A0A024RAA7_HUMAN Loading...

Adiponectin B

AlphaFold DB (P02747), UniProt , Accession A0A024RAA7, Species HUMAN (Homo sapiens, Human), Gene ADIB, Length 245 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
1M43.2Very low49.8Very low233 Ų233140 Ų140100%1.14882%0.82SS**  061.40-53.8-168.1-174.800106.1
2D40.2Very low50.6Low157 Ų157133.4 Ų133.484%0.8480%0.804SS**  45.5104.571.1-83.3-53.6000113.7
3V48.6Very low51.3Low148 Ų148132.8 Ų132.890%0.89779%0.793SS**  -163.2134.1112.5172.80000108.1
4G43.6Very low52.1Low63 Ų63135.1 Ų135.165%0.64979%0.787SS**  trans-86.4-171.1-174.500000116.5
5P46.9Very low52.7Low128 Ų128134.3 Ų134.383%0.83178%0.778SS**  trans-102.7160.8-168.239.7-32.9000113.9
6S54.5Low53.3Low114 Ų114133.1 Ų133.180%0.79777%0.767SS**  trans179.6152.2167.922.80000108.7
7S53.5Low53.8Low102 Ų102131.9 Ų131.971%0.71376%0.757SS**  cis-174.2130.3-10.738.60000104.7
8L51.3Low54.3Low179 Ų179131.6 Ų131.694%0.93775%0.751SS**  trans-123.899.6176.4-120.5101.1000110.3
9P51.6Low54.7Low100 Ų100130.9 Ų130.965%0.64974%0.744SS**  trans-143.174.8159.237.6-18.2000112.1
10H57.6Low55Low157 Ų157131.3 Ų131.373%0.72774%0.744SS**SBendtrans-131.4-8.4170.7-74.3-52.6000115
11L57.3Low55.1Low159 Ų159131.7 Ų131.783%0.83274%0.743SS**Hα-helixtrans-82.8-32.5-176.2-133.975.4000113.5
12G59.4Low56Low61 Ų61126.5 Ų126.563%0.62972%0.719SS**Hα-helixtrans-70.5-33-176.600000114.7
13L59.8Low56.8Low125 Ų125124.8 Ų124.865%0.65472%0.717SS**Hα-helixtrans-75.9-28-174.9-161.367.5000112.8L17L13-L17 PolarHBondContact O-N 3.28Å
14K61.8Low56.9Low165 Ų165125.7 Ų125.772%0.71772%0.716SS**Hα-helixtrans-74.1-28.8177.3-72.6-168.8174.9-173.10113.1
15L61.5Low57.1Low124 Ų124134.5 Ų134.565%0.64973%0.729SS**Hα-helixtrans-77-32.8179.3-154.972.2000112L18L15-L18 PolarHBondContact O-N 3.3Å
16L62.4Low57.1Low114 Ų114132.1 Ų132.160%0.59773%0.728SS**Hα-helixtrans-70.4-34.1176.4-158.774.2000112.4L18L16-L18 VanDerWaalsContact C-N 3.34Å
17L62.1Low56.4Low114 Ų114136.5 Ų136.560%0.59774%0.736SS**Hα-helixtrans-69-29174.6-114.691.2000113.2L13L13-L17 PolarHBondContact O-N 3.28Å
18L61.6Low56Low125 Ų125136.3 Ų136.365%0.65474%0.74SS**Hα-helixtrans-73.3-29.8179.2-120.592.2000112.8L15 L16L15-L18 PolarHBondContact O-N 3.3Å; L16-L18 VanDerWaalsContact C-N 3.34Å
19L62.9Low55.4Low119 Ų119135.5 Ų135.562%0.62374%0.737SS**Hα-helixtrans-76.9-20.5178.3-83.7149.9000113.2L21L19-L21 VanDerWaalsContact C-N 3.29Å; L19-L21 PolarHBondContact O-N 3.41Å
20L59.4Low55.1Low139 Ų139137.3 Ų137.373%0.72875%0.746SS**THydrogen-bonded Turntrans-80.1-6.1176.5-79.4155.8000113.8
21L59.1Low54.2Low139 Ų139133.4 Ų133.473%0.72875%0.748SS**THydrogen-bonded Turntrans-100.35.9-177.7-73166.7000114.2L19 P23L19-L21 VanDerWaalsContact C-N 3.29Å; L19-L21 PolarHBondContact O-N 3.41Å; L21-P23 WeakPolarHBondContact O-CD 3.46Å
22L61.4Low53.4Low125 Ų125131.2 Ų131.265%0.65475%0.745SS**  trans-95.2114.1175.9-71.1168000110.7L24L22-L24 PolarHBondContact O-N 3.3Å
23P55.7Low52.7Low121 Ų121139 Ų13979%0.78676%0.757SS**  trans-74.8114.4175.330.3-29.7000109.4L21L21-P23 WeakPolarHBondContact O-CD 3.46Å
24L51.6Low52Low167 Ų167136.6 Ų136.687%0.87476%0.763SS**  trans-71.7120.8158.9-81.999.1000108.9L22L22-L24 PolarHBondContact O-N 3.3Å
25R48.9Very low51.6Low248 Ų248136.3 Ų136.394%0.93677%0.767SS**  trans-157.1120.1156.2-97.9168.1-166.9-163.81.8105.9
26G46.1Very low51.3Low78 Ų78135.9 Ų135.980%0.80477%0.772SS**  cis111.898.635.300000107.1
27Q40.2Very low50.8Low205 Ų205133.8 Ų133.896%0.95878%0.778SS**  trans-58.9138.3175.5-106.8168.1-3500111.9
28A45.1Very low50.6Low98 Ų98136.9 Ų136.981%0.8179%0.791SS**  trans-159.6113.2149.300000111.5
29N37.6Very low50.5Low162 Ų162136.8 Ų136.887%0.86680%0.798SS**  trans-59.2131.7159-87.6-22.2000110.4
30T46.8Very low50Low138 Ų138134.6 Ų134.685%0.84780%0.804SS**  trans-164.6136.6135.2-26.20000110.2
31G37.2Very low50.1Low75 Ų75136 Ų13677%0.77381%0.812SS**  trans-65.8141.6-169.700000115.4
32C40.3Very low50.3Low114 Ų114135.1 Ų135.177%0.7781%0.814SS**  trans-106.498.6174.5-66.10000110
33Y46.4Very low49.9Very low224 Ų224132.6 Ų132.688%0.87882%0.818SS**PPolyproline II helixtrans-65.2135.8150.7-81.2-90.3000107.9I35Y33-I35 PolarHBondContact O-N 3.44Å
34G44.2Very low50.1Low74 Ų74131.4 Ų131.476%0.76382%0.819SS**PPolyproline II helixtrans-54.4130.3-178.700000111.8P36G34-P36 WeakPolarHBondContact O-CD 3.48Å
35I53Low50.6Low160 Ų160129.4 Ų129.482%0.82182%0.816SS**PPolyproline II helixtrans-69.7126.1179.4-42.2174.6000107.8Y33Y33-I35 PolarHBondContact O-N 3.44Å
36P55.1Low50.9Low115 Ų115120.9 Ų120.975%0.74781%0.805SS**PPolyproline II helixtrans-55.2142.6170.3-24.734.5000110.8G34G34-P36 WeakPolarHBondContact O-CD 3.48Å
37G51.7Low51.4Low69 Ų69127.2 Ų127.271%0.71181%0.811SS**PPolyproline II helixtrans-59145.3178.700000111.9
38M58.4Low52.5Low180 Ų180125 Ų12589%0.88781%0.806SS**PPolyproline II helixtrans-61.3144.1173-69.6179.863.900110.6
39P60.4Low52.9Low122 Ų122123.8 Ų123.879%0.79280%0.802SS**PPolyproline II helixtrans-54.5148.1171.2-24.133.7000111.9
40G51.2Low54Low73 Ų73127.2 Ų127.275%0.75381%0.805SS**PPolyproline II helixtrans-60.4153.7174.400000112.2
41L62.1Low54.6Low170 Ų170128.4 Ų128.489%0.8981%0.806SS**PPolyproline II helixtrans-64.7142.5174.6-67.9169.6000110.3
42P63Low55.3Low119 Ų119128.4 Ų128.477%0.77381%0.806SS**PPolyproline II helixtrans-56.3146.6170.9-23.733.8000111.9
43G52.8Low56.3Low72 Ų72131 Ų13174%0.74281%0.811SS**PPolyproline II helixtrans-61.7154.7175.200000112.5
44A60.2Low57.2Low97 Ų97126.3 Ų126.380%0.80281%0.808SS**PPolyproline II helixtrans-62.8145.4176.500000111.3
45P63.1Low57.9Low124 Ų124125.9 Ų125.981%0.80580%0.804SS**PPolyproline II helixtrans-55.7148.1172.5-24.234000112.2
46G53.9Low58.7Low70 Ų70124.6 Ų124.672%0.72281%0.806SS**PPolyproline II helixtrans-61.6157.1173.100000112.1
47K57.8Low59.3Low211 Ų211128.9 Ų128.992%0.91781%0.813SS**PPolyproline II helixtrans-69.5147.8173-64.2-177.9179179.70110.3
48D62.3Low59.8Low159 Ų159128.6 Ų128.685%0.8581%0.809SS**PPolyproline II helixtrans-58.4147.5173.4-62.6-29000111.2
49G53.4Low60.4Low72 Ų72129.1 Ų129.174%0.74281%0.81SS**PPolyproline II helixtrans-68.7157175.700000112.3
50Y59.9Low61Low233 Ų233129.3 Ų129.391%0.91481%0.811SS**PPolyproline II helixtrans-72.3149.1173-64-78.5000111.5
51D60.2Low61.9Low164 Ų164129.2 Ų129.288%0.87781%0.81SS**PPolyproline II helixtrans-58.8142.3172.3-67.9-29.7000111.5
52G51.6Low62.2Low74 Ų74129 Ų12976%0.76381%0.808SS**PPolyproline II helixtrans-68.2150.9177.100000113
53L62.1Low62.7Low168 Ų168128.6 Ų128.688%0.8881%0.806SS**PPolyproline II helixtrans-67.4147.5174.5-66.5171.7000111.4
54P65Low63.3Low126 Ų126129.8 Ų129.882%0.81881%0.809SS**PPolyproline II helixtrans-56.1138.5172.6-24.233.6000112.4
55G59.6Low63.6Low66 Ų66132.9 Ų132.968%0.6881%0.81SS**PPolyproline II helixtrans-65.6158.7177.800000113.4
56P68.3Low63.8Low132 Ų132132.8 Ų132.886%0.85781%0.809SS**PPolyproline II helixtrans-64.5149.7177.627.8-34.3000111.8G58P56-G58 PolarHBondContact O-N 3.19Å
57K68.8Low64.3Low206 Ų206133 Ų13390%0.89681%0.811SS**PPolyproline II helixtrans-62.1133173.4-175-179.6179.5-179.10109.9
58G62.5Low64.2Low62 Ų62131.3 Ų131.364%0.63981%0.81SS**PPolyproline II helixtrans-60.9150176.500000113.1P56P56-G58 PolarHBondContact O-N 3.19Å
59E70.2Confident64.1Low191 Ų191135.3 Ų135.389%0.89381%0.813SS**PPolyproline II helixtrans-64.3145.2177.8-64.8-172.2156.500111.6
60P74.1Confident64.6Low126 Ų126134.5 Ų134.582%0.81881%0.805SS**PPolyproline II helixtrans-57.9142.3173.4-22.633.3000112.2
61G68.4Low64.5Low71 Ų71129.8 Ų129.873%0.73280%0.803SS**PPolyproline II helixtrans-59.4145.9175.500000112.6
62I68.9Low64.1Low166 Ų166132.2 Ų132.285%0.85181%0.806SS**PPolyproline II helixtrans-64.1128.9-179.8-51.6169.4000109.2
63P73.5Confident64.4Low111 Ų111131.9 Ų131.972%0.72180%0.802SS**PPolyproline II helixtrans-58.7138174.8-22.832.7000111.7I65P63-I65 PolarHBondContact O-N 3.43Å
64A65.1Low64.2Low97 Ų97133.5 Ų133.580%0.80281%0.805SS**PPolyproline II helixtrans-62.1133.8175.800000111
65I66.2Low63.6Low162 Ų162137.7 Ų137.783%0.83181%0.811SS**PPolyproline II helixtrans-63.2126.6176.6-57.7167.9000108.6P63 G67P63-I65 PolarHBondContact O-N 3.43Å; I65-G67 PolarHBondContact O-N 3.43Å
66P68.7Low63.5Low121 Ų121137.6 Ų137.679%0.78681%0.81SS**PPolyproline II helixtrans-62.1119.4176.2-21.832.7000111.2
67G63.4Low63.5Low74 Ų74140.3 Ų140.376%0.76381%0.811SS**PPolyproline II helixtrans-65.1147.9171.800000112.3I65I65-G67 PolarHBondContact O-N 3.43Å
68I56.9Low63.6Low176 Ų176136.7 Ų136.790%0.90381%0.809SS**PPolyproline II helixtrans-67136-174.1-30.4174.4000110.5G70I68-G70 PolarHBondContact O-N 3.45Å
69R60.1Low63.7Low243 Ų243137.2 Ų137.292%0.91781%0.814SS**  trans-70.3111.6-175.6-171.3178.7-168.9174.24.1111.9
70G64Low63.9Low55 Ų55136 Ų13657%0.56781%0.813SS**  trans-80164.3163.800000112.7I68I68-G70 PolarHBondContact O-N 3.45Å
71P57.1Low64Low135 Ų135135.6 Ų135.688%0.87781%0.81SS**  trans-68.9155.1-175.328.4-32.9000113.1G73P71-G73 PolarHBondContact O-N 3.49Å
72K50.9Low64.1Low215 Ų215135.6 Ų135.694%0.93581%0.81SS**  trans-69.8108.3-166.9-167.6-179.7-177-176.10112.5
73G59.1Low64.3Low66 Ų66136.4 Ų136.468%0.6881%0.809SS**PPolyproline II helixtrans-89.7162.3168.200000113.3P71P71-G73 PolarHBondContact O-N 3.49Å
74Q58.5Low64.5Low202 Ų202137 Ų13794%0.94481%0.813SS**PPolyproline II helixtrans-65146.3-178.1-61.4-178.937.100112.6
75K51.3Low64.7Low214 Ų214135.7 Ų135.793%0.9381%0.809SS**PPolyproline II helixtrans-75.1127.4172.3-177.2-175.6-174.9-176.30107.9
76G57.8Low65.1Low65 Ų65138 Ų13867%0.6781%0.813SS**  cis128.7129.214.700000106.9
77E67.6Low65.6Low189 Ų189139.8 Ų139.888%0.88382%0.816SS**PPolyproline II helixtrans-87.9143.1153.7-75.1-159.614500108.4G79E77-G79 PolarHBondContact O-N 3.5Å
78P71.3Confident66Low130 Ų130139.2 Ų139.284%0.84481%0.811SS**PPolyproline II helixtrans-57.6126.2174.1-21.132.3000110.5
79G64.7Low67Low72 Ų72137 Ų13774%0.74281%0.808SS**PPolyproline II helixtrans-62.8145.1173.100000111.1E77E77-G79 PolarHBondContact O-N 3.5Å
80L74.7Confident67.7Low166 Ų166134.2 Ų134.287%0.86981%0.807SS**PPolyproline II helixtrans-57.2147.4170.9-69.4166.6000110.4G82L80-G82 PolarHBondContact O-N 3.41Å
81P75.7Confident68.1Low118 Ų118134.1 Ų134.177%0.76681%0.806SS**PPolyproline II helixtrans-51.7136.1172.7-24.833.5000111.3
82G70.5Confident69Low70 Ų70133.5 Ų133.572%0.72280%0.803SS**PPolyproline II helixtrans-60.714417500000111.1L80L80-G82 PolarHBondContact O-N 3.41Å
83H74.3Confident70.3Confident183 Ų183129.3 Ų129.385%0.84780%0.797SS**PPolyproline II helixtrans-59.2143.9172.8-67.690.9000110.2G85H83-G85 PolarHBondContact O-N 3.46Å
84P76.7Confident71Confident123 Ų123129.6 Ų129.680%0.79980%0.8SS**PPolyproline II helixtrans-51.2139171.6-25.533.8000111.1
85G70.2Confident72Confident70 Ų70128.6 Ų128.672%0.72280%0.798SS**PPolyproline II helixtrans-56.8142175.400000110.7H83H83-G85 PolarHBondContact O-N 3.46Å
86K74.1Confident73.2Confident210 Ų210124.4 Ų124.491%0.91379%0.792SS**PPolyproline II helixtrans-60.8139.3171.2-71.3-177.8176.1179.80109G88K86-G88 PolarHBondContact O-N 3.4Å
87N79Confident74Confident159 Ų159124.7 Ų124.785%0.8580%0.795SS**PPolyproline II helixtrans-54137.5169.3-69.1-18.5000109.2
88G72.1Confident74.6Confident63 Ų63122.3 Ų122.365%0.64979%0.794SS**PPolyproline II helixtrans-61.1157.3174.800000111.5K86K86-G88 PolarHBondContact O-N 3.4Å
89P76.4Confident75.1Confident129 Ų129122.1 Ų122.184%0.83879%0.792SS**PPolyproline II helixtrans-58.8147.9174.426.6-33.9000110.7G91P89-G91 PolarHBondContact O-N 3.35Å
90M75.7Confident75.8Confident184 Ų184121.7 Ų121.791%0.90679%0.788SS**PPolyproline II helixtrans-59134.5169.7-177.116763.800109.2
91G72.6Confident76.1Confident53 Ų53120 Ų12055%0.54679%0.787SS.*PPolyproline II helixtrans-61.6157.1177.400000112.2P89P89-G91 PolarHBondContact O-N 3.35Å
92P76.7Confident76.3Confident123 Ų123123.2 Ų123.280%0.79979%0.794SS**PPolyproline II helixtrans-60.9151.2175.527.3-34.2000110.9
93P76.3Confident76.7Confident127 Ų127122.8 Ų122.883%0.82579%0.789SS**PPolyproline II helixtrans-54.7144.9171.3-23.433.4000111.6
94G75.6Confident77.1Confident72 Ų72121.8 Ų121.874%0.74279%0.788SS**PPolyproline II helixtrans-61.5154.2174.100000112.1
95M78.4Confident77.4Confident180 Ų180121.7 Ų121.789%0.88779%0.788SS**PPolyproline II helixtrans-63.1146.4173.9-66.7-176.469.900110.7G97M95-G97 PolarHBondContact O-N 3.49Å
96P76.5Confident77.8Confident126 Ų126121.8 Ų121.882%0.81879%0.788SS**PPolyproline II helixtrans-54.6140.2170.7-23.733.5000111.2
97G74.9Confident78.3Confident71 Ų71120.3 Ų120.373%0.73279%0.785SS**PPolyproline II helixtrans-61.1150.2174.800000111.9M95M95-G97 PolarHBondContact O-N 3.49Å
98V80.6Confident78.3Confident140 Ų140118.4 Ų118.485%0.84878%0.781SS**PPolyproline II helixtrans-62.6138.2171.7-101.90000110G100V98-G100 PolarHBondContact O-N 3.26Å
99P80.9Confident78Confident126 Ų126118.8 Ų118.882%0.81879%0.785SS**PPolyproline II helixtrans-52.7136.4172.8-25.834.4000111.1
100G79Confident77.6Confident63 Ų63121.9 Ų121.965%0.64979%0.788SS**PPolyproline II helixtrans-61.4158.3175.700000111.9V98V98-G100 PolarHBondContact O-N 3.26Å
101P82.8Confident77.2Confident130 Ų130121.2 Ų121.284%0.84478%0.783SS**PPolyproline II helixtrans-59.4149.1174.627.3-34.3000110.6G103P101-G103 PolarHBondContact O-N 3.44Å
102M78.8Confident76.4Confident186 Ų186120.5 Ų120.592%0.91678%0.776SS**PPolyproline II helixtrans-55.3132.2171.2-171.1-179.2-60.800109.2
103G78.1Confident75.5Confident60 Ų60123.3 Ų123.362%0.61977%0.77SS**PPolyproline II helixtrans-59.3150174.800000111P101P101-G103 PolarHBondContact O-N 3.44Å
104I83Confident74.5Confident163 Ų163124.4 Ų124.484%0.83676%0.759SS**PPolyproline II helixtrans-57.5140171.153.6173.9000109.6G106I104-G106 PolarHBondContact O-N 3.34Å
105P82.9Confident73.9Confident121 Ų121126.5 Ų126.579%0.78675%0.748SS**PPolyproline II helixtrans-51.6139.5169.8-25.534.6000110.3
106G79.7Confident73.2Confident71 Ų71122.1 Ų122.173%0.73273%0.725SS**PPolyproline II helixtrans-60.5149.2173.900000110.9I104I104-G106 PolarHBondContact O-N 3.34Å
107E83.7Confident72.9Confident179 Ų179124.3 Ų124.384%0.83672%0.722SS**PPolyproline II helixtrans-52.9143.2168.9-70-78.3132.800109.7G109E107-G109 PolarHBondContact O-N 3.43Å
108P78.9Confident73.2Confident119 Ų119127.5 Ų127.577%0.77372%0.716SS**PPolyproline II helixtrans-50.2135169.3-24.834.1000110.4
109G67.1Low73.6Confident71 Ų71126 Ų12673%0.73270%0.699SS**PPolyproline II helixtrans-59149.2175.700000111.1E107 E111E107-G109 PolarHBondContact O-N 3.43Å; G109-E111 PolarHBondContact O-N 3.1Å
110E67.4Low74.3Confident194 Ų194120.1 Ų120.191%0.90766%0.662SS**PPolyproline II helixtrans-55.4141.4174.9-66.8-151.8150.200110.8G112E110-G112 PolarHBondContact O-N 3Å
111E66.3Low75.2Confident171 Ų171119.4 Ų119.480%0.79964%0.644SS**PPolyproline II helixtrans-50.8135.7173-170-179-169.800109.3G109 R113G109-E111 PolarHBondContact O-N 3.1Å; E111-R113 PolarHBondContact O-N 2.79Å
112G57.6Low75.9Confident38 Ų38113.2 Ų113.239%0.39260%0.604SS.*SBendtrans-65.746.3-165.800000117.5E110 Y114 K115E110-G112 PolarHBondContact O-N 3Å; G112-Y114 PolarHBondContact O-N 2.73Å; G112-K115 PolarHBondContact O-N 3.34Å
113R57.1Low76.9Confident182 Ų182105.8 Ų105.869%0.68757%0.569SS**THydrogen-bonded Turntrans-61.4-10.5173.5-84.3-173.3176.6-171.4-0.7113.9E111 K115 Q116E111-R113 PolarHBondContact O-N 2.79Å; R113-K115 PolarHBondContact O-N 3.49Å; R113-K115 VanDerWaalsContact O-N 3.16Å; R113-Q116 PolarHBondContact O-N 2.68Å
114Y54.3Low77.9Confident150 Ų150103 Ų10359%0.58854%0.54SS*.Hα-helixtrans-56.2-28.8170.474.2-84.8000111.5G112 Q116 F118G112-Y114 PolarHBondContact O-N 2.73Å; Y114-Q116 PolarHBondContact O-N 3.47Å; Y114-F118 WeakPolarHBondContact O-CD2 3.35Å
115K63.4Low78.6Confident115 Ų11596.2 Ų96.250%0.551%0.506SS..Hα-helixtrans-66-35.7174.3-63.1-61.3-170.9-178.50113.1G112 R113 F118 Q119G112-K115 PolarHBondContact O-N 3.34Å; R113-K115 PolarHBondContact O-N 3.49Å; R113-K115 VanDerWaalsContact O-N 3.16Å; K115-F118 PolarHBondContact O-N 2.89Å; K115-Q119 WeakPolarHBondContact O-CG 3.48Å; K115-Q119 PolarHBondContact O-N 2.74Å
116Q63.9Low79.3Confident88 Ų8891.8 Ų91.841%0.41147%0.474SS..Hα-helixtrans-73.2-31.8-174-166.1175.55.200112.7R113 Y114 F118 Q119 Q148R113-Q116 PolarHBondContact O-N 2.68Å; Y114-Q116 PolarHBondContact O-N 3.47Å; Q116-F118 VanDerWaalsContact C-N 3.33Å; Q116-Q119 PolarHBondContact O-N 2.73Å; Q116-Q148 PolarHBondContact O-NE2 2.86Å
117K70.7Confident79.9Confident173 Ų17395.3 Ų95.375%0.75247%0.471SS*.Hα-helixtrans-71.4-25.7178.1-69.8-173.2179.8179.40113.6
118F80.8Confident80.3Confident138 Ų13889.6 Ų89.661%0.60545%0.449SS*.THydrogen-bonded Turntrans-104.312178.7-67.5-87.6000112.8Y114 K115 Q116Y114-F118 WeakPolarHBondContact O-CD2 3.35Å; K115-F118 PolarHBondContact O-N 2.89Å; Q116-F118 VanDerWaalsContact C-N 3.33Å
119Q89Confident80.8Confident107 Ų10791.6 Ų91.650%0.545%0.447SS..  trans-104.7156169.1-77.9173.5-100109.1K115 Q116 Q148K115-Q119 WeakPolarHBondContact O-CG 3.48Å; K115-Q119 PolarHBondContact O-N 2.74Å; Q116-Q119 PolarHBondContact O-N 2.73Å; Q119-Q148 VanDerWaalsContact O-CG 3.23Å; Q119-Q148 WeakPolarHBondContact O-CG 3.34Å; Q119-Q148 PolarHBondContact O-NE2 2.84Å
120S96.2Very high82.1Confident4 Ų495.2 Ų95.23%0.02845%0.445CS..  trans-142.9120.2173.9177.40000107.2D150 Y166 F240 L241S120-D150 WeakPolarHBondContact CB-OD2 3.47Å; S120-D150 PolarHBondContact OG-OD2 3.13Å; S120-Y166 VanDerWaalsContact CB-OH 3.28Å; S120-Y166 WeakPolarHBondContact CB-OH 3.21Å; S120-Y166 WeakPolarHBondContact OG-CE1 3.38Å; S120-Y166 PolarHBondContact OG-OH 3.07Å; S120-F240 CarbonylContact O-C 3.44Å; S120-F240 VanDerWaalsContact O-CA 3.23Å; S120-F240 WeakPolarHBondContact O-CA 3.37Å; S120-L241 PolarHBondContact O-N 3.49Å
121V97.5Very high83.3Confident47 Ų4788.3 Ų88.329%0.28542%0.417SS..EExtended strand (participates in β ladder)trans-150.9138.6178.857.90000109.5P147 G239 F240V121-P147 HydrophobicContact CG1-CG 3.82Å; V121-P147 WeakPolarHBondContact O-CD 3.32Å; V121-G239 CarbonylContact C-O 3.51Å; V121-G239 WeakPolarHBondContact CA-O 3.32Å; V121-F240 HydrophobicContact CB-CB 4.13Å; V121-F240 HydrophobicContact CG2-CB 4.06Å
122F98.5Very high84.8Confident0 Ų080.7 Ų80.70%038%0.382CS..EExtended strand (participates in β ladder)trans-147.4153.5168.371.4-87.3000111.4V124 T145 N146 Y151 F158 F168 F237 S238 G239F122-V124 HydrophobicContact CD2-CG1 4.26Å; F122-V124 HydrophobicContact CD2-CG2 4.06Å; F122-V124 HydrophobicContact CE2-CG2 4.17Å; F122-T145 CarbonylContact C-O 3.54Å; F122-T145 WeakPolarHBondContact CA-O 3.36Å; F122-N146 HydrophobicContact CB-CB 4.19Å; F122-Y151 HydrophobicContact CD2-CD2 4.12Å; F122-Y151 HydrophobicContact CD2-CG 4.08Å; F122-Y151 AromaticContact CE2-CD2 3.76Å; F122-Y151 HydrophobicContact CE2-CD2 3.76Å; F122-Y151 HydrophobicContact CE2-CG 4.2Å; F122-Y151 HydrophobicContact CZ-CD2 4.15Å; F122-F158 AromaticContact CD1-CD2 3.66Å; F122-F158 HydrophobicContact CD1-CD2 3.66Å; F122-F158 HydrophobicContact CD1-CE2 4.06Å; F122-F158 HydrophobicContact CE1-CB 4.17Å; F122-F158 AromaticContact CE1-CD2 3.28Å; F122-F158 HydrophobicContact CE1-CD2 3.28Å; F122-F158 AromaticContact CE1-CE2 3.87Å; F122-F158 HydrophobicContact CE1-CE2 3.87Å; F122-F158 AromaticContact CE1-CG 3.93Å; F122-F158 HydrophobicContact CE1-CG 3.93Å; F122-F158 HydrophobicContact CZ-CB 4.31Å; F122-F158 HydrophobicContact CZ-CD2 4.22Å; F122-F168 HydrophobicContact CE1-CD1 4.36Å; F122-F168 AromaticContact CE1-CE1 3.96Å; F122-F168 HydrophobicContact CE1-CE1 3.96Å; F122-F168 HydrophobicContact CZ-CD1 4.16Å; F122-F168 HydrophobicContact CZ-CE1 4.11Å; F122-F237 AromaticContact CE2-CD1 3.71Å; F122-F237 HydrophobicContact CE2-CD1 3.71Å; F122-F237 AromaticContact CE2-CE1 3.81Å; F122-F237 HydrophobicContact CE2-CE1 3.81Å; F122-F237 HydrophobicContact CE2-CG 4.11Å; F122-F237 HydrophobicContact CE2-CZ 4.31Å; F122-F237 HydrophobicContact CZ-CD1 4.1Å; F122-F237 AromaticContact CZ-CE1 3.71Å; F122-F237 HydrophobicContact CZ-CE1 3.71Å; F122-F237 HydrophobicContact CZ-CE2 4.4Å; F122-F237 AromaticContact CZ-CZ 3.88Å; F122-F237 HydrophobicContact CZ-CZ 3.88Å; F122-S238 VanDerWaalsContact O-CA 3.23Å; F122-S238 WeakPolarHBondContact O-CA 3.18Å; F122-G239 WeakPolarHBondContact CD1-O 3.5Å; F122-G239 VanDerWaalsContact CE1-CA 3.4Å; F122-G239 PolarHBondContact N-O 2.99Å; F122-G239 PolarHBondContact O-N 3.16Å
123T98.7Very high86.7Confident31 Ų3181.7 Ų81.719%0.1939%0.387CS..EExtended strand (participates in β ladder)trans-138.8121.4162.3-63.50000107.1L144 T145 V236 F237 S238T123-L144 HydrophobicContact CG2-CB 4.13Å; T123-L144 HydrophobicContact CG2-CD1 3.88Å; T123-L144 HydrophobicContact CG2-CG 4.42Å; T123-L144 WeakPolarHBondContact O-CB 3.43Å; T123-L144 PolarHBondContact O-N 2.64Å; T123-T145 PolarHBondContact N-O 3.36Å; T123-T145 PolarHBondContact O-N 3.33Å; T123-T145 VanDerWaalsContact O-N 3.1Å; T123-V236 HydrophobicContact CG2-CG2 3.38Å; T123-F237 WeakPolarHBondContact CA-O 3.34Å; T123-S238 WeakPolarHBondContact CB-OG 3.34Å; T123-S238 WeakPolarHBondContact CG2-OG 3.28Å; T123-S238 PolarHBondContact OG1-OG 2.68Å
124V98.6Very high88.7Confident0 Ų076.1 Ų76.10%037%0.374CS..EExtended strand (participates in β ladder)trans-125.7149.2-179.9-66.40000110.2F122 F140 A142 V143 Y151 V236 F237F122-V124 HydrophobicContact CD2-CG1 4.26Å; F122-V124 HydrophobicContact CD2-CG2 4.06Å; F122-V124 HydrophobicContact CE2-CG2 4.17Å; V124-F140 HydrophobicContact CB-CB 3.8Å; V124-F140 HydrophobicContact CG2-CB 3.44Å; V124-F140 VanDerWaalsContact CG2-CB 3.44Å; V124-F140 HydrophobicContact CG2-CD1 4.27Å; V124-F140 HydrophobicContact CG2-CD2 4.42Å; V124-F140 HydrophobicContact CG2-CG 3.81Å; V124-A142 CarbonylContact C-O 3.54Å; V124-A142 VanDerWaalsContact CA-O 3.27Å; V124-A142 WeakPolarHBondContact CA-O 3.39Å; V124-A142 WeakPolarHBondContact CB-O 3.22Å; V124-V143 HydrophobicContact CG1-CG2 4.18Å; V124-Y151 HydrophobicContact CB-CD1 4.24Å; V124-Y151 HydrophobicContact CB-CE1 4.18Å; V124-Y151 HydrophobicContact CG1-CD1 3.56Å; V124-Y151 HydrophobicContact CG1-CE1 3.97Å; V124-Y151 HydrophobicContact CG1-CG 4.03Å; V124-Y151 HydrophobicContact CG2-CD1 4Å; V124-Y151 HydrophobicContact CG2-CD2 4.16Å; V124-Y151 HydrophobicContact CG2-CE1 3.81Å; V124-Y151 HydrophobicContact CG2-CE2 4.01Å; V124-Y151 HydrophobicContact CG2-CG 4.16Å; V124-V236 WeakPolarHBondContact O-CA 3.26Å; V124-F237 HydrophobicContact CG2-CB 4.12Å; V124-F237 HydrophobicContact CG2-CD1 4.34Å; V124-F237 WeakPolarHBondContact CG2-O 3.37Å; V124-F237 PolarHBondContact N-O 3.18Å; V124-F237 PolarHBondContact O-N 3.33Å
125T98.1Very high90.7Very high21 Ų2174 Ų7413%0.12937%0.373CS..EExtended strand (participates in β ladder)trans-123154.8-179.7590000110.9F140 N141 A142 L144 S235 V236T125-F140 CarbonylContact O-C 3.47Å; T125-N141 PolarHBondContact O-N 3.03Å; T125-A142 PolarHBondContact N-O 3.1Å; T125-A142 PolarHBondContact O-N 2.82Å; T125-A142 WeakPolarHBondContact OG1-CB 3.39Å; T125-L144 HydrophobicContact CG2-CD1 3.58Å; T125-L144 HydrophobicContact CG2-CD2 4.48Å; T125-L144 HydrophobicContact CG2-CG 3.84Å; T125-S235 VanDerWaalsContact CA-O 3.25Å; T125-S235 WeakPolarHBondContact CA-O 3.38Å; T125-V236 HydrophobicContact CG2-CB 4.17Å; T125-V236 HydrophobicContact CG2-CG2 4.1Å
126R97.1Very high92.4Very high29 Ų2970.1 Ų70.111%0.10936%0.361CS..EExtended strand (participates in β ladder)trans-100.898.1176.1-172.7171.6-174.2-78-7108.9T128 Q130 P131 F140 N141 S235R126-T128 HydrophobicContact CG-CG2 3.93Å; R126-T128 PolarHBondContact O-N 2.88Å; R126-Q130 PolarHBondContact NH1-O 3.18Å; R126-Q130 PolarHBondContact NH2-O 3.48Å; R126-P131 PolarHBondContact NH2-O 2.82Å; R126-F140 HydrophobicContact CB-CD1 3.88Å; R126-F140 HydrophobicContact CB-CE1 4.23Å; R126-F140 HydrophobicContact CB-CG 4.47Å; R126-N141 WeakPolarHBondContact CA-OD1 3.5Å; R126-S235 PolarHBondContact N-O 3.28Å
127Q93.1Very high94Very high144 Ų14468 Ų6867%0.67335%0.352SS*.  trans-100.676.8-177.1-165.2175.67.200109.7N141 A142Q127-N141 PolarHBondContact N-OD1 3.3Å; Q127-N141 PolarHBondContact O-ND2 2.83Å; Q127-N141 VanDerWaalsContact O-ND2 3.11Å; Q127-A142 HydrophobicContact CB-CB 4.07Å
128T91.8Very high95.4Very high59 Ų5959.8 Ų59.836%0.36232%0.316SS..  trans-158.8144.5173.6175.50000110.2R126 Q130R126-T128 HydrophobicContact CG-CG2 3.93Å; R126-T128 PolarHBondContact O-N 2.88Å; T128-Q130 PolarHBondContact OG1-N 3.45Å
129H90Very high96.2Very high161 Ų16159.8 Ų59.875%0.74531%0.312SS*.SBendtrans-80.6-15.1177.7-75.3-79.2000113.8V228H129-V228 WeakPolarHBondContact O-CG2 3.36Å
130Q93.4Very high96.6Very high148 Ų14854.9 Ų54.969%0.69229%0.289SS*.SBendtrans-85.2137.5178.2-67.3177.6-9.400109.4R126 T128R126-Q130 PolarHBondContact NH1-O 3.18Å; R126-Q130 PolarHBondContact NH2-O 3.48Å; T128-Q130 PolarHBondContact OG1-N 3.45Å
131P94.3Very high96.7Very high48 Ų4858.5 Ų58.531%0.31231%0.308SS..PPolyproline II helixtrans-69.7165.417331.9-35.5000111.2R126 Y225 V228R126-P131 PolarHBondContact NH2-O 2.82Å; P131-Y225 HydrophobicContact CB-CD2 3.98Å; P131-Y225 HydrophobicContact CB-CE2 4.24Å; P131-Y225 HydrophobicContact CG-CD2 4.18Å; P131-Y225 HydrophobicContact CG-CE2 3.93Å; P131-V228 HydrophobicContact CB-CG2 4.12Å; P131-V228 HydrophobicContact CG-CG2 4.22Å
132P97.2Very high96.6Very high11 Ų1157.1 Ų57.17%0.07130%0.302CS..PPolyproline II helixtrans-59.1162.4167.4-18.829.7000111.9I138 V221 Y225 M227P132-I138 HydrophobicContact CG-CG1 4.14Å; P132-I138 HydrophobicContact CG-CG2 4.43Å; P132-V221 HydrophobicContact CB-CG2 4.01Å; P132-V221 HydrophobicContact CG-CG1 4.34Å; P132-Y225 WeakPolarHBondContact CD-O 3.44Å; P132-Y225 WeakPolarHBondContact O-CD2 3.35Å; P132-M227 HydrophobicContact CG-CG 4.15Å; P132-M227 HydrophobicContact CG-SD 3.53Å; P132-M227 VanDerWaalsContact CG-SD 3.53Å
133A97.7Very high96.6Very high59 Ų5960.6 Ų60.649%0.48832%0.323SS..PPolyproline II helixtrans-68.3149.3168.200000110.2S136 V221A133-S136 PolarHBondContact N-OG 3.06Å; A133-S136 WeakPolarHBondContact O-CB 3.38Å; A133-S136 PolarHBondContact O-N 3.13Å; A133-S136 PolarHBondContact O-OG 2.72Å; A133-V221 VanDerWaalsContact O-CG2 3.25Å; A133-V221 WeakPolarHBondContact O-CG2 3.29Å
134P97.8Very high96.6Very high65 Ų6564.9 Ų64.942%0.42234%0.344SS..THydrogen-bonded Turntrans-55.6144.3172.9-2130.8000111.5S136 Y225P134-S136 PolarHBondContact O-N 2.86Å; P134-Y225 HydrophobicContact CB-CD1 4.02Å; P134-Y225 HydrophobicContact CB-CE1 4.37Å; P134-Y225 HydrophobicContact CG-CD1 3.77Å; P134-Y225 HydrophobicContact CG-CE1 3.7Å; P134-Y225 HydrophobicContact CG-CE2 4.48Å; P134-Y225 HydrophobicContact CG-CG 4.22Å
135N98Very high96.5Very high106 Ų10667.6 Ų67.657%0.56736%0.36SS*.THydrogen-bonded Turntrans54.236.9177.8-58.9-63.4000114.4V221 N222 D223N135-V221 VanDerWaalsContact CA-O 3.24Å; N135-V221 WeakPolarHBondContact CA-O 3.11Å; N135-N222 PolarHBondContact N-O 3.4Å; N135-N222 WeakPolarHBondContact OD1-CA 3.27Å; N135-D223 PolarHBondContact ND2-OD1 2.92Å
136S98.4Very high96.5Very high33 Ų3368 Ų6823%0.23136%0.362CS..  trans-126.4164.2-175.879.70000113.3A133 P134 A220 V221A133-S136 PolarHBondContact N-OG 3.06Å; A133-S136 WeakPolarHBondContact O-CB 3.38Å; A133-S136 PolarHBondContact O-N 3.13Å; A133-S136 PolarHBondContact O-OG 2.72Å; P134-S136 PolarHBondContact O-N 2.86Å; S136-A220 CarbonylContact O-C 3.55Å; S136-A220 VanDerWaalsContact O-CA 3.23Å; S136-A220 WeakPolarHBondContact O-CA 3.29Å; S136-A220 WeakPolarHBondContact O-CB 3.34Å; S136-V221 PolarHBondContact N-O 2.94Å; S136-V221 PolarHBondContact O-N 2.85Å
137L98.4Very high96.3Very high44 Ų4469.7 Ų69.723%0.2338%0.377CS..BIsolated β-bridgetrans-66.3136.2171.5-178.7153.3000110.4R139 K157 W218L137-R139 HydrophobicContact CD2-CG 3.65Å; L137-R139 PolarHBondContact O-N 3.08Å; L137-K157 HydrophobicContact CD1-CG 3.83Å; L137-W218 HydrophobicContact CD1-CB 3.86Å; L137-W218 VanDerWaalsContact CD1-CD1 3.47Å; L137-W218 HydrophobicContact CD1-CD2 4.35Å; L137-W218 HydrophobicContact CD1-CG 3.63Å; L137-W218 HydrophobicContact CG-CB 4.34Å; L137-W218 HydrophobicContact CG-CG 4.23Å
138I98.4Very high96.3Very high1 Ų164.7 Ų64.71%0.00535%0.353CS..  trans-82.9112.7174.1-59.4162.1000109P132 F140 V180 L219 V221 M227P132-I138 HydrophobicContact CG-CG1 4.14Å; P132-I138 HydrophobicContact CG-CG2 4.43Å; I138-F140 HydrophobicContact CB-CE2 4.1Å; I138-F140 HydrophobicContact CG2-CD2 4.05Å; I138-F140 HydrophobicContact CG2-CE2 3.46Å; I138-F140 VanDerWaalsContact CG2-CE2 3.46Å; I138-F140 HydrophobicContact CG2-CZ 3.81Å; I138-V180 HydrophobicContact CD1-CG1 4.02Å; I138-V180 HydrophobicContact CD1-CG2 4.21Å; I138-L219 HydrophobicContact CB-CB 4.29Å; I138-L219 HydrophobicContact CD1-CB 3.89Å; I138-L219 PolarHBondContact N-O 3.14Å; I138-V221 HydrophobicContact CD1-CG1 3.7Å; I138-V221 HydrophobicContact CG1-CG1 3.75Å; I138-M227 HydrophobicContact CB-SD 4.47Å; I138-M227 HydrophobicContact CD1-SD 3.87Å; I138-M227 HydrophobicContact CG1-SD 3.94Å; I138-M227 HydrophobicContact CG2-CE 3.9Å; I138-M227 HydrophobicContact CG2-SD 3.63Å
139R97.9Very high96.6Very high138 Ų13863.8 Ų63.852%0.52136%0.356SS..  trans-88.5116.9173.8-67.8179.6169.5-129.9-10.1110.9L137 S154L137-R139 HydrophobicContact CD2-CG 3.65Å; L137-R139 PolarHBondContact O-N 3.08Å; R139-S154 PolarHBondContact NH1-O 2.8Å; R139-S154 PolarHBondContact NH2-O 2.81Å; R139-S154 VanDerWaalsContact NH2-O 3.14Å
140F98.3Very high96.9Very high3 Ų356.3 Ų56.31%0.01332%0.321CS..  trans-89.9114.4164.7-59.9-102.2000108.8V124 T125 R126 I138 Y151 L219 F237V124-F140 HydrophobicContact CB-CB 3.8Å; V124-F140 HydrophobicContact CG2-CB 3.44Å; V124-F140 VanDerWaalsContact CG2-CB 3.44Å; V124-F140 HydrophobicContact CG2-CD1 4.27Å; V124-F140 HydrophobicContact CG2-CD2 4.42Å; V124-F140 HydrophobicContact CG2-CG 3.81Å; T125-F140 CarbonylContact O-C 3.47Å; R126-F140 HydrophobicContact CB-CD1 3.88Å; R126-F140 HydrophobicContact CB-CE1 4.23Å; R126-F140 HydrophobicContact CB-CG 4.47Å; I138-F140 HydrophobicContact CB-CE2 4.1Å; I138-F140 HydrophobicContact CG2-CD2 4.05Å; I138-F140 HydrophobicContact CG2-CE2 3.46Å; I138-F140 VanDerWaalsContact CG2-CE2 3.46Å; I138-F140 HydrophobicContact CG2-CZ 3.81Å; F140-Y151 HydrophobicContact CB-CE1 4.24Å; F140-Y151 WeakPolarHBondContact CB-OH 3.31Å; F140-Y151 WeakPolarHBondContact CD2-OH 3.23Å; F140-Y151 PolarHBondContact N-OH 2.85Å; F140-Y151 VanDerWaalsContact N-OH 3.13Å; F140-Y151 WeakPolarHBondContact O-CE1 3.22Å; F140-L219 HydrophobicContact CE2-CB 4.45Å; F140-L219 HydrophobicContact CE2-CD1 3.89Å; F140-L219 HydrophobicContact CZ-CD1 3.93Å; F140-F237 HydrophobicContact CD1-CB 4Å; F140-F237 HydrophobicContact CD2-CB 4.05Å; F140-F237 HydrophobicContact CD2-CD1 4.28Å; F140-F237 HydrophobicContact CE1-CB 3.68Å; F140-F237 HydrophobicContact CE2-CB 3.73Å; F140-F237 HydrophobicContact CE2-CD1 4.22Å; F140-F237 HydrophobicContact CE2-CG 4.27Å; F140-F237 HydrophobicContact CG-CB 4.2Å; F140-F237 HydrophobicContact CZ-CB 3.54Å; F140-F237 HydrophobicContact CZ-CG 4.45Å
141N96.8Very high97.2Very high81 Ų8149.4 Ų49.443%0.43329%0.289SS..  trans-98.8-13.7-16860-50.5000114.1T125 R126 Q127T125-N141 PolarHBondContact O-N 3.03Å; R126-N141 WeakPolarHBondContact CA-OD1 3.5Å; Q127-N141 PolarHBondContact N-OD1 3.3Å; Q127-N141 PolarHBondContact O-ND2 2.83Å; Q127-N141 VanDerWaalsContact O-ND2 3.11Å
142A97.4Very high97.4Very high17 Ų1750 Ų5014%0.1429%0.289CS..EExtended strand (participates in β ladder)trans-114.5142.5-179.900000110.8V124 T125 Q127V124-A142 CarbonylContact C-O 3.54Å; V124-A142 VanDerWaalsContact CA-O 3.27Å; V124-A142 WeakPolarHBondContact CA-O 3.39Å; V124-A142 WeakPolarHBondContact CB-O 3.22Å; T125-A142 PolarHBondContact N-O 3.1Å; T125-A142 PolarHBondContact O-N 2.82Å; T125-A142 WeakPolarHBondContact OG1-CB 3.39Å; Q127-A142 HydrophobicContact CB-CB 4.07Å
143V98.3Very high97.4Very high73 Ų7352 Ų5244%0.44230%0.301SS..EExtended strand (participates in β ladder)trans-109.2124.4-177.6177.90000109.2V124 N146 T153V124-V143 HydrophobicContact CG1-CG2 4.18Å; V143-N146 HydrophobicContact CG1-CB 3.49Å; V143-N146 VanDerWaalsContact CG1-CB 3.49Å; V143-T153 HydrophobicContact CG2-CG2 3.63Å
144L97.6Very high97.4Very high121 Ų12152.6 Ų52.663%0.63430%0.302SS*.EExtended strand (participates in β ladder)trans-90.5-43.7167.2-63-175.7000110.9T123 T125T123-L144 HydrophobicContact CG2-CB 4.13Å; T123-L144 HydrophobicContact CG2-CD1 3.88Å; T123-L144 HydrophobicContact CG2-CG 4.42Å; T123-L144 WeakPolarHBondContact O-CB 3.43Å; T123-L144 PolarHBondContact O-N 2.64Å; T125-L144 HydrophobicContact CG2-CD1 3.58Å; T125-L144 HydrophobicContact CG2-CD2 4.48Å; T125-L144 HydrophobicContact CG2-CG 3.84Å
145T97Very high97.4Very high57 Ų5752.1 Ų52.135%0.3530%0.298SS..EExtended strand (participates in β ladder)trans-150.3137169.6-175.20000109.2F122 T123 P147F122-T145 CarbonylContact C-O 3.54Å; F122-T145 WeakPolarHBondContact CA-O 3.36Å; T123-T145 PolarHBondContact N-O 3.36Å; T123-T145 PolarHBondContact O-N 3.33Å; T123-T145 VanDerWaalsContact O-N 3.1Å; T145-P147 WeakPolarHBondContact OG1-CD 3.2Å
146N97.2Very high97.4Very high30 Ų3047 Ų4716%0.1627%0.271CS..  trans-163.757.6175.2-173.919.6000110F122 V143 Q148 G149 D150 Y151F122-N146 HydrophobicContact CB-CB 4.19Å; V143-N146 HydrophobicContact CG1-CB 3.49Å; V143-N146 VanDerWaalsContact CG1-CB 3.49Å; N146-Q148 PolarHBondContact O-N 3.36Å; N146-Q148 VanDerWaalsContact O-N 3.13Å; N146-G149 PolarHBondContact O-N 3.06Å; N146-G149 WeakPolarHBondContact OD1-CA 3.22Å; N146-G149 PolarHBondContact OD1-N 2.98Å; N146-D150 PolarHBondContact OD1-N 3.33Å; N146-Y151 PolarHBondContact ND2-O 2.66Å; N146-Y151 PolarHBondContact OD1-N 2.99Å
147P94.1Very high97.4Very high65 Ų6547.9 Ų47.942%0.42227%0.27SS..THydrogen-bonded Turntrans-59.9-28-16816.3-27000114.2V121 T145V121-P147 HydrophobicContact CG1-CG 3.82Å; V121-P147 WeakPolarHBondContact O-CD 3.32Å; T145-P147 WeakPolarHBondContact OG1-CD 3.2Å
148Q93.5Very high97.5Very high39 Ų3945.8 Ų45.818%0.18226%0.259CS..THydrogen-bonded Turntrans-90.6-11.8177.2-66.480.517.600113.8Q116 Q119 N146 D150 K161Q116-Q148 PolarHBondContact O-NE2 2.86Å; Q119-Q148 VanDerWaalsContact O-CG 3.23Å; Q119-Q148 WeakPolarHBondContact O-CG 3.34Å; Q119-Q148 PolarHBondContact O-NE2 2.84Å; N146-Q148 PolarHBondContact O-N 3.36Å; N146-Q148 VanDerWaalsContact O-N 3.13Å; Q148-D150 VanDerWaalsContact C-N 3.31Å; Q148-D150 WeakPolarHBondContact CB-OD1 3.23Å; Q148-K161 PolarHBondContact O-NZ 3.37Å
149G96.1Very high97.5Very high40 Ų4048.1 Ų48.141%0.41227%0.274SS..  trans63.538.4-172.800000112N146 K161N146-G149 PolarHBondContact O-N 3.06Å; N146-G149 WeakPolarHBondContact OD1-CA 3.22Å; N146-G149 PolarHBondContact OD1-N 2.98Å; G149-K161 VanDerWaalsContact C-NZ 3.31Å; G149-K161 PolarHBondContact O-NZ 3.14Å
150D97.8Very high97.5Very high4 Ų441.6 Ų41.62%0.02125%0.25CC..  trans-83.3-29.1-178.2-66.5-15000111.6S120 N146 Q148 F158 T159 K161S120-D150 WeakPolarHBondContact CB-OD2 3.47Å; S120-D150 PolarHBondContact OG-OD2 3.13Å; N146-D150 PolarHBondContact OD1-N 3.33Å; Q148-D150 VanDerWaalsContact C-N 3.31Å; Q148-D150 WeakPolarHBondContact CB-OD1 3.23Å; D150-F158 HydrophobicContact CB-CD2 3.8Å; D150-F158 HydrophobicContact CB-CE2 3.46Å; D150-F158 VanDerWaalsContact CB-CE2 3.46Å; D150-F158 HydrophobicContact CB-CZ 4.38Å; D150-F158 CarbonylContact O-C 3.44Å; D150-F158 VanDerWaalsContact O-CA 3.32Å; D150-F158 WeakPolarHBondContact O-CA 3.37Å; D150-T159 PolarHBondContact O-N 2.79Å; D150-K161 WeakPolarHBondContact OD1-CD 3.36Å; D150-K161 VanDerWaalsContact OD1-CE 3.32Å; D150-K161 WeakPolarHBondContact OD1-CE 3.45Å; D150-K161 WeakPolarHBondContact OD1-CG 3.32Å; D150-K161 IonicContact OD1-NZ 3.78Å; D150-K161 PolarHBondContact OD1-NZ 2.67Å
151Y98.7Very high97.4Very high3 Ų346.7 Ų46.71%0.01227%0.272CS..EExtended strand (participates in β ladder)trans-90124.7164.3-174.6-82.5000110F122 V124 F140 N146 T153 G156 F158 F237F122-Y151 HydrophobicContact CD2-CD2 4.12Å; F122-Y151 HydrophobicContact CD2-CG 4.08Å; F122-Y151 AromaticContact CE2-CD2 3.76Å; F122-Y151 HydrophobicContact CE2-CD2 3.76Å; F122-Y151 HydrophobicContact CE2-CG 4.2Å; F122-Y151 HydrophobicContact CZ-CD2 4.15Å; V124-Y151 HydrophobicContact CB-CD1 4.24Å; V124-Y151 HydrophobicContact CB-CE1 4.18Å; V124-Y151 HydrophobicContact CG1-CD1 3.56Å; V124-Y151 HydrophobicContact CG1-CE1 3.97Å; V124-Y151 HydrophobicContact CG1-CG 4.03Å; V124-Y151 HydrophobicContact CG2-CD1 4Å; V124-Y151 HydrophobicContact CG2-CD2 4.16Å; V124-Y151 HydrophobicContact CG2-CE1 3.81Å; V124-Y151 HydrophobicContact CG2-CE2 4.01Å; V124-Y151 HydrophobicContact CG2-CG 4.16Å; F140-Y151 HydrophobicContact CB-CE1 4.24Å; F140-Y151 WeakPolarHBondContact CB-OH 3.31Å; F140-Y151 WeakPolarHBondContact CD2-OH 3.23Å; F140-Y151 PolarHBondContact N-OH 2.85Å; F140-Y151 VanDerWaalsContact N-OH 3.13Å; F140-Y151 WeakPolarHBondContact O-CE1 3.22Å; N146-Y151 PolarHBondContact ND2-O 2.66Å; N146-Y151 PolarHBondContact OD1-N 2.99Å; Y151-T153 HydrophobicContact CD1-CG2 4.13Å; Y151-T153 HydrophobicContact CE1-CG2 4.02Å; Y151-G156 WeakPolarHBondContact OH-CA 3.38Å; Y151-F158 HydrophobicContact CD2-CB 4.29Å; Y151-F237 HydrophobicContact CD2-CD1 4.25Å; Y151-F237 HydrophobicContact CD2-CE1 4.21Å; Y151-F237 AromaticContact CE2-CD1 3.82Å; Y151-F237 HydrophobicContact CE2-CD1 3.82Å; Y151-F237 AromaticContact CE2-CE1 3.98Å; Y151-F237 HydrophobicContact CE2-CE1 3.98Å
152D98.5Very high97.3Very high60 Ų6043.6 Ų43.632%0.32126%0.256SS..EExtended strand (participates in β ladder)trans-102.2112.7177.5173.98.3000110.1S154 T155 G156 K157D152-S154 VanDerWaalsContact CG-OG 3.24Å; D152-S154 PolarHBondContact O-N 3.33Å; D152-S154 WeakPolarHBondContact OD1-CA 3.28Å; D152-S154 VanDerWaalsContact OD1-CB 3.27Å; D152-S154 WeakPolarHBondContact OD1-CB 3.32Å; D152-S154 PolarHBondContact OD1-N 2.52Å; D152-S154 PolarHBondContact OD1-OG 3.24Å; D152-S154 PolarHBondContact OD2-OG 2.9Å; D152-S154 VanDerWaalsContact OD2-OG 3.1Å; D152-T155 WeakPolarHBondContact CB-OG1 3.47Å; D152-T155 VanDerWaalsContact CG-OG1 3.27Å; D152-T155 PolarHBondContact O-N 3.47Å; D152-T155 PolarHBondContact O-OG1 3.29Å; D152-T155 WeakPolarHBondContact OD2-CG2 3.38Å; D152-T155 PolarHBondContact OD2-OG1 3.17Å; D152-G156 WeakPolarHBondContact O-CA 3.34Å; D152-G156 PolarHBondContact O-N 2.87Å; D152-K157 PolarHBondContact N-O 2.87Å; D152-K157 PolarHBondContact O-N 2.83Å
153T98.2Very high97.3Very high52 Ų5244.6 Ų44.632%0.31926%0.261SS..THydrogen-bonded Turntrans-69.2-21.1-179.456.20000113.1V143 Y151V143-T153 HydrophobicContact CG2-CG2 3.63Å; Y151-T153 HydrophobicContact CD1-CG2 4.13Å; Y151-T153 HydrophobicContact CE1-CG2 4.02Å
154S97.7Very high97.2Very high73 Ų7341.1 Ų41.151%0.5124%0.24SC..THydrogen-bonded Turntrans-76.6-27.2178.578.80000112.5R139 D152R139-S154 PolarHBondContact NH1-O 2.8Å; R139-S154 PolarHBondContact NH2-O 2.81Å; R139-S154 VanDerWaalsContact NH2-O 3.14Å; D152-S154 VanDerWaalsContact CG-OG 3.24Å; D152-S154 PolarHBondContact O-N 3.33Å; D152-S154 WeakPolarHBondContact OD1-CA 3.28Å; D152-S154 VanDerWaalsContact OD1-CB 3.27Å; D152-S154 WeakPolarHBondContact OD1-CB 3.32Å; D152-S154 PolarHBondContact OD1-N 2.52Å; D152-S154 PolarHBondContact OD1-OG 3.24Å; D152-S154 PolarHBondContact OD2-OG 2.9Å; D152-S154 VanDerWaalsContact OD2-OG 3.1Å
155T97.8Very high97.3Very high54 Ų5437.5 Ų37.533%0.33122%0.221SC..THydrogen-bonded Turntrans-105.1-27.8177.856.40000112.5D152D152-T155 WeakPolarHBondContact CB-OG1 3.47Å; D152-T155 VanDerWaalsContact CG-OG1 3.27Å; D152-T155 PolarHBondContact O-N 3.47Å; D152-T155 PolarHBondContact O-OG1 3.29Å; D152-T155 WeakPolarHBondContact OD2-CG2 3.38Å; D152-T155 PolarHBondContact OD2-OG1 3.17Å
156G98.1Very high97.3Very high0 Ų034.8 Ų34.80%020%0.204CC..THydrogen-bonded Turntrans79.923.5-174.100000113.4Y151 D152Y151-G156 WeakPolarHBondContact OH-CA 3.38Å; D152-G156 WeakPolarHBondContact O-CA 3.34Å; D152-G156 PolarHBondContact O-N 2.87Å
157K98.7Very high97.4Very high50 Ų5037 Ų3722%0.21721%0.211CC..EExtended strand (participates in β ladder)trans-122.8144.7-175.1-61.9-172.9178.4-1780111.5L137 D152 E216 W218L137-K157 HydrophobicContact CD1-CG 3.83Å; D152-K157 PolarHBondContact N-O 2.87Å; D152-K157 PolarHBondContact O-N 2.83Å; K157-E216 HydrophobicContact CD-CB 4.5Å; K157-E216 HydrophobicContact CD-CG 4.41Å; K157-E216 WeakPolarHBondContact CD-OE1 3.44Å; K157-E216 VanDerWaalsContact NZ-CD 3.3Å; K157-E216 IonicContact NZ-OE1 3.18Å; K157-E216 PolarHBondContact NZ-OE1 2.96Å; K157-E216 IonicContact NZ-OE2 2.68Å; K157-E216 PolarHBondContact NZ-OE2 2.81Å; K157-W218 HydrophobicContact CD-CE3 4.35Å; K157-W218 HydrophobicContact CG-CB 4.11Å
158F98.8Very high97.6Very high0 Ų033.9 Ų33.90%019%0.191CC..EExtended strand (participates in β ladder)trans-86136.5160.5169.8-90.2000109.6F122 D150 Y151 C160 Y166 F168 L211 E216 V217F122-F158 AromaticContact CD1-CD2 3.66Å; F122-F158 HydrophobicContact CD1-CD2 3.66Å; F122-F158 HydrophobicContact CD1-CE2 4.06Å; F122-F158 HydrophobicContact CE1-CB 4.17Å; F122-F158 AromaticContact CE1-CD2 3.28Å; F122-F158 HydrophobicContact CE1-CD2 3.28Å; F122-F158 AromaticContact CE1-CE2 3.87Å; F122-F158 HydrophobicContact CE1-CE2 3.87Å; F122-F158 AromaticContact CE1-CG 3.93Å; F122-F158 HydrophobicContact CE1-CG 3.93Å; F122-F158 HydrophobicContact CZ-CB 4.31Å; F122-F158 HydrophobicContact CZ-CD2 4.22Å; D150-F158 HydrophobicContact CB-CD2 3.8Å; D150-F158 HydrophobicContact CB-CE2 3.46Å; D150-F158 VanDerWaalsContact CB-CE2 3.46Å; D150-F158 HydrophobicContact CB-CZ 4.38Å; D150-F158 CarbonylContact O-C 3.44Å; D150-F158 VanDerWaalsContact O-CA 3.32Å; D150-F158 WeakPolarHBondContact O-CA 3.37Å; Y151-F158 HydrophobicContact CD2-CB 4.29Å; F158-C160 HydrophobicContact CE1-CB 3.97Å; F158-C160 HydrophobicContact CZ-CB 4.47Å; F158-Y166 HydrophobicContact CE1-CE1 4.32Å; F158-Y166 HydrophobicContact CE2-CE1 4.14Å; F158-Y166 HydrophobicContact CZ-CD1 4Å; F158-Y166 AromaticContact CZ-CE1 3.46Å; F158-Y166 HydrophobicContact CZ-CE1 3.46Å; F158-Y166 VanDerWaalsContact CZ-CE1 3.46Å; F158-Y166 AromaticContact CZ-CZ 3.84Å; F158-F168 HydrophobicContact CB-CE1 4.42Å; F158-F168 AromaticContact CD1-CE1 3.89Å; F158-F168 HydrophobicContact CD1-CE1 3.89Å; F158-F168 AromaticContact CD1-CZ 3.74Å; F158-F168 HydrophobicContact CD1-CZ 3.74Å; F158-F168 HydrophobicContact CD2-CE1 4.39Å; F158-F168 HydrophobicContact CE1-CE1 4.23Å; F158-F168 AromaticContact CE1-CZ 3.76Å; F158-F168 HydrophobicContact CE1-CZ 3.76Å; F158-F168 AromaticContact CG-CE1 3.97Å; F158-F168 HydrophobicContact CG-CE1 3.97Å; F158-F168 HydrophobicContact CG-CZ 4.29Å; F158-F168 HydrophobicContact CZ-CZ 4.31Å; F158-L211 HydrophobicContact CD1-CD1 4.31Å; F158-L211 HydrophobicContact CE1-CD1 3.66Å; F158-E216 CarbonylContact O-C 3.51Å; F158-E216 WeakPolarHBondContact O-CA 3.46Å; F158-V217 HydrophobicContact CB-CB 4.34Å; F158-V217 WeakPolarHBondContact CB-O 3.31Å; F158-V217 HydrophobicContact CD1-CB 4.07Å; F158-V217 HydrophobicContact CD1-CG2 4.3Å; F158-V217 PolarHBondContact N-O 2.86Å; F158-V217 PolarHBondContact O-N 3.41Å
159T98.6Very high97.9Very high50 Ų5033.1 Ų33.131%0.30719%0.188SC..EExtended strand (participates in β ladder)trans-122.5122.6172.4-54.20000109.9D150 K161D150-T159 PolarHBondContact O-N 2.79Å; T159-K161 PolarHBondContact O-N 2.78Å
160C98.2Very high98Very high2 Ų231.4 Ų31.41%0.01417%0.169CC..  trans-67.2122.3-178.1179.70000111.6F158 V162 L211 Q212 G214 E215F158-C160 HydrophobicContact CE1-CB 3.97Å; F158-C160 HydrophobicContact CZ-CB 4.47Å; C160-V162 PolarHBondContact SG-O 3.36Å; C160-L211 HydrophobicContact CB-CB 4.14Å; C160-L211 HydrophobicContact CB-CD1 4.23Å; C160-Q212 WeakPolarHBondContact CB-O 3.47Å; C160-Q212 PolarHBondContact SG-O 3.11Å; C160-G214 PolarHBondContact O-N 2.87Å; C160-E215 PolarHBondContact N-O 2.74Å
161K96.3Very high98Very high109 Ų10935.3 Ų35.347%0.47419%0.187SC..SBendtrans-102.7-28.7170.8-61.9-170.5-169.61230113.5Q148 G149 D150 T159Q148-K161 PolarHBondContact O-NZ 3.37Å; G149-K161 VanDerWaalsContact C-NZ 3.31Å; G149-K161 PolarHBondContact O-NZ 3.14Å; D150-K161 WeakPolarHBondContact OD1-CD 3.36Å; D150-K161 VanDerWaalsContact OD1-CE 3.32Å; D150-K161 WeakPolarHBondContact OD1-CE 3.45Å; D150-K161 WeakPolarHBondContact OD1-CG 3.32Å; D150-K161 IonicContact OD1-NZ 3.78Å; D150-K161 PolarHBondContact OD1-NZ 2.67Å; T159-K161 PolarHBondContact O-N 2.78Å
162V95.6Very high98Very high16 Ų1635.2 Ų35.210%0.09719%0.187CC..SBendtrans-117.7114179.8-176.30000108C160 Y166 L241 P244C160-V162 PolarHBondContact SG-O 3.36Å; V162-Y166 VanDerWaalsContact O-CE2 3.26Å; V162-Y166 WeakPolarHBondContact O-CE2 3.29Å; V162-Y166 PolarHBondContact O-OH 2.81Å; V162-L241 HydrophobicContact CB-CD2 3.9Å; V162-L241 HydrophobicContact CG1-CD2 3.48Å; V162-L241 VanDerWaalsContact CG1-CD2 3.48Å; V162-P244 HydrophobicContact CG1-CB 4.43Å
163P97Very high97.9Very high38 Ų3832.4 Ų32.425%0.24717%0.173CC..  trans-66.2148-179.630.3-32.8000109.8L211 V213 D245P163-L211 WeakPolarHBondContact CA-O 3.36Å; P163-V213 HydrophobicContact CB-CG2 4.23Å; P163-V213 HydrophobicContact CG-CG2 4.04Å; P163-D245 HydrophobicContact CB-CB 4.09Å; P163-D245 HydrophobicContact CG-CB 4.18Å; P163-D245 PolarHBondContact O-N 2.79Å
164G96.7Very high97.9Very high0 Ų030 Ų300%016%0.158CC..EExtended strand (participates in β ladder)trans154.4-176.2-176.600000114.7Y166 R210 L211 F243 D245G164-Y166 WeakPolarHBondContact O-CD2 3.18Å; G164-R210 CarbonylContact O-C 3.58Å; G164-R210 VanDerWaalsContact O-CA 3.29Å; G164-R210 WeakPolarHBondContact O-CA 3.36Å; G164-L211 PolarHBondContact N-O 3.32Å; G164-L211 PolarHBondContact O-N 2.04Å; G164-F243 CarbonylContact C-O 3.48Å; G164-F243 WeakPolarHBondContact CA-O 3.39Å; G164-D245 WeakPolarHBondContact CA-OD1 3.38Å
165L98.2Very high97.8Very high45 Ų4528.1 Ų28.124%0.23614%0.143CC..EExtended strand (participates in β ladder)trans-84120.2173.7-170.972.9000110.9L208 R210 L242 F243L165-L208 HydrophobicContact CD1-CB 4.38Å; L165-L208 HydrophobicContact CD2-CD2 4.38Å; L165-L208 HydrophobicContact CG-CD2 4.48Å; L165-R210 HydrophobicContact CD1-CB 4.12Å; L165-L242 HydrophobicContact CD2-CD1 4.4Å; L165-L242 WeakPolarHBondContact O-CB 3.24Å; L165-L242 PolarHBondContact O-N 3.4Å; L165-F243 HydrophobicContact CB-CB 4.22Å; L165-F243 HydrophobicContact CB-CD2 4.03Å; L165-F243 HydrophobicContact CD2-CD2 3.54Å; L165-F243 HydrophobicContact CD2-CE2 3.86Å; L165-F243 HydrophobicContact CG-CD2 4.38Å; L165-F243 PolarHBondContact N-O 3.35Å; L165-F243 PolarHBondContact O-N 2.72Å
166Y98.6Very high97.7Very high0 Ų027.6 Ų27.60%014%0.144CC..EExtended strand (participates in β ladder)trans-108148.6176.9-77.1-99.4000111.8S120 F158 V162 G164 F168 L208 L209 L211 F240 L241S120-Y166 VanDerWaalsContact CB-OH 3.28Å; S120-Y166 WeakPolarHBondContact CB-OH 3.21Å; S120-Y166 WeakPolarHBondContact OG-CE1 3.38Å; S120-Y166 PolarHBondContact OG-OH 3.07Å; F158-Y166 HydrophobicContact CE1-CE1 4.32Å; F158-Y166 HydrophobicContact CE2-CE1 4.14Å; F158-Y166 HydrophobicContact CZ-CD1 4Å; F158-Y166 AromaticContact CZ-CE1 3.46Å; F158-Y166 HydrophobicContact CZ-CE1 3.46Å; F158-Y166 VanDerWaalsContact CZ-CE1 3.46Å; F158-Y166 AromaticContact CZ-CZ 3.84Å; V162-Y166 VanDerWaalsContact O-CE2 3.26Å; V162-Y166 WeakPolarHBondContact O-CE2 3.29Å; V162-Y166 PolarHBondContact O-OH 2.81Å; G164-Y166 WeakPolarHBondContact O-CD2 3.18Å; Y166-F168 VanDerWaalsContact CB-CE2 3.44Å; Y166-F168 HydrophobicContact CD1-CZ 4.15Å; Y166-F168 HydrophobicContact CG-CE2 4.17Å; Y166-F168 HydrophobicContact CG-CZ 4.19Å; Y166-L208 CarbonylContact O-C 3.54Å; Y166-L208 VanDerWaalsContact O-CA 3.28Å; Y166-L208 WeakPolarHBondContact O-CA 3.23Å; Y166-L209 PolarHBondContact N-O 2.92Å; Y166-L209 PolarHBondContact O-N 3.43Å; Y166-L211 HydrophobicContact CD2-CB 4.06Å; Y166-L211 HydrophobicContact CD2-CD1 3.89Å; Y166-L211 HydrophobicContact CD2-CG 4.02Å; Y166-L211 HydrophobicContact CE2-CB 4.29Å; Y166-L211 HydrophobicContact CE2-CD1 4.35Å; Y166-L211 HydrophobicContact CG-CD1 4.14Å; Y166-F240 WeakPolarHBondContact CA-O 3.33Å; Y166-L241 HydrophobicContact CD1-CB 4.16Å; Y166-L241 HydrophobicContact CD2-CD1 3.96Å; Y166-L241 HydrophobicContact CE1-CB 3.71Å; Y166-L241 HydrophobicContact CE1-CD1 4.45Å; Y166-L241 HydrophobicContact CE2-CB 4.39Å; Y166-L241 HydrophobicContact CE2-CD1 3.61Å
167Y98.7Very high97.6Very high77 Ų7730.1 Ų30.130%0.30216%0.158SC..EExtended strand (participates in β ladder)trans-106.1130162-177.2-122.4000109.7V169 L208 G239 F240Y167-V169 HydrophobicContact CD1-CB 4.39Å; Y167-V169 HydrophobicContact CD1-CG1 4.23Å; Y167-V169 HydrophobicContact CE1-CB 3.65Å; Y167-V169 HydrophobicContact CE1-CG1 3.69Å; Y167-V169 HydrophobicContact CE1-CG2 4.34Å; Y167-L208 HydrophobicContact CD2-CD2 3.8Å; Y167-L208 HydrophobicContact CD2-CG 4.08Å; Y167-L208 HydrophobicContact CG-CD2 4.18Å; Y167-G239 WeakPolarHBondContact O-CA 3.39Å; Y167-F240 AromaticContact CD1-CE1 3.66Å; Y167-F240 HydrophobicContact CD1-CE1 3.66Å; Y167-F240 HydrophobicContact CD1-CE2 4.28Å; Y167-F240 AromaticContact CD1-CZ 3.45Å; Y167-F240 HydrophobicContact CD1-CZ 3.45Å; Y167-F240 VanDerWaalsContact CD1-CZ 3.45Å; Y167-F240 HydrophobicContact CE1-CE1 4.48Å; Y167-F240 HydrophobicContact CE1-CZ 4.35Å; Y167-F240 HydrophobicContact CG-CZ 4.22Å; Y167-F240 PolarHBondContact N-O 2.78Å; Y167-F240 PolarHBondContact O-N 3.09Å
168F98.9Very high97.6Very high0 Ų027.8 Ų27.80%015%0.147CC..EExtended strand (participates in β ladder)trans-117.2135.1173-66.9-81.1000109.2F122 F158 Y166 L182 G206 V207 L209 L211 V217 F237 S238F122-F168 HydrophobicContact CE1-CD1 4.36Å; F122-F168 AromaticContact CE1-CE1 3.96Å; F122-F168 HydrophobicContact CE1-CE1 3.96Å; F122-F168 HydrophobicContact CZ-CD1 4.16Å; F122-F168 HydrophobicContact CZ-CE1 4.11Å; F158-F168 HydrophobicContact CB-CE1 4.42Å; F158-F168 AromaticContact CD1-CE1 3.89Å; F158-F168 HydrophobicContact CD1-CE1 3.89Å; F158-F168 AromaticContact CD1-CZ 3.74Å; F158-F168 HydrophobicContact CD1-CZ 3.74Å; F158-F168 HydrophobicContact CD2-CE1 4.39Å; F158-F168 HydrophobicContact CE1-CE1 4.23Å; F158-F168 AromaticContact CE1-CZ 3.76Å; F158-F168 HydrophobicContact CE1-CZ 3.76Å; F158-F168 AromaticContact CG-CE1 3.97Å; F158-F168 HydrophobicContact CG-CE1 3.97Å; F158-F168 HydrophobicContact CG-CZ 4.29Å; F158-F168 HydrophobicContact CZ-CZ 4.31Å; Y166-F168 VanDerWaalsContact CB-CE2 3.44Å; Y166-F168 HydrophobicContact CD1-CZ 4.15Å; Y166-F168 HydrophobicContact CG-CE2 4.17Å; Y166-F168 HydrophobicContact CG-CZ 4.19Å; F168-L182 HydrophobicContact CB-CD1 3.97Å; F168-G206 CarbonylContact O-C 3.58Å; F168-G206 WeakPolarHBondContact O-CA 3.47Å; F168-V207 PolarHBondContact N-O 3.44Å; F168-V207 PolarHBondContact O-N 3.13Å; F168-L209 HydrophobicContact CD2-CB 4.47Å; F168-L209 HydrophobicContact CD2-CD1 4.15Å; F168-L209 HydrophobicContact CE2-CB 4.37Å; F168-L209 HydrophobicContact CE2-CD1 4.36Å; F168-L211 HydrophobicContact CE2-CD1 3.77Å; F168-L211 HydrophobicContact CZ-CD1 3.71Å; F168-V217 HydrophobicContact CD1-CG1 4Å; F168-V217 HydrophobicContact CD2-CG1 4.27Å; F168-V217 HydrophobicContact CE1-CB 4.1Å; F168-V217 HydrophobicContact CE1-CG1 3.94Å; F168-V217 HydrophobicContact CE1-CG2 4.45Å; F168-V217 HydrophobicContact CE2-CB 4.42Å; F168-V217 HydrophobicContact CE2-CG1 4.23Å; F168-V217 HydrophobicContact CE2-CG2 3.96Å; F168-V217 HydrophobicContact CG-CG1 4.17Å; F168-V217 HydrophobicContact CZ-CB 3.99Å; F168-V217 HydrophobicContact CZ-CG1 4.07Å; F168-V217 HydrophobicContact CZ-CG2 3.83Å; F168-F237 HydrophobicContact CB-CE2 4.15Å; F168-F237 HydrophobicContact CD1-CE2 4.04Å; F168-F237 AromaticContact CD1-CZ 3.79Å; F168-F237 HydrophobicContact CD1-CZ 3.79Å; F168-S238 WeakPolarHBondContact CA-O 3.48Å
169V98.8Very high97.6Very high22 Ų2227.9 Ų27.913%0.13315%0.148CC..EExtended strand (participates in β ladder)trans-148.6142.1-179.662.30000110.7Y167 G205 F237 S238Y167-V169 HydrophobicContact CD1-CB 4.39Å; Y167-V169 HydrophobicContact CD1-CG1 4.23Å; Y167-V169 HydrophobicContact CE1-CB 3.65Å; Y167-V169 HydrophobicContact CE1-CG1 3.69Å; Y167-V169 HydrophobicContact CE1-CG2 4.34Å; V169-G205 WeakPolarHBondContact CA-O 3.38Å; V169-F237 WeakPolarHBondContact O-CD2 3.42Å; V169-S238 PolarHBondContact N-O 2.91Å; V169-S238 PolarHBondContact O-N 3.04Å
170Y98.7Very high97.6Very high4 Ų425.6 Ų25.62%0.01613%0.134CC..EExtended strand (participates in β ladder)trans-133.5156.5173.874.2-92.1000111.5A172 V180 F192 N203 S204 G205 L219 V236Y170-A172 HydrophobicContact CD2-CB 4.03Å; Y170-A172 HydrophobicContact CE2-CB 4.27Å; Y170-V180 HydrophobicContact CD1-CG1 4.07Å; Y170-V180 HydrophobicContact CD2-CG1 4.2Å; Y170-V180 HydrophobicContact CD2-CG2 4.44Å; Y170-V180 HydrophobicContact CE1-CB 4.09Å; Y170-V180 HydrophobicContact CE1-CG1 3.62Å; Y170-V180 HydrophobicContact CE2-CB 3.72Å; Y170-V180 HydrophobicContact CE2-CG1 3.81Å; Y170-V180 HydrophobicContact CE2-CG2 3.78Å; Y170-V180 HydrophobicContact CG-CG1 4.35Å; Y170-V180 VanDerWaalsContact CZ-CB 3.49Å; Y170-V180 WeakPolarHBondContact OH-CB 3.46Å; Y170-F192 HydrophobicContact CE1-CD2 4.31Å; Y170-F192 WeakPolarHBondContact OH-CB 3Å; Y170-F192 WeakPolarHBondContact OH-CD2 3.38Å; Y170-N203 WeakPolarHBondContact CE2-O 3.46Å; Y170-N203 WeakPolarHBondContact CE2-OD1 3.45Å; Y170-N203 PolarHBondContact OH-OD1 2.85Å; Y170-S204 WeakPolarHBondContact O-CA 3.07Å; Y170-G205 WeakPolarHBondContact CD1-O 3.46Å; Y170-G205 VanDerWaalsContact CE1-CA 3.49Å; Y170-G205 PolarHBondContact N-O 2.81Å; Y170-G205 PolarHBondContact O-N 3.04Å; Y170-L219 HydrophobicContact CD1-CD1 3.86Å; Y170-L219 HydrophobicContact CD1-CD2 4.07Å; Y170-L219 HydrophobicContact CG-CD1 3.78Å; Y170-V236 VanDerWaalsContact CA-O 3.25Å; Y170-V236 WeakPolarHBondContact CA-O 3.5Å; Y170-V236 WeakPolarHBondContact CB-O 3.35Å
171H98.4Very high97.6Very high86 Ų8626.1 Ų26.140%0.39814%0.137SC..EExtended strand (participates in β ladder)trans-134.3115.2168-59.1-91.8000107V202 N203 S235 V236H171-V202 HydrophobicContact CB-CG1 3.8Å; H171-N203 CarbonylContact C-O 3.41Å; H171-N203 WeakPolarHBondContact CA-O 3.33Å; H171-S235 CarbonylContact O-C 3.59Å; H171-S235 WeakPolarHBondContact O-CA 3.33Å; H171-V236 HydrophobicContact CB-CG1 3.84Å; H171-V236 PolarHBondContact N-O 3.17Å; H171-V236 PolarHBondContact O-N 2.89Å
172A97.8Very high97.7Very high1 Ų121 Ų211%0.00812%0.115CC..EExtended strand (participates in β ladder)trans-118.9116.9-173.900000110.4Y170 L178 V180 V202 N203 M227 S235Y170-A172 HydrophobicContact CD2-CB 4.03Å; Y170-A172 HydrophobicContact CE2-CB 4.27Å; A172-L178 HydrophobicContact CB-CD2 3.74Å; A172-V180 HydrophobicContact CB-CG2 4.35Å; A172-V202 CarbonylContact O-C 3.59Å; A172-V202 WeakPolarHBondContact O-CA 3.48Å; A172-N203 PolarHBondContact N-O 3.5Å; A172-N203 PolarHBondContact O-N 2.87Å; A172-M227 HydrophobicContact CB-CE 3.96Å; A172-S235 WeakPolarHBondContact CA-OG 3.37Å
173S96.8Very high97.9Very high2 Ų223.1 Ų23.11%0.01412%0.121CC..EExtended strand (participates in β ladder)trans-77.5136.3175.9-63.50000111.5Q201 M227 S233 D234 S235S173-Q201 WeakPolarHBondContact CA-O 3.27Å; S173-M227 CarbonylContact O-C 3.42Å; S173-M227 WeakPolarHBondContact O-CA 3.47Å; S173-S233 WeakPolarHBondContact CB-O 3.37Å; S173-S233 WeakPolarHBondContact CB-OG 3.46Å; S173-S233 PolarHBondContact OG-OG 3.24Å; S173-D234 PolarHBondContact OG-O 2.85Å; S173-D234 VanDerWaalsContact OG-O 3.09Å; S173-S235 PolarHBondContact N-OG 3.36Å; S173-S235 VanDerWaalsContact N-OG 3.08Å
174H97Very high98Very high1 Ų124.7 Ų24.71%0.00512%0.122CC..EExtended strand (participates in β ladder)trans-150.3150-177.968109.7000111.4A176 L178 G194 T196 N200 Q201 D226H174-A176 PolarHBondContact ND1-O 2.95Å; H174-L178 HydrophobicContact CB-CB 3.88Å; H174-L178 HydrophobicContact CB-CD2 3.85Å; H174-L178 HydrophobicContact CB-CG 4.5Å; H174-G194 PolarHBondContact CE1-O 2.83Å; H174-T196 WeakPolarHBondContact ND1-CG2 3.41Å; H174-N200 WeakPolarHBondContact O-CA 3.44Å; H174-Q201 PolarHBondContact CD2-O 3.3Å; H174-Q201 VanDerWaalsContact CD2-O 3.28Å; H174-Q201 PolarHBondContact N-O 3.46Å; H174-Q201 PolarHBondContact O-N 2.84Å; H174-D226 WeakPolarHBondContact CB-O 3.39Å
175T95.4Very high98Very high33 Ų3327.4 Ų27.420%0.20214%0.141CC..SBendtrans-119.2-4.1178.753.80000113.2T196 K198 N200 D226 V228 I230T175-T196 VanDerWaalsContact C-CG2 3.46Å; T175-K198 PolarHBondContact O-N 3.03Å; T175-K198 VanDerWaalsContact O-N 3.09Å; T175-N200 HydrophobicContact CG2-CB 4Å; T175-D226 PolarHBondContact N-OD2 2.79Å; T175-V228 VanDerWaalsContact CG2-O 3.24Å; T175-V228 WeakPolarHBondContact CG2-O 3.45Å; T175-V228 PolarHBondContact OG1-O 2.68Å; T175-I230 HydrophobicContact CG2-CG2 4.03Å
176A95.7Very high98Very high43 Ų4327.6 Ų27.636%0.35515%0.154SC..SBendtrans-134.8-174.3166.900000110.6H174 L178 D226H174-A176 PolarHBondContact ND1-O 2.95Å; A176-L178 PolarHBondContact O-N 3.03Å; A176-D226 HydrophobicContact CB-CB 3.78Å; A176-D226 PolarHBondContact N-OD2 2.71Å
177N97.3Very high98Very high54 Ų5432.4 Ų32.429%0.28918%0.184SC..  trans-61.7133.2-175.4-65.4-10.5000112.6H195 T196 Y224 Y225 D226N177-H195 WeakPolarHBondContact OD1-CA 3.38Å; N177-T196 PolarHBondContact OD1-N 2.88Å; N177-T196 PolarHBondContact OD1-O 2.93Å; N177-Y224 HydrophobicContact CB-CD1 3.88Å; N177-Y224 HydrophobicContact CB-CD2 4.17Å; N177-Y224 HydrophobicContact CB-CE1 4.42Å; N177-Y224 HydrophobicContact CB-CG 3.76Å; N177-Y224 CarbonylContact O-C 3.56Å; N177-Y225 PolarHBondContact O-N 2.9Å; N177-D226 PolarHBondContact O-N 3.2Å
178L98.3Very high97.9Very high0 Ų034.3 Ų34.30%019%0.193CC..EExtended strand (participates in β ladder)trans-136.8126.7178.4174.658.8000110.8A172 H174 A176 V180 C193 G194 N203 V221 Y224 D226 M227A172-L178 HydrophobicContact CB-CD2 3.74Å; H174-L178 HydrophobicContact CB-CB 3.88Å; H174-L178 HydrophobicContact CB-CD2 3.85Å; H174-L178 HydrophobicContact CB-CG 4.5Å; A176-L178 PolarHBondContact O-N 3.03Å; L178-V180 HydrophobicContact CD1-CG2 3.85Å; L178-V180 HydrophobicContact CD2-CG2 3.91Å; L178-V180 HydrophobicContact CG-CG2 3.88Å; L178-C193 CarbonylContact O-C 3.54Å; L178-C193 VanDerWaalsContact O-CA 3.32Å; L178-C193 WeakPolarHBondContact O-CA 3.38Å; L178-G194 PolarHBondContact N-O 2.81Å; L178-G194 PolarHBondContact O-N 3.03Å; L178-N203 HydrophobicContact CD2-CB 4.05Å; L178-N203 PolarHBondContact O-ND2 2.9Å; L178-N203 VanDerWaalsContact O-ND2 3.11Å; L178-V221 HydrophobicContact CD1-CG1 3.78Å; L178-Y224 WeakPolarHBondContact CA-O 3.32Å; L178-D226 VanDerWaalsContact CB-O 3.32Å; L178-D226 WeakPolarHBondContact CB-O 3.32Å; L178-D226 VanDerWaalsContact CD1-O 3.29Å; L178-D226 WeakPolarHBondContact CD1-O 3.38Å; L178-D226 WeakPolarHBondContact CD2-O 3.34Å; L178-D226 WeakPolarHBondContact CG-O 3.43Å; L178-M227 HydrophobicContact CD1-CG 3.91Å; L178-M227 HydrophobicContact CD2-CG 4.07Å
179C98.6Very high97.9Very high3 Ų336.9 Ų36.92%0.0221%0.209CC..EExtended strand (participates in β ladder)trans-115129.3160.2-65.50000109.9L181 T191 F192 C193 V221 N222 Y224C179-L181 HydrophobicContact CB-CD1 4.33Å; C179-T191 HydrophobicContact CB-CG2 4.37Å; C179-F192 WeakPolarHBondContact CA-O 3.5Å; C179-C193 HydrophobicContact CB-CB 4.11Å; C179-C193 WeakPolarHBondContact CB-SG 3.49Å; C179-C193 WeakPolarHBondContact SG-CB 3.39Å; C179-C193 CovalentContact SG-SG 2.04Å; C179-C193 PolarHBondContact SG-SG 2.88Å; C179-V221 WeakPolarHBondContact O-CA 3.32Å; C179-N222 WeakPolarHBondContact CB-OD1 3.36Å; C179-Y224 PolarHBondContact N-O 3.34Å
180V98.7Very high97.9Very high1 Ų137.6 Ų37.61%0.00621%0.213CC..EExtended strand (participates in β ladder)trans-108.3129.1174.2178.60000108.9I138 Y170 A172 L178 T191 F192 L219 A220I138-V180 HydrophobicContact CD1-CG1 4.02Å; I138-V180 HydrophobicContact CD1-CG2 4.21Å; Y170-V180 HydrophobicContact CD1-CG1 4.07Å; Y170-V180 HydrophobicContact CD2-CG1 4.2Å; Y170-V180 HydrophobicContact CD2-CG2 4.44Å; Y170-V180 HydrophobicContact CE1-CB 4.09Å; Y170-V180 HydrophobicContact CE1-CG1 3.62Å; Y170-V180 HydrophobicContact CE2-CB 3.72Å; Y170-V180 HydrophobicContact CE2-CG1 3.81Å; Y170-V180 HydrophobicContact CE2-CG2 3.78Å; Y170-V180 HydrophobicContact CG-CG1 4.35Å; Y170-V180 VanDerWaalsContact CZ-CB 3.49Å; Y170-V180 WeakPolarHBondContact OH-CB 3.46Å; A172-V180 HydrophobicContact CB-CG2 4.35Å; L178-V180 HydrophobicContact CD1-CG2 3.85Å; L178-V180 HydrophobicContact CD2-CG2 3.91Å; L178-V180 HydrophobicContact CG-CG2 3.88Å; V180-T191 WeakPolarHBondContact O-CA 3.23Å; V180-F192 PolarHBondContact N-O 2.96Å; V180-F192 PolarHBondContact O-N 2.94Å; V180-L219 HydrophobicContact CG1-CB 4.08Å; V180-L219 HydrophobicContact CG1-CD1 4.08Å; V180-L219 HydrophobicContact CG1-CD2 4.08Å; V180-L219 HydrophobicContact CG1-CG 4.31Å; V180-A220 WeakPolarHBondContact CA-O 3.44Å
181L98.7Very high97.9Very high13 Ų1340 Ų407%0.06823%0.228CC..EExtended strand (participates in β ladder)trans-112.3126.8-178.5-63.877.7000108.1C179 Y183 K188 V190 T191 L219 A220 N222C179-L181 HydrophobicContact CB-CD1 4.33Å; L181-Y183 HydrophobicContact CB-CD2 4.28Å; L181-Y183 HydrophobicContact CB-CE2 3.81Å; L181-Y183 HydrophobicContact CD2-CE2 4.18Å; L181-K188 HydrophobicContact CD2-CD 3.65Å; L181-K188 HydrophobicContact CD2-CG 4.44Å; L181-K188 HydrophobicContact CG-CD 4.32Å; L181-V190 WeakPolarHBondContact CA-O 3.25Å; L181-T191 HydrophobicContact CD1-CG2 4.25Å; L181-T191 HydrophobicContact CG-CG2 3.92Å; L181-L219 CarbonylContact O-C 3.55Å; L181-L219 VanDerWaalsContact O-CA 3.29Å; L181-L219 WeakPolarHBondContact O-CA 3.39Å; L181-A220 HydrophobicContact CB-CB 4.46Å; L181-A220 PolarHBondContact N-O 3.11Å; L181-A220 PolarHBondContact O-N 2.83Å; L181-N222 HydrophobicContact CD1-CB 4.09Å
182L98.8Very high97.9Very high2 Ų239.5 Ų39.51%0.0123%0.225CC..EExtended strand (participates in β ladder)trans-96129.6172-172.7151.3000109.6F168 V189 V190 V207 L209 V217 L219F168-L182 HydrophobicContact CB-CD1 3.97Å; L182-V189 HydrophobicContact CD2-CB 3.86Å; L182-V189 HydrophobicContact CD2-CG1 4.46Å; L182-V189 HydrophobicContact CD2-CG2 3.86Å; L182-V189 PolarHBondContact O-N 3Å; L182-V190 HydrophobicContact CB-CG2 3.74Å; L182-V190 PolarHBondContact N-O 2.82Å; L182-V207 HydrophobicContact CD1-CG1 3.71Å; L182-V207 HydrophobicContact CD2-CG1 4.01Å; L182-V207 HydrophobicContact CG-CG1 4.48Å; L182-L209 HydrophobicContact CD2-CD1 3.9Å; L182-V217 HydrophobicContact CD1-CG1 4.44Å; L182-V217 HydrophobicContact CD2-CG1 4.09Å; L182-V217 HydrophobicContact CG-CG1 4.23Å; L182-L219 HydrophobicContact CB-CD2 3.8Å; L182-L219 HydrophobicContact CD1-CD2 3.95Å; L182-L219 HydrophobicContact CG-CD2 3.93Å
183Y98.8Very high97.9Very high60 Ų6042.7 Ų42.724%0.23525%0.247CC..EExtended strand (participates in β ladder)trans-111.4146.3176.6-79.4-99.3000111.1L181 V187 K188 V217 W218 A220L181-Y183 HydrophobicContact CB-CD2 4.28Å; L181-Y183 HydrophobicContact CB-CE2 3.81Å; L181-Y183 HydrophobicContact CD2-CE2 4.18Å; Y183-V187 CarbonylContact C-O 3.51Å; Y183-V187 WeakPolarHBondContact CA-O 3.46Å; Y183-K188 HydrophobicContact CD1-CB 4.25Å; Y183-K188 HydrophobicContact CE1-CB 3.81Å; Y183-K188 HydrophobicContact CE2-CB 4.47Å; Y183-K188 HydrophobicContact CE2-CG 4.45Å; Y183-V217 VanDerWaalsContact O-CA 3.31Å; Y183-V217 WeakPolarHBondContact O-CA 3.25Å; Y183-W218 AromaticContact CD1-CZ2 3.89Å; Y183-W218 HydrophobicContact CD1-CZ2 3.89Å; Y183-W218 AromaticContact CD2-NE1 3.75Å; Y183-W218 AromaticContact CG-CE2 3.72Å; Y183-W218 AromaticContact CG-CZ2 3.78Å; Y183-W218 HydrophobicContact CG-CZ2 3.78Å; Y183-W218 AromaticContact CG-NE1 3.7Å; Y183-W218 PolarHBondContact N-O 2.9Å; Y183-W218 PolarHBondContact O-N 2.79Å; Y183-A220 HydrophobicContact CD2-CB 4.13Å; Y183-A220 HydrophobicContact CE2-CB 3.93Å
184R98.7Very high97.9Very high72 Ų7243.2 Ų43.227%0.27225%0.252SS..EExtended strand (participates in β ladder)trans-127.6119.5168.6174.1-167.5172.21669.1108G186 V187 V189 L209 R210 L211 E215 E216R184-G186 PolarHBondContact O-N 2.92Å; R184-V187 PolarHBondContact N-O 3.39Å; R184-V187 PolarHBondContact O-N 3.1Å; R184-V189 HydrophobicContact CB-CG2 3.6Å; R184-L209 HydrophobicContact CB-CD1 4.38Å; R184-R210 VanDerWaalsContact CZ-O 3.29Å; R184-R210 PolarHBondContact NH1-O 3.29Å; R184-R210 PolarHBondContact NH2-O 3.17Å; R184-L211 HydrophobicContact CG-CD2 4.11Å; R184-E215 IonicContact CZ-OE1 3.38Å; R184-E215 IonicContact CZ-OE2 3.56Å; R184-E215 IonicContact NE-OE1 2.8Å; R184-E215 PolarHBondContact NE-OE1 2.99Å; R184-E215 IonicContact NE-OE2 3.6Å; R184-E215 VanDerWaalsContact NH2-CD 3.33Å; R184-E215 IonicContact NH2-OE1 3.14Å; R184-E215 PolarHBondContact NH2-OE1 3.31Å; R184-E215 VanDerWaalsContact NH2-OE1 3.14Å; R184-E215 IonicContact NH2-OE2 2.72Å; R184-E215 PolarHBondContact NH2-OE2 3.3Å; R184-E216 CarbonylContact C-O 3.53Å; R184-E216 WeakPolarHBondContact CA-O 3.17Å
185S97.8Very high97.8Very high56 Ų5648.5 Ų48.539%0.39228%0.277SS..THydrogen-bonded Turntrans48.440.2173.1-53.50000113.4E215 E216S185-E215 WeakPolarHBondContact OG-CB 3.36Å; S185-E215 WeakPolarHBondContact OG-CG 3.37Å; S185-E215 PolarHBondContact OG-OE1 3.47Å; S185-E215 VanDerWaalsContact OG-OE1 3.08Å; S185-E216 PolarHBondContact N-O 3.08Å
186G97.1Very high97.6Very high50 Ų5047.7 Ų47.752%0.51527%0.272SS..THydrogen-bonded Turntrans89.6-10.2-179.700000115.6R184R184-G186 PolarHBondContact O-N 2.92Å
187V98.3Very high97.3Very high101 Ų10150.2 Ų50.261%0.61229%0.287SS*.EExtended strand (participates in β ladder)trans-101.2128.8-179.3-176.50000110.3Y183 R184 V189Y183-V187 CarbonylContact C-O 3.51Å; Y183-V187 WeakPolarHBondContact CA-O 3.46Å; R184-V187 PolarHBondContact N-O 3.39Å; R184-V187 PolarHBondContact O-N 3.1Å; V187-V189 PolarHBondContact O-N 2.6Å
188K98.4Very high96.7Very high116 Ų11656.7 Ų56.750%0.50431%0.312SS..EExtended strand (participates in β ladder)trans-68.4124.2172.7-174-179.872174.80110L181 Y183L181-K188 HydrophobicContact CD2-CD 3.65Å; L181-K188 HydrophobicContact CD2-CG 4.44Å; L181-K188 HydrophobicContact CG-CD 4.32Å; Y183-K188 HydrophobicContact CD1-CB 4.25Å; Y183-K188 HydrophobicContact CE1-CB 3.81Å; Y183-K188 HydrophobicContact CE2-CB 4.47Å; Y183-K188 HydrophobicContact CE2-CG 4.45Å
189V98.4Very high96.3Very high55 Ų5560.9 Ų60.933%0.33334%0.338SS..EExtended strand (participates in β ladder)trans-95.8-53.7-177.5-175.70000111.2L182 R184 V187 V207 L209L182-V189 HydrophobicContact CD2-CB 3.86Å; L182-V189 HydrophobicContact CD2-CG1 4.46Å; L182-V189 HydrophobicContact CD2-CG2 3.86Å; L182-V189 PolarHBondContact O-N 3Å; R184-V189 HydrophobicContact CB-CG2 3.6Å; V187-V189 PolarHBondContact O-N 2.6Å; V189-V207 HydrophobicContact CG1-CG2 4.22Å; V189-L209 HydrophobicContact CG1-CD2 4.01Å; V189-L209 HydrophobicContact CG2-CD1 4.47Å
190V98.2Very high96.1Very high37 Ų3762.7 Ų62.722%0.22435%0.348CS..EExtended strand (participates in β ladder)trans-142.7160.4-177.3-72.40000110.9L181 L182 F192L181-V190 WeakPolarHBondContact CA-O 3.25Å; L182-V190 HydrophobicContact CB-CG2 3.74Å; L182-V190 PolarHBondContact N-O 2.82Å; V190-F192 HydrophobicContact CB-CE2 3.76Å; V190-F192 HydrophobicContact CB-CZ 4.02Å; V190-F192 HydrophobicContact CG1-CE2 4.5Å; V190-F192 HydrophobicContact CG1-CZ 4.34Å; V190-F192 HydrophobicContact CG2-CD2 4.43Å; V190-F192 HydrophobicContact CG2-CE2 3.59Å; V190-F192 HydrophobicContact CG2-CZ 4.21Å
191T98.5Very high95.9Very high54 Ų5466.8 Ų66.833%0.33137%0.367SS..EExtended strand (participates in β ladder)trans-143.1129.7175-56.40000108.6C179 V180 L181C179-T191 HydrophobicContact CB-CG2 4.37Å; V180-T191 WeakPolarHBondContact O-CA 3.23Å; L181-T191 HydrophobicContact CD1-CG2 4.25Å; L181-T191 HydrophobicContact CG-CG2 3.92Å
192F98.4Very high95.8Very high75 Ų7569.9 Ų69.933%0.32939%0.386SS..EExtended strand (participates in β ladder)trans-128.5135.9173.6-49.2-88.2000109.6Y170 C179 V180 V190 N203Y170-F192 HydrophobicContact CE1-CD2 4.31Å; Y170-F192 WeakPolarHBondContact OH-CB 3Å; Y170-F192 WeakPolarHBondContact OH-CD2 3.38Å; C179-F192 WeakPolarHBondContact CA-O 3.5Å; V180-F192 PolarHBondContact N-O 2.96Å; V180-F192 PolarHBondContact O-N 2.94Å; V190-F192 HydrophobicContact CB-CE2 3.76Å; V190-F192 HydrophobicContact CB-CZ 4.02Å; V190-F192 HydrophobicContact CG1-CE2 4.5Å; V190-F192 HydrophobicContact CG1-CZ 4.34Å; V190-F192 HydrophobicContact CG2-CD2 4.43Å; V190-F192 HydrophobicContact CG2-CE2 3.59Å; V190-F192 HydrophobicContact CG2-CZ 4.21Å; F192-N203 PolarHBondContact O-ND2 2.81Å
193C98.2Very high95.8Very high68 Ų6870.1 Ų70.146%0.45939%0.387SS..EExtended strand (participates in β ladder)trans-123139.5-174.1-60.20000110.6L178 C179L178-C193 CarbonylContact O-C 3.54Å; L178-C193 VanDerWaalsContact O-CA 3.32Å; L178-C193 WeakPolarHBondContact O-CA 3.38Å; C179-C193 HydrophobicContact CB-CB 4.11Å; C179-C193 WeakPolarHBondContact CB-SG 3.49Å; C179-C193 WeakPolarHBondContact SG-CB 3.39Å; C179-C193 CovalentContact SG-SG 2.04Å; C179-C193 PolarHBondContact SG-SG 2.88Å
194G95.7Very high95.8Very high13 Ų1370.4 Ų70.413%0.13440%0.398CS..EExtended strand (participates in β ladder)trans-122.9127.317100000108.8H174 L178 N203H174-G194 PolarHBondContact CE1-O 2.83Å; L178-G194 PolarHBondContact N-O 2.81Å; L178-G194 PolarHBondContact O-N 3.03Å; G194-N203 PolarHBondContact N-ND2 2.94Å
195H95.4Very high95.7Very high112 Ų11267.4 Ų67.452%0.51939%0.389SS..  trans-107.4127.6176-64.9179.4000108.8N177 Q201 Y224N177-H195 WeakPolarHBondContact OD1-CA 3.38Å; H195-Q201 PolarHBondContact O-OE1 2.88Å; H195-Y224 AromaticContact NE2-CD2 3.86Å; H195-Y224 AromaticContact NE2-CE2 3.55Å
196T92.2Very high95.7Very high17 Ų1766 Ų6610%0.10438%0.384CS..  trans-148.4157.1177.5-171.20000110.3H174 T175 N177 T199H174-T196 WeakPolarHBondContact ND1-CG2 3.41Å; T175-T196 VanDerWaalsContact C-CG2 3.46Å; N177-T196 PolarHBondContact OD1-N 2.88Å; N177-T196 PolarHBondContact OD1-O 2.93Å; T196-T199 WeakPolarHBondContact CG2-O 3.35Å; T196-T199 PolarHBondContact OG1-O 2.79Å; T196-T199 PolarHBondContact OG1-OG1 2.79Å; T196-T199 VanDerWaalsContact OG1-OG1 3.07Å
197S88.9Confident95.8Very high95 Ų9565 Ų6566%0.66437%0.367SS*.SBendtrans-129.2106.8175.1-178.40000108.3T199S197-T199 PolarHBondContact O-N 2.85Å
198K83.7Confident95.8Very high190 Ų19064.6 Ų64.683%0.82636%0.361SS*.SBendtrans69.7-27.7175.9-52.9179.7178.9-179.80116.4T175T175-K198 PolarHBondContact O-N 3.03Å; T175-K198 VanDerWaalsContact O-N 3.09Å
199T91.6Very high95.8Very high88 Ų8859.8 Ų59.854%0.5434%0.341SS..SBendtrans-84.3138.1175.853.80000110.7T196 S197 Q201T196-T199 WeakPolarHBondContact CG2-O 3.35Å; T196-T199 PolarHBondContact OG1-O 2.79Å; T196-T199 PolarHBondContact OG1-OG1 2.79Å; T196-T199 VanDerWaalsContact OG1-OG1 3.07Å; S197-T199 PolarHBondContact O-N 2.85Å; T199-Q201 PolarHBondContact O-N 3.24Å
200N93.9Very high95.8Very high41 Ų4164.2 Ų64.222%0.21935%0.352CS..  trans-71.8129176.9-170.990.9000110.4H174 T175 G229 I230 S233H174-N200 WeakPolarHBondContact O-CA 3.44Å; T175-N200 HydrophobicContact CG2-CB 4Å; N200-G229 WeakPolarHBondContact OD1-CA 3.44Å; N200-I230 HydrophobicContact CB-CB 4.4Å; N200-I230 HydrophobicContact CB-CD1 3.89Å; N200-I230 HydrophobicContact CB-CG1 3.88Å; N200-I230 HydrophobicContact CB-CG2 3.81Å; N200-I230 PolarHBondContact OD1-N 3.32Å; N200-S233 PolarHBondContact ND2-OG 3.27Å
201Q94.7Very high95.8Very high87 Ų8762.4 Ų62.441%0.40734%0.341SS..EExtended strand (participates in β ladder)trans-127.7169.2171.7-68.2-170.6-22.200109.8S173 H174 H195 T199S173-Q201 WeakPolarHBondContact CA-O 3.27Å; H174-Q201 PolarHBondContact CD2-O 3.3Å; H174-Q201 VanDerWaalsContact CD2-O 3.28Å; H174-Q201 PolarHBondContact N-O 3.46Å; H174-Q201 PolarHBondContact O-N 2.84Å; H195-Q201 PolarHBondContact O-OE1 2.88Å; T199-Q201 PolarHBondContact O-N 3.24Å
202V97.1Very high95.8Very high78 Ų7864.6 Ų64.647%0.47335%0.347SS..EExtended strand (participates in β ladder)trans-121.5113.6176.2-178.20000108.4H171 A172H171-V202 HydrophobicContact CB-CG1 3.8Å; A172-V202 CarbonylContact O-C 3.59Å; A172-V202 WeakPolarHBondContact O-CA 3.48Å
203N97.7Very high95.8Very high8 Ų865.8 Ų65.84%0.04336%0.361CS..EExtended strand (participates in β ladder)trans-80.2127.9169.7-179.4-33.6000108.2Y170 H171 A172 L178 F192 G194Y170-N203 WeakPolarHBondContact CE2-O 3.46Å; Y170-N203 WeakPolarHBondContact CE2-OD1 3.45Å; Y170-N203 PolarHBondContact OH-OD1 2.85Å; H171-N203 CarbonylContact C-O 3.41Å; H171-N203 WeakPolarHBondContact CA-O 3.33Å; A172-N203 PolarHBondContact N-O 3.5Å; A172-N203 PolarHBondContact O-N 2.87Å; L178-N203 HydrophobicContact CD2-CB 4.05Å; L178-N203 PolarHBondContact O-ND2 2.9Å; L178-N203 VanDerWaalsContact O-ND2 3.11Å; F192-N203 PolarHBondContact O-ND2 2.81Å; G194-N203 PolarHBondContact N-ND2 2.94Å
204S98.1Very high95.7Very high66 Ų6664.8 Ų64.846%0.46236%0.362SS..EExtended strand (participates in β ladder)trans-124.1152.1176.962.50000111.5Y170Y170-S204 WeakPolarHBondContact O-CA 3.07Å
205G98Very high95.9Very high8 Ų865.8 Ų65.88%0.08236%0.363CS..EExtended strand (participates in β ladder)trans-164.6153.4176.600000110.2V169 Y170V169-G205 WeakPolarHBondContact CA-O 3.38Å; Y170-G205 WeakPolarHBondContact CD1-O 3.46Å; Y170-G205 VanDerWaalsContact CE1-CA 3.49Å; Y170-G205 PolarHBondContact N-O 2.81Å; Y170-G205 PolarHBondContact O-N 3.04Å
206G97.8Very high96Very high27 Ų2763.4 Ų63.428%0.27835%0.352SS..EExtended strand (participates in β ladder)trans-163.5160.3178.200000112.2F168F168-G206 CarbonylContact O-C 3.58Å; F168-G206 WeakPolarHBondContact O-CA 3.47Å
207V98.6Very high96.3Very high28 Ų2862.6 Ų62.617%0.1735%0.347CS..EExtended strand (participates in β ladder)trans-157.4148.6-17765.50000110.9F168 L182 V189 L209F168-V207 PolarHBondContact N-O 3.44Å; F168-V207 PolarHBondContact O-N 3.13Å; L182-V207 HydrophobicContact CD1-CG1 3.71Å; L182-V207 HydrophobicContact CD2-CG1 4.01Å; L182-V207 HydrophobicContact CG-CG1 4.48Å; V189-V207 HydrophobicContact CG1-CG2 4.22Å; V207-L209 HydrophobicContact CG1-CD1 3.95Å; V207-L209 HydrophobicContact CG1-CG 3.94Å; V207-L209 HydrophobicContact CG2-CD2 4.13Å; V207-L209 HydrophobicContact CG2-CG 4.25Å
208L98.7Very high96.8Very high93 Ų9359.7 Ų59.749%0.48732%0.322SS..EExtended strand (participates in β ladder)trans-93.1128.4168.2-72168.5000109.7L165 Y166 Y167 L242L165-L208 HydrophobicContact CD1-CB 4.38Å; L165-L208 HydrophobicContact CD2-CD2 4.38Å; L165-L208 HydrophobicContact CG-CD2 4.48Å; Y166-L208 CarbonylContact O-C 3.54Å; Y166-L208 VanDerWaalsContact O-CA 3.28Å; Y166-L208 WeakPolarHBondContact O-CA 3.23Å; Y167-L208 HydrophobicContact CD2-CD2 3.8Å; Y167-L208 HydrophobicContact CD2-CG 4.08Å; Y167-L208 HydrophobicContact CG-CD2 4.18Å; L208-L242 HydrophobicContact CD2-CD1 3.39Å
209L98.4Very high97.5Very high15 Ų1550.8 Ų50.88%0.07928%0.283CS..EExtended strand (participates in β ladder)trans-134.5127-179.6-66.4175.6000110.6Y166 F168 L182 R184 V189 V207 L211Y166-L209 PolarHBondContact N-O 2.92Å; Y166-L209 PolarHBondContact O-N 3.43Å; F168-L209 HydrophobicContact CD2-CB 4.47Å; F168-L209 HydrophobicContact CD2-CD1 4.15Å; F168-L209 HydrophobicContact CE2-CB 4.37Å; F168-L209 HydrophobicContact CE2-CD1 4.36Å; L182-L209 HydrophobicContact CD2-CD1 3.9Å; R184-L209 HydrophobicContact CB-CD1 4.38Å; V189-L209 HydrophobicContact CG1-CD2 4.01Å; V189-L209 HydrophobicContact CG2-CD1 4.47Å; V207-L209 HydrophobicContact CG1-CD1 3.95Å; V207-L209 HydrophobicContact CG1-CG 3.94Å; V207-L209 HydrophobicContact CG2-CD2 4.13Å; V207-L209 HydrophobicContact CG2-CG 4.25Å; L209-L211 HydrophobicContact CB-CD2 3.96Å; L209-L211 HydrophobicContact CB-CG 4.36Å
210R98.4Very high97.9Very high148 Ų14847 Ų4756%0.55826%0.26SS*.EExtended strand (participates in β ladder)trans-83.7115.5167.7-168177.1-171.4168.33.9109G164 L165 R184 D245G164-R210 CarbonylContact O-C 3.58Å; G164-R210 VanDerWaalsContact O-CA 3.29Å; G164-R210 WeakPolarHBondContact O-CA 3.36Å; L165-R210 HydrophobicContact CD1-CB 4.12Å; R184-R210 VanDerWaalsContact CZ-O 3.29Å; R184-R210 PolarHBondContact NH1-O 3.29Å; R184-R210 PolarHBondContact NH2-O 3.17Å; R210-D245 IonicContact CZ-OD1 2.68Å; R210-D245 IonicContact NE-OD1 2.73Å; R210-D245 PolarHBondContact NE-OD1 3.07Å; R210-D245 IonicContact NE-OD2 3.09Å; R210-D245 PolarHBondContact NE-OD2 2.93Å; R210-D245 VanDerWaalsContact NH2-CG 3.34Å; R210-D245 IonicContact NH2-OD1 2.73Å; R210-D245 PolarHBondContact NH2-OD1 2.87Å; R210-D245 IonicContact NH2-OD2 3.49Å
211L98.4Very high98.1Very high0 Ų045.2 Ų45.20%025%0.251CS..EExtended strand (participates in β ladder)trans-109.4149.5-174.6-59.1-175.7000111.7F158 C160 P163 G164 Y166 F168 R184 L209 E215 V217F158-L211 HydrophobicContact CD1-CD1 4.31Å; F158-L211 HydrophobicContact CE1-CD1 3.66Å; C160-L211 HydrophobicContact CB-CB 4.14Å; C160-L211 HydrophobicContact CB-CD1 4.23Å; P163-L211 WeakPolarHBondContact CA-O 3.36Å; G164-L211 PolarHBondContact N-O 3.32Å; G164-L211 PolarHBondContact O-N 2.04Å; Y166-L211 HydrophobicContact CD2-CB 4.06Å; Y166-L211 HydrophobicContact CD2-CD1 3.89Å; Y166-L211 HydrophobicContact CD2-CG 4.02Å; Y166-L211 HydrophobicContact CE2-CB 4.29Å; Y166-L211 HydrophobicContact CE2-CD1 4.35Å; Y166-L211 HydrophobicContact CG-CD1 4.14Å; F168-L211 HydrophobicContact CE2-CD1 3.77Å; F168-L211 HydrophobicContact CZ-CD1 3.71Å; R184-L211 HydrophobicContact CG-CD2 4.11Å; L209-L211 HydrophobicContact CB-CD2 3.96Å; L209-L211 HydrophobicContact CB-CG 4.36Å; L211-E215 WeakPolarHBondContact CA-OE2 3.44Å; L211-E215 HydrophobicContact CD2-CB 4.48Å; L211-V217 HydrophobicContact CD1-CG2 3.83Å; L211-V217 HydrophobicContact CD2-CG2 4.13Å
212Q98.1Very high98.3Very high99 Ų9943 Ų4346%0.46324%0.242SC..  trans-103.4160.1169-60.4-60-64.900110.5C160 G214 E215 D245C160-Q212 WeakPolarHBondContact CB-O 3.47Å; C160-Q212 PolarHBondContact SG-O 3.11Å; Q212-G214 PolarHBondContact O-N 2.71Å; Q212-E215 HydrophobicContact CB-CG 4.29Å; Q212-E215 PolarHBondContact N-OE2 2.84Å; Q212-E215 WeakPolarHBondContact O-CB 3.41Å; Q212-E215 WeakPolarHBondContact O-CG 3.48Å; Q212-E215 PolarHBondContact O-N 3.45Å; Q212-E215 VanDerWaalsContact O-N 3.1Å; Q212-D245 PolarHBondContact NE2-OD2 3.44Å
213V97.5Very high98.3Very high100 Ų10044.7 Ų44.761%0.60625%0.248SC*.THydrogen-bonded Turntrans-55.7131.5179.6179.60000110.7P163 E215P163-V213 HydrophobicContact CB-CG2 4.23Å; P163-V213 HydrophobicContact CG-CG2 4.04Å; V213-E215 VanDerWaalsContact C-N 3.32Å
214G97.4Very high98.3Very high47 Ų4749 Ų4949%0.48527%0.265SS..THydrogen-bonded Turntrans85.4-7.218000000115.1C160 Q212C160-G214 PolarHBondContact O-N 2.87Å; Q212-G214 PolarHBondContact O-N 2.71Å
215E98.6Very high98.3Very high34 Ų3450.2 Ų50.216%0.15926%0.26CS..  trans-66.4139.1171.9-70.5-161.689.700111.5C160 R184 S185 L211 Q212 V213C160-E215 PolarHBondContact N-O 2.74Å; R184-E215 IonicContact CZ-OE1 3.38Å; R184-E215 IonicContact CZ-OE2 3.56Å; R184-E215 IonicContact NE-OE1 2.8Å; R184-E215 PolarHBondContact NE-OE1 2.99Å; R184-E215 IonicContact NE-OE2 3.6Å; R184-E215 VanDerWaalsContact NH2-CD 3.33Å; R184-E215 IonicContact NH2-OE1 3.14Å; R184-E215 PolarHBondContact NH2-OE1 3.31Å; R184-E215 VanDerWaalsContact NH2-OE1 3.14Å; R184-E215 IonicContact NH2-OE2 2.72Å; R184-E215 PolarHBondContact NH2-OE2 3.3Å; S185-E215 WeakPolarHBondContact OG-CB 3.36Å; S185-E215 WeakPolarHBondContact OG-CG 3.37Å; S185-E215 PolarHBondContact OG-OE1 3.47Å; S185-E215 VanDerWaalsContact OG-OE1 3.08Å; L211-E215 WeakPolarHBondContact CA-OE2 3.44Å; L211-E215 HydrophobicContact CD2-CB 4.48Å; Q212-E215 HydrophobicContact CB-CG 4.29Å; Q212-E215 PolarHBondContact N-OE2 2.84Å; Q212-E215 WeakPolarHBondContact O-CB 3.41Å; Q212-E215 WeakPolarHBondContact O-CG 3.48Å; Q212-E215 PolarHBondContact O-N 3.45Å; Q212-E215 VanDerWaalsContact O-N 3.1Å; V213-E215 VanDerWaalsContact C-N 3.32Å
216E98.7Very high98.2Very high63 Ų6350.7 Ų50.729%0.29426%0.261SS..EExtended strand (participates in β ladder)trans-103.4141.7-178.6-65.7-176.5141.300111.3K157 F158 R184 S185 W218K157-E216 HydrophobicContact CD-CB 4.5Å; K157-E216 HydrophobicContact CD-CG 4.41Å; K157-E216 WeakPolarHBondContact CD-OE1 3.44Å; K157-E216 VanDerWaalsContact NZ-CD 3.3Å; K157-E216 IonicContact NZ-OE1 3.18Å; K157-E216 PolarHBondContact NZ-OE1 2.96Å; K157-E216 IonicContact NZ-OE2 2.68Å; K157-E216 PolarHBondContact NZ-OE2 2.81Å; F158-E216 CarbonylContact O-C 3.51Å; F158-E216 WeakPolarHBondContact O-CA 3.46Å; R184-E216 CarbonylContact C-O 3.53Å; R184-E216 WeakPolarHBondContact CA-O 3.17Å; S185-E216 PolarHBondContact N-O 3.08Å; E216-W218 HydrophobicContact CB-CE3 4.08Å; E216-W218 HydrophobicContact CB-CZ3 3.89Å
217V98.9Very high98.1Very high0 Ų049.7 Ų49.70%025%0.249CC..EExtended strand (participates in β ladder)trans-129.3134.6171.8178.10000109.9F158 F168 L182 Y183 L211 F237F158-V217 HydrophobicContact CB-CB 4.34Å; F158-V217 WeakPolarHBondContact CB-O 3.31Å; F158-V217 HydrophobicContact CD1-CB 4.07Å; F158-V217 HydrophobicContact CD1-CG2 4.3Å; F158-V217 PolarHBondContact N-O 2.86Å; F158-V217 PolarHBondContact O-N 3.41Å; F168-V217 HydrophobicContact CD1-CG1 4Å; F168-V217 HydrophobicContact CD2-CG1 4.27Å; F168-V217 HydrophobicContact CE1-CB 4.1Å; F168-V217 HydrophobicContact CE1-CG1 3.94Å; F168-V217 HydrophobicContact CE1-CG2 4.45Å; F168-V217 HydrophobicContact CE2-CB 4.42Å; F168-V217 HydrophobicContact CE2-CG1 4.23Å; F168-V217 HydrophobicContact CE2-CG2 3.96Å; F168-V217 HydrophobicContact CG-CG1 4.17Å; F168-V217 HydrophobicContact CZ-CB 3.99Å; F168-V217 HydrophobicContact CZ-CG1 4.07Å; F168-V217 HydrophobicContact CZ-CG2 3.83Å; L182-V217 HydrophobicContact CD1-CG1 4.44Å; L182-V217 HydrophobicContact CD2-CG1 4.09Å; L182-V217 HydrophobicContact CG-CG1 4.23Å; Y183-V217 VanDerWaalsContact O-CA 3.31Å; Y183-V217 WeakPolarHBondContact O-CA 3.25Å; L211-V217 HydrophobicContact CD1-CG2 3.83Å; L211-V217 HydrophobicContact CD2-CG2 4.13Å; V217-F237 HydrophobicContact CG1-CZ 4.48Å
218W98.8Very high97.6Very high34 Ų3450.5 Ų50.513%0.12925%0.254CS..EExtended strand (participates in β ladder)trans-152.3166.8176.968.693.1000112.2L137 K157 Y183 E216L137-W218 HydrophobicContact CD1-CB 3.86Å; L137-W218 VanDerWaalsContact CD1-CD1 3.47Å; L137-W218 HydrophobicContact CD1-CD2 4.35Å; L137-W218 HydrophobicContact CD1-CG 3.63Å; L137-W218 HydrophobicContact CG-CB 4.34Å; L137-W218 HydrophobicContact CG-CG 4.23Å; K157-W218 HydrophobicContact CD-CE3 4.35Å; K157-W218 HydrophobicContact CG-CB 4.11Å; Y183-W218 AromaticContact CD1-CZ2 3.89Å; Y183-W218 HydrophobicContact CD1-CZ2 3.89Å; Y183-W218 AromaticContact CD2-NE1 3.75Å; Y183-W218 AromaticContact CG-CE2 3.72Å; Y183-W218 AromaticContact CG-CZ2 3.78Å; Y183-W218 HydrophobicContact CG-CZ2 3.78Å; Y183-W218 AromaticContact CG-NE1 3.7Å; Y183-W218 PolarHBondContact N-O 2.9Å; Y183-W218 PolarHBondContact O-N 2.79Å; E216-W218 HydrophobicContact CB-CE3 4.08Å; E216-W218 HydrophobicContact CB-CZ3 3.89Å
219L98.8Very high96.7Very high2 Ų247 Ų471%0.0124%0.24CC..EExtended strand (participates in β ladder)trans-105.7148.6173-57.4-178.1000110.6I138 F140 Y170 V180 L181 L182 F237I138-L219 HydrophobicContact CB-CB 4.29Å; I138-L219 HydrophobicContact CD1-CB 3.89Å; I138-L219 PolarHBondContact N-O 3.14Å; F140-L219 HydrophobicContact CE2-CB 4.45Å; F140-L219 HydrophobicContact CE2-CD1 3.89Å; F140-L219 HydrophobicContact CZ-CD1 3.93Å; Y170-L219 HydrophobicContact CD1-CD1 3.86Å; Y170-L219 HydrophobicContact CD1-CD2 4.07Å; Y170-L219 HydrophobicContact CG-CD1 3.78Å; V180-L219 HydrophobicContact CG1-CB 4.08Å; V180-L219 HydrophobicContact CG1-CD1 4.08Å; V180-L219 HydrophobicContact CG1-CD2 4.08Å; V180-L219 HydrophobicContact CG1-CG 4.31Å; L181-L219 CarbonylContact O-C 3.55Å; L181-L219 VanDerWaalsContact O-CA 3.29Å; L181-L219 WeakPolarHBondContact O-CA 3.39Å; L182-L219 HydrophobicContact CB-CD2 3.8Å; L182-L219 HydrophobicContact CD1-CD2 3.95Å; L182-L219 HydrophobicContact CG-CD2 3.93Å; L219-F237 HydrophobicContact CD1-CB 4.12Å; L219-F237 HydrophobicContact CD1-CD1 4.2Å; L219-F237 HydrophobicContact CD1-CD2 3.72Å; L219-F237 HydrophobicContact CD1-CE2 4.14Å; L219-F237 HydrophobicContact CD1-CG 3.77Å; L219-F237 HydrophobicContact CD2-CE2 4.31Å; L219-F237 HydrophobicContact CD2-CZ 4.48Å; L219-F237 HydrophobicContact CG-CD1 4.34Å; L219-F237 HydrophobicContact CG-CD2 4.25Å; L219-F237 HydrophobicContact CG-CE1 4.28Å; L219-F237 HydrophobicContact CG-CE2 4.19Å; L219-F237 HydrophobicContact CG-CG 4.33Å; L219-F237 HydrophobicContact CG-CZ 4.21Å
220A98.8Very high96Very high8 Ų850.9 Ų50.97%0.06626%0.26CS..EExtended strand (participates in β ladder)trans-140.5163.7176.400000110.7S136 V180 L181 Y183S136-A220 CarbonylContact O-C 3.55Å; S136-A220 VanDerWaalsContact O-CA 3.23Å; S136-A220 WeakPolarHBondContact O-CA 3.29Å; S136-A220 WeakPolarHBondContact O-CB 3.34Å; V180-A220 WeakPolarHBondContact CA-O 3.44Å; L181-A220 HydrophobicContact CB-CB 4.46Å; L181-A220 PolarHBondContact N-O 3.11Å; L181-A220 PolarHBondContact O-N 2.83Å; Y183-A220 HydrophobicContact CD2-CB 4.13Å; Y183-A220 HydrophobicContact CE2-CB 3.93Å
221V98.7Very high95.3Very high4 Ų453.4 Ų53.42%0.02428%0.278CS..EExtended strand (participates in β ladder)trans-110.1159.1170.3-67.30000110.5P132 A133 N135 S136 I138 L178 C179P132-V221 HydrophobicContact CB-CG2 4.01Å; P132-V221 HydrophobicContact CG-CG1 4.34Å; A133-V221 VanDerWaalsContact O-CG2 3.25Å; A133-V221 WeakPolarHBondContact O-CG2 3.29Å; N135-V221 VanDerWaalsContact CA-O 3.24Å; N135-V221 WeakPolarHBondContact CA-O 3.11Å; S136-V221 PolarHBondContact N-O 2.94Å; S136-V221 PolarHBondContact O-N 2.85Å; I138-V221 HydrophobicContact CD1-CG1 3.7Å; I138-V221 HydrophobicContact CG1-CG1 3.75Å; L178-V221 HydrophobicContact CD1-CG1 3.78Å; C179-V221 WeakPolarHBondContact O-CA 3.32Å
222N98.1Very high94.6Very high42 Ų4257 Ų5723%0.22532%0.315CS..EExtended strand (participates in β ladder)trans-102.6-146166.363.82.5000109.7N135 C179 L181 Y224N135-N222 PolarHBondContact N-O 3.4Å; N135-N222 WeakPolarHBondContact OD1-CA 3.27Å; C179-N222 WeakPolarHBondContact CB-OD1 3.36Å; L181-N222 HydrophobicContact CD1-CB 4.09Å; N222-Y224 PolarHBondContact O-N 2.99Å; N222-Y224 WeakPolarHBondContact OD1-CA 3.48Å; N222-Y224 WeakPolarHBondContact OD1-CB 3.25Å; N222-Y224 PolarHBondContact OD1-N 2.94Å; N222-Y224 PolarHBondContact OD1-O 3.29Å
223D97.8Very high94Very high112 Ų11253.5 Ų53.560%0.59930%0.301SS*.EExtended strand (participates in β ladder)trans-66.2-14.1173.9-56.6-49000113.7N135 Y225N135-D223 PolarHBondContact ND2-OD1 2.92Å; D223-Y225 VanDerWaalsContact O-CD1 3.31Å; D223-Y225 WeakPolarHBondContact O-CD1 3.49Å
224Y97.6Very high93.8Very high99 Ų9954.3 Ų54.339%0.38830%0.302SS..EExtended strand (participates in β ladder)trans-100.893.9169.1-61.6-21.2000108.8N177 L178 C179 H195 N222N177-Y224 HydrophobicContact CB-CD1 3.88Å; N177-Y224 HydrophobicContact CB-CD2 4.17Å; N177-Y224 HydrophobicContact CB-CE1 4.42Å; N177-Y224 HydrophobicContact CB-CG 3.76Å; N177-Y224 CarbonylContact O-C 3.56Å; L178-Y224 WeakPolarHBondContact CA-O 3.32Å; C179-Y224 PolarHBondContact N-O 3.34Å; H195-Y224 AromaticContact NE2-CD2 3.86Å; H195-Y224 AromaticContact NE2-CE2 3.55Å; N222-Y224 PolarHBondContact O-N 2.99Å; N222-Y224 WeakPolarHBondContact OD1-CA 3.48Å; N222-Y224 WeakPolarHBondContact OD1-CB 3.25Å; N222-Y224 PolarHBondContact OD1-N 2.94Å; N222-Y224 PolarHBondContact OD1-O 3.29Å
225Y97.9Very high93.8Very high91 Ų9152.4 Ų52.436%0.35728%0.282SS..EExtended strand (participates in β ladder)trans-120.26.8-164.963.6-88.2000114.5P131 P132 P134 N177 D223 M227P131-Y225 HydrophobicContact CB-CD2 3.98Å; P131-Y225 HydrophobicContact CB-CE2 4.24Å; P131-Y225 HydrophobicContact CG-CD2 4.18Å; P131-Y225 HydrophobicContact CG-CE2 3.93Å; P132-Y225 WeakPolarHBondContact CD-O 3.44Å; P132-Y225 WeakPolarHBondContact O-CD2 3.35Å; P134-Y225 HydrophobicContact CB-CD1 4.02Å; P134-Y225 HydrophobicContact CB-CE1 4.37Å; P134-Y225 HydrophobicContact CG-CD1 3.77Å; P134-Y225 HydrophobicContact CG-CE1 3.7Å; P134-Y225 HydrophobicContact CG-CE2 4.48Å; P134-Y225 HydrophobicContact CG-CG 4.22Å; N177-Y225 PolarHBondContact O-N 2.9Å; D223-Y225 VanDerWaalsContact O-CD1 3.31Å; D223-Y225 WeakPolarHBondContact O-CD1 3.49Å; Y225-M227 PolarHBondContact O-N 2.96Å
226D96.4Very high93.8Very high19 Ų1952.4 Ų52.410%0.10228%0.284CS..  trans-66.5127.6-175.6-179.553.8000112H174 T175 A176 N177 L178 V228H174-D226 WeakPolarHBondContact CB-O 3.39Å; T175-D226 PolarHBondContact N-OD2 2.79Å; A176-D226 HydrophobicContact CB-CB 3.78Å; A176-D226 PolarHBondContact N-OD2 2.71Å; N177-D226 PolarHBondContact O-N 3.2Å; L178-D226 VanDerWaalsContact CB-O 3.32Å; L178-D226 WeakPolarHBondContact CB-O 3.32Å; L178-D226 VanDerWaalsContact CD1-O 3.29Å; L178-D226 WeakPolarHBondContact CD1-O 3.38Å; L178-D226 WeakPolarHBondContact CD2-O 3.34Å; L178-D226 WeakPolarHBondContact CG-O 3.43Å; D226-V228 WeakPolarHBondContact OD1-CB 3.04Å; D226-V228 WeakPolarHBondContact OD1-CG2 3.46Å; D226-V228 PolarHBondContact OD1-N 3.09Å
227M95.8Very high93.8Very high6 Ų649.4 Ų49.43%0.0327%0.27CS..  trans-135.931.1171.7-63.2-175.467.600110.4P132 I138 A172 S173 L178 Y225 G229P132-M227 HydrophobicContact CG-CG 4.15Å; P132-M227 HydrophobicContact CG-SD 3.53Å; P132-M227 VanDerWaalsContact CG-SD 3.53Å; I138-M227 HydrophobicContact CB-SD 4.47Å; I138-M227 HydrophobicContact CD1-SD 3.87Å; I138-M227 HydrophobicContact CG1-SD 3.94Å; I138-M227 HydrophobicContact CG2-CE 3.9Å; I138-M227 HydrophobicContact CG2-SD 3.63Å; A172-M227 HydrophobicContact CB-CE 3.96Å; S173-M227 CarbonylContact O-C 3.42Å; S173-M227 WeakPolarHBondContact O-CA 3.47Å; L178-M227 HydrophobicContact CD1-CG 3.91Å; L178-M227 HydrophobicContact CD2-CG 4.07Å; Y225-M227 PolarHBondContact O-N 2.96Å; M227-G229 PolarHBondContact O-N 3.46Å
228V88.8Confident93.8Very high44 Ų4450.4 Ų50.427%0.26728%0.277SS..  trans-89.391.2176.8-173.40000107.9H129 P131 T175 D226H129-V228 WeakPolarHBondContact O-CG2 3.36Å; P131-V228 HydrophobicContact CB-CG2 4.12Å; P131-V228 HydrophobicContact CG-CG2 4.22Å; T175-V228 VanDerWaalsContact CG2-O 3.24Å; T175-V228 WeakPolarHBondContact CG2-O 3.45Å; T175-V228 PolarHBondContact OG1-O 2.68Å; D226-V228 WeakPolarHBondContact OD1-CB 3.04Å; D226-V228 WeakPolarHBondContact OD1-CG2 3.46Å; D226-V228 PolarHBondContact OD1-N 3.09Å
229G78.2Confident93.8Very high20 Ų2048.8 Ų48.821%0.20627%0.27CS..PPolyproline II helixtrans-71.9157171.600000112.4N200 M227N200-G229 WeakPolarHBondContact OD1-CA 3.44Å; M227-G229 PolarHBondContact O-N 3.46Å
230I84.1Confident93.8Very high97 Ų9752.1 Ų52.150%0.49729%0.285SS..PPolyproline II helixtrans-68.1164.9167.162.3175000110.9T175 N200 G232 S233T175-I230 HydrophobicContact CG2-CG2 4.03Å; N200-I230 HydrophobicContact CB-CB 4.4Å; N200-I230 HydrophobicContact CB-CD1 3.89Å; N200-I230 HydrophobicContact CB-CG1 3.88Å; N200-I230 HydrophobicContact CB-CG2 3.81Å; N200-I230 PolarHBondContact OD1-N 3.32Å; I230-G232 PolarHBondContact O-N 2.71Å; I230-G232 VanDerWaalsContact O-N 3.17Å; I230-S233 WeakPolarHBondContact O-CB 3.24Å; I230-S233 PolarHBondContact O-N 3.39Å
231Q84Confident93.7Very high201 Ų20152.9 Ų52.994%0.93929%0.288SS*.THydrogen-bonded Turntrans-53.9124173-170.5177.921.100110.5
232G83.8Confident93.5Very high74 Ų7455.9 Ų55.976%0.76330%0.303SS*.THydrogen-bonded Turntrans86.64.2-17600000115.2I230I230-G232 PolarHBondContact O-N 2.71Å; I230-G232 VanDerWaalsContact O-N 3.17Å
233S84.9Confident93.3Very high26 Ų2659.6 Ų59.618%0.18232%0.318CS..  trans-115.198.4174.4-154.90000110.8S173 N200 I230S173-S233 WeakPolarHBondContact CB-O 3.37Å; S173-S233 WeakPolarHBondContact CB-OG 3.46Å; S173-S233 PolarHBondContact OG-OG 3.24Å; N200-S233 PolarHBondContact ND2-OG 3.27Å; I230-S233 WeakPolarHBondContact O-CB 3.24Å; I230-S233 PolarHBondContact O-N 3.39Å
234D93.6Very high93Very high117 Ų11758 Ų5863%0.62631%0.313SS*.  trans-96.2158.5-174.4-59.8-60.5000113S173S173-D234 PolarHBondContact OG-O 2.85Å; S173-D234 VanDerWaalsContact OG-O 3.09Å
235S97.6Very high92.7Very high7 Ų758.5 Ų58.55%0.04932%0.323CS..EExtended strand (participates in β ladder)trans-105.1128.8171.1-64.50000111T125 R126 H171 A172 S173T125-S235 VanDerWaalsContact CA-O 3.25Å; T125-S235 WeakPolarHBondContact CA-O 3.38Å; R126-S235 PolarHBondContact N-O 3.28Å; H171-S235 CarbonylContact O-C 3.59Å; H171-S235 WeakPolarHBondContact O-CA 3.33Å; A172-S235 WeakPolarHBondContact CA-OG 3.37Å; S173-S235 PolarHBondContact N-OG 3.36Å; S173-S235 VanDerWaalsContact N-OG 3.08Å
236V98.3Very high92.4Very high34 Ų3456.9 Ų56.921%0.20632%0.321CS..EExtended strand (participates in β ladder)trans-128.9144.8-175.463.90000111.7T123 V124 T125 Y170 H171T123-V236 HydrophobicContact CG2-CG2 3.38Å; V124-V236 WeakPolarHBondContact O-CA 3.26Å; T125-V236 HydrophobicContact CG2-CB 4.17Å; T125-V236 HydrophobicContact CG2-CG2 4.1Å; Y170-V236 VanDerWaalsContact CA-O 3.25Å; Y170-V236 WeakPolarHBondContact CA-O 3.5Å; Y170-V236 WeakPolarHBondContact CB-O 3.35Å; H171-V236 HydrophobicContact CB-CG1 3.84Å; H171-V236 PolarHBondContact N-O 3.17Å; H171-V236 PolarHBondContact O-N 2.89Å
237F98.8Very high92.2Very high1 Ų158.9 Ų58.90%0.00433%0.333CS..EExtended strand (participates in β ladder)trans-132.1128.9170.9176.6-140000109.7F122 T123 V124 F140 Y151 F168 V169 V217 L219F122-F237 AromaticContact CE2-CD1 3.71Å; F122-F237 HydrophobicContact CE2-CD1 3.71Å; F122-F237 AromaticContact CE2-CE1 3.81Å; F122-F237 HydrophobicContact CE2-CE1 3.81Å; F122-F237 HydrophobicContact CE2-CG 4.11Å; F122-F237 HydrophobicContact CE2-CZ 4.31Å; F122-F237 HydrophobicContact CZ-CD1 4.1Å; F122-F237 AromaticContact CZ-CE1 3.71Å; F122-F237 HydrophobicContact CZ-CE1 3.71Å; F122-F237 HydrophobicContact CZ-CE2 4.4Å; F122-F237 AromaticContact CZ-CZ 3.88Å; F122-F237 HydrophobicContact CZ-CZ 3.88Å; T123-F237 WeakPolarHBondContact CA-O 3.34Å; V124-F237 HydrophobicContact CG2-CB 4.12Å; V124-F237 HydrophobicContact CG2-CD1 4.34Å; V124-F237 WeakPolarHBondContact CG2-O 3.37Å; V124-F237 PolarHBondContact N-O 3.18Å; V124-F237 PolarHBondContact O-N 3.33Å; F140-F237 HydrophobicContact CD1-CB 4Å; F140-F237 HydrophobicContact CD2-CB 4.05Å; F140-F237 HydrophobicContact CD2-CD1 4.28Å; F140-F237 HydrophobicContact CE1-CB 3.68Å; F140-F237 HydrophobicContact CE2-CB 3.73Å; F140-F237 HydrophobicContact CE2-CD1 4.22Å; F140-F237 HydrophobicContact CE2-CG 4.27Å; F140-F237 HydrophobicContact CG-CB 4.2Å; F140-F237 HydrophobicContact CZ-CB 3.54Å; F140-F237 HydrophobicContact CZ-CG 4.45Å; Y151-F237 HydrophobicContact CD2-CD1 4.25Å; Y151-F237 HydrophobicContact CD2-CE1 4.21Å; Y151-F237 AromaticContact CE2-CD1 3.82Å; Y151-F237 HydrophobicContact CE2-CD1 3.82Å; Y151-F237 AromaticContact CE2-CE1 3.98Å; Y151-F237 HydrophobicContact CE2-CE1 3.98Å; F168-F237 HydrophobicContact CB-CE2 4.15Å; F168-F237 HydrophobicContact CD1-CE2 4.04Å; F168-F237 AromaticContact CD1-CZ 3.79Å; F168-F237 HydrophobicContact CD1-CZ 3.79Å; V169-F237 WeakPolarHBondContact O-CD2 3.42Å; V217-F237 HydrophobicContact CG1-CZ 4.48Å; L219-F237 HydrophobicContact CD1-CB 4.12Å; L219-F237 HydrophobicContact CD1-CD1 4.2Å; L219-F237 HydrophobicContact CD1-CD2 3.72Å; L219-F237 HydrophobicContact CD1-CE2 4.14Å; L219-F237 HydrophobicContact CD1-CG 3.77Å; L219-F237 HydrophobicContact CD2-CE2 4.31Å; L219-F237 HydrophobicContact CD2-CZ 4.48Å; L219-F237 HydrophobicContact CG-CD1 4.34Å; L219-F237 HydrophobicContact CG-CD2 4.25Å; L219-F237 HydrophobicContact CG-CE1 4.28Å; L219-F237 HydrophobicContact CG-CE2 4.19Å; L219-F237 HydrophobicContact CG-CG 4.33Å; L219-F237 HydrophobicContact CG-CZ 4.21Å
238S98.8Very high92Very high20 Ų2061.8 Ų61.814%0.1435%0.35CS..EExtended strand (participates in β ladder)trans-127.2148.5-179.2-64.50000111F122 T123 F168 V169F122-S238 VanDerWaalsContact O-CA 3.23Å; F122-S238 WeakPolarHBondContact O-CA 3.18Å; T123-S238 WeakPolarHBondContact CB-OG 3.34Å; T123-S238 WeakPolarHBondContact CG2-OG 3.28Å; T123-S238 PolarHBondContact OG1-OG 2.68Å; F168-S238 WeakPolarHBondContact CA-O 3.48Å; V169-S238 PolarHBondContact N-O 2.91Å; V169-S238 PolarHBondContact O-N 3.04Å
239G98.7Very high92.2Very high0 Ų062.9 Ų62.90%036%0.355CS..EExtended strand (participates in β ladder)trans-151.1143.617100000111.3V121 F122 Y167V121-G239 CarbonylContact C-O 3.51Å; V121-G239 WeakPolarHBondContact CA-O 3.32Å; F122-G239 WeakPolarHBondContact CD1-O 3.5Å; F122-G239 VanDerWaalsContact CE1-CA 3.4Å; F122-G239 PolarHBondContact N-O 2.99Å; F122-G239 PolarHBondContact O-N 3.16Å; Y167-G239 WeakPolarHBondContact O-CA 3.39Å
240F98.2Very high93.1Very high72 Ų7265.6 Ų65.632%0.31636%0.364SS..EExtended strand (participates in β ladder)trans-152.5147.8178.252-89.5000112.9S120 V121 Y166 Y167 L242S120-F240 CarbonylContact O-C 3.44Å; S120-F240 VanDerWaalsContact O-CA 3.23Å; S120-F240 WeakPolarHBondContact O-CA 3.37Å; V121-F240 HydrophobicContact CB-CB 4.13Å; V121-F240 HydrophobicContact CG2-CB 4.06Å; Y166-F240 WeakPolarHBondContact CA-O 3.33Å; Y167-F240 AromaticContact CD1-CE1 3.66Å; Y167-F240 HydrophobicContact CD1-CE1 3.66Å; Y167-F240 HydrophobicContact CD1-CE2 4.28Å; Y167-F240 AromaticContact CD1-CZ 3.45Å; Y167-F240 HydrophobicContact CD1-CZ 3.45Å; Y167-F240 VanDerWaalsContact CD1-CZ 3.45Å; Y167-F240 HydrophobicContact CE1-CE1 4.48Å; Y167-F240 HydrophobicContact CE1-CZ 4.35Å; Y167-F240 HydrophobicContact CG-CZ 4.22Å; Y167-F240 PolarHBondContact N-O 2.78Å; Y167-F240 PolarHBondContact O-N 3.09Å; F240-L242 HydrophobicContact CD2-CD2 3.88Å; F240-L242 HydrophobicContact CD2-CG 4.28Å; F240-L242 HydrophobicContact CE2-CD2 3.56Å; F240-L242 HydrophobicContact CE2-CG 4.22Å
241L97.4Very high93.7Very high24 Ų2463.5 Ų63.513%0.12636%0.355CS..EExtended strand (participates in β ladder)trans-75.5127.2174.9177.863.5000110.1S120 V162 Y166 P244S120-L241 PolarHBondContact O-N 3.49Å; V162-L241 HydrophobicContact CB-CD2 3.9Å; V162-L241 HydrophobicContact CG1-CD2 3.48Å; V162-L241 VanDerWaalsContact CG1-CD2 3.48Å; Y166-L241 HydrophobicContact CD1-CB 4.16Å; Y166-L241 HydrophobicContact CD2-CD1 3.96Å; Y166-L241 HydrophobicContact CE1-CB 3.71Å; Y166-L241 HydrophobicContact CE1-CD1 4.45Å; Y166-L241 HydrophobicContact CE2-CB 4.39Å; Y166-L241 HydrophobicContact CE2-CD1 3.61Å; L241-P244 HydrophobicContact CD2-CB 4.22Å; L241-P244 HydrophobicContact CD2-CG 3.82Å; L241-P244 HydrophobicContact CG-CG 4.27Å
242L94.8Very high94.4Very high67 Ų6753.6 Ų53.635%0.35131%0.313SS..EExtended strand (participates in β ladder)trans-97.2-53176.3-69.5172.9000111.8L165 L208 F240L165-L242 HydrophobicContact CD2-CD1 4.4Å; L165-L242 WeakPolarHBondContact O-CB 3.24Å; L165-L242 PolarHBondContact O-N 3.4Å; L208-L242 HydrophobicContact CD2-CD1 3.39Å; F240-L242 HydrophobicContact CD2-CD2 3.88Å; F240-L242 HydrophobicContact CD2-CG 4.28Å; F240-L242 HydrophobicContact CE2-CD2 3.56Å; F240-L242 HydrophobicContact CE2-CG 4.22Å
243F93.2Very high95.2Very high121 Ų12152.1 Ų52.153%0.53128%0.279SS..EExtended strand (participates in β ladder)trans-131.3101.9-176.1-52.3-59.6000109G164 L165G164-F243 CarbonylContact C-O 3.48Å; G164-F243 WeakPolarHBondContact CA-O 3.39Å; L165-F243 HydrophobicContact CB-CB 4.22Å; L165-F243 HydrophobicContact CB-CD2 4.03Å; L165-F243 HydrophobicContact CD2-CD2 3.54Å; L165-F243 HydrophobicContact CD2-CE2 3.86Å; L165-F243 HydrophobicContact CG-CD2 4.38Å; L165-F243 PolarHBondContact N-O 3.35Å; L165-F243 PolarHBondContact O-N 2.72Å
244P92.6Very high96Very high77 Ų7754.3 Ų54.350%0.529%0.287SS..EExtended strand (participates in β ladder)trans-56143169.4-18.128.7000110.8V162 L241V162-P244 HydrophobicContact CG1-CB 4.43Å; L241-P244 HydrophobicContact CD2-CB 4.22Å; L241-P244 HydrophobicContact CD2-CG 3.82Å; L241-P244 HydrophobicContact CG-CG 4.27Å
245D90.2Very high96.2Very high111 Ų11148.5 Ų48.559%0.59426%0.256SS*.  trans-69.30174.7-79.7-11.1000113.1P163 G164 R210 Q212P163-D245 HydrophobicContact CB-CB 4.09Å; P163-D245 HydrophobicContact CG-CB 4.18Å; P163-D245 PolarHBondContact O-N 2.79Å; G164-D245 WeakPolarHBondContact CA-OD1 3.38Å; R210-D245 IonicContact CZ-OD1 2.68Å; R210-D245 IonicContact NE-OD1 2.73Å; R210-D245 PolarHBondContact NE-OD1 3.07Å; R210-D245 IonicContact NE-OD2 3.09Å; R210-D245 PolarHBondContact NE-OD2 2.93Å; R210-D245 VanDerWaalsContact NH2-CG 3.34Å; R210-D245 IonicContact NH2-OD1 2.73Å; R210-D245 PolarHBondContact NH2-OD1 2.87Å; R210-D245 IonicContact NH2-OD2 3.49Å; Q212-D245 PolarHBondContact NE2-OD2 3.44Å

Retrieved 245 of 245 residues in 274.6 ms (Link to these results)