A0A087YMG1_POEFO Loading...

Atonal bHLH transcription factor 1a

AlphaFold DB , UniProt , Accession A0A087YMG1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 276 aa.

Structure Viewer
Loading PAE data...
(Predicted Aligned Error values between residue pairs)
Error loading PAE data: please refresh the page.

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
1S59.6Low59.1Low177 Ų177133.4 Ų133.4100%1.23877%0.769SS**  0121.50-47.70000108.4
2D67.2Low58.1Low120 Ų120127.4 Ų127.464%0.64276%0.758SS**  trans-87.7128.4-175.9-171.1-44.1000110.7R4D2-R4 PolarHBondContact O-N 3.12Å; D2-R4 PolarHBondContact OD1-N 3.12Å
3P60.7Low57.3Low113 Ų113128.3 Ų128.373%0.73477%0.765SS**THydrogen-bonded Turntrans-71.30.4-179.130.4-36.6000115.6W6P3-W6 PolarHBondContact O-NE1 3.4Å
4R64Low56.3Low184 Ų184128.1 Ų128.169%0.69477%0.772SS**THydrogen-bonded Turntrans-1119.2180-81.1-174.9165.5149.1-2.6116.2D2 W6 L7D2-R4 PolarHBondContact O-N 3.12Å; D2-R4 PolarHBondContact OD1-N 3.12Å; R4-W6 PolarHBondContact O-N 2.79Å; R4-L7 HydrophobicContact CG-CD1 4.31Å; R4-L7 PolarHBondContact O-N 3.31Å
5A63.6Low55.1Low80 Ų80126.4 Ų126.466%0.66178%0.776SS**THydrogen-bonded Turntrans-60.2-7179.500000116
6W61.8Low54Low198 Ų198123.8 Ų123.875%0.7577%0.772SS**THydrogen-bonded Turntrans-95.8-1-179.363.5-86.8000114.6P3 R4P3-W6 PolarHBondContact O-NE1 3.4Å; R4-W6 PolarHBondContact O-N 2.79Å
7L61.3Low53.3Low102 Ų102127.5 Ų127.553%0.53478%0.777SS.*  trans-101.69.7-175.4-75.9169.2000114.6R4R4-L7 HydrophobicContact CG-CD1 4.31Å; R4-L7 PolarHBondContact O-N 3.31Å
8T60.7Low52.7Low119 Ų119126.1 Ų126.173%0.7378%0.781SS**  trans-93.997.7174.754.60000110.6A10T8-A10 PolarHBondContact O-N 3.43Å
9D49.6Very low52.5Low160 Ų160126.5 Ų126.586%0.85678%0.783SS**  trans-59.7121.2166.7-92.8-40000109.9S11D9-S11 PolarHBondContact O-N 2.92Å; D9-S11 VanDerWaalsContact O-N 3.12Å
10A50.5Low51.9Low97 Ų97125.3 Ų125.380%0.80278%0.78SS**  trans-69.6108.8174.900000109.3T8 G12T8-A10 PolarHBondContact O-N 3.43Å; A10-G12 PolarHBondContact O-N 3.12Å
11S51.1Low51.7Low117 Ų117125.4 Ų125.482%0.81878%0.782SS**  trans-69.278.4170.3-68.40000110.4D9 T13D9-S11 PolarHBondContact O-N 2.92Å; D9-S11 VanDerWaalsContact O-N 3.12Å; S11-T13 PolarHBondContact O-N 3.25Å; S11-T13 VanDerWaalsContact O-N 3.12Å
12G46.7Very low51.2Low62 Ų62123.6 Ų123.664%0.63976%0.758SS**  trans-75.489.8176.600000111.6A10 C14A10-G12 PolarHBondContact O-N 3.12Å; G12-C14 PolarHBondContact O-N 2.92Å; G12-C14 VanDerWaalsContact O-N 3.12Å
13T48.1Very low50.3Low139 Ų139128.4 Ų128.485%0.85377%0.769SS**  trans-73.196.6169.449.30000110.5S11S11-T13 PolarHBondContact O-N 3.25Å; S11-T13 VanDerWaalsContact O-N 3.12Å
14C43.1Very low49.7Very low126 Ų126131 Ų13185%0.85178%0.776SS**  trans-103.492.8175.1-61.40000110.5G12G12-C14 PolarHBondContact O-N 2.92Å; G12-C14 VanDerWaalsContact O-N 3.12Å
15A39.1Very low48.9Very low102 Ų102132.3 Ų132.384%0.84378%0.781SS**  trans-98.4118.816900000109.8
16A36.4Very low47.5Very low85 Ų85137 Ų13770%0.70279%0.789SS**  trans-159.1108.8170.900000113.3
17H42.9Very low46.3Very low186 Ų186133.2 Ų133.286%0.86179%0.792SS**  trans49.5121141.9-54.3-71.6000121.7
18A43.2Very low45.8Very low103 Ų103133.8 Ų133.885%0.85180%0.803SS**  trans-84.4130.4164.400000111.8
19T48.5Very low45Very low134 Ų134134.2 Ų134.282%0.82281%0.809SS**  trans-148.7128.1157.151.50000110.7
20S39.7Very low44.9Very low102 Ų102132.7 Ų132.771%0.71381%0.807SS**  trans67.7112.2163.9-1460000119.8
21P48.4Very low44.5Very low128 Ų128133.1 Ų133.183%0.83181%0.805SS**  trans-106.799.3159.634.9-21.3000110.5
22D48.9Very low43.8Very low138 Ų138134.2 Ų134.274%0.73881%0.807SS**  trans-134.6152.5171-105.8-49.2000111.2
23Y47.4Very low43.2Very low221 Ų221134.9 Ų134.987%0.86781%0.814SS**  trans68.384.9-168.7-68-93.1000116.6
24L48Very low42.6Very low168 Ų168133.7 Ų133.788%0.8881%0.811SS**  -169.881.6126.8-100.5172.8000111.2
25R47.6Very low42.1Very low212 Ų212137 Ų13780%0.881%0.807SS**  trans-131.3161.2167.3-76.1-85.280.5179.52.3109.1
26H35.5Very low41.9Very low178 Ų178139.9 Ų139.982%0.82480%0.803SS**  trans73.4130.8-172.3-37.5-66.1000112.3
27S35.2Very low42Very low118 Ų118143.6 Ų143.683%0.82581%0.806SS**  cis-130.8164.525.4-730000114.8
28P51.5Low41.6Very low115 Ų115140.4 Ų140.475%0.74780%0.804SS**  trans-101.5160.7-169.736.4-28000114.4
29C44.1Very low41Very low127 Ų127141.8 Ų141.886%0.85881%0.807SS**  trans-72150.4163-49.20000110.9
30P48Very low40.7Very low128 Ų128140.9 Ų140.983%0.83181%0.806SS**  trans-115.4146.7154.235.1-26000112
31S40.5Very low41.5Very low106 Ų106142.3 Ų142.374%0.74181%0.813SS**  trans-139.3146.5170.1-154.60000109.3
32T37.8Very low40.7Very low140 Ų140139.8 Ų139.886%0.85981%0.809SS**  trans67127.3162.862.20000122
33G34.3Very low40.2Very low77 Ų77138.7 Ų138.779%0.79481%0.813SS**  trans92.3151.1153.100000117.8
34S35Very low39.8Very low114 Ų114134 Ų13480%0.79781%0.812SS**  cis-168.4156.4-20.9560000111.6
35Y31.7Very low39.2Very low195 Ų195129.4 Ų129.477%0.76581%0.805SS**  trans82150148.6-130.6-103.6000123.8
36Q35.8Very low39.2Very low163 Ų163128.3 Ų128.376%0.76281%0.809SS**  trans61.1118.9175.8-90.5157100118.5
37E37.3Very low40Very low162 Ų162125 Ų12576%0.75780%0.803SS**  cis101.1108.328.9-170.8176.7171.600113.7
38S36.2Very low40.5Very low119 Ų119125 Ų12583%0.83280%0.803SS**  trans-167109.6158.3-80.90000112.2
39C30.2Very low40.7Very low133 Ų133125.2 Ų125.290%0.89981%0.805SS**  trans41.1135.4150.6-61.20000124.3
40S42.8Very low41Very low115 Ų115123.7 Ų123.780%0.80479%0.793SS**  trans-70.6-169.1174.2-37.60000113.7
41P55.1Low41Very low132 Ų132125.7 Ų125.786%0.85780%0.795SS**  cis-141.5174.69.242-22.1000118.5
42G32.6Very low40.9Very low74 Ų74128.1 Ų128.176%0.76380%0.795SS**  trans173.671169.200000120.4
43S37.1Very low41.3Very low116 Ų116133.4 Ų133.481%0.81180%0.799SS**  trans70.9133.9147.8-152.70000122.9
44S40.7Very low41.4Very low122 Ų122141.5 Ų141.585%0.85381%0.805SS**  trans54.9146.9161.970.20000119.6
45G35.3Very low41.5Very low71 Ų71141.5 Ų141.573%0.73281%0.805SS**  cis168.7130.3-3.700000110
46H47Very low42.3Very low189 Ų189136.9 Ų136.988%0.87581%0.807SS**  trans-41.5168.8178.6-75.1-93.3000117.7
47P51.2Low42.5Very low109 Ų109138.7 Ų138.771%0.70881%0.813SS**  cis-138.4179.1-29.237-19.1000113.9
48S47.2Very low42.8Very low118 Ų118136 Ų13683%0.82581%0.812SS**  trans-68.7142.1169.1-48.60000113.8
49P54.2Low43.3Very low119 Ų119136.8 Ų136.877%0.77381%0.814SS**  trans-94.1166.1163.235.5-30.9000112.7
50P50.9Low43.8Very low96 Ų96136.1 Ų136.162%0.62381%0.811SS**  trans-107.8172-144.340.1-37.6000116.9H52P50-H52 PolarHBondContact O-N 3.2Å
51I48.3Very low44.2Very low170 Ų170135.9 Ų135.987%0.87281%0.809SS**  trans-61.4116168.1-61.1167.7000109.9
52H37.9Very low44.2Very low157 Ų157134.5 Ų134.573%0.72780%0.803SS**  trans-124.7130.4167.5-77.5-46.2000112.6P50 R54P50-H52 PolarHBondContact O-N 3.2Å; H52-R54 PolarHBondContact O-N 3.15Å
53R46Very low45.3Very low251 Ų251136.5 Ų136.595%0.94781%0.805SS**  trans-50.2127.2174-65.5174175.2177.3-2.6110.5S55R53-S55 PolarHBondContact O-N 3.43Å
54R37.1Very low46.3Very low247 Ų247136.7 Ų136.793%0.93280%0.796SS**  trans-85.1108.4164.3-87.9-177.1156.2-116.6-2.7110H52H52-R54 PolarHBondContact O-N 3.15Å
55S37.1Very low47.5Very low113 Ų113138.2 Ų138.279%0.7979%0.788SS**  trans-62.5154.7169.9-165.20000111.2R53 K57R53-S55 PolarHBondContact O-N 3.43Å; S55-K57 PolarHBondContact O-N 3.04Å
56A49.5Very low48.5Very low98 Ų98140.5 Ų140.581%0.8179%0.787SS**  trans-58.1135.7178.300000111.2
57K39.6Very low49.3Very low201 Ų201141.4 Ų141.487%0.87478%0.783SS**  trans-123.9114.6173.6-157.373.9176.3-179.30109.2S55S55-K57 PolarHBondContact O-N 3.04Å
58S42.1Very low49.8Very low106 Ų106139.8 Ų139.874%0.74177%0.768SS**PPolyproline II helixtrans-54151172.6-48.20000111.3S60S58-S60 PolarHBondContact O-N 3.33Å
59P47.3Very low50.4Low135 Ų135139.1 Ų139.188%0.87776%0.755SS**PPolyproline II helixtrans-69.8121.5-170.327.9-34.5000111.6
60S40.3Very low50.6Low120 Ų120138.7 Ų138.784%0.83975%0.753SS**PPolyproline II helixtrans-92.9155.4163.6-168.60000110.3S58S58-S60 PolarHBondContact O-N 3.33Å
61S52Low51.1Low110 Ų110144.1 Ų144.177%0.76976%0.761SS**SBendtrans-61.8175.8-167.9-1660000116
62S54.8Low51.4Low103 Ų103143.2 Ų143.272%0.7276%0.758SS**  trans81.567163.674.90000120.6
63S54.9Low52.1Low115 Ų115145.3 Ų145.380%0.80476%0.764SS**  trans-155.558.9143.8-84.80000112.3K65S63-K65 PolarHBondContact O-N 3.47Å
64L59.2Low52.4Low120 Ų120136.8 Ų136.863%0.62876%0.755SS**  trans-67.1123.1167.9-65.2178.3000108.8L69L64-L69 HydrophobicContact CB-CG 4.44Å; L64-L69 HydrophobicContact CD1-CD2 4.02Å
65K65.6Low52.6Low155 Ų155131 Ų13167%0.67475%0.747SS**  trans-70.2147.6174.5-64.3-179.917965.80107.6S63 R67 D68S63-K65 PolarHBondContact O-N 3.47Å; K65-R67 PolarHBondContact O-N 3.48Å; K65-D68 PolarHBondContact N-OD2 2.88Å; K65-D68 PolarHBondContact O-N 3.1Å
66V57.2Low52.7Low119 Ų119133.2 Ų133.272%0.72175%0.749SS**Hα-helixtrans-49.5-27.9-179.9177.40000112.8D68V66-D68 VanDerWaalsContact C-N 3.35Å; V66-D68 PolarHBondContact O-N 2.96Å
67R63.7Low52Low208 Ų208134.7 Ų134.779%0.78575%0.753SS**Hα-helixtrans-65.4-29.6176.5-154.5178.3-150.798.56.3114.8K65K65-R67 PolarHBondContact O-N 3.48Å
68D60Low51.8Low74 Ų74128.7 Ų128.740%0.39675%0.748SS.*Hα-helixtrans-86.1-33.6-175.5-55.8-45.3000111.2K65 V66 C70 R71 L72K65-D68 PolarHBondContact N-OD2 2.88Å; K65-D68 PolarHBondContact O-N 3.1Å; V66-D68 VanDerWaalsContact C-N 3.35Å; V66-D68 PolarHBondContact O-N 2.96Å; D68-C70 VanDerWaalsContact C-N 3.26Å; D68-C70 PolarHBondContact O-N 3.42Å; D68-R71 PolarHBondContact O-N 3.4Å; D68-L72 PolarHBondContact O-N 2.96Å
69L60.8Low52.1Low105 Ų105129.3 Ų129.355%0.5575%0.75SS.*Hα-helixtrans-60-35.2172.9-70.7168.4000112.3L64 R71L64-L69 HydrophobicContact CB-CG 4.44Å; L64-L69 HydrophobicContact CD1-CD2 4.02Å; L69-R71 PolarHBondContact O-N 3.47Å
70C58.4Low52.3Low109 Ų109131.3 Ų131.374%0.73675%0.747SS**THydrogen-bonded Turntrans-71.8-8.8174.6-63.20000114.5D68D68-C70 VanDerWaalsContact C-N 3.26Å; D68-C70 PolarHBondContact O-N 3.42Å
71R60.4Low52.5Low211 Ų211134.5 Ų134.580%0.79675%0.749SS**THydrogen-bonded Turntrans-98.3-19.3177.5-82.8-176.5141.4-162.8-8.3113.9D68 L69D68-R71 PolarHBondContact O-N 3.4Å; L69-R71 PolarHBondContact O-N 3.47Å
72L55.2Low52.6Low151 Ų151137.6 Ų137.679%0.79175%0.751SS**SBendtrans-107.246.9-171.3-156.172000113.1D68D68-L72 PolarHBondContact O-N 2.96Å
73K51.9Low52.2Low200 Ų200136.4 Ų136.487%0.8775%0.748SS**  trans-136.175175.6-165.274.9174.3-176.10110
74G53.3Low51.8Low73 Ų73136.7 Ų136.775%0.75375%0.747SS**  trans-169.238.6-172.400000115.8
75T40.5Very low51.1Low124 Ų124138.6 Ų138.676%0.76176%0.757SS**  trans-162.2140.1178.347.80000109.1
76I39.1Very low50.5Low161 Ų161143 Ų14383%0.82677%0.769SS**  cis-155.2130.1-14.931.9157.5000108.2
77S36.6Very low50.3Low129 Ų129145.5 Ų145.590%0.90277%0.773SS**  trans-176.7117.615557.70000111.7
78G33.9Very low49.8Very low75 Ų75146.9 Ų146.977%0.77378%0.778SS**  trans131.5121.3172.500000113.2
79P49.6Very low49.2Very low119 Ų119147.3 Ų147.377%0.77379%0.792SS**  trans-92.4158.4175.737.5-34.1000112.9
80E50Low49.1Very low176 Ų176150.4 Ų150.482%0.82280%0.804SS**  trans47.698.2162.7-51-509400120
81E45Very low48.7Very low187 Ų187149 Ų14987%0.87480%0.795SS**  -176.4150.5119.5-107.3-82.985.500112.1
82E54.5Low48.7Very low176 Ų176144.3 Ų144.382%0.82280%0.795SS**  trans-67.9127.8-170.2-94.4-89.6115.900115.1
83A46.8Very low49Very low78 Ų78144.7 Ų144.765%0.64579%0.79SS**  trans-153.3126.4155.800000111.6L85A83-L85 PolarHBondContact O-N 3.04Å
84P45.2Very low49.6Very low121 Ų121141 Ų14179%0.78679%0.787SS**  trans-75.3106.7-172.329.1-34.6000111.3R86P84-R86 PolarHBondContact O-N 2.91Å
85L44.9Very low50.1Low159 Ų159141.3 Ų141.383%0.83277%0.774SS**  trans-56.2104.5165-69.6173000109A83 Q87A83-L85 PolarHBondContact O-N 3.04Å; L85-Q87 PolarHBondContact O-N 2.95Å
86R54.1Low52Low247 Ų247138.6 Ų138.693%0.93276%0.76SS**  trans-67.976.9162.7-83.6-153.4169.1-158.8-2.2109.2P84 R88P84-R86 PolarHBondContact O-N 2.91Å; R86-R88 PolarHBondContact O-N 2.7Å
87Q53.2Low54.1Low172 Ų172133.7 Ų133.780%0.80475%0.748SS**  trans-47.2110.4155.6-75.3-174-7.300106.5L85 A89L85-Q87 PolarHBondContact O-N 2.95Å; Q87-A89 PolarHBondContact O-N 3.07Å
88R52.5Low56.6Low237 Ų237131.4 Ų131.489%0.89473%0.729SS**  trans-64.196.6170-177.6171.1-172.1136.42.5105.9R86 Q90R86-R88 PolarHBondContact O-N 2.7Å; R88-Q90 PolarHBondContact O-N 2.86Å
89A47.2Very low59.3Low83 Ų83133.2 Ų133.269%0.68672%0.717SS**  trans-46.4114.8-174.500000108.5Q87 S91Q87-A89 PolarHBondContact O-N 3.07Å; A89-S91 PolarHBondContact O-N 3.19Å
90Q58.6Low61.4Low171 Ų171135.6 Ų135.680%0.79971%0.711SS**  trans-65.196.3167.5-67.9-169.44.100104.6R88 S92R88-Q90 PolarHBondContact O-N 2.86Å; Q90-S92 PolarHBondContact O-N 3.23Å; Q90-S92 PolarHBondContact O-OG 3.26Å
91S51.1Low63.5Low78 Ų78134 Ų13455%0.54570%0.703SS.*  trans-7280.5179.4-154.80000107.1A89 K93A89-S91 PolarHBondContact O-N 3.19Å; S91-K93 PolarHBondContact O-N 2.85Å; S91-K93 WeakPolarHBondContact OG-CD 3.5Å; S91-K93 WeakPolarHBondContact OG-CE 3.4Å; S91-K93 PolarHBondContact OG-NZ 3.32Å
92S58.6Low66Low114 Ų114133.9 Ų133.980%0.79770%0.695SS**  trans-70.840.6177.2490000111.5Q90 P94Q90-S92 PolarHBondContact O-N 3.23Å; Q90-S92 PolarHBondContact O-OG 3.26Å; S92-P94 WeakPolarHBondContact O-CD 3.33Å
93K63.5Low68Low158 Ų158131.2 Ų131.269%0.68768%0.677SS**  trans-66116.8160.8-69.6160.2-175.5159.30105.3S91 V95S91-K93 PolarHBondContact O-N 2.85Å; S91-K93 WeakPolarHBondContact OG-CD 3.5Å; S91-K93 WeakPolarHBondContact OG-CE 3.4Å; S91-K93 PolarHBondContact OG-NZ 3.32Å; K93-V95 PolarHBondContact O-N 3.38Å
94P63Low70.4Confident124 Ų124131.9 Ų131.981%0.80567%0.673SS**  trans-61.7106.9178.724.5-32.4000108.1S92 S96S92-P94 WeakPolarHBondContact O-CD 3.33Å; P94-S96 PolarHBondContact O-N 2.77Å
95V63.8Low72.9Confident79 Ų79128 Ų12848%0.47965%0.651SS.*  trans-55.4111.6173.3170.50000106.6K93 Q99K93-V95 PolarHBondContact O-N 3.38Å; V95-Q99 HydrophobicContact CG1-CB 3.87Å; V95-Q99 HydrophobicContact CG1-CG 4.01Å
96S81.5Confident75.5Confident67 Ų67122.3 Ų122.347%0.46963%0.627SS.*  trans-53.7146-171.567.40000110.6P94 V98 Q99 R100P94-S96 PolarHBondContact O-N 2.77Å; S96-V98 PolarHBondContact O-N 3.44Å; S96-Q99 WeakPolarHBondContact O-CA 3.24Å; S96-Q99 PolarHBondContact O-N 2.88Å; S96-Q99 PolarHBondContact OG-N 3.39Å; S96-R100 PolarHBondContact O-N 2.95Å
97G83.6Confident77.6Confident57 Ų57114.7 Ų114.759%0.58861%0.605SS**Hα-helixtrans-51.2-38.6-177.900000112.1R100 Q101G97-R100 WeakPolarHBondContact O-CB 3.28Å; G97-R100 PolarHBondContact O-N 3.1Å; G97-Q101 WeakPolarHBondContact O-CB 3.27Å; G97-Q101 PolarHBondContact O-N 3.09Å
98V87.8Confident79.7Confident82 Ų82108.1 Ų108.150%0.49758%0.58SS.*Hα-helixtrans-57.6-47.2172.8-177.20000112.6S96 R100 Q101 R102S96-V98 PolarHBondContact O-N 3.44Å; V98-R100 VanDerWaalsContact C-N 3.34Å; V98-R100 PolarHBondContact O-N 2.96Å; V98-Q101 PolarHBondContact O-N 2.87Å; V98-R102 HydrophobicContact CG1-CG 4.48Å; V98-R102 WeakPolarHBondContact O-CB 3.42Å; V98-R102 VanDerWaalsContact O-CG 3.32Å; V98-R102 WeakPolarHBondContact O-CG 3.25Å; V98-R102 PolarHBondContact O-N 3.22Å
99Q91.9Very high82Confident112 Ų112103.7 Ų103.752%0.52356%0.563SS.*Hα-helixtrans-67.9-33.8178.5-169.4178.718.700112V95 S96 R103V95-Q99 HydrophobicContact CG1-CB 3.87Å; V95-Q99 HydrophobicContact CG1-CG 4.01Å; S96-Q99 WeakPolarHBondContact O-CA 3.24Å; S96-Q99 PolarHBondContact O-N 2.88Å; S96-Q99 PolarHBondContact OG-N 3.39Å; Q99-R103 PolarHBondContact O-N 3.23Å
100R92.8Very high84.4Confident170 Ų170103.7 Ų103.764%0.64255%0.549SS*.Hα-helixtrans-64.5-45.7170.7-176177.3179.7175.7-1.4111.2S96 G97 V98 R103 V104S96-R100 PolarHBondContact O-N 2.95Å; G97-R100 WeakPolarHBondContact O-CB 3.28Å; G97-R100 PolarHBondContact O-N 3.1Å; V98-R100 VanDerWaalsContact C-N 3.34Å; V98-R100 PolarHBondContact O-N 2.96Å; R100-R103 PolarHBondContact O-N 3.41Å; R100-V104 WeakPolarHBondContact O-CG2 3.5Å; R100-V104 PolarHBondContact O-N 3.42Å
101Q94.4Very high86.3Confident142 Ų142103.5 Ų103.566%0.66454%0.541SS*.Hα-helixtrans-66.1-42.7-179.9-165.9173.716.600112.2G97 V98 R103 V104 A105G97-Q101 WeakPolarHBondContact O-CB 3.27Å; G97-Q101 PolarHBondContact O-N 3.09Å; V98-Q101 PolarHBondContact O-N 2.87Å; Q101-R103 VanDerWaalsContact C-N 3.3Å; Q101-R103 PolarHBondContact O-N 3.14Å; Q101-V104 PolarHBondContact O-N 3.33Å; Q101-V104 VanDerWaalsContact O-N 3.16Å; Q101-A105 PolarHBondContact O-N 3.35Å
102R96.7Very high88.6Confident185 Ų185107.9 Ų107.970%0.69855%0.546SS*.Hα-helixtrans-55.7-43172.5-74.7177.5-177.5-167.41.9111.9V98 A105 A106V98-R102 HydrophobicContact CG1-CG 4.48Å; V98-R102 WeakPolarHBondContact O-CB 3.42Å; V98-R102 VanDerWaalsContact O-CG 3.32Å; V98-R102 WeakPolarHBondContact O-CG 3.25Å; V98-R102 PolarHBondContact O-N 3.22Å; R102-A105 PolarHBondContact O-N 3.33Å; R102-A106 WeakPolarHBondContact O-CB 3.47Å; R102-A106 PolarHBondContact O-N 2.88Å
103R97.3Very high90.5Very high120 Ų120109.9 Ų109.945%0.45354%0.536SS..Hα-helixtrans-65.7-41.4176-176.8171.964-108.15.4112.6Q99 R100 Q101 A106 N107Q99-R103 PolarHBondContact O-N 3.23Å; R100-R103 PolarHBondContact O-N 3.41Å; Q101-R103 VanDerWaalsContact C-N 3.3Å; Q101-R103 PolarHBondContact O-N 3.14Å; R103-A106 PolarHBondContact O-N 2.93Å; R103-N107 VanDerWaalsContact O-CG 3.28Å; R103-N107 PolarHBondContact O-N 3.15Å; R103-N107 PolarHBondContact O-OD1 3.49Å
104V97.4Very high92.2Very high91 Ų91105.3 Ų105.355%0.55252%0.518SS*.Hα-helixtrans-62.3-45.9175.41720000110.9R100 Q101 A106 N107 A108R100-V104 WeakPolarHBondContact O-CG2 3.5Å; R100-V104 PolarHBondContact O-N 3.42Å; Q101-V104 PolarHBondContact O-N 3.33Å; Q101-V104 VanDerWaalsContact O-N 3.16Å; V104-A106 PolarHBondContact O-N 3.07Å; V104-N107 PolarHBondContact O-N 3.07Å; V104-A108 PolarHBondContact O-N 3.34Å
105A97.8Very high93.9Very high40 Ų40105.5 Ų105.533%0.33151%0.508SS..Hα-helixtrans-62.9-38.917700000112.6Q101 R102 A108 R109Q101-A105 PolarHBondContact O-N 3.35Å; R102-A105 PolarHBondContact O-N 3.33Å; A105-A108 PolarHBondContact O-N 3.45Å; A105-R109 WeakPolarHBondContact O-CG 3.46Å; A105-R109 PolarHBondContact O-N 3.35Å; A105-R109 VanDerWaalsContact O-N 3.11Å
106A98.2Very high95.5Very high40 Ų40103.9 Ų103.933%0.33151%0.507SS..Hα-helixtrans-63-48.1173.900000112R102 R103 V104 A108 R109 E110R102-A106 WeakPolarHBondContact O-CB 3.47Å; R102-A106 PolarHBondContact O-N 2.88Å; R103-A106 PolarHBondContact O-N 2.93Å; V104-A106 PolarHBondContact O-N 3.07Å; A106-A108 VanDerWaalsContact C-N 3.28Å; A106-A108 PolarHBondContact O-N 3.13Å; A106-R109 WeakPolarHBondContact O-CB 3.47Å; A106-R109 PolarHBondContact O-N 3.48Å; A106-R109 VanDerWaalsContact O-N 3.11Å; A106-E110 PolarHBondContact O-N 3.5Å
107N98.6Very high96.3Very high86 Ų86104.1 Ų104.146%0.4650%0.503SS..Hα-helixtrans-62.3-35.1177.8-69.8-1.5000112.4R103 V104 E110 R111R103-N107 VanDerWaalsContact O-CG 3.28Å; R103-N107 PolarHBondContact O-N 3.15Å; R103-N107 PolarHBondContact O-OD1 3.49Å; V104-N107 PolarHBondContact O-N 3.07Å; N107-E110 PolarHBondContact O-N 2.9Å; N107-R111 WeakPolarHBondContact O-CG 3.39Å; N107-R111 PolarHBondContact O-N 3.01Å
108A98.6Very high97Very high35 Ų35104.3 Ų104.329%0.28949%0.49SS..Hα-helixtrans-66.6-38174.500000112.4V104 A105 A106 R112V104-A108 PolarHBondContact O-N 3.34Å; A105-A108 PolarHBondContact O-N 3.45Å; A106-A108 VanDerWaalsContact C-N 3.28Å; A106-A108 PolarHBondContact O-N 3.13Å; A108-R112 PolarHBondContact O-N 2.96Å
109R98.8Very high97.5Very high143 Ų143105.9 Ų105.954%0.5449%0.492SS..Hα-helixtrans-65.1-45.7173-71.2-175.6-63.6-100.46111.8A105 A106 R111 R112 R113A105-R109 WeakPolarHBondContact O-CG 3.46Å; A105-R109 PolarHBondContact O-N 3.35Å; A105-R109 VanDerWaalsContact O-N 3.11Å; A106-R109 WeakPolarHBondContact O-CB 3.47Å; A106-R109 PolarHBondContact O-N 3.48Å; A106-R109 VanDerWaalsContact O-N 3.11Å; R109-R111 VanDerWaalsContact C-N 3.34Å; R109-R111 PolarHBondContact O-N 3.25Å; R109-R112 PolarHBondContact O-N 3.01Å; R109-R112 VanDerWaalsContact O-N 3.14Å; R109-R113 PolarHBondContact O-N 3.08Å
110E98.7Very high97.9Very high84 Ų84102.9 Ų102.939%0.39349%0.487SS..Hα-helixtrans-64.8-37.8-179.4-170.954.3-145.400112.2A106 N107 R112 R113 M114A106-E110 PolarHBondContact O-N 3.5Å; N107-E110 PolarHBondContact O-N 2.9Å; E110-R112 PolarHBondContact O-N 3.43Å; E110-R113 WeakPolarHBondContact O-CB 3.33Å; E110-R113 PolarHBondContact O-N 3.31Å; E110-R113 IonicContact OE1-CZ 3.8Å; E110-R113 IonicContact OE1-NH1 2.77Å; E110-R113 PolarHBondContact OE1-NH1 2.77Å; E110-R113 WeakPolarHBondContact OE2-CD 3.26Å; E110-M114 HydrophobicContact CG-CG 4.44Å; E110-M114 WeakPolarHBondContact O-CB 3.39Å; E110-M114 WeakPolarHBondContact O-CG 3.3Å; E110-M114 PolarHBondContact O-N 2.89Å
111R98.8Very high98.1Very high166 Ų16696.2 Ų96.263%0.62646%0.462SS*.Hα-helixtrans-57.2-47.9171.1-75.5177.2-178.4143-2.7111.8N107 R109 R113 M114 H115N107-R111 WeakPolarHBondContact O-CG 3.39Å; N107-R111 PolarHBondContact O-N 3.01Å; R109-R111 VanDerWaalsContact C-N 3.34Å; R109-R111 PolarHBondContact O-N 3.25Å; R111-R113 PolarHBondContact O-N 2.98Å; R111-M114 PolarHBondContact O-N 3.18Å; R111-H115 PolarHBondContact O-CD2 3.28Å; R111-H115 PolarHBondContact O-N 3.43Å
112R98.7Very high98.2Very high170 Ų17092.6 Ų92.664%0.64245%0.447SS*.Hα-helixtrans-60-43.4177-71.6-168.3-67.9-106.69.6112.5A108 R109 E110 M114 H115 G116A108-R112 PolarHBondContact O-N 2.96Å; R109-R112 PolarHBondContact O-N 3.01Å; R109-R112 VanDerWaalsContact O-N 3.14Å; E110-R112 PolarHBondContact O-N 3.43Å; R112-M114 PolarHBondContact O-N 3.42Å; R112-H115 PolarHBondContact O-N 3.02Å; R112-G116 PolarHBondContact O-N 3.3Å; R112-G116 VanDerWaalsContact O-N 3.09Å
113R98.8Very high98.3Very high156 Ų15688.8 Ų88.859%0.58944%0.438SS*.Hα-helixtrans-57.2-47.3173.5179.1-178.8170.4-84.3-8.3111.6R109 E110 R111 G116 L117R109-R113 PolarHBondContact O-N 3.08Å; E110-R113 WeakPolarHBondContact O-CB 3.33Å; E110-R113 PolarHBondContact O-N 3.31Å; E110-R113 IonicContact OE1-CZ 3.8Å; E110-R113 IonicContact OE1-NH1 2.77Å; E110-R113 PolarHBondContact OE1-NH1 2.77Å; E110-R113 WeakPolarHBondContact OE2-CD 3.26Å; R111-R113 PolarHBondContact O-N 2.98Å; R113-G116 PolarHBondContact O-N 2.64Å; R113-L117 PolarHBondContact O-N 2.86Å
114M98.8Very high98.3Very high63 Ų6385.7 Ų85.731%0.3143%0.43SS..Hα-helixtrans-70.2-29.7179.2-69.9-58.3-5900113.6E110 R111 R112 L117 N118E110-M114 HydrophobicContact CG-CG 4.44Å; E110-M114 WeakPolarHBondContact O-CB 3.39Å; E110-M114 WeakPolarHBondContact O-CG 3.3Å; E110-M114 PolarHBondContact O-N 2.89Å; R111-M114 PolarHBondContact O-N 3.18Å; R112-M114 PolarHBondContact O-N 3.42Å; M114-L117 HydrophobicContact CE-CD2 3.91Å; M114-L117 HydrophobicContact SD-CD2 4.04Å; M114-N118 WeakPolarHBondContact O-CB 3.46Å; M114-N118 PolarHBondContact O-N 3.09Å; M114-N118 PolarHBondContact O-ND2 3.06Å
115H98.6Very high98.2Very high128 Ų12883.6 Ų83.659%0.59341%0.412SS*.Hα-helixtrans-64.3-45.9170.2-72.1-61.6000111.3R111 R112 L117 N118 H119R111-H115 PolarHBondContact O-CD2 3.28Å; R111-H115 PolarHBondContact O-N 3.43Å; R112-H115 PolarHBondContact O-N 3.02Å; H115-L117 PolarHBondContact O-N 3.26Å; H115-N118 PolarHBondContact O-N 3.29Å; H115-H119 PolarHBondContact O-N 3.34Å
116G98.5Very high98.1Very high45 Ų4586.4 Ų86.446%0.46443%0.429SS..Hα-helixtrans-60.7-42.217500000113R112 R113 N118 H119 A120R112-G116 PolarHBondContact O-N 3.3Å; R112-G116 VanDerWaalsContact O-N 3.09Å; R113-G116 PolarHBondContact O-N 2.64Å; G116-N118 PolarHBondContact O-N 3.39Å; G116-H119 WeakPolarHBondContact O-CB 3.48Å; G116-H119 PolarHBondContact O-N 3.03Å; G116-A120 PolarHBondContact O-N 2.86Å; G116-A120 VanDerWaalsContact O-N 3.13Å
117L98.5Very high98Very high72 Ų7288.9 Ų88.938%0.37744%0.44SS..Hα-helixtrans-61.7-43.3173.4178.362.1000112.3R113 M114 H115 H119 A120 F121R113-L117 PolarHBondContact O-N 2.86Å; M114-L117 HydrophobicContact CE-CD2 3.91Å; M114-L117 HydrophobicContact SD-CD2 4.04Å; H115-L117 PolarHBondContact O-N 3.26Å; L117-H119 VanDerWaalsContact C-N 3.33Å; L117-A120 PolarHBondContact O-N 3.2Å; L117-F121 HydrophobicContact CD1-CD2 4.06Å; L117-F121 HydrophobicContact CD1-CE2 4.05Å; L117-F121 HydrophobicContact CG-CD2 4.19Å; L117-F121 HydrophobicContact CG-CE2 4.36Å; L117-F121 WeakPolarHBondContact O-CD2 3.42Å; L117-F121 PolarHBondContact O-N 3.47Å; L117-F121 VanDerWaalsContact O-N 3.13Å
118N98.4Very high97.8Very high60 Ų6085.2 Ų85.232%0.32142%0.42SS..Hα-helixtrans-68.4-33.4179.4-71.1-18.4000112M114 H115 G116 F121 D122 K139M114-N118 WeakPolarHBondContact O-CB 3.46Å; M114-N118 PolarHBondContact O-N 3.09Å; M114-N118 PolarHBondContact O-ND2 3.06Å; H115-N118 PolarHBondContact O-N 3.29Å; G116-N118 PolarHBondContact O-N 3.39Å; N118-F121 WeakPolarHBondContact O-CB 3.39Å; N118-F121 PolarHBondContact O-N 2.79Å; N118-D122 PolarHBondContact O-N 3.37Å; N118-K139 WeakPolarHBondContact OD1-CE 3.36Å; N118-K139 PolarHBondContact OD1-NZ 3.47Å
119H98.4Very high97.6Very high115 Ų11586.4 Ų86.453%0.53243%0.425SS..Hα-helixtrans-59.8-52.6172.5-173.7-82.3000111.2H115 G116 L117 F121 D122 E123H115-H119 PolarHBondContact O-N 3.34Å; G116-H119 WeakPolarHBondContact O-CB 3.48Å; G116-H119 PolarHBondContact O-N 3.03Å; L117-H119 VanDerWaalsContact C-N 3.33Å; H119-F121 PolarHBondContact O-N 3.31Å; H119-D122 CarbonylContact O-C 3.59Å; H119-D122 WeakPolarHBondContact O-CA 3.4Å; H119-D122 PolarHBondContact O-N 3.11Å; H119-E123 IonicContact CE1-OE1 3.38Å; H119-E123 PolarHBondContact CE1-OE1 3.13Å; H119-E123 IonicContact CE1-OE2 3.32Å; H119-E123 PolarHBondContact CE1-OE2 3.35Å; H119-E123 IonicContact CG-OE2 3.78Å; H119-E123 IonicContact ND1-OE1 3.7Å; H119-E123 IonicContact ND1-OE2 2.77Å; H119-E123 PolarHBondContact ND1-OE2 2.83Å; H119-E123 PolarHBondContact O-N 3.36Å
120A98.6Very high96.6Very high50 Ų5082.5 Ų82.541%0.41342%0.423SS..Hα-helixtrans-58.6-32176.200000112.9G116 L117 E123 L124G116-A120 PolarHBondContact O-N 2.86Å; G116-A120 VanDerWaalsContact O-N 3.13Å; L117-A120 PolarHBondContact O-N 3.2Å; A120-E123 WeakPolarHBondContact CA-OE2 3.25Å; A120-L124 WeakPolarHBondContact O-CB 3.45Å; A120-L124 PolarHBondContact O-N 2.95Å
121F98.4Very high95.1Very high30 Ų3087 Ų8713%0.13244%0.442CS..Hα-helixtrans-70-33.4171.8-101.3-78.3000113.5L117 N118 H119 R125 K139 T142 L143L117-F121 HydrophobicContact CD1-CD2 4.06Å; L117-F121 HydrophobicContact CD1-CE2 4.05Å; L117-F121 HydrophobicContact CG-CD2 4.19Å; L117-F121 HydrophobicContact CG-CE2 4.36Å; L117-F121 WeakPolarHBondContact O-CD2 3.42Å; L117-F121 PolarHBondContact O-N 3.47Å; L117-F121 VanDerWaalsContact O-N 3.13Å; N118-F121 WeakPolarHBondContact O-CB 3.39Å; N118-F121 PolarHBondContact O-N 2.79Å; H119-F121 PolarHBondContact O-N 3.31Å; F121-R125 WeakPolarHBondContact O-CG 3.38Å; F121-R125 PolarHBondContact O-N 3.35Å; F121-R125 VanDerWaalsContact O-N 3.14Å; F121-R125 PolarHBondContact O-NH1 2.97Å; F121-K139 HydrophobicContact CD1-CG 4.3Å; F121-K139 HydrophobicContact CE1-CB 3.95Å; F121-K139 HydrophobicContact CE1-CG 4.07Å; F121-K139 HydrophobicContact CE2-CD 4.34Å; F121-K139 HydrophobicContact CZ-CB 4.18Å; F121-K139 HydrophobicContact CZ-CD 4.29Å; F121-K139 HydrophobicContact CZ-CG 4.28Å; F121-T142 HydrophobicContact CD1-CG2 4.13Å; F121-L143 HydrophobicContact CE1-CD2 4.22Å; F121-L143 HydrophobicContact CE1-CG 4.11Å; F121-L143 HydrophobicContact CZ-CD1 4.32Å; F121-L143 HydrophobicContact CZ-CD2 4.29Å; F121-L143 HydrophobicContact CZ-CG 4.31Å
122D96.7Very high93.8Very high65 Ų6584.1 Ų84.135%0.34844%0.438SS..Hα-helixtrans-76.6-34.9174.9-81.9-33.5000111.4N118 H119 R125 S126 K136N118-D122 PolarHBondContact O-N 3.37Å; H119-D122 CarbonylContact O-C 3.59Å; H119-D122 WeakPolarHBondContact O-CA 3.4Å; H119-D122 PolarHBondContact O-N 3.11Å; D122-R125 WeakPolarHBondContact O-CB 3.33Å; D122-R125 PolarHBondContact O-N 3.43Å; D122-R125 IonicContact OD1-CZ 3.31Å; D122-R125 IonicContact OD1-NH1 2.98Å; D122-R125 PolarHBondContact OD1-NH1 2.79Å; D122-S126 PolarHBondContact O-N 3.3Å; D122-S126 VanDerWaalsContact O-N 3.09Å; D122-K136 IonicContact OD1-NZ 3.97Å; D122-K136 PolarHBondContact OD1-NZ 3.29Å; D122-K136 IonicContact OD2-NZ 2.73Å; D122-K136 PolarHBondContact OD2-NZ 2.59Å
123E97.5Very high92.4Very high106 Ų10683 Ų8350%0.49545%0.445SS..Hα-helixtrans-62.1-42.3168.5-69.3173.311800111.6H119 A120 R125 S126H119-E123 IonicContact CE1-OE1 3.38Å; H119-E123 PolarHBondContact CE1-OE1 3.13Å; H119-E123 IonicContact CE1-OE2 3.32Å; H119-E123 PolarHBondContact CE1-OE2 3.35Å; H119-E123 IonicContact CG-OE2 3.78Å; H119-E123 IonicContact ND1-OE1 3.7Å; H119-E123 IonicContact ND1-OE2 2.77Å; H119-E123 PolarHBondContact ND1-OE2 2.83Å; H119-E123 PolarHBondContact O-N 3.36Å; A120-E123 WeakPolarHBondContact CA-OE2 3.25Å; E123-R125 VanDerWaalsContact C-N 3.3Å; E123-R125 PolarHBondContact O-N 3.39Å; E123-S126 PolarHBondContact O-N 3.48Å; E123-S126 PolarHBondContact O-OG 3.26Å
124L97.8Very high91.4Very high55 Ų5583.6 Ų83.629%0.28846%0.46SS..Hα-helixtrans-63.3-35.8173.4-178.859.4000112.2A120 S126 V127 I128 T142 L143 A146A120-L124 WeakPolarHBondContact O-CB 3.45Å; A120-L124 PolarHBondContact O-N 2.95Å; L124-S126 VanDerWaalsContact C-N 3.35Å; L124-V127 HydrophobicContact CD1-CG2 4.32Å; L124-V127 WeakPolarHBondContact O-CG2 3.26Å; L124-I128 HydrophobicContact CD1-CD1 4.36Å; L124-I128 HydrophobicContact CG-CD1 4.03Å; L124-I128 WeakPolarHBondContact O-CD1 3.38Å; L124-I128 VanDerWaalsContact O-CG1 3.3Å; L124-I128 WeakPolarHBondContact O-CG1 3.33Å; L124-I128 PolarHBondContact O-N 2.85Å; L124-T142 HydrophobicContact CB-CG2 4.42Å; L124-T142 HydrophobicContact CD2-CG2 3.91Å; L124-T142 HydrophobicContact CG-CG2 3.96Å; L124-L143 HydrophobicContact CD2-CD2 4.46Å; L124-A146 HydrophobicContact CD1-CB 4.06Å; L124-A146 HydrophobicContact CD2-CB 4.27Å; L124-A146 HydrophobicContact CG-CB 4.47Å
125R96.1Very high90.9Very high47 Ų4786.3 Ų86.318%0.17747%0.47CS..Hα-helixtrans-65.4-35174.6-75.8176.3-166.383.835112.8F121 D122 E123 V127 I128 L137 T142F121-R125 WeakPolarHBondContact O-CG 3.38Å; F121-R125 PolarHBondContact O-N 3.35Å; F121-R125 VanDerWaalsContact O-N 3.14Å; F121-R125 PolarHBondContact O-NH1 2.97Å; D122-R125 WeakPolarHBondContact O-CB 3.33Å; D122-R125 PolarHBondContact O-N 3.43Å; D122-R125 IonicContact OD1-CZ 3.31Å; D122-R125 IonicContact OD1-NH1 2.98Å; D122-R125 PolarHBondContact OD1-NH1 2.79Å; E123-R125 VanDerWaalsContact C-N 3.3Å; E123-R125 PolarHBondContact O-N 3.39Å; R125-V127 PolarHBondContact O-N 3.32Å; R125-I128 PolarHBondContact O-N 3.31Å; R125-L137 PolarHBondContact NE-O 3.3Å; R125-L137 PolarHBondContact NH2-O 3.45Å; R125-T142 HydrophobicContact CG-CG2 3.8Å; R125-T142 PolarHBondContact NE-OG1 3.49Å; R125-T142 PolarHBondContact NH2-OG1 3.47Å
126S95Very high90.6Very high99 Ų9987.3 Ų87.369%0.69247%0.473SS*.Hα-helixtrans-69.9-20.1-176.170.60000113.7D122 E123 L124D122-S126 PolarHBondContact O-N 3.3Å; D122-S126 VanDerWaalsContact O-N 3.09Å; E123-S126 PolarHBondContact O-N 3.48Å; E123-S126 PolarHBondContact O-OG 3.26Å; L124-S126 VanDerWaalsContact C-N 3.35Å
127V95.8Very high90.3Very high91 Ų9187.3 Ų87.355%0.55246%0.462SS*.Hα-helixtrans-101.1-6.9176.7-59.40000114L124 R125 Y149L124-V127 HydrophobicContact CD1-CG2 4.32Å; L124-V127 WeakPolarHBondContact O-CG2 3.26Å; R125-V127 PolarHBondContact O-N 3.32Å; V127-Y149 VanDerWaalsContact O-CE1 3.24Å; V127-Y149 WeakPolarHBondContact O-CE1 3.38Å
128I95.4Very high90.2Very high10 Ų1086.5 Ų86.55%0.05146%0.462CS..SBendtrans-83.2130.4173.9-73.2164.1000108.9L124 R125 A130 L137 T142 M145 A146L124-I128 HydrophobicContact CD1-CD1 4.36Å; L124-I128 HydrophobicContact CG-CD1 4.03Å; L124-I128 WeakPolarHBondContact O-CD1 3.38Å; L124-I128 VanDerWaalsContact O-CG1 3.3Å; L124-I128 WeakPolarHBondContact O-CG1 3.33Å; L124-I128 PolarHBondContact O-N 2.85Å; R125-I128 PolarHBondContact O-N 3.31Å; I128-A130 PolarHBondContact O-N 3.11Å; I128-L137 HydrophobicContact CG2-CD1 4.05Å; I128-T142 HydrophobicContact CD1-CG2 3.67Å; I128-T142 VanDerWaalsContact CD1-O 3.25Å; I128-T142 WeakPolarHBondContact CD1-O 3.46Å; I128-M145 HydrophobicContact CD1-CB 4.36Å; I128-M145 HydrophobicContact CG2-CB 3.71Å; I128-A146 HydrophobicContact CD1-CB 4.1Å; I128-A146 HydrophobicContact CG1-CB 4.49Å
129P93.1Very high90.2Very high60 Ų6087.9 Ų87.939%0.3947%0.466SS..  trans-57.7113.7171.2-24.534.4000111.3Y149P129-Y149 HydrophobicContact CG-CD1 4.35Å; P129-Y149 HydrophobicContact CG-CD2 3.73Å; P129-Y149 HydrophobicContact CG-CE1 4.16Å; P129-Y149 HydrophobicContact CG-CE2 3.53Å; P129-Y149 HydrophobicContact CG-CG 4.15Å
130A78.9Confident90.1Very high60 Ų6090.2 Ų90.250%0.49647%0.471SS..  trans-90.5133.3178.900000110.9I128I128-A130 PolarHBondContact O-N 3.11Å
131F65.3Low90Very high180 Ų18090.9 Ų90.979%0.78947%0.465SS*.SBendtrans-87.1-32.1172.3-76-93.1000112.3M145F131-M145 HydrophobicContact CE2-CE 4.32Å
132D73.4Confident90Very high104 Ų10489.5 Ų89.556%0.55646%0.459SS*.SBendtrans-116.598.5177.9-60.9-37.8000109.5D134 K135D132-D134 PolarHBondContact O-N 3.28Å; D132-K135 HydrophobicContact CB-CB 3.98Å; D132-K135 PolarHBondContact O-N 3.45Å; D132-K135 VanDerWaalsContact O-N 3.15Å
133N67.9Low90.1Very high147 Ų14791 Ų9179%0.78647%0.467SS*.THydrogen-bonded Turntrans-57.5-27.7-171.3-67.4-54.7000114.7
134D78.8Confident90.1Very high169 Ų16990.1 Ų90.190%0.90446%0.462SS*.THydrogen-bonded Turntrans-92.5-12.5-175.9-57.5-48.3000113.9D132D132-D134 PolarHBondContact O-N 3.28Å
135K88.7Confident90Very high119 Ų11989.8 Ų89.852%0.51746%0.46SS..  trans-103.6111.9-171.9-172.1-168.6172.3-158.10111.8D132 L137D132-K135 HydrophobicContact CB-CB 3.98Å; D132-K135 PolarHBondContact O-N 3.45Å; D132-K135 VanDerWaalsContact O-N 3.15Å; K135-L137 PolarHBondContact O-N 2.99Å
136K90.8Very high90.1Very high150 Ų15088.2 Ų88.265%0.65246%0.457SS*.PPolyproline II helixtrans-64.2121169.7-70.9-161.2169-152.20111.5D122D122-K136 IonicContact OD1-NZ 3.97Å; D122-K136 PolarHBondContact OD1-NZ 3.29Å; D122-K136 IonicContact OD2-NZ 2.73Å; D122-K136 PolarHBondContact OD2-NZ 2.59Å
137L93.5Very high90.3Very high45 Ų4589.5 Ų89.524%0.23645%0.452CS..PPolyproline II helixtrans-58.9137.7170.7-61.6178.1000111.5R125 I128 K135 E141 T142 M145R125-L137 PolarHBondContact NE-O 3.3Å; R125-L137 PolarHBondContact NH2-O 3.45Å; I128-L137 HydrophobicContact CG2-CD1 4.05Å; K135-L137 PolarHBondContact O-N 2.99Å; L137-E141 HydrophobicContact CB-CB 4.14Å; L137-E141 HydrophobicContact CD2-CB 4.28Å; L137-T142 PolarHBondContact O-OG1 3.38Å; L137-M145 HydrophobicContact CD1-CB 4.38Å; L137-M145 HydrophobicContact CD1-CG 4.15Å
138S96.1Very high90.3Very high54 Ų5489.4 Ų89.438%0.37845%0.448SS..PPolyproline II helixtrans-63.4166.9171.172.30000111.5Y140 E141 T142S138-Y140 VanDerWaalsContact C-N 3.28Å; S138-Y140 PolarHBondContact O-N 3.49Å; S138-E141 WeakPolarHBondContact CA-OE2 3.32Å; S138-E141 WeakPolarHBondContact CB-OE2 3.45Å; S138-E141 PolarHBondContact N-OE2 3.14Å; S138-E141 PolarHBondContact O-N 2.94Å; S138-E141 VanDerWaalsContact OG-CD 3.32Å; S138-E141 WeakPolarHBondContact OG-CG 3.39Å; S138-E141 PolarHBondContact OG-N 3.43Å; S138-E141 PolarHBondContact OG-OE2 3.06Å; S138-T142 WeakPolarHBondContact O-CB 3.38Å; S138-T142 PolarHBondContact O-N 3.2Å; S138-T142 PolarHBondContact O-OG1 3.29Å
139K97.5Very high90.5Very high90 Ų9093.1 Ų93.139%0.39146%0.462SS..Hα-helixtrans-59.3-37.5-179.6-67.5-168.6174.4-165.70113N118 F121 L143N118-K139 WeakPolarHBondContact OD1-CE 3.36Å; N118-K139 PolarHBondContact OD1-NZ 3.47Å; F121-K139 HydrophobicContact CD1-CG 4.3Å; F121-K139 HydrophobicContact CE1-CB 3.95Å; F121-K139 HydrophobicContact CE1-CG 4.07Å; F121-K139 HydrophobicContact CE2-CD 4.34Å; F121-K139 HydrophobicContact CZ-CB 4.18Å; F121-K139 HydrophobicContact CZ-CD 4.29Å; F121-K139 HydrophobicContact CZ-CG 4.28Å; K139-L143 WeakPolarHBondContact O-CG 3.48Å; K139-L143 PolarHBondContact O-N 2.89Å
140Y97.9Very high90.7Very high164 Ų16495.6 Ų95.664%0.64347%0.47SS*.Hα-helixtrans-69.5-51.4177.4176.3-95.5000111.3S138 T142 L143 Q144S138-Y140 VanDerWaalsContact C-N 3.28Å; S138-Y140 PolarHBondContact O-N 3.49Å; Y140-T142 VanDerWaalsContact C-N 3.27Å; Y140-T142 PolarHBondContact O-N 2.73Å; Y140-L143 PolarHBondContact O-N 3.06Å; Y140-L143 VanDerWaalsContact O-N 3.11Å; Y140-Q144 VanDerWaalsContact CE1-OE1 3.26Å; Y140-Q144 PolarHBondContact O-N 3.31Å
141E96.3Very high91.6Very high64 Ų6496.6 Ų96.630%0.29947%0.468SS..Hα-helixtrans-58-39.4177-67.6160.9129.800111.5L137 S138 L143 Q144 M145L137-E141 HydrophobicContact CB-CB 4.14Å; L137-E141 HydrophobicContact CD2-CB 4.28Å; S138-E141 WeakPolarHBondContact CA-OE2 3.32Å; S138-E141 WeakPolarHBondContact CB-OE2 3.45Å; S138-E141 PolarHBondContact N-OE2 3.14Å; S138-E141 PolarHBondContact O-N 2.94Å; S138-E141 VanDerWaalsContact OG-CD 3.32Å; S138-E141 WeakPolarHBondContact OG-CG 3.39Å; S138-E141 PolarHBondContact OG-N 3.43Å; S138-E141 PolarHBondContact OG-OE2 3.06Å; E141-L143 PolarHBondContact O-N 2.99Å; E141-Q144 PolarHBondContact O-N 3.31Å; E141-M145 WeakPolarHBondContact O-CB 3.45Å; E141-M145 VanDerWaalsContact O-CG 3.26Å; E141-M145 WeakPolarHBondContact O-CG 3.48Å; E141-M145 PolarHBondContact O-N 2.98Å
142T97.1Very high93.1Very high0 Ų090 Ų900%045%0.446CS..Hα-helixtrans-59-45.1176.8-49.40000111.1F121 L124 R125 I128 L137 S138 Y140 A146F121-T142 HydrophobicContact CD1-CG2 4.13Å; L124-T142 HydrophobicContact CB-CG2 4.42Å; L124-T142 HydrophobicContact CD2-CG2 3.91Å; L124-T142 HydrophobicContact CG-CG2 3.96Å; R125-T142 HydrophobicContact CG-CG2 3.8Å; R125-T142 PolarHBondContact NE-OG1 3.49Å; R125-T142 PolarHBondContact NH2-OG1 3.47Å; I128-T142 HydrophobicContact CD1-CG2 3.67Å; I128-T142 VanDerWaalsContact CD1-O 3.25Å; I128-T142 WeakPolarHBondContact CD1-O 3.46Å; L137-T142 PolarHBondContact O-OG1 3.38Å; S138-T142 WeakPolarHBondContact O-CB 3.38Å; S138-T142 PolarHBondContact O-N 3.2Å; S138-T142 PolarHBondContact O-OG1 3.29Å; Y140-T142 VanDerWaalsContact C-N 3.27Å; Y140-T142 PolarHBondContact O-N 2.73Å; T142-A146 WeakPolarHBondContact O-CB 3.49Å; T142-A146 PolarHBondContact O-N 3.44Å
143L98.4Very high94.2Very high97 Ų9788.5 Ų88.551%0.50844%0.438SS..Hα-helixtrans-70.5-41179.6-67172.6000112F121 L124 K139 Y140 E141 A146 Q147F121-L143 HydrophobicContact CE1-CD2 4.22Å; F121-L143 HydrophobicContact CE1-CG 4.11Å; F121-L143 HydrophobicContact CZ-CD1 4.32Å; F121-L143 HydrophobicContact CZ-CD2 4.29Å; F121-L143 HydrophobicContact CZ-CG 4.31Å; L124-L143 HydrophobicContact CD2-CD2 4.46Å; K139-L143 WeakPolarHBondContact O-CG 3.48Å; K139-L143 PolarHBondContact O-N 2.89Å; Y140-L143 PolarHBondContact O-N 3.06Å; Y140-L143 VanDerWaalsContact O-N 3.11Å; E141-L143 PolarHBondContact O-N 2.99Å; L143-A146 PolarHBondContact O-N 3.1Å; L143-Q147 PolarHBondContact O-N 3.11Å; L143-Q147 VanDerWaalsContact O-N 3.08Å
144Q97.6Very high95.6Very high87 Ų8783.5 Ų83.541%0.40742%0.417SS..Hα-helixtrans-63.1-46.8177.3-173.4177.77.200111.4Y140 E141 Q147 I148Y140-Q144 VanDerWaalsContact CE1-OE1 3.26Å; Y140-Q144 PolarHBondContact O-N 3.31Å; E141-Q144 PolarHBondContact O-N 3.31Å; Q144-Q147 PolarHBondContact O-N 3.11Å; Q144-I148 HydrophobicContact CG-CD1 4.03Å; Q144-I148 WeakPolarHBondContact O-CG1 3.05Å; Q144-I148 PolarHBondContact O-N 2.93Å
145M97.1Very high96.4Very high49 Ų4981.8 Ų81.824%0.24140%0.403CS..Hα-helixtrans-66.5-36.8177.8-69.5-59-63.600112.4I128 F131 L137 E141 I148 Y149I128-M145 HydrophobicContact CD1-CB 4.36Å; I128-M145 HydrophobicContact CG2-CB 3.71Å; F131-M145 HydrophobicContact CE2-CE 4.32Å; L137-M145 HydrophobicContact CD1-CB 4.38Å; L137-M145 HydrophobicContact CD1-CG 4.15Å; E141-M145 WeakPolarHBondContact O-CB 3.45Å; E141-M145 VanDerWaalsContact O-CG 3.26Å; E141-M145 WeakPolarHBondContact O-CG 3.48Å; E141-M145 PolarHBondContact O-N 2.98Å; M145-I148 PolarHBondContact O-N 2.96Å; M145-I148 HydrophobicContact SD-CD1 4.26Å; M145-Y149 VanDerWaalsContact O-CB 3.26Å; M145-Y149 WeakPolarHBondContact O-CB 3.47Å; M145-Y149 PolarHBondContact O-N 3.38Å
146A98.3Very high96.7Very high13 Ų1382.6 Ų82.611%0.10741%0.413CS..Hα-helixtrans-59.7-45.5172.600000111.8L124 I128 T142 L143 Y149 I150L124-A146 HydrophobicContact CD1-CB 4.06Å; L124-A146 HydrophobicContact CD2-CB 4.27Å; L124-A146 HydrophobicContact CG-CB 4.47Å; I128-A146 HydrophobicContact CD1-CB 4.1Å; I128-A146 HydrophobicContact CG1-CB 4.49Å; T142-A146 WeakPolarHBondContact O-CB 3.49Å; T142-A146 PolarHBondContact O-N 3.44Å; L143-A146 PolarHBondContact O-N 3.1Å; A146-Y149 PolarHBondContact O-N 3.46Å; A146-I150 WeakPolarHBondContact O-CB 3.5Å; A146-I150 WeakPolarHBondContact O-CD1 3.08Å; A146-I150 VanDerWaalsContact O-CG1 3.25Å; A146-I150 WeakPolarHBondContact O-CG1 3.27Å; A146-I150 PolarHBondContact O-N 2.92Å
147Q98.3Very high96.9Very high127 Ų12782.8 Ų82.859%0.59342%0.42SS*.Hα-helixtrans-62.9-46.2177.5-175.4179.83.500112L143 Q144 Y149 N151L143-Q147 PolarHBondContact O-N 3.11Å; L143-Q147 VanDerWaalsContact O-N 3.08Å; Q144-Q147 PolarHBondContact O-N 3.11Å; Q147-Y149 VanDerWaalsContact C-N 3.31Å; Q147-Y149 PolarHBondContact O-N 3.45Å; Q147-N151 VanDerWaalsContact O-CG 3.29Å; Q147-N151 PolarHBondContact O-N 3.34Å; Q147-N151 VanDerWaalsContact O-N 3.1Å; Q147-N151 PolarHBondContact O-OD1 2.97Å
148I97.2Very high96.7Very high89 Ų8987.8 Ų87.846%0.45644%0.442SS..Hα-helixtrans-59.6-44.4176.6-67.3164.4000110.4Q144 M145 N151 A152Q144-I148 HydrophobicContact CG-CD1 4.03Å; Q144-I148 WeakPolarHBondContact O-CG1 3.05Å; Q144-I148 PolarHBondContact O-N 2.93Å; M145-I148 PolarHBondContact O-N 2.96Å; M145-I148 HydrophobicContact SD-CD1 4.26Å; I148-N151 PolarHBondContact O-N 2.97Å; I148-A152 WeakPolarHBondContact O-CB 3.41Å; I148-A152 PolarHBondContact O-N 3.43Å
149Y97.7Very high95.6Very high88 Ų8886.6 Ų86.635%0.34544%0.439SS..Hα-helixtrans-68.8-42-177.3-174.1-136.4000112.7V127 P129 M145 A146 Q147 N151 A152 L153V127-Y149 VanDerWaalsContact O-CE1 3.24Å; V127-Y149 WeakPolarHBondContact O-CE1 3.38Å; P129-Y149 HydrophobicContact CG-CD1 4.35Å; P129-Y149 HydrophobicContact CG-CD2 3.73Å; P129-Y149 HydrophobicContact CG-CE1 4.16Å; P129-Y149 HydrophobicContact CG-CE2 3.53Å; P129-Y149 HydrophobicContact CG-CG 4.15Å; M145-Y149 VanDerWaalsContact O-CB 3.26Å; M145-Y149 WeakPolarHBondContact O-CB 3.47Å; M145-Y149 PolarHBondContact O-N 3.38Å; A146-Y149 PolarHBondContact O-N 3.46Å; Q147-Y149 VanDerWaalsContact C-N 3.31Å; Q147-Y149 PolarHBondContact O-N 3.45Å; Y149-N151 VanDerWaalsContact C-N 3.32Å; Y149-N151 PolarHBondContact O-N 3.32Å; Y149-A152 PolarHBondContact O-N 3.11Å; Y149-L153 HydrophobicContact CD1-CD1 4.24Å; Y149-L153 HydrophobicContact CD2-CD1 4.27Å; Y149-L153 HydrophobicContact CD2-CG 4.07Å; Y149-L153 HydrophobicContact CE1-CD1 3.87Å; Y149-L153 HydrophobicContact CE2-CD1 3.89Å; Y149-L153 HydrophobicContact CE2-CD2 3.86Å; Y149-L153 HydrophobicContact CE2-CG 3.77Å; Y149-L153 HydrophobicContact CG-CD1 4.43Å; Y149-L153 WeakPolarHBondContact O-CG 3.32Å; Y149-L153 PolarHBondContact O-N 2.95Å
150I97.9Very high94.1Very high111 Ų11188.4 Ų88.457%0.56946%0.46SS*.Hα-helixtrans-58.5-45.5173.8-69.8164.2000110.6A146 L153 A154A146-I150 WeakPolarHBondContact O-CB 3.5Å; A146-I150 WeakPolarHBondContact O-CD1 3.08Å; A146-I150 VanDerWaalsContact O-CG1 3.25Å; A146-I150 WeakPolarHBondContact O-CG1 3.27Å; A146-I150 PolarHBondContact O-N 2.92Å; I150-L153 PolarHBondContact O-N 3.23Å; I150-A154 WeakPolarHBondContact O-CB 3.45Å; I150-A154 PolarHBondContact O-N 2.86Å
151N97.6Very high92.3Very high82 Ų8286.6 Ų86.644%0.43947%0.465SS..Hα-helixtrans-63.8-46.9178.3-70.1-3.1000111.8Q147 I148 Y149 L153 A154 E155Q147-N151 VanDerWaalsContact O-CG 3.29Å; Q147-N151 PolarHBondContact O-N 3.34Å; Q147-N151 VanDerWaalsContact O-N 3.1Å; Q147-N151 PolarHBondContact O-OD1 2.97Å; I148-N151 PolarHBondContact O-N 2.97Å; Y149-N151 VanDerWaalsContact C-N 3.32Å; Y149-N151 PolarHBondContact O-N 3.32Å; N151-L153 VanDerWaalsContact C-N 3.34Å; N151-L153 PolarHBondContact O-N 3.21Å; N151-A154 WeakPolarHBondContact O-CB 3.46Å; N151-A154 PolarHBondContact O-N 3.48Å; N151-A154 VanDerWaalsContact O-N 3.1Å; N151-E155 WeakPolarHBondContact O-CG 3.44Å; N151-E155 PolarHBondContact O-N 3.28Å
152A96.4Very high90.1Very high42 Ų4288.1 Ų88.135%0.34748%0.483SS..Hα-helixtrans-60.7-41.3178.800000112.3I148 Y149 E155 L156I148-A152 WeakPolarHBondContact O-CB 3.41Å; I148-A152 PolarHBondContact O-N 3.43Å; Y149-A152 PolarHBondContact O-N 3.11Å; A152-E155 PolarHBondContact O-N 3.47Å; A152-L156 VanDerWaalsContact O-CG 3.27Å; A152-L156 WeakPolarHBondContact O-CG 3.45Å; A152-L156 PolarHBondContact O-N 3.16Å
153L96.8Very high87.8Confident71 Ų7193.9 Ų93.937%0.37252%0.523SS..Hα-helixtrans-64.8-40.2173.3-69.2177.5000111.9Y149 I150 N151 L156 L157Y149-L153 HydrophobicContact CD1-CD1 4.24Å; Y149-L153 HydrophobicContact CD2-CD1 4.27Å; Y149-L153 HydrophobicContact CD2-CG 4.07Å; Y149-L153 HydrophobicContact CE1-CD1 3.87Å; Y149-L153 HydrophobicContact CE2-CD1 3.89Å; Y149-L153 HydrophobicContact CE2-CD2 3.86Å; Y149-L153 HydrophobicContact CE2-CG 3.77Å; Y149-L153 HydrophobicContact CG-CD1 4.43Å; Y149-L153 WeakPolarHBondContact O-CG 3.32Å; Y149-L153 PolarHBondContact O-N 2.95Å; I150-L153 PolarHBondContact O-N 3.23Å; N151-L153 VanDerWaalsContact C-N 3.34Å; N151-L153 PolarHBondContact O-N 3.21Å; L153-L156 PolarHBondContact O-N 3.23Å; L153-L157 WeakPolarHBondContact O-CB 3.49Å; L153-L157 VanDerWaalsContact O-CG 3.28Å; L153-L157 WeakPolarHBondContact O-CG 3.47Å; L153-L157 PolarHBondContact O-N 3.03Å
154A97Very high85.3Confident42 Ų4294.9 Ų94.935%0.34753%0.533SS..Hα-helixtrans-65.4-39177.400000112.4I150 N151 L157 Q158I150-A154 WeakPolarHBondContact O-CB 3.45Å; I150-A154 PolarHBondContact O-N 2.86Å; N151-A154 WeakPolarHBondContact O-CB 3.46Å; N151-A154 PolarHBondContact O-N 3.48Å; N151-A154 VanDerWaalsContact O-N 3.1Å; A154-L157 PolarHBondContact O-N 3.36Å; A154-Q158 WeakPolarHBondContact O-CG 3.33Å; A154-Q158 PolarHBondContact O-N 2.87Å; A154-Q158 VanDerWaalsContact O-N 3.15Å; A154-Q158 PolarHBondContact O-NE2 3.48Å
155E95.6Very high82.9Confident133 Ų13397.8 Ų97.862%0.62155%0.552SS**Hα-helixtrans-64.3-46.3174-73.2171.1-158.200111.4N151 A152 L157 Q158 G159N151-E155 WeakPolarHBondContact O-CG 3.44Å; N151-E155 PolarHBondContact O-N 3.28Å; A152-E155 PolarHBondContact O-N 3.47Å; E155-L157 VanDerWaalsContact C-N 3.29Å; E155-L157 PolarHBondContact O-N 3.29Å; E155-Q158 PolarHBondContact O-N 3.42Å; E155-G159 PolarHBondContact O-N 3.45Å
156L95.7Very high80.2Confident136 Ų136102.8 Ų102.871%0.71258%0.579SS**Hα-helixtrans-59.4-37.6176.4-71.9169.9000112.7A152 L153 G159A152-L156 VanDerWaalsContact O-CG 3.27Å; A152-L156 WeakPolarHBondContact O-CG 3.45Å; A152-L156 PolarHBondContact O-N 3.16Å; L153-L156 PolarHBondContact O-N 3.23Å; L156-G159 PolarHBondContact O-N 3.07Å
157L95.3Very high78Confident155 Ų155111.2 Ų111.281%0.81262%0.616SS**Hα-helixtrans-74.7-26.1178.5-71.9172.1000114L153 A154 E155 G159L153-L157 WeakPolarHBondContact O-CB 3.49Å; L153-L157 VanDerWaalsContact O-CG 3.28Å; L153-L157 WeakPolarHBondContact O-CG 3.47Å; L153-L157 PolarHBondContact O-N 3.03Å; A154-L157 PolarHBondContact O-N 3.36Å; E155-L157 VanDerWaalsContact C-N 3.29Å; E155-L157 PolarHBondContact O-N 3.29Å; L157-G159 PolarHBondContact O-N 3.19Å
158Q89.9Confident75.3Confident150 Ų150111.2 Ų111.270%0.70162%0.621SS**Hα-helixtrans-75.7-8.1172.5-74.8166.592.700112.4A154 E155A154-Q158 WeakPolarHBondContact O-CG 3.33Å; A154-Q158 PolarHBondContact O-N 2.87Å; A154-Q158 VanDerWaalsContact O-N 3.15Å; A154-Q158 PolarHBondContact O-NE2 3.48Å; E155-Q158 PolarHBondContact O-N 3.42Å
159G72Confident72.7Confident29 Ų29111 Ų11130%0.29963%0.627SS.*  trans72.2169.5-173.400000112E155 L156 L157 V161E155-G159 PolarHBondContact O-N 3.45Å; L156-G159 PolarHBondContact O-N 3.07Å; L157-G159 PolarHBondContact O-N 3.19Å; G159-V161 PolarHBondContact O-N 2.84Å
160P66.8Low70.3Confident128 Ų128115.8 Ų115.883%0.83165%0.652SS**SBendtrans-61.6107.3163.227.7-31.2000106.9S162P160-S162 PolarHBondContact O-N 3.44Å
161V59.8Low67.4Low126 Ų126114 Ų11476%0.76466%0.66SS**  trans-49.3115169.5-139.10000105.4G159 S163G159-V161 PolarHBondContact O-N 2.84Å; V161-S163 PolarHBondContact O-N 3.24Å
162S50.2Low64.8Low95 Ų95115.8 Ų115.866%0.66468%0.68SS**  trans-60.8114.1174-66.80000105.4P160 T164P160-S162 PolarHBondContact O-N 3.44Å; S162-T164 PolarHBondContact O-N 3.19Å; S162-T164 PolarHBondContact O-OG1 3.06Å
163S49.2Very low62.5Low121 Ų121117.9 Ų117.985%0.84669%0.69SS**  trans-70.359.6177.4-60.50000110.1V161 N165V161-S163 PolarHBondContact O-N 3.24Å; S163-N165 VanDerWaalsContact C-N 3.34Å; S163-N165 PolarHBondContact O-N 3.36Å; S163-N165 VanDerWaalsContact O-N 3.07Å
164T45.4Very low60Low118 Ų118123.8 Ų123.872%0.72471%0.712SS**  trans-7790.1170.752.80000107.5S162S162-T164 PolarHBondContact O-N 3.19Å; S162-T164 PolarHBondContact O-OG1 3.06Å
165N46.1Very low57.7Low148 Ų148131.8 Ų131.879%0.79173%0.733SS**  trans26.498.5154.5-62.8-10.6000116.3S163S163-N165 VanDerWaalsContact C-N 3.34Å; S163-N165 PolarHBondContact O-N 3.36Å; S163-N165 VanDerWaalsContact O-N 3.07Å
166N42Very low55.2Low154 Ų154132.1 Ų132.182%0.82474%0.74SS**  trans-132.166.3142.7-155.9-6.2000110.2N168N166-N168 PolarHBondContact O-N 3.47Å
167E50.4Low53Low190 Ų190133.2 Ų133.289%0.88874%0.744SS**  trans-66.882.9162.3-71.2-113.9118.400108.9
168N41.9Very low50.7Low128 Ų128133.9 Ų133.968%0.68475%0.748SS**  trans-152.8128.4153.5-147.1-9.8000115.2N166N166-N168 PolarHBondContact O-N 3.47Å
169S43.7Very low48.4Very low83 Ų83133.8 Ų133.858%0.5875%0.752SS**  trans76.5103.6147.4-75.60000121.5
170H47Very low46.7Very low190 Ų190138 Ų13888%0.8878%0.777SS**  trans73.8107.8137.1-68.7-74000120.3
171G37.3Very low46Very low72 Ų72138 Ų13874%0.74278%0.776SS**  trans172.146.3164.900000116.3P173G171-P173 VanDerWaalsContact O-CD 3.27Å; G171-P173 WeakPolarHBondContact O-CD 3.32Å
172S42.4Very low45Very low121 Ų121136.2 Ų136.285%0.84678%0.775SS**  trans-59.4119.9-177-49.60000113.4K174S172-K174 PolarHBondContact O-N 3.28Å
173P47.8Very low44.4Very low85 Ų85139.6 Ų139.655%0.55279%0.785SS**  trans-85.6111.316831.9-27.8000109.7G171 R175G171-P173 VanDerWaalsContact O-CD 3.27Å; G171-P173 WeakPolarHBondContact O-CD 3.32Å; P173-R175 PolarHBondContact O-N 3.03Å
174K45.1Very low43.6Very low196 Ų196137.3 Ų137.385%0.85278%0.781SS**  trans-61.4131.5165.6-79.8-178171-178.40109.3S172S172-K174 PolarHBondContact O-N 3.28Å
175R47.5Very low43Very low209 Ų209140.3 Ų140.379%0.78979%0.785SS**  trans-12858.3-178.7-54.4-170-172.2109.4-3.2111.3P173P173-R175 PolarHBondContact O-N 3.03Å
176D43.8Very low42.5Very low140 Ų140141.3 Ų141.375%0.74979%0.785SS**  trans-113.372.3-177.9-57.9-54.9000111.4
177I49.3Very low42Very low159 Ų159137.4 Ų137.482%0.81578%0.781SS**  trans-131.388.6156.5-59.4-176.4000107.7
178L46.6Very low41.2Very low169 Ų169133 Ų13389%0.88578%0.777SS**  trans-73.2133169.5-169.778.9000109.1
179L41.5Very low41Very low149 Ų149135.4 Ų135.478%0.7878%0.781SS**  trans-71.3134.9166.6-74.571.2000109.5
180S37.3Very low40.5Very low118 Ų118138 Ų13883%0.82578%0.784SS**  -179.4160.1126.2-86.30000114.1
181P51.6Low40Very low126 Ų126139.9 Ų139.982%0.81878%0.784SS**  trans-100.8168.5-165.740-35.8000114.2
182A39.3Very low39.7Very low89 Ų89141.3 Ų141.374%0.73679%0.788SS**  trans-150.5116.1165.300000112.8
183D36.8Very low39.5Very low166 Ų166139.5 Ų139.589%0.88878%0.781SS**  trans45.4145.8133.2-57.8-49.6000126
184G32.7Very low39Very low74 Ų74144.7 Ų144.776%0.76380%0.797SS**  trans86.3101.2139.700000117.2
185F33.8Very low38.6Very low181 Ų181140.7 Ų140.779%0.79479%0.794SS**  83115.668.4-171.2-95.8000115.4
186E35.4Very low38.5Very low168 Ų168136.4 Ų136.479%0.78579%0.793SS**  trans38.3151.5163.1-71.9-162.717000124.3
187G31Very low38.2Very low72 Ų72134.5 Ų134.574%0.74279%0.791SS**  trans15280.7139.100000118.2
188A34.3Very low37.7Very low98 Ų98134.7 Ų134.781%0.8179%0.793SS**  trans38.9116.9144.300000122.5
189K36.2Very low37.4Very low178 Ų178131.9 Ų131.977%0.77478%0.783SS**  63.4106.6113-151.6-149.1-176.9-148.10119.4
190E34.6Very low37Very low139 Ų139130.8 Ų130.865%0.6579%0.787SS**  167.6125.2108.8-86.3-159.1-177.400115.4
191R34.9Very low37.2Very low229 Ų229136.2 Ų136.286%0.86479%0.789SS**  42.3107.6129.1-167-175-166.3172.33.2120.4
192A32.8Very low36.5Very low101 Ų101137.1 Ų137.184%0.83579%0.792SS**  -165.2156.3116.800000113
193A36.4Very low36.4Very low83 Ų83137.1 Ų137.169%0.68679%0.792SS**  trans-76.5147.8-177.500000114
194Q37.8Very low36.4Very low194 Ų194135.8 Ų135.891%0.90779%0.79SS**  -169.9120.1127.1-102.2147.194.400111.1
195S38.1Very low36.7Very low113 Ų113136.6 Ų136.679%0.7979%0.789SS**  trans-88.6159.1159.942.60000109.4
196P45.2Very low36.8Very low118 Ų118136 Ų13677%0.76679%0.793SS**  -131.7142.3117.533.7-25.1000113.3
197S35.7Very low37.4Very low100 Ų100132.6 Ų132.670%0.69979%0.786SS**  trans-65.4138.4166.7177.10000110.5
198L39.9Very low37.9Very low164 Ų164136.7 Ų136.786%0.85979%0.79SS**  trans-112.9104.1162-73.3-179.2000110.3C200L198-C200 PolarHBondContact O-N 3.49Å
199T39.3Very low38.1Very low109 Ų109137.9 Ų137.967%0.66979%0.792SS**  trans-55.1121.4179.6-54.40000113.2R201T199-R201 HydrophobicContact CG2-CG 4.25Å; T199-R201 PolarHBondContact O-N 3.29Å
200C34Very low38.4Very low127 Ų127132.9 Ų132.986%0.85879%0.791SS**  trans-69.399.3166.6-60.70000110.3L198L198-C200 PolarHBondContact O-N 3.49Å
201R40.4Very low38.6Very low232 Ų232134 Ų13488%0.87580%0.802SS**  trans-87.7106.9171.9-85.9-170.1162.2-161-4.6111.5T199T199-R201 HydrophobicContact CG2-CG 4.25Å; T199-R201 PolarHBondContact O-N 3.29Å
202T38.3Very low39.1Very low144 Ų144127.5 Ų127.588%0.88380%0.797SS**  trans-67.8129.4161.5-59.90000110
203A37.7Very low39.6Very low89 Ų89129.7 Ų129.774%0.73679%0.793SS**  trans-143.8110.3167.500000111.7
204V34.9Very low40.2Very low139 Ų139131.2 Ų131.284%0.84280%0.796SS**  trans18.8127.8142.8-171.90000118.8
205A39.5Very low40.6Very low91 Ų91127.6 Ų127.675%0.75279%0.787SS**  trans-81.6152.7170.300000113.3
206L37.4Very low40.9Very low167 Ų167130.2 Ų130.287%0.87479%0.786SS**  trans-173166.2150.6-96.8161.6000107.6
207P47.4Very low40.9Very low97 Ų97131.5 Ų131.563%0.6379%0.785SS**  -125.5175.9-124.743.8-32.2000117
208L40.9Very low41.4Very low159 Ų159133.6 Ų133.683%0.83279%0.788SS**  trans59.699.6152-73.4157.6000118.9
209S38.6Very low41.5Very low122 Ų122128.9 Ų128.985%0.85378%0.779SS**  -174.5160.4108.7-77.70000109.9
210G41.8Very low41.8Very low73 Ų73132.2 Ų132.275%0.75379%0.79SS**  trans-75.7143.8-167.900000114.4
211D38.9Very low42.3Very low164 Ų164132.4 Ų132.488%0.87779%0.789SS**  -158.8162.4127.4-114.2-32000110.7
212A45.9Very low42.2Very low92 Ų92131.1 Ų131.176%0.7679%0.79SS**  trans-68.8137.7-171.300000113.4P214A212-P214 WeakPolarHBondContact O-CD 3.45Å
213I42.7Very low42.7Very low146 Ų146135.2 Ų135.275%0.74979%0.79SS**  trans-82.3117.8173.2-59-63.9000110.1V215I213-V215 HydrophobicContact CG2-CG2 4.3Å; I213-V215 PolarHBondContact O-N 2.97Å
214P48.7Very low42.8Very low116 Ų116136 Ų13675%0.75379%0.79SS**  trans-82.1100.8172.432.2-31.6000110.3A212 H216A212-P214 WeakPolarHBondContact O-CD 3.45Å; P214-H216 PolarHBondContact O-N 2.83Å; P214-H216 VanDerWaalsContact O-N 3.15Å
215V46.9Very low43.5Very low117 Ų117134.2 Ų134.271%0.70978%0.783SS**  trans-76.999.1167.6-176.40000108.3I213 I217I213-V215 HydrophobicContact CG2-CG2 4.3Å; I213-V215 PolarHBondContact O-N 2.97Å; V215-I217 HydrophobicContact CG1-CD1 4.37Å; V215-I217 HydrophobicContact CG1-CG1 3.9Å; V215-I217 PolarHBondContact O-N 2.88Å
216H44.4Very low43.3Very low169 Ų169139.2 Ų139.278%0.78279%0.789SS**  trans-76.390.5-178.3-159.3-79.7000111.1P214 N218P214-H216 PolarHBondContact O-N 2.83Å; P214-H216 VanDerWaalsContact O-N 3.15Å; H216-N218 PolarHBondContact CE1-OD1 3.46Å; H216-N218 PolarHBondContact ND1-OD1 2.87Å
217I45.8Very low43.8Very low144 Ų144139.5 Ų139.574%0.73879%0.786SS**  trans-92.2115.9174.2-45.2177.5000108.4V215 G219V215-I217 HydrophobicContact CG1-CD1 4.37Å; V215-I217 HydrophobicContact CG1-CG1 3.9Å; V215-I217 PolarHBondContact O-N 2.88Å; I217-G219 PolarHBondContact O-N 3.13Å
218N46.4Very low43.3Very low144 Ų144143.9 Ų143.977%0.7780%0.797SS**  trans-67.9112.4175.9-75.1-2.3000110.5H216H216-N218 PolarHBondContact CE1-OD1 3.46Å; H216-N218 PolarHBondContact ND1-OD1 2.87Å
219G42.5Very low43.6Very low65 Ų65143.1 Ų143.167%0.6779%0.794SS**  trans168.588.5172.800000115.9I217I217-G219 PolarHBondContact O-N 3.13Å
220M44.1Very low44.1Very low179 Ų179142.9 Ų142.988%0.88279%0.792SS**  trans59.6114.6159.7-57.9-170.2175.300118.9F222M220-F222 PolarHBondContact O-N 3.26Å
221P45.2Very low43.8Very low131 Ų131148.9 Ų148.985%0.85180%0.798SS**  trans-76.1107.7167.431.1-31.6000110.9R223P221-R223 PolarHBondContact O-N 3.15Å
222F38.4Very low44.1Very low205 Ų205148.5 Ų148.590%0.89980%0.802SS**  trans-69.6110165.9-125.3-90.8000108.9M220 S224M220-F222 PolarHBondContact O-N 3.26Å; F222-S224 VanDerWaalsContact C-N 3.28Å; F222-S224 PolarHBondContact O-N 2.83Å
223R49.2Very low44.1Very low230 Ų230147.2 Ų147.287%0.86880%0.798SS**  trans-78.478.3179-160-176.7-155.3-93.74.1109.9P221 S225P221-R223 PolarHBondContact O-N 3.15Å; R223-S225 PolarHBondContact O-N 2.73Å; R223-S225 VanDerWaalsContact O-N 3.1Å
224S38.6Very low43.9Very low106 Ų106151.7 Ų151.774%0.74181%0.805SS**  trans-69.4104172.7-170.10000110F222 F226F222-S224 VanDerWaalsContact C-N 3.28Å; F222-S224 PolarHBondContact O-N 2.83Å; S224-F226 PolarHBondContact O-N 2.8Å
225S49.2Very low43.5Very low101 Ų101152.9 Ų152.971%0.70681%0.81SS**  trans-9183.4166.858.50000109.6R223R223-S225 PolarHBondContact O-N 2.73Å; R223-S225 VanDerWaalsContact O-N 3.1Å
226F36.9Very low43.2Very low197 Ų197156.9 Ų156.986%0.86482%0.821SS**  trans-142.9142.3154.9-137.2-98.8000110.5S224S224-F226 PolarHBondContact O-N 2.8Å
227Q46.3Very low42.9Very low173 Ų173158 Ų15881%0.80883%0.827SS**  trans-99.999.4-157.7-171.7171.11900110.7
228E38.4Very low42.5Very low188 Ų188155.8 Ų155.888%0.87983%0.831SS**  trans-107.859.3179.8-159167.7179.100112.2
229N47.1Very low42Very low144 Ų144158.1 Ų158.177%0.7784%0.839SS**  trans-106.261.1170.5-79.294.7000110.8
230S48.7Very low41.6Very low116 Ų116160.8 Ų160.881%0.81185%0.846SS**SBendtrans-170.883.9164.5-84.40000113.6
231F35.1Very low41.4Very low199 Ų199157.8 Ų157.887%0.87384%0.843SS**SBendtrans-160.7-27.5143.7-151.4-111.5000116.4G233F231-G233 PolarHBondContact O-N 2.99Å
232T46Very low41.3Very low156 Ų156157.7 Ų157.796%0.95784%0.842SS**  trans-81.477.6-176.255.80000111.8
233G44.5Very low41.2Very low66 Ų66153.4 Ų153.468%0.6884%0.837SS**  trans-163.945-17200000116.2F231F231-G233 PolarHBondContact O-N 2.99Å
234R39.6Very low40.4Very low239 Ų239148.1 Ų148.190%0.90284%0.836SS**  trans-159.4149.9161.8-126.8170.8-174.2160.43.2112.9
235V39.2Very low40.2Very low141 Ų141148.4 Ų148.486%0.85584%0.838SS**  trans74.760.9170.2-520000119.3
236E42.5Very low39.5Very low201 Ų201148.7 Ų148.794%0.93984%0.84SS**  trans-133.765.6148.1-163.1175.5-144.900111.2
237E38Very low39.4Very low192 Ų192146.5 Ų146.590%0.89784%0.843SS**  trans-156.590.3171.7-165.4177179.200111.5
238A36.4Very low39.3Very low99 Ų99146.2 Ų146.282%0.81885%0.846SS**  trans-169.246.3163.100000112.7C240A238-C240 PolarHBondContact O-N 3.3Å; A238-C240 VanDerWaalsContact O-N 3.13Å
239M35.8Very low39.4Very low192 Ų192144.6 Ų144.695%0.94685%0.849SS**  trans-8279.2170.5-75.7-76.7-8800110.4
240C34.9Very low38.8Very low122 Ų122140.8 Ų140.882%0.82484%0.843SS**  trans-144.8120.1167.8-91.60000111.7A238A238-C240 PolarHBondContact O-N 3.3Å; A238-C240 VanDerWaalsContact O-N 3.13Å
241S39.2Very low38.2Very low116 Ų116143.8 Ų143.881%0.81185%0.85SS**  trans-67160173.3-48.10000112.6
242P43.4Very low38.2Very low129 Ų129137.9 Ų137.984%0.83885%0.846SS**  -132.8131.8129.734.8-24.9000113.1
243S35.3Very low38.3Very low114 Ų114141.5 Ų141.580%0.79784%0.842SS**  trans-91.1127.5163.2-65.50000109.7
244S33.7Very low38.3Very low120 Ų120148.1 Ų148.184%0.83985%0.852SS**  trans-165.5103.7154.8-840000113
245S34.2Very low38.7Very low111 Ų111145.1 Ų145.178%0.77685%0.848SS**  trans35.8119.5140.7-530000123.3
246S34.2Very low39.1Very low107 Ų107143.9 Ų143.975%0.74885%0.846SS**  trans65.4114.3130.5660000122
247T35.7Very low39.7Very low151 Ų151140 Ų14093%0.92684%0.838SS**  -157151.2115.9-2.80000111.7
248L42.6Very low40.2Very low168 Ų168142 Ų14288%0.8884%0.837SS**  trans-93.1125.3-178.1-76.9155.3000111.8
249V41Very low41Very low154 Ų154143 Ų14393%0.93384%0.838SS**  trans-178.6150.7147.2-89.70000106.4
250G35.2Very low41.5Very low63 Ų63141.2 Ų141.265%0.64983%0.832SS**  cis147.595.8600000109.9
251N36.1Very low42.2Very low179 Ų179139.1 Ų139.196%0.95783%0.831SS**  trans68.2149.3166.7-58.2-4.9000119.5
252G35.5Very low43Very low76 Ų76141.9 Ų141.978%0.78483%0.832SS**  trans136.364.2158.600000117.5K254G252-K254 PolarHBondContact O-N 3.34Å
253R47.2Very low43Very low231 Ų231144.2 Ų144.287%0.87283%0.829SS**  trans-67.7126.5163.5-68.1177.7179.1-109.50.6109.7
254K45Very low44.3Very low205 Ų205143.9 Ų143.989%0.89183%0.826SS**  trans-140.488.1160.5-83.5-170.4174.5177.90110.1G252G252-K254 PolarHBondContact O-N 3.34Å
255E48.5Very low45.3Very low176 Ų176142.8 Ų142.882%0.82282%0.816SS**  trans-68.5138.4159.6-70.4164.5137.400108.2
256S46.6Very low45.9Very low116 Ų116148 Ų14881%0.81182%0.819SS**  trans-112.3141.8179.1-148.20000109.7
257P55.1Low46.6Very low119 Ų119147.5 Ų147.577%0.77382%0.816SS**  trans-81.7142.9-149.1-15.832.5000114.3
258R48.6Very low47.6Very low234 Ų234147.8 Ų147.888%0.88381%0.806SS**  trans-76.1135.7158.1-72.7-177.6165.4103.7-0.3108.2D260R258-D260 PolarHBondContact O-N 3.25Å
259S52.5Low47.7Very low119 Ų119149 Ų14983%0.83281%0.805SS**  trans-76.8102.4175.455.40000110.5G261S259-G261 PolarHBondContact O-N 3.49Å
260D46.5Very low48.6Very low155 Ų155146.9 Ų146.983%0.82980%0.797SS**  trans-68.699.4168.1-76.5-51000109.7R258 E262R258-D260 PolarHBondContact O-N 3.25Å; D260-E262 VanDerWaalsContact C-N 3.31Å; D260-E262 PolarHBondContact O-N 2.96Å
261G51.2Low49.4Very low78 Ų78149.9 Ų149.980%0.80480%0.798SS**  trans-73.684.6171.800000110.2S259 F263S259-G261 PolarHBondContact O-N 3.49Å; G261-F263 PolarHBondContact O-N 3.49Å
262E55.7Low50.7Low175 Ų175146.5 Ų146.582%0.81879%0.788SS**  trans-60.3122.9-173.1-159.6177.3160.100112.5D260 S264D260-E262 VanDerWaalsContact C-N 3.31Å; D260-E262 PolarHBondContact O-N 2.96Å; E262-S264 PolarHBondContact O-N 2.78Å
263F43.3Very low51.9Low178 Ų178149.4 Ų149.478%0.78179%0.786SS**  trans-72.9112.1179.4176.3-97.5000109.7G261 P265G261-F263 PolarHBondContact O-N 3.49Å; F263-P265 HydrophobicContact CD1-CB 4.33Å; F263-P265 HydrophobicContact CD1-CG 4.22Å; F263-P265 HydrophobicContact CE1-CB 3.8Å; F263-P265 HydrophobicContact CE1-CG 4.09Å; F263-P265 WeakPolarHBondContact O-CD 3.35Å
264S61.2Low52.8Low106 Ų106147.3 Ų147.374%0.74179%0.786SS**  trans-96.198.4174.6-81.40000112.4E262 R266E262-S264 PolarHBondContact O-N 2.78Å; S264-R266 VanDerWaalsContact C-N 3.34Å; S264-R266 PolarHBondContact O-N 2.93Å; S264-R266 VanDerWaalsContact O-N 3.11Å
265P54.8Low53.4Low97 Ų97144.9 Ų144.963%0.6378%0.781SS**  trans-84.673173.435.4-35.3000110.4F263 S267F263-P265 HydrophobicContact CD1-CB 4.33Å; F263-P265 HydrophobicContact CD1-CG 4.22Å; F263-P265 HydrophobicContact CE1-CB 3.8Å; F263-P265 HydrophobicContact CE1-CG 4.09Å; F263-P265 WeakPolarHBondContact O-CD 3.35Å; P265-S267 PolarHBondContact O-N 2.9Å; P265-S267 VanDerWaalsContact O-N 3.11Å
266R47.6Very low53.9Low220 Ų220144.6 Ų144.683%0.8381%0.809SS**  trans-81.597178.3-154.2168.1-177.7176.2-0.8110.7S264 H268S264-R266 VanDerWaalsContact C-N 3.34Å; S264-R266 PolarHBondContact O-N 2.93Å; S264-R266 VanDerWaalsContact O-N 3.11Å; R266-H268 PolarHBondContact O-N 2.73Å
267S49.6Very low54.3Low98 Ų98146.1 Ų146.169%0.68581%0.809SS**  trans-66.4123175.449.50000112P265P265-S267 PolarHBondContact O-N 2.9Å; P265-S267 VanDerWaalsContact O-N 3.11Å
268H55.8Low54.2Low157 Ų157147.5 Ų147.573%0.72781%0.811SS**  trans-122.882.8154.6-80.4-82.8000108.6R266 S270R266-H268 PolarHBondContact O-N 2.73Å; H268-S270 PolarHBondContact O-N 3.06Å
269F45.8Very low54.5Low194 Ų194142.7 Ų142.785%0.85181%0.807SS**  trans-66105.6149.1-103.3-101.8000106D271F269-D271 VanDerWaalsContact C-N 3.27Å; F269-D271 PolarHBondContact O-N 3.06Å
270S59.3Low54.7Low109 Ų109144.1 Ų144.176%0.76281%0.805SS**  trans-83.688.8153.6-83.30000106.5H268H268-S270 PolarHBondContact O-N 3.06Å
271D51Low55.2Low126 Ų126143.4 Ų143.467%0.67480%0.804SS**  trans-68.8134.9157.8-171.128.8000108.3F269F269-D271 VanDerWaalsContact C-N 3.27Å; F269-D271 PolarHBondContact O-N 3.06Å
272S63.5Low55.4Low107 Ų107147.7 Ų147.775%0.74880%0.804SS**  trans-156.373.1177.1-66.10000108.2E274S272-E274 PolarHBondContact O-N 3.45Å
273D62.2Low55.4Low137 Ų137145.8 Ų145.873%0.73380%0.803SS**  trans-49.9117.9148.3-96.2-60.7000109.2
274E65.6Low56.4Low187 Ų187143.3 Ų143.387%0.87480%0.804SS**  trans-131121.8145.8-166.3177.8104.800108.6S272S272-E274 PolarHBondContact O-N 3.45Å
275I57.5Low56Low154 Ų154146.4 Ų146.479%0.7981%0.81SS**  trans-99126.9179.542.8160.2000110.1
276A58.8Low56.1Low171 Ų171150.9 Ų150.9100%1.41383%0.826SS**  trans-155.50161.500000110.2

Retrieved 276 of 276 residues in 156.1 ms (Link to these results)