154 A167 E168Y154-G156 PolarHBondContact O-N 2.7Å; G156-A167 WeakPolarHBondContact O-CA 3.41Å; G156-E168 PolarHBondContact O-N 3.39Å
157V94.9Very high81.4Confident24 Ų2495 Ų9515%0.14545%0.453CS..EExtended strand (participates in β ladder)trans-97.9134.1177.1-173.70000110.3Y154 R155 Y165 A166 A190 A191Y154-V157 WeakPolarHBondContact O-CB 3.34Å; Y154-V157 PolarHBondContact O-N 3.27Å; R155-V157 VanDerWaalsContact C-N 3.28Å; R155-V157 PolarHBondContact O-N 2.77Å; V157-Y165 HydrophobicContact CG1-CD1 4.08Å; V157-Y165 HydrophobicContact CG1-CG 4.43Å; V157-A166 WeakPolarHBondContact CA-O 3.4Å; V157-A190 HydrophobicContact CB-CB 4.34Å; V157-A190 HydrophobicContact CG1-CB 3.71Å; V157-A190 HydrophobicContact CG2-CB 3.69Å; V157-A191 HydrophobicContact CG2-CB 3.94Å
158R94.3Very high83.5Confident106 Ų10692.7 Ų92.740%0.443%0.43SS..EExtended strand (participates in β ladder)trans-129.9137.916958.2173.8168.9772.4111A166 E168R158-A166 HydrophobicContact CG-CB 4.08Å; R158-A166 PolarHBondContact N-O 2.93Å; R158-A166 PolarHBondContact O-N 3.29Å; R158-E168 IonicContact CZ-OE2 2.76Å; R158-E168 IonicContact NE-OE2 3.19Å; R158-E168 PolarHBondContact NE-OE2 2.75Å; R158-E168 IonicContact NH2-OE2 3.87Å; R158-E168 PolarHBondContact NH2-OE2 2.76Å
159Q93.5Very high85.4Confident111 Ų11190.6 Ų90.652%0.51942%0.417SS..EExtended strand (participates in β ladder)trans-81.8139.8172.5-158.5175.425.200109.6Y165Q159-Y165 HydrophobicContact CB-CD1 4.23Å; Q159-Y165 HydrophobicContact CB-CE1 4.17Å; Q159-Y165 HydrophobicContact CG-CD1 4.15Å; Q159-Y165 HydrophobicContact CG-CE1 3.79Å; Q159-Y165 PolarHBondContact NE2-OH 2.85Å
160R92.1Very high87.6Confident158 Ų15890.6 Ų90.660%0.59641%0.411SS*.  trans-93.9152.1167-159.173-146.1-105.39.1108W162 G163 K164R160-W162 HydrophobicContact CB-CB 4.34Å; R160-W162 HydrophobicContact CG-CB 4.22Å; R160-W162 PolarHBondContact O-N 3.14Å; R160-G163 PolarHBondContact O-N 3.16Å; R160-K164 PolarHBondContact N-O 2.94Å
161P91.7Very high89.2Confident132 Ų13283.1 Ų83.186%0.85737%0.371SS*.THydrogen-bonded Turntrans-55.6-1216719.7-34000114.7G163P161-G163 PolarHBondContact O-N 2.67Å
162W88.5Confident91Very high213 Ų21385.3 Ų85.381%0.80739%0.391SS*.THydrogen-bonded Turntrans-7912.7168.2-170.6-112.4000113.9R160 K164R160-W162 HydrophobicContact CB-CB 4.34Å; R160-W162 HydrophobicContact CG-CB 4.22Å; R160-W162 PolarHBondContact O-N 3.14Å; W162-K164 PolarHBondContact O-N 2.87Å
163G90Very high92.2Very high40 Ų4083.2 Ų83.241%0.41239%0.389SS..SBendtrans73.3-30.5-179.100000115.8R160 P161R160-G163 PolarHBondContact O-N 3.16Å; P161-G163 PolarHBondContact O-N 2.67Å
164K93.9Very high92.3Very high79 Ų7982.8 Ų82.834%0.34338%0.382SS..  trans-65.9149.5180-58.9-65.8-175.3176.10113R160 W162 D185R160-K164 PolarHBondContact N-O 2.94Å; W162-K164 PolarHBondContact O-N 2.87Å; K164-D185 VanDerWaalsContact CD-OD1 3.28Å; K164-D185 WeakPolarHBondContact CD-OD1 3.47Å; K164-D185 WeakPolarHBondContact CE-OD1 3.12Å; K164-D185 IonicContact NZ-OD1 2.87Å; K164-D185 PolarHBondContact NZ-OD1 3.33Å; K164-D185 IonicContact NZ-OD2 3.95Å; K164-D185 PolarHBondContact NZ-OD2 3.48Å
165Y94.9Very high92.2Very high27 Ų2791.3 Ų91.311%0.10641%0.414CS..EExtended strand (participates in β ladder)trans-100.6129.9179.5-57.7-84.6000110.4F151 V157 Q159 T183 Y184 P187F151-Y165 HydrophobicContact CZ-CE1 4.4Å; V157-Y165 HydrophobicContact CG1-CD1 4.08Å; V157-Y165 HydrophobicContact CG1-CG 4.43Å; Q159-Y165 HydrophobicContact CB-CD1 4.23Å; Q159-Y165 HydrophobicContact CB-CE1 4.17Å; Q159-Y165 HydrophobicContact CG-CD1 4.15Å; Q159-Y165 HydrophobicContact CG-CE1 3.79Å; Q159-Y165 PolarHBondContact NE2-OH 2.85Å; Y165-T183 CarbonylContact O-C 3.29Å; Y165-T183 VanDerWaalsContact O-CA 3.32Å; Y165-T183 WeakPolarHBondContact O-CA 3.49Å; Y165-Y184 PolarHBondContact N-O 2.96Å; Y165-Y184 PolarHBondContact O-N 3.01Å; Y165-P187 HydrophobicContact CD1-CB 3.86Å; Y165-P187 HydrophobicContact CD2-CB 4.43Å; Y165-P187 HydrophobicContact CE1-CB 3.8Å; Y165-P187 HydrophobicContact CE1-CG 4.31Å; Y165-P187 HydrophobicContact CE2-CB 4.39Å; Y165-P187 HydrophobicContact CE2-CG 4.35Å; Y165-P187 HydrophobicContact CG-CB 4.19Å
166A95Very high91.9Very high4 Ų489.1 Ų89.13%0.03342%0.417CS..EExtended strand (participates in β ladder)trans-107.7137.7174.500000110.4V157 R158 T183V157-A166 WeakPolarHBondContact CA-O 3.4Å; R158-A166 HydrophobicContact CG-CB 4.08Å; R158-A166 PolarHBondContact N-O 2.93Å; R158-A166 PolarHBondContact O-N 3.29Å; A166-T183 HydrophobicContact CB-CG2 4Å
167A96.1Very high91.8Very high0 Ų090.7 Ų90.70%042%0.424CS..EExtended strand (participates in β ladder)trans-106.1129.4173.700000110.6G156 L181 G182 Y184 A190G156-A167 WeakPolarHBondContact O-CA 3.41Å; A167-L181 HydrophobicContact CB-CB 4.08Å; A167-L181 HydrophobicContact CB-CD1 4.36Å; A167-L181 PolarHBondContact O-N 3.35Å; A167-G182 PolarHBondContact N-O 3.34Å; A167-Y184 HydrophobicContact CB-CD2 4.27Å; A167-Y184 HydrophobicContact CB-CE2 3.94Å; A167-A190 HydrophobicContact CB-CB 4.36Å
168E94.6Very high91.7Very high27 Ų2797 Ų9713%0.12645%0.446CS..EExtended strand (participates in β ladder)trans-139.3142.7173.266.3-175-12300111.5G156 R158 R178 V179 Y194G156-E168 PolarHBondContact O-N 3.39Å; R158-E168 IonicContact CZ-OE2 2.76Å; R158-E168 IonicContact NE-OE2 3.19Å; R158-E168 PolarHBondContact NE-OE2 2.75Å; R158-E168 IonicContact NH2-OE2 3.87Å; R158-E168 PolarHBondContact NH2-OE2 2.76Å; E168-R178 IonicContact OE1-NH1 3.19Å; E168-R178 PolarHBondContact OE1-NH1 3.34Å; E168-V179 WeakPolarHBondContact CA-O 3.38Å; E168-Y194 WeakPolarHBondContact O-CD2 3.49Å; E168-Y194 WeakPolarHBondContact O-CE2 3.42Å
169I94.6Very high91.7Very high9 Ų994.9 Ų94.95%0.04644%0.444CS..EExtended strand (participates in β ladder)trans-112.8159.5174.9-166.8157.6000111R178 V179 L181 Y194 A197 A198 M201I169-R178 CarbonylContact O-C 3.52Å; I169-R178 WeakPolarHBondContact O-CA 3.48Å; I169-V179 HydrophobicContact CG2-CB 3.78Å; I169-V179 PolarHBondContact N-O 2.89Å; I169-V179 PolarHBondContact O-N 2.91Å; I169-L181 HydrophobicContact CB-CD1 4.15Å; I169-L181 HydrophobicContact CG2-CD1 4.21Å; I169-L181 HydrophobicContact CG2-CD2 3.91Å; I169-L181 HydrophobicContact CG2-CG 4.23Å; I169-Y194 HydrophobicContact CB-CD2 4.13Å; I169-Y194 HydrophobicContact CB-CE2 3.9Å; I169-Y194 HydrophobicContact CD1-CD2 4.49Å; I169-Y194 HydrophobicContact CD1-CE2 4.04Å; I169-Y194 HydrophobicContact CG1-CD2 4.41Å; I169-Y194 HydrophobicContact CG1-CE2 3.8Å; I169-A197 HydrophobicContact CB-CB 4.45Å; I169-A197 HydrophobicContact CD1-CB 3.79Å; I169-A197 HydrophobicContact CG2-CB 4.17Å; I169-A198 HydrophobicContact CD1-CB 3.97Å; I169-M201 HydrophobicContact CD1-CG 4.44Å; I169-M201 HydrophobicContact CD1-SD 3.55Å; I169-M201 VanDerWaalsContact CD1-SD 3.55Å; I169-M201 HydrophobicContact CG1-SD 3.87Å; I169-M201 HydrophobicContact CG2-SD 4.36Å
170R94Very high91.7Very high142 Ų14297.6 Ų97.654%0.53645%0.45SS..EExtended strand (participates in β ladder)trans-132.4129.9-173.3-70.8177174-115.911.4110.2P172 R178R170-P172 VanDerWaalsContact O-CD 3.25Å; R170-P172 WeakPolarHBondContact O-CD 3.4Å; R170-R178 HydrophobicContact CG-CG 4.33Å
171D88.3Confident91.8Very high6 Ų692.4 Ų92.43%0.03243%0.434CS..EExtended strand (participates in β ladder)trans-112.294-163.5-68.927.7000110.5K173 R174 G176 S177 M201D171-K173 PolarHBondContact O-N 2.93Å; D171-R174 HydrophobicContact CB-CB 3.75Å; D171-R174 HydrophobicContact CB-CG 4.24Å; D171-R174 CarbonylContact O-C 3.43Å; D171-R174 PolarHBondContact O-N 3.03Å; D171-R174 WeakPolarHBondContact OD2-CD 3.44Å; D171-G176 VanDerWaalsContact O-CA 3.31Å; D171-G176 WeakPolarHBondContact O-CA 3.47Å; D171-G176 PolarHBondContact O-N 2.79Å; D171-S177 PolarHBondContact N-O 3.06Å; D171-S177 VanDerWaalsContact N-O 3.09Å; D171-M201 HydrophobicContact CB-CE 3.8Å; D171-M201 VanDerWaalsContact OD1-CE 3.26Å; D171-M201 WeakPolarHBondContact OD1-CE 3.26Å; D171-M201 VanDerWaalsContact OD1-SD 3.38Å; D171-M201 WeakPolarHBondContact OD2-CE 3.36Å
172P87.8Confident92Very high108 Ų10886.7 Ų86.770%0.70140%0.399SS*.G310 helixtrans-60.2-33.1-179.723.8-33.5000111.8R170 R174R170-P172 VanDerWaalsContact O-CD 3.25Å; R170-P172 WeakPolarHBondContact O-CD 3.4Å; P172-R174 VanDerWaalsContact C-N 3.29Å; P172-R174 PolarHBondContact O-N 3.05Å
173K87.4Confident92.4Very high192 Ų19280.8 Ų80.884%0.83539%0.386SS*.G310 helixtrans-68-21.3174.2-63-173.4178-177.30114D171D171-K173 PolarHBondContact O-N 2.93Å
174R87.9Confident92.7Very high175 Ų17580.8 Ų80.866%0.6637%0.374SS*.G310 helixtrans-115.652.4-177.2-62.3-177.3164.9-174.6-7.3111D171 P172 G176 S177D171-R174 HydrophobicContact CB-CB 3.75Å; D171-R174 HydrophobicContact CB-CG 4.24Å; D171-R174 CarbonylContact O-C 3.43Å; D171-R174 PolarHBondContact O-N 3.03Å; D171-R174 WeakPolarHBondContact OD2-CD 3.44Å; P172-R174 VanDerWaalsContact C-N 3.29Å; P172-R174 PolarHBondContact O-N 3.05Å; R174-G176 PolarHBondContact O-N 2.92Å; R174-G176 VanDerWaalsContact O-N 3.1Å; R174-S177 WeakPolarHBondContact CB-OG 3.38Å; R174-S177 VanDerWaalsContact O-CB 3.32Å; R174-S177 WeakPolarHBondContact O-CB 3.34Å; R174-S177 PolarHBondContact O-N 2.92Å; R174-S177 PolarHBondContact O-OG 3.38Å
175R89.4Confident92.7Very high257 Ų25782.1 Ų82.197%0.9739%0.385SS*.THydrogen-bonded Turntrans54.128.6179-58.9179.3177.6-109.82.8114.2S177R175-S177 PolarHBondContact O-N 2.74Å
176G87.5Confident92.7Very high39 Ų3984 Ų8440%0.40240%0.399SS..THydrogen-bonded Turntrans70.315.2-178.400000114.8D171 R174D171-G176 VanDerWaalsContact O-CA 3.31Å; D171-G176 WeakPolarHBondContact O-CA 3.47Å; D171-G176 PolarHBondContact O-N 2.79Å; R174-G176 PolarHBondContact O-N 2.92Å; R174-G176 VanDerWaalsContact O-N 3.1Å
177S91.6Very high92.6Very high55 Ų5584.9 Ų84.939%0.38541%0.405SS..EExtended strand (participates in β ladder)trans-57.5149.4177.254.20000111.6D171 R174 R175D171-S177 PolarHBondContact N-O 3.06Å; D171-S177 VanDerWaalsContact N-O 3.09Å; R174-S177 WeakPolarHBondContact CB-OG 3.38Å; R174-S177 VanDerWaalsContact O-CB 3.32Å; R174-S177 WeakPolarHBondContact O-CB 3.34Å; R174-S177 PolarHBondContact O-N 2.92Å; R174-S177 PolarHBondContact O-OG 3.38Å; R175-S177 PolarHBondContact O-N 2.74Å
178R93.4Very high92.5Very high158 Ų15887.1 Ų87.160%0.59642%0.418SS*.EExtended strand (participates in β ladder)trans-103.2126.7-177.5-47.8-170.5-162.4-174.910.4109.3E168 I169 R170E168-R178 IonicContact OE1-NH1 3.19Å; E168-R178 PolarHBondContact OE1-NH1 3.34Å; I169-R178 CarbonylContact O-C 3.52Å; I169-R178 WeakPolarHBondContact O-CA 3.48Å; R170-R178 HydrophobicContact CG-CG 4.33Å
179V93.1Very high92.4Very high60 Ų6089.8 Ų89.836%0.36443%0.431SS..EExtended strand (participates in β ladder)trans-104.4116.5172.4-176.90000108.1E168 I169 L181E168-V179 WeakPolarHBondContact CA-O 3.38Å; I169-V179 HydrophobicContact CG2-CB 3.78Å; I169-V179 PolarHBondContact N-O 2.89Å; I169-V179 PolarHBondContact O-N 2.91Å; V179-L181 HydrophobicContact CG1-CD2 4.21Å
180W94Very high92.5Very high169 Ų16989.4 Ų89.464%0.6443%0.429SS*.EExtended strand (participates in β ladder)trans-72.9128.1170.8176.350.4000109.3G182 T183W180-G182 PolarHBondContact NE1-O 2.96Å; W180-T183 HydrophobicContact CZ2-CG2 4.13Å
181L94.7Very high92.5Very high49 Ų4982.6 Ų82.626%0.25740%0.403SS..EExtended strand (participates in β ladder)trans-101-27-175.3-58.6176.4000112.5A167 I169 V179 Y184 Y194 A197A167-L181 HydrophobicContact CB-CB 4.08Å; A167-L181 HydrophobicContact CB-CD1 4.36Å; A167-L181 PolarHBondContact O-N 3.35Å; I169-L181 HydrophobicContact CB-CD1 4.15Å; I169-L181 HydrophobicContact CG2-CD1 4.21Å; I169-L181 HydrophobicContact CG2-CD2 3.91Å; I169-L181 HydrophobicContact CG2-CG 4.23Å; V179-L181 HydrophobicContact CG1-CD2 4.21Å; L181-Y184 PolarHBondContact O-OH 3.47Å; L181-Y194 HydrophobicContact CD1-CD2 4.26Å; L181-A197 HydrophobicContact CD1-CB 3.51Å; L181-A197 HydrophobicContact CD2-CB 3.61Å; L181-A197 HydrophobicContact CG-CB 4.22Å
182G95.5Very high92.8Very high12 Ų1286.1 Ų86.112%0.12442%0.416CS..EExtended strand (participates in β ladder)trans155.3-179.2179.100000113.2A167 W180A167-G182 PolarHBondContact N-O 3.34Å; W180-G182 PolarHBondContact NE1-O 2.96Å
183T96.5Very high93.1Very high88 Ų8881.2 Ų81.254%0.5439%0.385SS..EExtended strand (participates in β ladder)trans-124.8136.1167.744.90000108.3Y165 A166 W180Y165-T183 CarbonylContact O-C 3.29Å; Y165-T183 VanDerWaalsContact O-CA 3.32Å; Y165-T183 WeakPolarHBondContact O-CA 3.49Å; A166-T183 HydrophobicContact CB-CG2 4Å; W180-T183 HydrophobicContact CZ2-CG2 4.13Å
184Y95.9Very high93.5Very high41 Ų4173.3 Ų73.316%0.16135%0.349CS..EExtended strand (participates in β ladder)trans-133.7157-170-57.4-78.4000110.5Y165 A167 L181 E189 A190 A193Y165-Y184 PolarHBondContact N-O 2.96Å; Y165-Y184 PolarHBondContact O-N 3.01Å; A167-Y184 HydrophobicContact CB-CD2 4.27Å; A167-Y184 HydrophobicContact CB-CE2 3.94Å; L181-Y184 PolarHBondContact O-OH 3.47Å; Y184-E189 HydrophobicContact CD1-CG 3.67Å; Y184-E189 HydrophobicContact CE1-CG 4.27Å; Y184-E189 HydrophobicContact CG-CG 4.14Å; Y184-A190 HydrophobicContact CD2-CB 3.75Å; Y184-A190 HydrophobicContact CG-CB 4.27Å; Y184-A193 HydrophobicContact CD2-CB 4.36Å; Y184-A193 HydrophobicContact CE1-CB 4.31Å; Y184-A193 HydrophobicContact CE2-CB 3.48Å; Y184-A193 VanDerWaalsContact CE2-CB 3.48Å; Y184-A193 VanDerWaalsContact CZ-CB 3.45Å; Y184-A193 WeakPolarHBondContact OH-CB 3.2Å
185D94.3Very high93.8Very high107 Ų10765 Ų6557%0.57232%0.318SS*.SBendtrans-86.6-23.9-175.4-75.813.7000112K164K164-D185 VanDerWaalsContact CD-OD1 3.28Å; K164-D185 WeakPolarHBondContact CD-OD1 3.47Å; K164-D185 WeakPolarHBondContact CE-OD1 3.12Å; K164-D185 IonicContact NZ-OD1 2.87Å; K164-D185 PolarHBondContact NZ-OD1 3.33Å; K164-D185 IonicContact NZ-OD2 3.95Å; K164-D185 PolarHBondContact NZ-OD2 3.48Å
186T94.7Very high94Very high65 Ų6554.6 Ų54.640%0.39928%0.279SS..SBendtrans-116.2148176.273.10000112V188 E189 A190T186-V188 VanDerWaalsContact C-N 3.3Å; T186-V188 PolarHBondContact O-N 2.86Å; T186-E189 WeakPolarHBondContact OG1-CB 3.25Å; T186-E189 PolarHBondContact OG1-N 3.13Å; T186-E189 VanDerWaalsContact OG1-N 3.14Å; T186-A190 PolarHBondContact O-N 3.27Å
187P93.3Very high94.2Very high24 Ų2453.2 Ų53.216%0.15626%0.264CS..Hα-helixtrans-69.4-31.2177.427.9-32.9000111.8F151 Y154 Y165 A190 A191F151-P187 HydrophobicContact CE1-CG 4.08Å; F151-P187 HydrophobicContact CZ-CG 4.42Å; Y154-P187 HydrophobicContact CD2-CB 4.02Å; Y154-P187 HydrophobicContact CE2-CB 4.06Å; Y154-P187 HydrophobicContact CE2-CG 4.45Å; Y165-P187 HydrophobicContact CD1-CB 3.86Å; Y165-P187 HydrophobicContact CD2-CB 4.43Å; Y165-P187 HydrophobicContact CE1-CB 3.8Å; Y165-P187 HydrophobicContact CE1-CG 4.31Å; Y165-P187 HydrophobicContact CE2-CB 4.39Å; Y165-P187 HydrophobicContact CE2-CG 4.35Å; Y165-P187 HydrophobicContact CG-CB 4.19Å; P187-A190 PolarHBondContact O-N 2.96Å; P187-A191 WeakPolarHBondContact O-CB 3.32Å; P187-A191 PolarHBondContact O-N 3.28Å
188V93.6Very high94.3Very high47 Ų4750.9 Ų50.929%0.28525%0.247SC..Hα-helixtrans-67.1-42.4178.4178.70000111.5Y154 T186 A191 R192 F210Y154-V188 HydrophobicContact CE2-CG2 4.24Å; T186-V188 VanDerWaalsContact C-N 3.3Å; T186-V188 PolarHBondContact O-N 2.86Å; V188-A191 PolarHBondContact O-N 2.84Å; V188-R192 WeakPolarHBondContact O-CG 3.31Å; V188-R192 PolarHBondContact O-N 3.26Å; V188-F210 HydrophobicContact CG1-CE2 4.25Å; V188-F210 HydrophobicContact CG1-CZ 3.88Å
189E93.8Very high94.3Very high83 Ų8345.2 Ų45.239%0.38823%0.227SC..Hα-helixtrans-66-42.9175.8-174.7-174.6-166.800111.8Y184 T186 A191 R192 A193Y184-E189 HydrophobicContact CD1-CG 3.67Å; Y184-E189 HydrophobicContact CE1-CG 4.27Å; Y184-E189 HydrophobicContact CG-CG 4.14Å; T186-E189 WeakPolarHBondContact OG1-CB 3.25Å; T186-E189 PolarHBondContact OG1-N 3.13Å; T186-E189 VanDerWaalsContact OG1-N 3.14Å; E189-A191 VanDerWaalsContact C-N 3.29Å; E189-A191 PolarHBondContact O-N 3Å; E189-R192 PolarHBondContact O-N 3.09Å; E189-A193 WeakPolarHBondContact O-CB 3.47Å; E189-A193 PolarHBondContact O-N 3.06Å
190A94.9Very high94.1Very high0 Ų047.5 Ų47.50%023%0.229CC..Hα-helixtrans-58.9-4117400000111.9V157 A167 Y184 T186 P187 A193 Y194V157-A190 HydrophobicContact CB-CB 4.34Å; V157-A190 HydrophobicContact CG1-CB 3.71Å; V157-A190 HydrophobicContact CG2-CB 3.69Å; A167-A190 HydrophobicContact CB-CB 4.36Å; Y184-A190 HydrophobicContact CD2-CB 3.75Å; Y184-A190 HydrophobicContact CG-CB 4.27Å; T186-A190 PolarHBondContact O-N 3.27Å; P187-A190 PolarHBondContact O-N 2.96Å; A190-A193 PolarHBondContact O-N 3.09Å; A190-Y194 PolarHBondContact O-N 3.41Å
191A94.6Very high93.9Very high0 Ų042.8 Ų42.80%022%0.215CC..Hα-helixtrans-66.6-42.6176.800000112.1Y154 V157 P187 V188 E189 A193 Y194 D195 N209 F210Y154-A191 HydrophobicContact CD1-CB 4.01Å; Y154-A191 HydrophobicContact CD2-CB 4.04Å; Y154-A191 HydrophobicContact CG-CB 3.63Å; V157-A191 HydrophobicContact CG2-CB 3.94Å; P187-A191 WeakPolarHBondContact O-CB 3.32Å; P187-A191 PolarHBondContact O-N 3.28Å; V188-A191 PolarHBondContact O-N 2.84Å; E189-A191 VanDerWaalsContact C-N 3.29Å; E189-A191 PolarHBondContact O-N 3Å; A191-A193 VanDerWaalsContact C-N 3.34Å; A191-A193 PolarHBondContact O-N 2.83Å; A191-Y194 PolarHBondContact O-N 2.87Å; A191-D195 WeakPolarHBondContact O-CB 3.08Å; A191-D195 PolarHBondContact O-N 3.09Å; A191-N209 HydrophobicContact CB-CB 4.31Å; A191-F210 HydrophobicContact CB-CE2 3.52Å; A191-F210 HydrophobicContact CB-CZ 3.93Å
192R94.1Very high93.7Very high80 Ų8047.2 Ų47.230%0.30223%0.229SC..Hα-helixtrans-61.9-39.4171.6-74.1-179.1175.41333.3112.1V188 E189 D195 R196 F210 E213V188-R192 WeakPolarHBondContact O-CG 3.31Å; V188-R192 PolarHBondContact O-N 3.26Å; E189-R192 PolarHBondContact O-N 3.09Å; R192-D195 PolarHBondContact O-N 3.38Å; R192-R196 WeakPolarHBondContact O-CG 3.5Å; R192-R196 PolarHBondContact O-N 2.92Å; R192-F210 HydrophobicContact CG-CD2 3.7Å; R192-F210 HydrophobicContact CG-CE2 3.75Å; R192-E213 IonicContact CZ-OE1 2.96Å; R192-E213 IonicContact CZ-OE2 2.7Å; R192-E213 VanDerWaalsContact NE-CD 3.33Å; R192-E213 IonicContact NE-OE1 2.75Å; R192-E213 PolarHBondContact NE-OE1 3.18Å; R192-E213 IonicContact NE-OE2 2.77Å; R192-E213 PolarHBondContact NE-OE2 2.93Å; R192-E213 IonicContact NH2-OE1 3.39Å; R192-E213 PolarHBondContact NH2-OE1 3.1Å
193A94.2Very high93.4Very high5 Ų548.1 Ų48.14%0.04124%0.238CC..Hα-helixtrans-65-41.2177.200000112.3Y184 E189 A190 A191 R196 A197Y184-A193 HydrophobicContact CD2-CB 4.36Å; Y184-A193 HydrophobicContact CE1-CB 4.31Å; Y184-A193 HydrophobicContact CE2-CB 3.48Å; Y184-A193 VanDerWaalsContact CE2-CB 3.48Å; Y184-A193 VanDerWaalsContact CZ-CB 3.45Å; Y184-A193 WeakPolarHBondContact OH-CB 3.2Å; E189-A193 WeakPolarHBondContact O-CB 3.47Å; E189-A193 PolarHBondContact O-N 3.06Å; A190-A193 PolarHBondContact O-N 3.09Å; A191-A193 VanDerWaalsContact C-N 3.34Å; A191-A193 PolarHBondContact O-N 2.83Å; A193-R196 PolarHBondContact O-N 3.33Å; A193-A197 PolarHBondContact O-N 3.5Å
194Y95.6Very high93Very high25 Ų2548.5 Ų48.510%0.09825%0.25CS..Hα-helixtrans-63.1-43.8171.6174.7-93.6000112.4R155 E168 I169 L181 A190 A191 R196 A197 A198R155-Y194 HydrophobicContact CB-CE1 4.13Å; R155-Y194 HydrophobicContact CG-CE1 4.33Å; R155-Y194 PolarHBondContact NE-OH 3.47Å; R155-Y194 VanDerWaalsContact NH2-CE1 3.29Å; R155-Y194 PolarHBondContact NH2-OH 3.23Å; R155-Y194 WeakPolarHBondContact O-CD1 3.29Å; R155-Y194 WeakPolarHBondContact O-CE1 3.32Å; R155-Y194 VanDerWaalsContact O-CG 3.29Å; E168-Y194 WeakPolarHBondContact O-CD2 3.49Å; E168-Y194 WeakPolarHBondContact O-CE2 3.42Å; I169-Y194 HydrophobicContact CB-CD2 4.13Å; I169-Y194 HydrophobicContact CB-CE2 3.9Å; I169-Y194 HydrophobicContact CD1-CD2 4.49Å; I169-Y194 HydrophobicContact CD1-CE2 4.04Å; I169-Y194 HydrophobicContact CG1-CD2 4.41Å; I169-Y194 HydrophobicContact CG1-CE2 3.8Å; L181-Y194 HydrophobicContact CD1-CD2 4.26Å; A190-Y194 PolarHBondContact O-N 3.41Å; A191-Y194 PolarHBondContact O-N 2.87Å; Y194-R196 VanDerWaalsContact C-N 3.34Å; Y194-R196 PolarHBondContact O-N 2.86Å; Y194-A197 WeakPolarHBondContact O-CB 3.48Å; Y194-A197 PolarHBondContact O-N 3.36Å; Y194-A197 VanDerWaalsContact O-N 3.09Å; Y194-A198 HydrophobicContact CE1-CB 4.26Å; Y194-A198 WeakPolarHBondContact O-CB 3.43Å; Y194-A198 PolarHBondContact O-N 2.98Å
195D94.6Very high92.7Very high0 Ų055.1 Ų55.10%028%0.28CS..Hα-helixtrans-63.1-39.2178.5-76.2-4.5000112A191 R192 A197 A198 F199 L208 N209 F210 W222A191-D195 WeakPolarHBondContact O-CB 3.08Å; A191-D195 PolarHBondContact O-N 3.09Å; R192-D195 PolarHBondContact O-N 3.38Å; D195-A197 VanDerWaalsContact C-N 3.32Å; D195-A197 PolarHBondContact O-N 3.48Å; D195-A198 PolarHBondContact O-N 3.3Å; D195-F199 WeakPolarHBondContact O-CB 3.32Å; D195-F199 PolarHBondContact O-N 3.47Å; D195-L208 HydrophobicContact CB-CB 4.33Å; D195-L208 HydrophobicContact CB-CD1 4.34Å; D195-L208 HydrophobicContact CB-CD2 3.91Å; D195-L208 HydrophobicContact CB-CG 4.42Å; D195-N209 VanDerWaalsContact CG-N 3.25Å; D195-N209 PolarHBondContact OD1-N 3.25Å; D195-N209 PolarHBondContact OD1-ND2 2.76Å; D195-N209 WeakPolarHBondContact OD2-CA 3.42Å; D195-N209 WeakPolarHBondContact OD2-CB 3.31Å; D195-N209 PolarHBondContact OD2-N 3.35Å; D195-F210 PolarHBondContact OD2-N 2.81Å; D195-W222 HydrophobicContact CB-CE3 4.28Å; D195-W222 HydrophobicContact CB-CH2 3.91Å; D195-W222 HydrophobicContact CB-CZ3 3.4Å; D195-W222 VanDerWaalsContact CB-CZ3 3.4Å
196R93.4Very high92.6Very high40 Ų4050.9 Ų50.915%0.15126%0.259CS..Hα-helixtrans-56.9-39.9170-73.7-166.5-60.5-856.4113.2R192 A193 Y194 R200 F221 W222R192-R196 WeakPolarHBondContact O-CG 3.5Å; R192-R196 PolarHBondContact O-N 2.92Å; A193-R196 PolarHBondContact O-N 3.33Å; Y194-R196 VanDerWaalsContact C-N 3.34Å; Y194-R196 PolarHBondContact O-N 2.86Å; R196-R200 WeakPolarHBondContact O-CG 3.38Å; R196-R200 PolarHBondContact O-NE 3.44Å; R196-F221 WeakPolarHBondContact CD-O 3.43Å; R196-W222 HydrophobicContact CB-CE3 4.23Å; R196-W222 HydrophobicContact CG-CE3 3.61Å; R196-W222 HydrophobicContact CG-CZ3 4.04Å
197A93.4Very high92.5Very high10 Ų1053.1 Ų53.18%0.08327%0.268CS..Hα-helixtrans-71.7-45.1174.700000111.8I169 L181 A193 Y194 D195 F199 R200 M201I169-A197 HydrophobicContact CB-CB 4.45Å; I169-A197 HydrophobicContact CD1-CB 3.79Å; I169-A197 HydrophobicContact CG2-CB 4.17Å; L181-A197 HydrophobicContact CD1-CB 3.51Å; L181-A197 HydrophobicContact CD2-CB 3.61Å; L181-A197 HydrophobicContact CG-CB 4.22Å; A193-A197 PolarHBondContact O-N 3.5Å; Y194-A197 WeakPolarHBondContact O-CB 3.48Å; Y194-A197 PolarHBondContact O-N 3.36Å; Y194-A197 VanDerWaalsContact O-N 3.09Å; D195-A197 VanDerWaalsContact C-N 3.32Å; D195-A197 PolarHBondContact O-N 3.48Å; A197-F199 PolarHBondContact O-N 3.2Å; A197-R200 PolarHBondContact O-N 2.91Å; A197-M201 WeakPolarHBondContact O-CB 3.47Å; A197-M201 WeakPolarHBondContact O-CG 3.2Å; A197-M201 PolarHBondContact O-N 3.1Å; A197-M201 VanDerWaalsContact O-N 3.13Å
198A93.5Very high92.5Very high5 Ų553 Ų534%0.04127%0.266CS..Hα-helixtrans-62.3-39.5-178.200000112.8I169 Y194 D195 M201 R202 A206 L208I169-A198 HydrophobicContact CD1-CB 3.97Å; Y194-A198 HydrophobicContact CE1-CB 4.26Å; Y194-A198 WeakPolarHBondContact O-CB 3.43Å; Y194-A198 PolarHBondContact O-N 2.98Å; D195-A198 PolarHBondContact O-N 3.3Å; A198-M201 PolarHBondContact O-N 2.97Å; A198-R202 PolarHBondContact O-N 3.23Å; A198-A206 WeakPolarHBondContact O-CB 3.39Å; A198-L208 HydrophobicContact CB-CD2 3.91Å
199F92.1Very high92.5Very high39 Ų3952.7 Ų52.717%0.17126%0.262CS..Hα-helixtrans-64.1-47.2176.9-169.6-96.2000111.9D195 A197 M201 R202 G203 A206 L208 V214 W222D195-F199 WeakPolarHBondContact O-CB 3.32Å; D195-F199 PolarHBondContact O-N 3.47Å; A197-F199 PolarHBondContact O-N 3.2Å; F199-M201 PolarHBondContact O-N 2.95Å; F199-R202 PolarHBondContact O-N 3.32Å; F199-G203 WeakPolarHBondContact O-CA 3.48Å; F199-G203 PolarHBondContact O-N 3.02Å; F199-A206 HydrophobicContact CD2-CB 4.5Å; F199-L208 HydrophobicContact CD2-CD1 4.47Å; F199-V214 HydrophobicContact CE2-CG1 4Å; F199-W222 HydrophobicContact CB-CB 4.15Å; F199-W222 HydrophobicContact CB-CG 4.4Å; F199-W222 HydrophobicContact CD1-CB 3.53Å; F199-W222 HydrophobicContact CD1-CG 4.09Å; F199-W222 HydrophobicContact CE1-CB 4.15Å; F199-W222 HydrophobicContact CG-CB 3.95Å; F199-W222 HydrophobicContact CG-CG 4.14Å
200R89.6Confident92.4Very high108 Ų10850.6 Ų50.641%0.40825%0.252SS..Hα-helixtrans-61-32.4175.8-65.1172.4-151.9147.86113.1R196 A197 W222 A223R196-R200 WeakPolarHBondContact O-CG 3.38Å; R196-R200 PolarHBondContact O-NE 3.44Å; A197-R200 PolarHBondContact O-N 2.91Å; R200-W222 PolarHBondContact NE-O 2.87Å; R200-W222 PolarHBondContact NH2-O 2.73Å; R200-W222 VanDerWaalsContact NH2-O 3.11Å; R200-A223 PolarHBondContact NH2-O 3.08Å
201M89.3Confident92.1Very high70 Ų7054.4 Ų54.435%0.34528%0.277SS..Hα-helixtrans-80.1-30.5-177.3-80.2-16376.400115.3I169 D171 A197 A198 F199I169-M201 HydrophobicContact CD1-CG 4.44Å; I169-M201 HydrophobicContact CD1-SD 3.55Å; I169-M201 VanDerWaalsContact CD1-SD 3.55Å; I169-M201 HydrophobicContact CG1-SD 3.87Å; I169-M201 HydrophobicContact CG2-SD 4.36Å; D171-M201 HydrophobicContact CB-CE 3.8Å; D171-M201 VanDerWaalsContact OD1-CE 3.26Å; D171-M201 WeakPolarHBondContact OD1-CE 3.26Å; D171-M201 VanDerWaalsContact OD1-SD 3.38Å; D171-M201 WeakPolarHBondContact OD2-CE 3.36Å; A197-M201 WeakPolarHBondContact O-CB 3.47Å; A197-M201 WeakPolarHBondContact O-CG 3.2Å; A197-M201 PolarHBondContact O-N 3.1Å; A197-M201 VanDerWaalsContact O-N 3.13Å; A198-M201 PolarHBondContact O-N 2.97Å; F199-M201 PolarHBondContact O-N 2.95Å
202R90.7Very high91.6Very high143 Ų14361 Ų6154%0.5431%0.312SS..Hα-helixtrans-125.9-1-173-152-172.9-74.3-173.5-2.2113.6A198 F199 K205 A206A198-R202 PolarHBondContact O-N 3.23Å; F199-R202 PolarHBondContact O-N 3.32Å; R202-K205 WeakPolarHBondContact CD-O 3.16Å; R202-K205 HydrophobicContact CG-CB 4.28Å; R202-K205 PolarHBondContact O-N 2.69Å; R202-A206 HydrophobicContact CB-CB 4.1Å
203G89.2Confident90.9Very high30 Ų3058.3 Ų58.331%0.30930%0.303SS..G310 helixtrans59.4-150.8-172.700000112.1F199 K205 A206F199-G203 WeakPolarHBondContact O-CA 3.48Å; F199-G203 PolarHBondContact O-N 3.02Å; G203-K205 PolarHBondContact O-N 3.4Å; G203-A206 WeakPolarHBondContact O-CB 3.28Å; G203-A206 PolarHBondContact O-N 2.92Å
204A88.7Confident89.7Confident97 Ų9760.1 Ų60.180%0.80231%0.313SS*.G310 helixtrans-58.7-12.117500000114.8A206A204-A206 PolarHBondContact O-N 3.2Å
205K89.6Confident88.3Confident180 Ų18062.7 Ų62.778%0.78335%0.347SS*.G310 helixtrans-84.14.4172.7-62.6-177.8179.7179.30112.8R202 G203 I207R202-K205 WeakPolarHBondContact CD-O 3.16Å; R202-K205 HydrophobicContact CG-CB 4.28Å; R202-K205 PolarHBondContact O-N 2.69Å; G203-K205 PolarHBondContact O-N 3.4Å; K205-I207 PolarHBondContact O-N 3.39Å
206A92Very high86.9Confident17 Ų1767.8 Ų67.814%0.1438%0.379CS..  trans-68117.8171.600000111.2A198 F199 R202 G203 A204 L208A198-A206 WeakPolarHBondContact O-CB 3.39Å; F199-A206 HydrophobicContact CD2-CB 4.5Å; R202-A206 HydrophobicContact CB-CB 4.1Å; G203-A206 WeakPolarHBondContact O-CB 3.28Å; G203-A206 PolarHBondContact O-N 2.92Å; A204-A206 PolarHBondContact O-N 3.2Å; A206-L208 HydrophobicContact CB-CD2 3.68Å; A206-L208 HydrophobicContact CB-CG 4.29Å; A206-L208 PolarHBondContact O-N 3.13Å
207I92.5Very high85.5Confident113 Ų11371.9 Ų71.958%0.57939%0.394SS*.  trans-69.7126.7160.3-54.2172.3000106R155 K205R155-I207 PolarHBondContact NH1-O 3.41Å; R155-I207 PolarHBondContact NH2-O 3.25Å; K205-I207 PolarHBondContact O-N 3.39Å
208L93.7Very high84Confident22 Ų2273.1 Ų73.112%0.11541%0.407CS..  trans-117.6167.6-178.4-60.4-171.5000111.1D195 A198 F199 A206 V214 W222D195-L208 HydrophobicContact CB-CB 4.33Å; D195-L208 HydrophobicContact CB-CD1 4.34Å; D195-L208 HydrophobicContact CB-CD2 3.91Å; D195-L208 HydrophobicContact CB-CG 4.42Å; A198-L208 HydrophobicContact CB-CD2 3.91Å; F199-L208 HydrophobicContact CD2-CD1 4.47Å; A206-L208 HydrophobicContact CB-CD2 3.68Å; A206-L208 HydrophobicContact CB-CG 4.29Å; A206-L208 PolarHBondContact O-N 3.13Å; L208-V214 HydrophobicContact CD1-CG2 3.37Å; L208-W222 HydrophobicContact CD1-CH2 4.23Å; L208-W222 HydrophobicContact CD1-CZ2 4.23Å
209N93.8Very high82.6Confident39 Ų3975.8 Ų75.821%0.20943%0.43CS..SBendtrans-75.3-38167.5-62.9-78.1000111.1Y154 R155 A191 D195 P211Y154-N209 HydrophobicContact CD1-CB 4.23Å; R155-N209 PolarHBondContact N-OD1 3.11Å; R155-N209 PolarHBondContact O-ND2 2.84Å; A191-N209 HydrophobicContact CB-CB 4.31Å; D195-N209 VanDerWaalsContact CG-N 3.25Å; D195-N209 PolarHBondContact OD1-N 3.25Å; D195-N209 PolarHBondContact OD1-ND2 2.76Å; D195-N209 WeakPolarHBondContact OD2-CA 3.42Å; D195-N209 WeakPolarHBondContact OD2-CB 3.31Å; D195-N209 PolarHBondContact OD2-N 3.35Å; N209-P211 VanDerWaalsContact O-CD 3.29Å; N209-P211 WeakPolarHBondContact O-CD 3.48Å
210F91.6Very high81.4Confident39 Ų3980.2 Ų80.217%0.17146%0.455CS..  trans-118.771.8-177.3-52.8-64.4000112.7Y154 V188 A191 R192 D195 N212 E213Y154-F210 HydrophobicContact CD1-CZ 4.2Å; Y154-F210 AromaticContact CE1-CE1 3.89Å; Y154-F210 HydrophobicContact CE1-CE1 3.89Å; Y154-F210 AromaticContact CE1-CZ 3.74Å; Y154-F210 HydrophobicContact CE1-CZ 3.74Å; V188-F210 HydrophobicContact CG1-CE2 4.25Å; V188-F210 HydrophobicContact CG1-CZ 3.88Å; A191-F210 HydrophobicContact CB-CE2 3.52Å; A191-F210 HydrophobicContact CB-CZ 3.93Å; R192-F210 HydrophobicContact CG-CD2 3.7Å; R192-F210 HydrophobicContact CG-CE2 3.75Å; D195-F210 PolarHBondContact OD2-N 2.81Å; F210-N212 PolarHBondContact O-N 3.08Å; F210-N212 VanDerWaalsContact O-N 3.16Å; F210-E213 HydrophobicContact CB-CB 4.29Å; F210-E213 HydrophobicContact CB-CG 4Å; F210-E213 PolarHBondContact O-N 3.42Å; F210-E213 VanDerWaalsContact O-N 3.09Å
211P87.6Confident80.3Confident81 Ų8178.1 Ų78.153%0.52645%0.449SS..THydrogen-bonded Turntrans-57.5-32.1-179.323.5-33.8000113.2N209 E213 V214N209-P211 VanDerWaalsContact O-CD 3.29Å; N209-P211 WeakPolarHBondContact O-CD 3.48Å; P211-E213 PolarHBondContact O-N 2.74Å; P211-V214 WeakPolarHBondContact O-CB 3.36Å; P211-V214 PolarHBondContact O-N 3.1Å; P211-V214 VanDerWaalsContact O-N 3.13Å
212N84.3Confident79.4Confident137 Ų13774.8 Ų74.873%0.73343%0.433SS*.Hα-helixtrans-65.8-22.8-179.6-5910.1000113.3F210 V214 T216F210-N212 PolarHBondContact O-N 3.08Å; F210-N212 VanDerWaalsContact O-N 3.16Å; N212-V214 VanDerWaalsContact C-N 3.29Å; N212-T216 PolarHBondContact O-OG1 2.84Å
213E79.2Confident78.3Confident25 Ų2570.2 Ų70.212%0.11743%0.425CS..Hα-helixtrans-77.7-13.7177.3-68.1-172.7-176.100112.5R192 F210 P211 W222R192-E213 IonicContact CZ-OE1 2.96Å; R192-E213 IonicContact CZ-OE2 2.7Å; R192-E213 VanDerWaalsContact NE-CD 3.33Å; R192-E213 IonicContact NE-OE1 2.75Å; R192-E213 PolarHBondContact NE-OE1 3.18Å; R192-E213 IonicContact NE-OE2 2.77Å; R192-E213 PolarHBondContact NE-OE2 2.93Å; R192-E213 IonicContact NH2-OE1 3.39Å; R192-E213 PolarHBondContact NH2-OE1 3.1Å; F210-E213 HydrophobicContact CB-CB 4.29Å; F210-E213 HydrophobicContact CB-CG 4Å; F210-E213 PolarHBondContact O-N 3.42Å; F210-E213 VanDerWaalsContact O-N 3.09Å; P211-E213 PolarHBondContact O-N 2.74Å; E213-W222 HydrophobicContact CB-CH2 4.04Å; E213-W222 HydrophobicContact CB-CZ2 3.61Å
214V68.6Low77.2Confident43 Ų4373.2 Ų73.226%0.26144%0.439SS..Hα-helixtrans-76-50.7178.5-170.30000111.7F199 L208 P211 N212 T216 W222F199-V214 HydrophobicContact CE2-CG1 4Å; L208-V214 HydrophobicContact CD1-CG2 3.37Å; P211-V214 WeakPolarHBondContact O-CB 3.36Å; P211-V214 PolarHBondContact O-N 3.1Å; P211-V214 VanDerWaalsContact O-N 3.13Å; N212-V214 VanDerWaalsContact C-N 3.29Å; V214-T216 PolarHBondContact O-N 3.39Å; V214-W222 HydrophobicContact CG2-CZ2 3.82Å
215G66Low76.2Confident79 Ų7972.3 Ų72.381%0.81443%0.425SS*.Hα-helixtrans-71.6-14.7-177.100000114.6
216T65.9Low75Confident107 Ų10767.7 Ų67.766%0.65642%0.421SS*.Hα-helixtrans-106.6-14.2-171.650.60000114.7N212 V214N212-T216 PolarHBondContact O-OG1 2.84Å; V214-T216 PolarHBondContact O-N 3.39Å
217R64Low73.4Confident126 Ų12672.5 Ų72.548%0.47545%0.45SS..Hα-helixtrans-130.613.8-173.8-61.5-173.2167.6-171.8-5.4114.8F221R217-F221 HydrophobicContact CB-CB 3.64Å; R217-F221 HydrophobicContact CB-CD1 4.4Å; R217-F221 HydrophobicContact CB-CG 4.05Å; R217-F221 VanDerWaalsContact NH1-CE2 3.28Å
218G62.6Low71.6Confident35 Ų3571.4 Ų71.436%0.36146%0.459SS..THydrogen-bonded Turntrans65.7-174.3-179.400000113.7D220 W222G218-D220 PolarHBondContact O-N 3.18Å; G218-W222 VanDerWaalsContact O-CD1 3.29Å
219A63.1Low69.2Low62 Ų6280.1 Ų80.151%0.51250%0.496SS..THydrogen-bonded Turntrans-70.5-21.9170.700000111.8F221 W222 A223A219-F221 PolarHBondContact O-N 3.01Å; A219-W222 CarbonylContact O-C 3.54Å; A219-W222 WeakPolarHBondContact O-CA 3.45Å; A219-W222 WeakPolarHBondContact O-CB 3.38Å; A219-W222 PolarHBondContact O-N 2.95Å; A219-A223 PolarHBondContact O-N 3.43Å; A219-A223 VanDerWaalsContact O-N 3.08Å
220D68.1Low66.8Low131 Ų13187 Ų8770%0.70152%0.523SS*.G310 helixtrans-65.9-38-169.5-43.8-64.2000112.3G218 W222 A223G218-D220 PolarHBondContact O-N 3.18Å; D220-W222 PolarHBondContact O-N 3.41Å; D220-A223 VanDerWaalsContact O-CB 3.28Å; D220-A223 WeakPolarHBondContact O-CB 3.42Å; D220-A223 PolarHBondContact O-N 3.3Å
221F66.1Low64.4Low64 Ų6487.8 Ų87.828%0.28154%0.538SS..G310 helixtrans-66.2-19.3173.8-171.1-108.5000113.4R196 R217 A219R196-F221 WeakPolarHBondContact CD-O 3.43Å; R217-F221 HydrophobicContact CB-CB 3.64Å; R217-F221 HydrophobicContact CB-CD1 4.4Å; R217-F221 HydrophobicContact CB-CG 4.05Å; R217-F221 VanDerWaalsContact NH1-CE2 3.28Å; A219-F221 PolarHBondContact O-N 3.01Å
222W69.4Low62.4Low1 Ų190.4 Ų90.40%0.00455%0.547CS..G310 helixtrans-97.4-12.6176.8-52.9102.7000113.2D195 R196 F199 R200 L208 E213 V214 G218 A219 D220D195-W222 HydrophobicContact CB-CE3 4.28Å; D195-W222 HydrophobicContact CB-CH2 3.91Å; D195-W222 HydrophobicContact CB-CZ3 3.4Å; D195-W222 VanDerWaalsContact CB-CZ3 3.4Å; R196-W222 HydrophobicContact CB-CE3 4.23Å; R196-W222 HydrophobicContact CG-CE3 3.61Å; R196-W222 HydrophobicContact CG-CZ3 4.04Å; F199-W222 HydrophobicContact CB-CB 4.15Å; F199-W222 HydrophobicContact CB-CG 4.4Å; F199-W222 HydrophobicContact CD1-CB 3.53Å; F199-W222 HydrophobicContact CD1-CG 4.09Å; F199-W222 HydrophobicContact CE1-CB 4.15Å; F199-W222 HydrophobicContact CG-CB 3.95Å; F199-W222 HydrophobicContact CG-CG 4.14Å; R200-W222 PolarHBondContact NE-O 2.87Å; R200-W222 PolarHBondContact NH2-O 2.73Å; R200-W222 VanDerWaalsContact NH2-O 3.11Å; L208-W222 HydrophobicContact CD1-CH2 4.23Å; L208-W222 HydrophobicContact CD1-CZ2 4.23Å; E213-W222 HydrophobicContact CB-CH2 4.04Å; E213-W222 HydrophobicContact CB-CZ2 3.61Å; V214-W222 HydrophobicContact CG2-CZ2 3.82Å; G218-W222 VanDerWaalsContact O-CD1 3.29Å; A219-W222 CarbonylContact O-C 3.54Å; A219-W222 WeakPolarHBondContact O-CA 3.45Å; A219-W222 WeakPolarHBondContact O-CB 3.38Å; A219-W222 PolarHBondContact O-N 2.95Å; D220-W222 PolarHBondContact O-N 3.41Å
223A68.3Low60.7Low46 Ų4688.2 Ų88.238%0.3854%0.539SS..SBendtrans-60.8167170.500000112R200 A219 D220R200-A223 PolarHBondContact NH2-O 3.08Å; A219-A223 PolarHBondContact O-N 3.43Å; A219-A223 VanDerWaalsContact O-N 3.08Å; D220-A223 VanDerWaalsContact O-CB 3.28Å; D220-A223 WeakPolarHBondContact O-CB 3.42Å; D220-A223 PolarHBondContact O-N 3.3Å
224P66.2Low59.2Low93 Ų9390 Ų9060%0.60456%0.558SS**  trans-11.1111.7160.438.8-27.8000118.2A226P224-A226 PolarHBondContact O-N 2.81Å; P224-A226 VanDerWaalsContact O-N 3.1Å
225P67.5Low58.1Low78 Ų7890.8 Ų90.851%0.50657%0.569SS.*  trans-57.3119.8138.328.7-32.4000104.5P227P225-P227 VanDerWaalsContact O-N 3.15Å
226A64Low57.1Low83 Ų8389.6 Ų89.669%0.68655%0.551SS**  trans-48.5127.9177.300000107.5P224 A228P224-A226 PolarHBondContact O-N 2.81Å; P224-A226 VanDerWaalsContact O-N 3.1Å; A226-A228 WeakPolarHBondContact O-CA 3.45Å; A226-A228 PolarHBondContact O-N 2.9Å
227P59.7Low56.2Low118 Ų11890.7 Ų90.777%0.76655%0.553SS**  trans-53.9111-167.321.3-33.2000107.7P225 K229P225-P227 VanDerWaalsContact O-N 3.15Å; P227-K229 WeakPolarHBondContact O-CA 3.27Å; P227-K229 PolarHBondContact O-N 3.5Å
228A53.8Low55.7Low91 Ų9192.9 Ų92.975%0.75257%0.566SS**  trans-49.3111.7-158.500000108.3A226 K230A226-A228 WeakPolarHBondContact O-CA 3.45Å; A226-A228 PolarHBondContact O-N 2.9Å; A228-K230 PolarHBondContact O-N 3.37Å
229K43.1Very low55Low205 Ų205101 Ų10189%0.89159%0.586SS**  trans-45.9112.6-162.2-77.1-173.3177.2-175.90107.3P227 A231P227-K229 WeakPolarHBondContact O-CA 3.27Å; P227-K229 PolarHBondContact O-N 3.5Å; K229-A231 PolarHBondContact O-N 3.11Å
230K43.5Very low54.1Low182 Ų182106.9 Ų106.979%0.79160%0.6SS**  trans-64.692.7174.4-76-174.4-179.7178.20105A228 D232A228-K230 PolarHBondContact O-N 3.37Å; K230-D232 PolarHBondContact O-N 2.79Å
231A41.5Very low53.2Low57 Ų57111.1 Ų111.147%0.47161%0.606SS.*  trans-51.2135.2174.900000106.8K229 T233 A234K229-A231 PolarHBondContact O-N 3.11Å; A231-T233 HydrophobicContact CB-CG2 4.41Å; A231-T233 PolarHBondContact O-N 3.19Å; A231-T233 PolarHBondContact O-OG1 3.46Å; A231-T233 VanDerWaalsContact O-OG1 3.08Å; A231-A234 PolarHBondContact O-N 3.09Å
232D45Very low52.4Low135 Ų135116.6 Ų116.672%0.72263%0.632SS**THydrogen-bonded Turntrans-68-0.2-165.1-55.1-88.4000112.9K230 A234 A235 A236K230-D232 PolarHBondContact O-N 2.79Å; D232-A234 PolarHBondContact O-N 3.03Å; D232-A235 WeakPolarHBondContact O-CA 3.35Å; D232-A235 WeakPolarHBondContact O-CB 3.44Å; D232-A235 PolarHBondContact O-N 3.02Å; D232-A236 PolarHBondContact O-N 3.07Å
233T50.2Low51.2Low92 Ų92124.9 Ų124.956%0.56467%0.671SS**Hα-helixtrans-45-34.2157.763.40000113.3A231 A235 A236 N237A231-T233 HydrophobicContact CB-CG2 4.41Å; A231-T233 PolarHBondContact O-N 3.19Å; A231-T233 PolarHBondContact O-OG1 3.46Å; A231-T233 VanDerWaalsContact O-OG1 3.08Å; T233-A235 VanDerWaalsContact C-N 3.3Å; T233-A235 PolarHBondContact O-N 3.47Å; T233-A236 PolarHBondContact O-N 2.75Å; T233-N237 WeakPolarHBondContact O-CB 3.45Å; T233-N237 PolarHBondContact O-N 3.2Å
234A46.2Very low50Low63 Ų63130.2 Ų130.252%0.52169%0.692SS.*Hα-helixtrans-67.6-27.2175.400000113.5A231 D232A231-A234 PolarHBondContact O-N 3.09Å; D232-A234 PolarHBondContact O-N 3.03Å
235A45.8Very low49.1Very low59 Ų59132.3 Ų132.349%0.48870%0.703SS.*Hα-helixtrans-87.2-39.7171.800000111.4D232 T233 N237 K238 R239D232-A235 WeakPolarHBondContact O-CA 3.35Å; D232-A235 WeakPolarHBondContact O-CB 3.44Å; D232-A235 PolarHBondContact O-N 3.02Å; T233-A235 VanDerWaalsContact C-N 3.3Å; T233-A235 PolarHBondContact O-N 3.47Å; A235-N237 PolarHBondContact O-N 3.09Å; A235-K238 PolarHBondContact O-N 3.45Å; A235-K238 VanDerWaalsContact O-N 3.16Å; A235-R239 PolarHBondContact O-N 3.47Å
236A45.2Very low48.1Very low53 Ų53137.1 Ų137.144%0.43872%0.719SS.*Hα-helixtrans-58.6-43.8177.400000112.3D232 T233 K238 R239 K240D232-A236 PolarHBondContact O-N 3.07Å; T233-A236 PolarHBondContact O-N 2.75Å; A236-K238 PolarHBondContact O-N 2.91Å; A236-K238 VanDerWaalsContact O-N 3.16Å; A236-R239 PolarHBondContact O-N 2.9Å; A236-K240 PolarHBondContact O-N 3.47Å
237N47.9Very low47.2Very low131 Ų131141.5 Ų141.570%0.70173%0.731SS**Hα-helixtrans-68.7-10.8180-76-1.4000114.3T233 A235T233-N237 WeakPolarHBondContact O-CB 3.45Å; T233-N237 PolarHBondContact O-N 3.2Å; A235-N237 PolarHBondContact O-N 3.09Å
238K51.9Low46.4Very low171 Ų171140.3 Ų140.374%0.74373%0.731SS**Hα-helixtrans-86.2-31.2167.8-89.8-168170-168.20113.2A235 A236A235-K238 PolarHBondContact O-N 3.45Å; A235-K238 VanDerWaalsContact O-N 3.16Å; A236-K238 PolarHBondContact O-N 2.91Å; A236-K238 VanDerWaalsContact O-N 3.16Å
239R49.3Very low46Very low206 Ų206144.3 Ų144.378%0.77774%0.739SS**Hα-helixtrans-83.4-29.8-177-71.6-177.5172.5166.4-2.8113.5A235 A236 R241A235-R239 PolarHBondContact O-N 3.47Å; A236-R239 PolarHBondContact O-N 2.9Å; R239-R241 PolarHBondContact O-N 3.43Å; R239-R241 VanDerWaalsContact O-N 3.16Å
240K43.8Very low46.3Very low185 Ų185137.6 Ų137.680%0.80473%0.728SS**THydrogen-bonded Turntrans-76.77.5179.2-166.4154.6-177.9169.80115.2A236A236-K240 PolarHBondContact O-N 3.47Å
241R49.6Very low46.7Very low221 Ų221136.1 Ų136.183%0.83473%0.729SS**THydrogen-bonded Turntrans-117.314.8179.8-141.5-179.878.8173.26.5114.7R239R239-R241 PolarHBondContact O-N 3.43Å; R239-R241 VanDerWaalsContact O-N 3.16Å
242Q48.3Very low47.3Very low178 Ų178140.8 Ų140.883%0.83275%0.746SS**SBendtrans-132.816.6174.5-66.1-176.9-72.500112.3
243Q44.9Very low47.5Very low175 Ų175140.6 Ų140.682%0.81875%0.75SS**SBendtrans-136.459.7179-165.8178.414.800109.3
244L43.7Very low47.5Very low158 Ų158144.8 Ų144.883%0.82776%0.763SS**SBendtrans-164.340.4176-16094.8000110.9
245V46.2Very low47.1Very low137 Ų137147.1 Ų147.183%0.8377%0.77SS**SBendtrans-143.633.3179-156.20000110.9
246E46.9Very low46.8Very low180 Ų180150.8 Ų150.884%0.84179%0.786SS**SBendtrans-135.1166.9167-65.5-177123.300106.2
247D45.3Very low46.6Very low174 Ų174152.6 Ų152.693%0.9380%0.801SS**  trans64.270.6-171.6-52-33000114.7
248A42.2Very low46.2Very low93 Ų93152.8 Ų152.877%0.76981%0.807SS**  trans-121.395.816400000110.1
249D45.5Very low45.9Very low175 Ų175150.1 Ų150.194%0.93681%0.805SS**  trans-169.5146.9164.8-92.3-36.9000108.6
250G49.9Very low45.4Very low64 Ų64146.6 Ų146.666%0.6681%0.806SS**  trans98.168.3163.800000119.6
251D52.5Low46.1Very low152 Ų152143 Ų14381%0.81380%0.804SS**  53155.3126.9-51.7-50.2000125.1
252D53.3Low45.7Very low154 Ų154142.2 Ų142.282%0.82481%0.807SS**  trans68.282.4155.7-63-22.3000123.4
253V48.2Very low45.8Very low131 Ų131138 Ų13879%0.79480%0.803SS**  trans-8.3124.6133.9-173.20000119.2V255V253-V255 HydrophobicContact CG1-CG2 4.15Å
254E51.2Low46Very low181 Ų181134.2 Ų134.285%0.84680%0.801SS**  -169.1101.1124.6-157.1162.2-154.400111
255V37.4Very low46.2Very low111 Ų111135.3 Ų135.367%0.67380%0.799SS**  65.2105.194.3-177.60000116.9V253V253-V255 HydrophobicContact CG1-CG2 4.15Å
256V39.8Very low46.7Very low136 Ų136135.5 Ų135.582%0.82480%0.8SS**  trans62.2114.7148.9178.90000120.5
257A40.5Very low46.9Very low91 Ų91130.8 Ų130.875%0.75278%0.784SS**  -157.6126.4126.800000111.7
258V39.7Very low47.5Very low136 Ų136130.1 Ų130.182%0.82478%0.78SS**  trans-96.3122.6166173.30000108.4
259V44.7Very low47.6Very low115 Ų115132.9 Ų132.970%0.69778%0.777SS**  trans-127.7108.2172.6-178.50000110.2
260V40.6Very low48.1Very low131 Ų131131.6 Ų131.679%0.79477%0.769SS**  trans-91.4116166.1174.10000108
261S57.8Low48.4Very low111 Ų111133.8 Ų133.878%0.77677%0.771SS**  trans-111.8126.5178.3-71.50000111.5
262K40.2Very low47.8Very low203 Ų203131.1 Ų131.188%0.88377%0.77SS**  trans-139.8114.8-176.9-179-171.6179.572.60109.8
263A52Low47.5Very low91 Ų91129.6 Ų129.675%0.75277%0.772SS**  trans-135125.3173.900000107.9
264A49.4Very low47.4Very low94 Ų94129 Ų12978%0.77777%0.773SS**  64.687.77500000110.2
265K47Very low47.6Very low181 Ų181126.6 Ų126.679%0.78777%0.774SS**  6299.875.6-169.7178.1177.9176.90112.5V267K265-V267 HydrophobicContact CG-CG2 4.37Å
266V56.3Low47.7Very low141 Ų141126.4 Ų126.486%0.85578%0.777SS**  trans-112.6152.1152174.40000107.1
267V50.5Low48.3Very low81 Ų81129 Ų12949%0.49178%0.78SS.*  trans-119.5138.6179.41720000107.8K265 E269K265-V267 HydrophobicContact CG-CG2 4.37Å; V267-E269 HydrophobicContact CG1-CG 4.35Å
268D59.1Low48.4Very low160 Ų160131 Ų13186%0.85678%0.778SS**  trans-148.4160.8154.9-131.1-36.5000109.9
269E44.4Very low48.5Very low151 Ų151132.9 Ų132.971%0.70678%0.778SS**  trans-130.8-172.4-169.2-72.1-169.5-149.300108.7V267V267-E269 HydrophobicContact CG1-CG 4.35Å
270I54.6Low48.5Very low149 Ų149134.4 Ų134.476%0.76479%0.788SS**  cis-130.8-125.920.5-41.9173.3000110.8
271P56.5Low48.6Very low110 Ų110133.6 Ų133.671%0.71479%0.788SS**  trans-121.4163.1-135.641.3-24.8000118.6
272A40Very low47.8Very low95 Ų95133.9 Ų133.979%0.78579%0.789SS**  trans50.4116.1137.100000121.3
273S48Very low47.7Very low123 Ų123130.8 Ų130.886%0.8679%0.787SS**  -161.1131.6126.826.30000111.6
274S45.4Very low47.8Very low117 Ų117132 Ų13282%0.81879%0.79SS**  trans-86.4163.5164.3-53.30000109.6
275P55.7Low47.3Very low132 Ų132138.7 Ų138.786%0.85780%0.795SS**  -141.1156.4102.137.5-25.7000115
276S40.4Very low47.4Very low107 Ų107135.4 Ų135.475%0.74880%0.795SS**  trans-101.913617252.80000111.1
277Q51.2Low46.9Very low191 Ų191133.5 Ų133.589%0.89379%0.788SS**  trans-168.6157.5163.8-100.1178.95.600108
278D43.6Very low46.6Very low131 Ų131134.7 Ų134.770%0.70180%0.8SS**  cis-156.7172.6-49.8-138.1-49.3000108.1
279Q40.7Very low46.1Very low176 Ų176133.7 Ų133.782%0.82280%0.799SS**  trans-68.2136.5-175.7-60.9154.58700113.1
280T44.7Very low45.9Very low147 Ų147131.2 Ų131.290%0.90280%0.799SS**  trans-147.8143.4143.427.80000110.7
281S44.2Very low45.2Very low114 Ų114129.9 Ų129.980%0.79780%0.798SS**  trans-110.4148.517855.10000110.8
282C40.7Very low45.2Very low118 Ų118135.5 Ų135.580%0.79781%0.805SS**  trans-142.8107.6167.255.40000111.5
283T36.5Very low45.3Very low137 Ų137139.9 Ų139.984%0.8481%0.809SS**  trans-96.3100.1176.5-55.70000109.5
284S54.7Low45.7Very low118 Ų118140.8 Ų140.883%0.82581%0.81SS**  trans-107.3103-176-66.40000112.6
285R39.8Very low45.6Very low233 Ų233141.2 Ų141.288%0.87981%0.807SS**  trans-87.1128.2165.9-71.5158.358.2-178-0.9109.6
286S47.9Very low45.2Very low113 Ų113139.3 Ų139.379%0.7980%0.803SS**  trans-162.7128.7160.3-89.50000106.6
287S46.3Very low45.1Very low100 Ų100140.4 Ų140.470%0.69981%0.805SS**  cis53.4132.228.981.40000115.2
288S44.2Very low44.9Very low106 Ų106135.2 Ų135.274%0.74180%0.795SS**  cis-174.6151.5-15.7-92.90000105.2
289V48.2Very low44.9Very low140 Ų140134.9 Ų134.985%0.84880%0.803SS**  trans42.4120.3158.970.40000119.4
290S41.6Very low45.5Very low99 Ų99132.5 Ų132.569%0.69281%0.806SS**  -175.4149.9110.8-159.60000112.4
291T38.8Very low45.1Very low121 Ų121131.4 Ų131.474%0.74280%0.799SS**  trans-79.2158.2174.742.20000112.5
292R57.4Low45.6Very low227 Ų227133 Ų13386%0.85780%0.803SS**  -175150.3124.358.3-160.781.1168.612.7110.8
293E41.3Very low45.3Very low187 Ų187133.5 Ų133.587%0.87480%0.803SS**  trans-89.1153.7-177.7-57.1156.8121.100111.1
294T57.5Low46Very low143 Ų143132.3 Ų132.388%0.87780%0.8SS**  trans-143.6144158.6-61.20000108.7
295T42.7Very low45.2Very low126 Ų126131.5 Ų131.577%0.77380%0.801SS**  trans-102.9171.9-17149.60000113.5
296A47.5Very low45.2Very low92 Ų92125 Ų12576%0.7680%0.797SS**  trans70.9154.5158.200000117.5
297T37.2Very low45Very low130 Ų130128.7 Ų128.780%0.79880%0.802SS**  cis-168160.6-16.5-96.50000108.7
298A47.4Very low44.5Very low82 Ų82132.7 Ų132.768%0.67881%0.809SS**  trans71.3128.8171.800000115.6
299S44.2Very low44.2Very low124 Ų124134.8 Ų134.887%0.86782%0.817SS**  cis97.8106.135.8-68.10000113.1
300S53.1Low43.7Very low126 Ų126131.6 Ų131.688%0.88181%0.813SS**  trans-158135.4150.749.40000111
301T37.3Very low43.3Very low124 Ų124133.3 Ų133.376%0.76183%0.825SS**  trans-107.2143-179.2-58.40000109.8T303T301-T303 HydrophobicContact CG2-CG2 4.05Å
302V53.7Low43.3Very low147 Ų147130.9 Ų130.989%0.89182%0.824SS**  trans-137.6144.9158.6-71.60000110.4
303T35Very low42.4Very low128 Ų128124.9 Ų124.979%0.78582%0.823SS**  trans-143.7132.5-172480000112T301T301-T303 HydrophobicContact CG2-CG2 4.05Å
304S51.1Low42.8Very low112 Ų112122.8 Ų122.878%0.78382%0.823SS**  trans-162.8125.7168.754.50000106.7
305A37.1Very low41.7Very low101 Ų101119.6 Ų119.684%0.83582%0.819SS**  cis61.1121.837.300000112.5
306A39.3Very low41.8Very low96 Ų96121.6 Ų121.679%0.79382%0.824SS**  cis-139.8-150.8-7.700000108.1
307E45Very low42.1Very low192 Ų192122.8 Ų122.890%0.89782%0.823SS**  cis-144.1-175.613.9-67.2177.2106.400110.2
308E35.5Very low42.6Very low184 Ų184125.7 Ų125.786%0.8683%0.83SS**  trans-90.8166.3180-54.7-173.7123.400114.2
309T36.9Very low43.1Very low149 Ų149127.4 Ų127.491%0.91483%0.833SS**  151.4135.4129.9-67.10000111.8
310G38.9Very low43.6Very low74 Ų74127.2 Ų127.276%0.76383%0.829SS**  trans151.477.6164.200000116.1
311S33.7Very low43.3Very low135 Ų135126.5 Ų126.594%0.94482%0.824SS**  trans-77143.7170.5-174.10000111.6
312G37.8Very low43.9Very low70 Ų70126.4 Ų126.472%0.72283%0.828SS**  trans-173.188.7179.500000113.2
313A37.9Very low43.7Very low101 Ų101122.1 Ų122.184%0.83581%0.814SS**  trans-84.5127.7179.400000112.3
314V49.3Very low44.7Very low142 Ų142119.6 Ų119.686%0.86180%0.795SS**  trans-147.3138.8164.5-118.40000109.5
315G35Very low45.1Very low77 Ų77123.5 Ų123.579%0.79479%0.793SS**PPolyproline II helixtrans-72.1146.7-165.600000115.3
316L45.4Very low46.2Very low168 Ų168123.7 Ų123.788%0.8878%0.777SS**PPolyproline II helixtrans-95.1129171.8-63.7177.4000110.4
317P52.5Low47.4Very low116 Ų116124.9 Ų124.975%0.75377%0.766SS**PPolyproline II helixtrans-71.9144.8176.930.1-34.6000111.4
318M49.2Very low48.2Very low191 Ų191124.8 Ų124.894%0.94176%0.759SS**PPolyproline II helixtrans-65.5136.7-176.7-51.9-160.387.400111.8
319T58.3Low49.5Very low118 Ų118124 Ų12472%0.72475%0.748SS**PPolyproline II helixtrans-97133.5176.955.60000110.6S321T319-S321 PolarHBondContact O-N 3.04Å
320P54.4Low50.9Low121 Ų121123.5 Ų123.579%0.78674%0.735SS**  trans-78.765-177.132.1-36.2000111.8S322P320-S322 PolarHBondContact O-N 3.5Å
321S46Very low52.1Low111 Ų111123.6 Ų123.678%0.77673%0.729SS**THydrogen-bonded Turntrans-82.232.6-172.9-169.10000114.7T319T319-S321 PolarHBondContact O-N 3.04Å
322S50.6Low53.6Low121 Ų121122.2 Ų122.285%0.84671%0.71SS**THydrogen-bonded Turntrans-159.813.5176.352.30000114.3P320P320-S322 PolarHBondContact O-N 3.5Å
323G48.1Very low54.9Low58 Ų58123.8 Ų123.860%0.59870%0.702SS**  trans-72.9129.6-178.100000113.3W325G323-W325 PolarHBondContact O-N 3.16Å
324N57.1Low56Low75 Ų75122.4 Ų122.440%0.40170%0.697SS.*  trans-66.8127.1173.6-173.617.8000110.1E326 Q327N324-E326 PolarHBondContact ND2-OE2 3.42Å; N324-E326 PolarHBondContact O-N 3.16Å; N324-E326 VanDerWaalsContact O-N 3.09Å; N324-E326 PolarHBondContact OD1-OE2 2.89Å; N324-Q327 HydrophobicContact CB-CG 4.45Å; N324-Q327 PolarHBondContact O-N 2.89Å; N324-Q327 VanDerWaalsContact O-N 3.09Å
325W59.3Low56.5Low194 Ų194120.5 Ų120.574%0.73569%0.69SS**Hα-helixtrans-59-24-175.465.8-20.9000114.5G323 Y328G323-W325 PolarHBondContact O-N 3.16Å; W325-Y328 PolarHBondContact O-N 3.43Å
326E59.4Low57.7Low105 Ų105122.6 Ų122.649%0.49168%0.682SS.*Hα-helixtrans-67-44175.9-72133.7-153.800111.5N324 Y328 W329 E330N324-E326 PolarHBondContact ND2-OE2 3.42Å; N324-E326 PolarHBondContact O-N 3.16Å; N324-E326 VanDerWaalsContact O-N 3.09Å; N324-E326 PolarHBondContact OD1-OE2 2.89Å; E326-Y328 PolarHBondContact O-N 3.06Å; E326-W329 PolarHBondContact O-N 3.16Å; E326-E330 PolarHBondContact O-N 3.2Å
327Q64.1Low58.4Low121 Ų121119.7 Ų119.757%0.56567%0.674SS**Hα-helixtrans-62.2-28177.9-68.4178.7-31.100112.6N324 W329 E330 A331N324-Q327 HydrophobicContact CB-CG 4.45Å; N324-Q327 PolarHBondContact O-N 2.89Å; N324-Q327 VanDerWaalsContact O-N 3.09Å; Q327-W329 VanDerWaalsContact C-N 3.29Å; Q327-W329 PolarHBondContact O-N 3.32Å; Q327-E330 PolarHBondContact O-N 3.1Å; Q327-A331 VanDerWaalsContact O-CB 3.27Å; Q327-A331 WeakPolarHBondContact O-CB 3.47Å; Q327-A331 PolarHBondContact O-N 3.46Å
328Y61.9Low58.6Low190 Ų190122.7 Ų122.775%0.74568%0.682SS**Hα-helixtrans-71.4-25.1177.5-151.9-90000112.5W325 E326 L332W325-Y328 PolarHBondContact O-N 3.43Å; E326-Y328 PolarHBondContact O-N 3.06Å; Y328-L332 WeakPolarHBondContact O-CB 3.36Å
329W63.9Low58.8Low167 Ų167121.3 Ų121.363%0.63368%0.678SS**Hα-helixtrans-85-40.7170.8-75.6106.3000111.8E326 Q327 A331 L332 L333E326-W329 PolarHBondContact O-N 3.16Å; Q327-W329 VanDerWaalsContact C-N 3.29Å; Q327-W329 PolarHBondContact O-N 3.32Å; W329-A331 VanDerWaalsContact C-N 3.35Å; W329-A331 PolarHBondContact O-N 2.96Å; W329-L332 HydrophobicContact CE3-CD2 4.01Å; W329-L332 HydrophobicContact CZ3-CD2 3.89Å; W329-L332 PolarHBondContact O-N 2.9Å; W329-L333 HydrophobicContact CE3-CD1 3.83Å; W329-L333 HydrophobicContact CZ3-CD1 4.49Å; W329-L333 VanDerWaalsContact O-CD1 3.31Å; W329-L333 WeakPolarHBondContact O-CD1 3.33Å; W329-L333 PolarHBondContact O-N 3.17Å
330E65.4Low58.8Low138 Ų138120 Ų12065%0.64567%0.674SS**Hα-helixtrans-62.2-40.3176.2-68.2-175.3155.900112.2E326 Q327 L332 L333 G334E326-E330 PolarHBondContact O-N 3.2Å; Q327-E330 PolarHBondContact O-N 3.1Å; E330-L332 VanDerWaalsContact C-N 3.27Å; E330-L332 PolarHBondContact O-N 3.12Å; E330-L333 PolarHBondContact O-N 2.83Å; E330-G334 WeakPolarHBondContact O-CA 3.5Å; E330-G334 PolarHBondContact O-N 3.35Å
331A65.8Low58.7Low76 Ų76120.5 Ų120.563%0.62868%0.677SS**Hα-helixtrans-66.5-26.5173.400000113.4Q327 W329Q327-A331 VanDerWaalsContact O-CB 3.27Å; Q327-A331 WeakPolarHBondContact O-CB 3.47Å; Q327-A331 PolarHBondContact O-N 3.46Å; W329-A331 VanDerWaalsContact C-N 3.35Å; W329-A331 PolarHBondContact O-N 2.96Å
332L64.7Low58.9Low106 Ų106123.6 Ų123.656%0.55568%0.679SS**Hα-helixtrans-84.9-32-179.9-168.669.7000112.6Y328 W329 E330Y328-L332 WeakPolarHBondContact O-CB 3.36Å; W329-L332 HydrophobicContact CE3-CD2 4.01Å; W329-L332 HydrophobicContact CZ3-CD2 3.89Å; W329-L332 PolarHBondContact O-N 2.9Å; E330-L332 VanDerWaalsContact C-N 3.27Å; E330-L332 PolarHBondContact O-N 3.12Å
333L64.4Low59.1Low104 Ų104122.6 Ų122.655%0.54567%0.672SS.*Hα-helixtrans-92.7-34.9178.2-83.475.3000112.6W329 E330 S335 L336W329-L333 HydrophobicContact CE3-CD1 3.83Å; W329-L333 HydrophobicContact CZ3-CD1 4.49Å; W329-L333 VanDerWaalsContact O-CD1 3.31Å; W329-L333 WeakPolarHBondContact O-CD1 3.33Å; W329-L333 PolarHBondContact O-N 3.17Å; E330-L333 PolarHBondContact O-N 2.83Å; L333-S335 PolarHBondContact O-N 3.34Å; L333-L336 WeakPolarHBondContact O-CB 3.29Å; L333-L336 PolarHBondContact O-N 3.05Å; L333-L336 VanDerWaalsContact O-N 3.11Å
334G60.6Low59.6Low72 Ų72126 Ų12674%0.74268%0.683SS**THydrogen-bonded Turntrans-70.2-9-176.700000115.3E330E330-G334 WeakPolarHBondContact O-CA 3.5Å; E330-G334 PolarHBondContact O-N 3.35Å
335S60.8Low59.5Low102 Ų102130 Ų13071%0.71370%0.704SS**THydrogen-bonded Turntrans-98.13173.8-1550000113L333L333-S335 PolarHBondContact O-N 3.34Å
336L59.8Low59.7Low120 Ų120125.9 Ų125.963%0.62870%0.702SS**SBendtrans-83.3124.2174.3-63.7175.9000109.8L333L333-L336 WeakPolarHBondContact O-CB 3.29Å; L333-L336 PolarHBondContact O-N 3.05Å; L333-L336 VanDerWaalsContact O-N 3.11Å
337P60.8Low59.6Low107 Ų107125.8 Ų125.870%0.69572%0.719SS**  trans-63142.4175.127.1-34000110.2L339P337-L339 PolarHBondContact O-N 3.15Å
338L55.9Low59.3Low179 Ų179127.4 Ų127.494%0.93773%0.731SS**  trans-61.295.7-178.1-63.7176000110.8S340L338-S340 PolarHBondContact O-N 3.47Å
339L53.4Low59.3Low163 Ų163121.6 Ų121.685%0.85373%0.729SS**  trans-71.3115-176-14875000109.6P337P337-L339 PolarHBondContact O-N 3.15Å
340S57.4Low59.4Low91 Ų91122.8 Ų122.864%0.63674%0.739SS**  trans-56.7134.1-167.1-172.90000112.9L338 Q342L338-S340 PolarHBondContact O-N 3.47Å; S340-Q342 PolarHBondContact O-N 3.46Å
341P53.7Low59.6Low130 Ų130121.7 Ų121.784%0.84474%0.744SS**SBendtrans-7860-178.634.3-37.3000111.8
342Q48.7Very low59.8Low176 Ų176126.6 Ų126.682%0.82275%0.754SS**  trans-154.370.6-176.2-148.8157.9105.700113.6S340S340-Q342 PolarHBondContact O-N 3.46Å
343S55.9Low60Low101 Ų101129.1 Ų129.171%0.70677%0.767SS**  trans-131.7127.8162.756.30000110.3L345S343-L345 PolarHBondContact O-N 3.32Å
344P58.3Low60.3Low128 Ų128130.5 Ų130.583%0.83178%0.78SS**PPolyproline II helixtrans-75.7117.817929.3-32.4000110
345L55.8Low60.7Low160 Ų160133.1 Ų133.184%0.83878%0.781SS**PPolyproline II helixtrans-64.1131.3170.4-70.5172000109.8S343 A347S343-L345 PolarHBondContact O-N 3.32Å; L345-A347 PolarHBondContact O-N 3.43Å
346P62.7Low60.8Low107 Ų107138 Ų13870%0.69581%0.807SS**PPolyproline II helixtrans-64129.4169.327.6-33.1000109.1L348P346-L348 PolarHBondContact O-N 3.03Å
347A57.9Low60.9Low103 Ų103138.9 Ų138.985%0.85182%0.816SS**  trans-69.296.1-176.900000111L345 G349L345-A347 PolarHBondContact O-N 3.43Å; A347-G349 VanDerWaalsContact C-N 3.26Å; A347-G349 PolarHBondContact O-N 3.33Å
348L58.4Low60.9Low155 Ų155140.6 Ų140.681%0.81282%0.822SS**  trans-68.886.8168-68.5177.3000109.1P346 F350P346-L348 PolarHBondContact O-N 3.03Å; L348-F350 PolarHBondContact O-N 3.08Å
349G61Low61.2Low68 Ų68138.4 Ų138.470%0.70182%0.816SS**  trans-65.7111.7-178.300000112A347A347-G349 VanDerWaalsContact C-N 3.26Å; A347-G349 PolarHBondContact O-N 3.33Å
350F66.1Low61.6Low193 Ų193137 Ų13785%0.84681%0.814SS**  trans-71.1126.1162.6-73-93.4000109L348 Q352L348-F350 PolarHBondContact O-N 3.08Å; F350-Q352 PolarHBondContact O-N 2.59Å; F350-Q352 VanDerWaalsContact O-N 3.15Å
351P70.2Confident61.9Low114 Ų114139.9 Ų139.974%0.7483%0.825SS**  trans-68.8112.4172.627.5-32.3000109.5L353P351-L353 PolarHBondContact O-N 3.22Å
352Q69.4Low62.4Low179 Ų179140.5 Ų140.584%0.83682%0.824SS**  trans-60.9115.1168.8-79.7-91.147.300109.3F350 T354F350-Q352 PolarHBondContact O-N 2.59Å; F350-Q352 VanDerWaalsContact O-N 3.15Å; Q352-T354 PolarHBondContact O-N 3.46Å; Q352-T354 VanDerWaalsContact O-N 3.1Å
353L67.6Low63.4Low160 Ų160138 Ų13884%0.83882%0.824SS**  trans-78.788.7171.2-69.8175.3000109.4P351 V355P351-L353 PolarHBondContact O-N 3.22Å; L353-V355 PolarHBondContact O-N 3.28Å
354T71.5Confident64Low132 Ų132140.8 Ų140.881%0.8183%0.833SS**  trans-68.7114.4168-55.90000109.3Q352Q352-T354 PolarHBondContact O-N 3.46Å; Q352-T354 VanDerWaalsContact O-N 3.1Å
355V69.6Low64.5Low127 Ų127141.9 Ų141.977%0.7783%0.833SS**  trans-75.4145.9164.4179.50000108.6L353L353-V355 PolarHBondContact O-N 3.28Å
356T63.3Low65.2Low205 Ų205140.3 Ų140.3100%1.25883%0.832SS**  trans-490-175.155.40000115.1

Retrieved 356 of 356 residues in 46.1 ms (Link to these results)