A0A096NH47_PAPAN Loading...

ALX homeobox 3

AlphaFold DB , UniProt , Accession A0A096NH47, Species PAPAN (Papio anubis, Olive baboon), Gene ALX3, Length 343 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
1M45.1Very low51.6Low226 Ų226153.5 Ų153.5100%1.11381%0.807SS**  046.80-65-176.5166.400108.4
2D40.8Very low50.9Low152 Ų152146.3 Ų146.381%0.81380%0.797SS**  87.4126.764.2-85.7-76.7000112.2
3P57.8Low51.5Low104 Ų104144.7 Ų144.768%0.67580%0.799SS**  trans-101.7-116.8-171.937.5-23.1000110.1
4E50.6Low51.7Low137 Ų137141.4 Ų141.464%0.6480%0.8SS**  trans66.5113.6-175.9-45.2-60.297.800113.9
5H59.9Low52.4Low185 Ų185140.3 Ų140.386%0.85680%0.801SS**  cis-139.7141.440.9-79.366.2000113.8
6C44.3Very low52.2Low116 Ų116136 Ų13678%0.78480%0.797SS**  trans-110.6134.1-176.3-170.90000110.9
7A55.3Low52.4Low86 Ų86135.5 Ų135.571%0.71180%0.798SS**  trans61.5-172152.200000117.4
8P58.4Low52.1Low109 Ų109141 Ų14171%0.70881%0.805SS**  cis-126.2172.2-22.711.313.1000114.7
9F48.8Very low52.1Low188 Ų188139.7 Ų139.783%0.82580%0.8SS**  trans-1.8134.1147.3-70.7-101.9000118.9V11F9-V11 HydrophobicContact CD1-CG2 4.42Å
10R50.3Low51.9Low254 Ų254137.5 Ų137.596%0.95880%0.799SS**  trans-132.3133.1132.1-89.2-152.9172.8-143.3-0.4112.9
11V56.1Low51.8Low131 Ų131136.7 Ų136.779%0.79480%0.801SS**  trans-100.6142.6175.9166.90000109.5F9F9-V11 HydrophobicContact CD1-CG2 4.42Å
12G44Very low51.7Low67 Ų67129.4 Ų129.469%0.69178%0.784SS**  trans90.3177152.900000117.5
13P58.2Low52.1Low126 Ų126130.4 Ų130.482%0.81879%0.789SS**  cis-121.6162.2-10.438.7-25.8000113.5
14A54.6Low51.9Low99 Ų99134 Ų13482%0.81880%0.797SS**  trans-87.4131.4160.500000109.9
15P61.8Low52.3Low125 Ų125132.1 Ų132.181%0.81280%0.797SS**  trans-90.6134.915832.7-28.1000110.2
16G49.3Very low52.5Low71 Ų71129 Ų12973%0.73279%0.793SS**  trans-88.5-143.5-172.800000115.5
17P54.9Low52.5Low127 Ų127127 Ų12783%0.82579%0.792SS**PPolyproline II helixtrans-82.6149.1-144.332.6-37.6000114.2
18Y47.5Very low52.6Low235 Ų235129.2 Ų129.292%0.92280%0.799SS**PPolyproline II helixtrans-79.3132.2164.8-147.7-95.2000110.6
19V52.3Low52.3Low117 Ų117133.6 Ų133.671%0.70981%0.81SS**PPolyproline II helixtrans-56.6142.4-169.8170.20000113.4
20A47.8Very low52.2Low94 Ų94128.4 Ų128.478%0.77781%0.81SS**PPolyproline II helixtrans-83138.3166.700000111.6
21S50.5Low52.1Low121 Ų121123 Ų12385%0.84681%0.805SS**  trans-133.7130.8151.4-57.70000105.3
22G43Very low52.2Low73 Ų73122.5 Ų122.575%0.75381%0.805SS**  cis125.985.211.500000108.9
23D49.4Very low52.1Low173 Ų173124.2 Ų124.293%0.92581%0.812SS**  trans-164.2143142.4-135.4-140.5000110.6
24E52.3Low51.8Low179 Ų179123.4 Ų123.484%0.83682%0.816SS**  trans-114.7177.7-176.9-115.9-142.526.400110.9
25P59.9Low51.8Low99 Ų99122.7 Ų122.764%0.64381%0.81SS**  trans-109.3-139.4-159.246.5-37.2000110.9
26P63.9Low51.8Low119 Ų119122.4 Ų122.477%0.77381%0.809SS**  cis-130.7166.4-29.136.1-19.8000115.9
27G43.9Very low51.9Low73 Ų73127.9 Ų127.975%0.75382%0.815SS**  trans93.9-179.715000000118.1
28P58.2Low51.8Low134 Ų134129.7 Ų129.787%0.8782%0.816SS**  cis-123.7-172.3-5.741.4-26.8000114.2
29Q52.4Low52.3Low201 Ų201126.8 Ų126.894%0.93981%0.811SS**  trans-73152.3-178.2-60.9179.277.700114.2
30G45.1Very low52.6Low79 Ų79126.5 Ų126.581%0.81481%0.811SS**  trans-166.286.8170.700000113.8
31T48.9Very low53.3Low139 Ų139126.3 Ų126.385%0.85381%0.81SS**  trans-84.1175.4159.553.70000109.6
32P58.7Low54.1Low122 Ų122125.9 Ų125.979%0.79280%0.804SS**  cis-130.8165.8-4.740.1-25.1000114.7
33A41.6Very low55.1Low102 Ų102128.5 Ų128.584%0.84381%0.808SS**  trans-160.3136.8149.900000111.1
34A51.7Low55.6Low110 Ų110132.2 Ų132.291%0.90981%0.809SS**  trans-87.7141.1-17900000112.5
35A55.2Low56.1Low84 Ų84126.5 Ų126.569%0.69480%0.798SS**  trans-144133.1159.800000109.1
36P60.7Low56.1Low119 Ų119127.9 Ų127.977%0.77381%0.807SS**  trans-76129.3-176.629.4-33.6000111.7L38P36-L38 PolarHBondContact O-N 3.36Å; P36-L38 VanDerWaalsContact O-N 3.1Å
37H50.9Low55.9Low186 Ų186133.6 Ų133.686%0.86181%0.813SS**  trans-68.5104.1171.8-71.5-90000111.1
38L54Low56.5Low164 Ų164138 Ų13886%0.85982%0.819SS**  trans-107.293.3161.1-77.1173.1000109.1P36P36-L38 PolarHBondContact O-N 3.36Å; P36-L38 VanDerWaalsContact O-N 3.1Å
39H57.8Low56.6Low174 Ų174137.3 Ų137.381%0.80681%0.812SS**PPolyproline II helixtrans-84.5127.9169.6-128.5-90.3000109.2
40P58.8Low56.6Low111 Ų111138.9 Ų138.972%0.72181%0.81SS**PPolyproline II helixtrans-70.2138.6178.328.3-33.5000110.9
41A61.6Low56.7Low90 Ų90144.5 Ų144.574%0.74481%0.812SS**PPolyproline II helixtrans-68.5145.617500000111.3
42P67.8Low57.2Low113 Ų113143.3 Ų143.373%0.73481%0.807SS**PPolyproline II helixtrans-66.9147.7177.727.9-34.7000111.7R44P42-R44 PolarHBondContact O-N 3.33Å
43P63.5Low56.9Low128 Ų128142.4 Ų142.483%0.83181%0.809SS**PPolyproline II helixtrans-65.4133.2-178.926.6-34000111.5G45P43-G45 PolarHBondContact O-N 3.11Å
44R61.3Low57Low251 Ų251143.3 Ų143.395%0.94781%0.808SS**  trans-72.6111.1176.7-60.6-179.6-176.7-139.30.6109.4P42P42-R44 PolarHBondContact O-N 3.33Å
45G62.6Low57Low59 Ų59140.8 Ų140.861%0.60879%0.793SS**  trans-63160.1172.100000112.8P43P43-G45 PolarHBondContact O-N 3.11Å
46P60.4Low56.6Low128 Ų128143.7 Ų143.783%0.83180%0.802SS**  trans-65.1138.1-174.725.9-33.9000112.5L48P46-L48 PolarHBondContact O-N 3.03Å
47R59.2Low56Low238 Ų238145.2 Ų145.290%0.89880%0.803SS**  trans-74.887.4-174.9-169.2-173.9-167.4-150.46.3110.9T49R47-T49 PolarHBondContact O-N 2.81Å
48L56.6Low56.5Low167 Ų167144 Ų14487%0.87480%0.798SS**  trans-60.2119171.9-89165000110.5P46P46-L48 PolarHBondContact O-N 3.03Å
49T58.9Low56.4Low119 Ų119141 Ų14173%0.7379%0.788SS**  trans-81.6135.7-176.847.70000112R47R47-T49 PolarHBondContact O-N 2.81Å
50R52.8Low56Low234 Ų234142.9 Ų142.988%0.88379%0.79SS**  trans53.690.8152.2-175-177.8-91.3175-9115.5
51F48.3Very low56.4Low197 Ų197145 Ų14586%0.86479%0.794SS**PPolyproline II helixtrans-66.5134.1148.1-68.1-85.4000109
52P58.2Low56.3Low114 Ų114145.2 Ų145.274%0.7479%0.788SS**PPolyproline II helixtrans-68.8141.4163.330.2-32.1000109C54P52-C54 PolarHBondContact O-N 2.93Å
53A53.3Low56.3Low102 Ų102147.3 Ų147.384%0.84379%0.788SS**PPolyproline II helixtrans-63.6120174.600000109.4G55A53-G55 PolarHBondContact O-N 2.85Å
54C44Very low56Low122 Ų122146.2 Ų146.282%0.82478%0.781SS**PPolyproline II helixtrans-68.8118.2169.5-159.50000107.6P52P52-C54 PolarHBondContact O-N 2.93Å
55G51.1Low55.8Low57 Ų57139.1 Ų139.159%0.58878%0.776SS**PPolyproline II helixtrans-65.7158.9-179.100000112.1A53 L57A53-G55 PolarHBondContact O-N 2.85Å; G55-L57 PolarHBondContact O-N 3.47Å
56T46.6Very low55.7Low144 Ų144145 Ų14588%0.88379%0.785SS**  trans-52.9111.4172.6-52.20000110.2E58T56-E58 PolarHBondContact O-N 3.2Å; T56-E58 VanDerWaalsContact O-N 3.15Å
57L48.1Very low55.5Low152 Ų152144.1 Ų144.180%0.79678%0.779SS**  trans-74.8103.3171-74.2174.7000108.8G55G55-L57 PolarHBondContact O-N 3.47Å
58E60.8Low55.6Low160 Ų160138.3 Ų138.375%0.74877%0.772SS**  trans-51.5130.9164-113.2-67119.600109.8T56 Y60T56-E58 PolarHBondContact O-N 3.2Å; T56-E58 VanDerWaalsContact O-N 3.15Å; E58-Y60 PolarHBondContact O-N 3.14Å
59P51.9Low55.7Low102 Ų102135.3 Ų135.366%0.66277%0.772SS**  trans-67.7104.9177.5-16.931000110.4L61P59-L61 PolarHBondContact O-N 3.48Å
60Y50.9Low55.7Low212 Ų212138.6 Ų138.683%0.83178%0.776SS**  trans-60.896.3176.9-173.5-93.3000111.1E58 P62E58-Y60 PolarHBondContact O-N 3.14Å; Y60-P62 WeakPolarHBondContact O-CD 3.21Å
61L67.3Low55.6Low155 Ų155138.2 Ų138.281%0.81278%0.776SS**  trans-77.8115.8170.7-122.7168.6000107.6P59 E63P59-L61 PolarHBondContact O-N 3.48Å; L61-E63 PolarHBondContact O-N 3.19Å
62P59.7Low56Low96 Ų96136.4 Ų136.462%0.62377%0.774SS**PPolyproline II helixtrans-65.6126.1178.225.1-33.2000110.7Y60Y60-P62 WeakPolarHBondContact O-CD 3.21Å
63E66.7Low55.9Low156 Ų156140.3 Ų140.373%0.72978%0.783SS**PPolyproline II helixtrans-57.4143.4175-123.3-138.8125.500110.9L61 A65L61-E63 PolarHBondContact O-N 3.19Å; E63-A65 PolarHBondContact O-N 3.06Å
64P57Low56Low105 Ų105142.4 Ų142.468%0.68278%0.78SS**PPolyproline II helixtrans-65.8124.8174.127.7-33.1000110.2K66P64-K66 PolarHBondContact O-N 3.26Å
65A56.6Low56.2Low102 Ų102144.5 Ų144.584%0.84378%0.782SS**  trans-56.2112.5-175.600000112.3E63E63-A65 PolarHBondContact O-N 3.06Å
66K60.9Low55.7Low183 Ų183145.4 Ų145.480%0.79679%0.791SS**PPolyproline II helixtrans-70.4124.9174.1-134.8162.3-169.5159.90109P64P64-K66 PolarHBondContact O-N 3.26Å
67P56.9Low55.6Low110 Ų110147.2 Ų147.271%0.71480%0.795SS**PPolyproline II helixtrans-64.8145.5177.926.6-33.6000110.5A69P67-A69 PolarHBondContact O-N 2.95Å
68P60.9Low55.1Low116 Ų116143.4 Ų143.475%0.75379%0.792SS**PPolyproline II helixtrans-65.2124.9-17625.2-33.6000111.5K70P68-K70 PolarHBondContact O-N 3.03Å
69A59Low54.7Low104 Ų104141.5 Ų141.586%0.8679%0.794SS**SBendtrans-7371.6176.900000111.6P67P67-A69 PolarHBondContact O-N 2.95Å
70K57.7Low54.5Low188 Ų188141.4 Ų141.482%0.81780%0.801SS**  trans-143.731.9-179.1-67.1-67.7-175.7172.50113.5P68P68-K70 PolarHBondContact O-N 3.03Å
71Y51.7Low54.1Low225 Ų225139 Ų13988%0.88280%0.802SS**SBendtrans-153.859.6165.9-151.8-96.1000113.1
72L56.4Low52.8Low159 Ų159139.3 Ų139.383%0.83280%0.804SS**SBendtrans-152.667.4166.2-153155.4000108.9
73Q57.3Low51.7Low196 Ų196138.6 Ų138.692%0.91681%0.814SS**SBendtrans-166.334.5-179.8-115.6143.29600111.8
74D54.1Low50.3Low146 Ų146134.8 Ų134.878%0.78182%0.817SS**SBendtrans-149.7157.4158.9-139.6-32.1000109.6
75L48.5Very low49.7Very low167 Ų167138.3 Ų138.387%0.87482%0.824SS**SBendtrans71.195.8-160.6-48-175.9000113.6
76G41.2Very low48.5Very low76 Ų76142.7 Ų142.778%0.78483%0.825SS**  trans-81-166179.400000115.6
77L43.8Very low47.6Very low182 Ų182143 Ų14395%0.95382%0.822SS**  trans-75.2122.3-168.3-74.577.7000114.8
78G38Very low46.5Very low72 Ų72146.7 Ų146.774%0.74283%0.83SS**  trans74-179.2140.700000118.9
79P52Low45.2Very low120 Ų120144 Ų14478%0.77982%0.824SS**  cis-116.3168-8.539.4-27.6000113.5
80A47.6Very low43.9Very low99 Ų99144.7 Ų144.782%0.81882%0.822SS**  trans-84128.717000000111.2
81L42.7Very low42.9Very low162 Ų162140 Ų14085%0.84882%0.818SS**  trans-143.4156.6166.6-74.8-178.2000111.9
82N40.4Very low42.2Very low161 Ų161137.7 Ų137.786%0.86182%0.816SS**  trans-70.3144.8-169.5-70.8-78.9000115.2
83G37.2Very low41.3Very low81 Ų81135 Ų13584%0.83582%0.816SS**  69.2154.7120.700000121
84G35.9Very low40.5Very low77 Ų77134.9 Ų134.979%0.79482%0.815SS**  trans99.779.2154.800000118
85H45.4Very low40Very low179 Ų179136.2 Ų136.283%0.82982%0.817SS**  15.8108.7126.4-176.1-73.9000119.1
86F30.7Very low39.7Very low194 Ų194137.9 Ų137.985%0.85182%0.817SS**  trans-155.5173142.7-154.1-111.1000112.3
87Y41.1Very low39.4Very low188 Ų188138.4 Ų138.474%0.73781%0.814SS**  trans-139.2135.1-146.4-166.9-79.5000113.8
88E34.5Very low39.1Very low188 Ų188135 Ų13588%0.87981%0.806SS**  trans-170.2134.1155.3-107169.4122.300106
89G33.2Very low38.9Very low61 Ų61141 Ų14163%0.62981%0.811SS**  cis101.6122.644.500000107.8
90S32.1Very low38.1Very low118 Ų118140.2 Ų140.283%0.82582%0.815SS**  cis-163.3166.510-71.50000111.6
91A37.4Very low37.6Very low89 Ų89139.8 Ų139.874%0.73681%0.811SS**  trans62.8150.4159.400000117.8
92E36.9Very low37.2Very low177 Ų177137.8 Ų137.883%0.82781%0.811SS**  cis-152.5123.79.136.3-139.552.800107.5
93A36.5Very low37.2Very low101 Ų101139.4 Ų139.484%0.83581%0.81SS**  88103.768.600000114.9
94E42.1Very low37.9Very low194 Ų194141.4 Ų141.491%0.90781%0.809SS**  trans177.287.5138-161.2172.411800108.8
95E42.8Very low37.8Very low174 Ų174145.9 Ų145.981%0.81381%0.809SS**  62101.494.5-165.1174.6131.800117.5
96K42.3Very low37.6Very low203 Ų203143.3 Ų143.388%0.88380%0.801SS**  -155.4118.9119.1-121173.7-174.9170.40113.4
97A35.1Very low38.3Very low86 Ų86140.1 Ų140.171%0.71180%0.8SS**  trans-77.4173169.400000110.3
98S36.5Very low38.5Very low112 Ų112138.5 Ų138.578%0.78380%0.803SS**  cis-145.2-173.28.8-49.50000108
99K34.7Very low38.7Very low197 Ų197136.6 Ų136.686%0.85780%0.799SS**  cis-156.6146.55.3-161165.6178.7172.10108.2
100A34.5Very low38.8Very low103 Ų103140.4 Ų140.485%0.85181%0.814SS**  trans-120.2139.2166.300000109.7
101A38Very low39.3Very low91 Ų91146.6 Ų146.675%0.75282%0.819SS**  trans-147.5119.917800000112.3
102S34.3Very low39.1Very low119 Ų119146.2 Ų146.283%0.83282%0.824SS**  trans42.7119.4151.2-144.40000121
103F40.7Very low39Very low195 Ų195141.1 Ų141.186%0.85582%0.819SS**  trans-61161.7146.1-76.4-96.6000111.5
104P50.6Low39.8Very low123 Ų123142.2 Ų142.280%0.79982%0.818SS**  trans-122.3156.1133.634.8-27.6000112.5
105Q35Very low39.9Very low172 Ų172144.7 Ų144.780%0.80482%0.819SS**  trans-84153.3179.3-79.2-162.9-52.400113.9
106L41.3Very low40Very low124 Ų124144.2 Ų144.265%0.64982%0.822SS**  trans25.3146.3134.2-48.3178.7000119.5
107P44.7Very low39.7Very low128 Ų128137.9 Ų137.983%0.83181%0.814SS**  -121.7148.378.7-3.625000115.4
108L45.7Very low40.7Very low153 Ų153139.4 Ų139.480%0.80182%0.817SS**  trans-113.9114.9160.8-85.5168000107.9
109D38.3Very low40.7Very low149 Ų149139.4 Ų139.480%0.79782%0.817SS**  trans-140.5125.1170-105.1-53.9000110.2
110C35.2Very low40.8Very low140 Ų140136.6 Ų136.695%0.94681%0.811SS**  trans178.3117.1142.3-95.50000109.4
111R42.8Very low41.3Very low249 Ų249138.3 Ų138.394%0.9481%0.805SS**  trans-118.9131.2-175.3-173.6-171.2-162.8-96.15.8110.2
112G33.6Very low41.3Very low80 Ų80143.1 Ų143.183%0.82581%0.812SS**  trans87.5148.817000000114.6
113G34.1Very low41.3Very low71 Ų71141 Ų14173%0.73281%0.809SS**  cis-166.4174.4-1.100000111.5
114P54.5Low41.1Very low124 Ų124137.1 Ų137.181%0.80581%0.806SS**  trans-93.1148.5-170.336-33.8000113.1
115R43.5Very low41.1Very low245 Ų245137.4 Ų137.493%0.92581%0.808SS**  trans-147.7139.2157.4-65.2-161.875.4-144.9-2.3111.4
116D44.4Very low41.2Very low164 Ų164132.5 Ų132.588%0.87780%0.804SS**  trans-75.8168.3-176.5-52.2-93000113.9
117G36.6Very low41.9Very low71 Ų71132.6 Ų132.673%0.73281%0.812SS**  trans-80.3-144.7179.600000114.3
118P55.8Low41.5Very low118 Ų118133 Ų13377%0.76682%0.816SS**  cis-136.6-163.93.241.7-22.6000114.4
119S37.3Very low41.5Very low111 Ų111133.9 Ų133.978%0.77682%0.821SS**  trans80.3153.1166-51.40000117.4
120N36.7Very low41.5Very low138 Ų138131.1 Ų131.174%0.73882%0.819SS**  cis-164.4172.8-33.8-162.8-47.1000105.7
121L44.8Very low41.7Very low140 Ų140130 Ų13073%0.73381%0.813SS**  trans79.1112.5163.2-56.4175.8000119.5
122Q37.6Very low42Very low192 Ų192125.5 Ų125.590%0.89781%0.806SS**  82.5133123.7-153125.672.900120.6
123G33.3Very low42.5Very low73 Ų73133 Ų13375%0.75381%0.809SS**  trans134.5108.8153.900000115.8
124S36.7Very low43.1Very low115 Ų115135.8 Ų135.880%0.80481%0.807SS**  trans-66.8149.9170-177.10000111.8
125P50.8Low42.7Very low128 Ų128135.9 Ų135.983%0.83181%0.808SS**  trans-73.5143.9173.931.1-35.8000112.2
126G38Very low42.7Very low70 Ų70131.3 Ų131.372%0.72280%0.801SS**  trans-154.3129.6172.100000109.9
127P56.3Low42.8Very low126 Ų126129.2 Ų129.282%0.81880%0.799SS**  trans-93.7142.4-168.335.3-33.9000113.1
128C34.6Very low43.8Very low136 Ų136132 Ų13292%0.91980%0.804SS**  trans-132.7147.9161.3-76.30000111.1
129L46.1Very low43.2Very low172 Ų172130 Ų13090%0.90181%0.805SS**  trans-96.1172.8-164.3-66.9163.3000113
130A38.7Very low43.7Very low91 Ų91132.8 Ų132.875%0.75281%0.81SS**  trans73.1120167.100000116.2
131S40.3Very low44.3Very low117 Ų117131.6 Ų131.682%0.81881%0.81SS**  -146.6140.468.7-72.50000115.4
132L48.2Very low44.2Very low153 Ų153131 Ų13180%0.80181%0.807SS**  trans-62.9131.9171.6-65.5142000111.4
133R44.8Very low44.8Very low238 Ų238127.8 Ų127.890%0.89881%0.806SS**  trans-147.3111.2138.8-75.9-158.6167.980.91.7109.9
134L45.6Very low45.7Very low129 Ų129132.1 Ų132.168%0.67581%0.809SS**  trans-72.3157.5154.8-78.579.2000108.3L136L134-L136 HydrophobicContact CD2-CD1 3.94Å
135P47.3Very low46.3Very low127 Ų127134.1 Ų134.183%0.82581%0.806SS**  -120.7155.3104.8-3.923.6000113.6
136L43.4Very low46.3Very low148 Ų148135.2 Ų135.278%0.77580%0.804SS**  trans-70.8139.8173.7-78.159.9000111L134L134-L136 HydrophobicContact CD2-CD1 3.94Å
137S46.8Very low47Very low120 Ų120135.7 Ų135.784%0.83980%0.801SS**  trans-159.4152.4132.7-86.60000111.4
138P57Low46.8Very low130 Ų130139.2 Ų139.284%0.84480%0.803SS**  trans-107.5147.2-156.837.4-29.7000114.8
139G43.8Very low47.4Very low76 Ų76138 Ų13878%0.78479%0.788SS**  trans110.892.1151.500000117.5
140L46.9Very low47.7Very low170 Ų170139.2 Ų139.289%0.8979%0.786SS**  trans-159.5137.3133.4-149.663.3000109.5
141P48.9Very low48.6Very low112 Ų112139.7 Ų139.773%0.72778%0.784SS**  trans-74.1159.8-175.629.1-36.4000114.1S143P141-S143 PolarHBondContact O-N 2.97Å
142D43.3Very low49.8Very low127 Ų127144 Ų14468%0.67979%0.788SS**  trans-27.3113.5178.2-154.4-59.5000116.3M144D142-M144 PolarHBondContact OD1-N 3.24Å
143S50.6Low50.7Low126 Ų126145.8 Ų145.888%0.88179%0.789SS**  trans-139.942.5165-146.50000111.3P141P141-S143 PolarHBondContact O-N 2.97Å
144M51.6Low52.3Low163 Ų163144.7 Ų144.780%0.80379%0.785SS**  trans-117.8-2.9174.668.7-179.2-67.500114.5D142D142-M144 PolarHBondContact OD1-N 3.24Å
145E48.9Very low54Low158 Ų158150.2 Ų150.274%0.73880%0.797SS**THydrogen-bonded Turntrans-89.84.3179.9-132.2-142.1134.100116.5
146L51.7Low55.7Low151 Ų151151 Ų15179%0.79179%0.794SS**THydrogen-bonded Turntrans-102.312.9179.4-154.160.9000115.1
147A53Low58Low80 Ų80154.4 Ų154.466%0.66180%0.796SS**SBendtrans-105.3-6.7-176.400000115.7
148K51.6Low60.1Low199 Ų199151 Ų15187%0.86577%0.77SS**SBendtrans-117.58.2-165.8-83-177.5176174.90117.9
149N46.7Very low61.9Low112 Ų112150.8 Ų150.860%0.59977%0.767SS**  trans-121.626.1-178.36236.3000115.9S151N149-S151 PolarHBondContact O-N 2.99Å
150K53.3Low64.5Low196 Ų196150.3 Ų150.385%0.85274%0.744SS**  trans-71.213.1168.3-72.1173.8179170.60114.4K152K150-K152 PolarHBondContact O-N 2.91Å; K150-K152 VanDerWaalsContact O-N 3.11Å
151S57.8Low66.9Low102 Ų102145.6 Ų145.671%0.71373%0.725SS**SBendtrans-70.898.6171.4-66.70000110.8N149 K153N149-S151 PolarHBondContact O-N 2.99Å; S151-K153 PolarHBondContact O-N 2.88Å
152K65Low69.3Low208 Ų208144.9 Ų144.990%0.90472%0.719SS**  trans-1387.3172.9-93.8165.7173.6161.60114.5K150 R154K150-K152 PolarHBondContact O-N 2.91Å; K150-K152 VanDerWaalsContact O-N 3.11Å; K152-R154 PolarHBondContact O-N 3.26Å
153K67.8Low71.9Confident190 Ų190144.1 Ų144.183%0.82671%0.71SS**  trans-60.2112.3175.6-165.1167.5-175.4172.90107.9S151 R155S151-K153 PolarHBondContact O-N 2.88Å; K153-R155 PolarHBondContact O-N 2.91Å
154R78.1Confident74.2Confident215 Ų215139.5 Ų139.581%0.81167%0.674SS**PPolyproline II helixtrans-53.5130178-93.2173.271.1-143.79.5108.2K152 N156K152-R154 PolarHBondContact O-N 3.26Å; R154-N156 PolarHBondContact O-N 2.89Å
155R80.4Confident76.4Confident245 Ų245135.1 Ų135.193%0.92565%0.653SS**PPolyproline II helixtrans-52.5129.1175.5-78.1-177-104.5163.7-6.2109.2K153 R157K153-R155 PolarHBondContact O-N 2.91Å; R155-R157 PolarHBondContact O-N 3.26Å
156N83.3Confident78.8Confident142 Ų142132.9 Ų132.976%0.75964%0.643SS**PPolyproline II helixtrans-52.8126.4179.6-64.6-23.8000109.5R154R154-N156 PolarHBondContact O-N 2.89Å
157R91.4Very high81Confident220 Ų220127.6 Ų127.683%0.8361%0.614SS**PPolyproline II helixtrans-85.8123.7-178.2-176.5-179.9-177.31771.8108.9R155 T159R155-R157 PolarHBondContact O-N 3.26Å; R157-T159 PolarHBondContact O-N 3.22Å
158T91.7Very high83.2Confident48 Ų48123.8 Ų123.829%0.29458%0.583SS.*PPolyproline II helixtrans-64.8125.3171.3-46.40000109.9F160 L192 R196T158-F160 HydrophobicContact CG2-CD1 4.25Å; T158-F160 HydrophobicContact CG2-CE1 3.85Å; T158-F160 HydrophobicContact CG2-CZ 4.15Å; T158-L192 HydrophobicContact CG2-CD2 4.37Å; T158-R196 WeakPolarHBondContact OG1-CD 3.48Å; T158-R196 PolarHBondContact OG1-NH1 3.37Å
159T95Very high85.4Confident127 Ų127116.2 Ų116.278%0.77955%0.551SS**PPolyproline II helixtrans-98.9134.6164.746.30000108.1R157R157-T159 PolarHBondContact O-N 3.22Å
160F97.5Very high87.9Confident66 Ų66115.2 Ų115.229%0.28954%0.541SS..PPolyproline II helixtrans-98.6138.1-179.1-58.6-74.5000110.1T158 Q164 L165 L192 W200T158-F160 HydrophobicContact CG2-CD1 4.25Å; T158-F160 HydrophobicContact CG2-CE1 3.85Å; T158-F160 HydrophobicContact CG2-CZ 4.15Å; F160-Q164 VanDerWaalsContact CA-OE1 3.29Å; F160-L165 HydrophobicContact CB-CD1 4.47Å; F160-L165 HydrophobicContact CB-CD2 3.7Å; F160-L165 HydrophobicContact CB-CG 3.86Å; F160-L165 HydrophobicContact CD2-CD2 4.29Å; F160-L165 HydrophobicContact CG-CD2 4.17Å; F160-L192 HydrophobicContact CD1-CD1 3.77Å; F160-L192 HydrophobicContact CD1-CD2 4.09Å; F160-L192 HydrophobicContact CE1-CD1 3.68Å; F160-L192 HydrophobicContact CE1-CD2 3.99Å; F160-W200 AromaticContact CD2-CD1 3.93Å; F160-W200 AromaticContact CE2-CD1 3.69Å; F160-W200 HydrophobicContact CZ-CB 4.41Å; F160-W200 AromaticContact CZ-CD1 3.96Å
161S98.4Very high90Very high70 Ų70107.4 Ų107.449%0.4951%0.509SS..PPolyproline II helixtrans-70.9157.5169.5-179.50000110.9F163 Q164 L165S161-F163 VanDerWaalsContact C-N 3.35Å; S161-F163 PolarHBondContact O-N 3.27Å; S161-Q164 WeakPolarHBondContact O-CB 3.46Å; S161-Q164 PolarHBondContact O-N 3.43Å; S161-Q164 VanDerWaalsContact O-N 3.13Å; S161-L165 WeakPolarHBondContact O-CG 3.21Å; S161-L165 PolarHBondContact O-N 3.35Å
162T98Very high92Very high98 Ų98102.8 Ų102.860%0.60148%0.477SS*.Hα-helixtrans-54.3-49.2177.8-46.30000111.6Q164 L165 E166T162-Q164 VanDerWaalsContact C-N 3.31Å; T162-Q164 PolarHBondContact O-N 3.37Å; T162-L165 WeakPolarHBondContact O-CA 3.4Å; T162-L165 WeakPolarHBondContact O-CB 3.3Å; T162-L165 PolarHBondContact O-N 3.3Å; T162-E166 WeakPolarHBondContact CG2-OE1 3.35Å; T162-E166 WeakPolarHBondContact O-CG 3.42Å; T162-E166 PolarHBondContact O-N 3.01Å
163F98.3Very high93.6Very high111 Ų111100 Ų10049%0.48747%0.467SS..Hα-helixtrans-55.3-42.1176.2170.2-105.2000113.2S161 L165 E166 E167S161-F163 VanDerWaalsContact C-N 3.35Å; S161-F163 PolarHBondContact O-N 3.27Å; F163-L165 VanDerWaalsContact C-N 3.34Å; F163-L165 PolarHBondContact O-N 3.01Å; F163-E166 PolarHBondContact O-N 3.3Å; F163-E167 HydrophobicContact CE2-CG 4.15Å; F163-E167 HydrophobicContact CZ-CG 4.28Å; F163-E167 PolarHBondContact O-N 3.47Å
164Q98.4Very high95Very high29 Ų2999 Ų9914%0.13646%0.462CS..Hα-helixtrans-64.8-40.9177.3-62.6175-33.800110.9F160 S161 T162 L168 T190F160-Q164 VanDerWaalsContact CA-OE1 3.29Å; S161-Q164 WeakPolarHBondContact O-CB 3.46Å; S161-Q164 PolarHBondContact O-N 3.43Å; S161-Q164 VanDerWaalsContact O-N 3.13Å; T162-Q164 VanDerWaalsContact C-N 3.31Å; T162-Q164 PolarHBondContact O-N 3.37Å; Q164-L168 VanDerWaalsContact O-CB 3.31Å; Q164-L168 WeakPolarHBondContact O-CB 3.33Å; Q164-L168 VanDerWaalsContact O-CD1 3.25Å; Q164-L168 WeakPolarHBondContact O-CD1 3.25Å; Q164-L168 WeakPolarHBondContact O-CG 3.31Å; Q164-L168 PolarHBondContact O-N 2.82Å; Q164-T190 WeakPolarHBondContact CG-O 3.48Å; Q164-T190 PolarHBondContact NE2-O 3.41Å
165L98.6Very high96Very high71 Ų7191.4 Ų91.437%0.37244%0.44SS..Hα-helixtrans-66.4-36.5177-66.1175.5000112.2F160 S161 T162 F163 E169 W200F160-L165 HydrophobicContact CB-CD1 4.47Å; F160-L165 HydrophobicContact CB-CD2 3.7Å; F160-L165 HydrophobicContact CB-CG 3.86Å; F160-L165 HydrophobicContact CD2-CD2 4.29Å; F160-L165 HydrophobicContact CG-CD2 4.17Å; S161-L165 WeakPolarHBondContact O-CG 3.21Å; S161-L165 PolarHBondContact O-N 3.35Å; T162-L165 WeakPolarHBondContact O-CA 3.4Å; T162-L165 WeakPolarHBondContact O-CB 3.3Å; T162-L165 PolarHBondContact O-N 3.3Å; F163-L165 VanDerWaalsContact C-N 3.34Å; F163-L165 PolarHBondContact O-N 3.01Å; L165-E169 VanDerWaalsContact O-CB 3.28Å; L165-E169 WeakPolarHBondContact O-CB 3.43Å; L165-E169 PolarHBondContact O-N 2.95Å; L165-W200 HydrophobicContact CD2-CZ2 4.4Å; L165-W200 VanDerWaalsContact CD2-NE1 3.25Å
166E98.5Very high96.8Very high111 Ų11182.7 Ų82.752%0.51941%0.41SS..Hα-helixtrans-63.3-53.3178-73.5167-179.900112T162 F163 L168 E169 K170T162-E166 WeakPolarHBondContact CG2-OE1 3.35Å; T162-E166 WeakPolarHBondContact O-CG 3.42Å; T162-E166 PolarHBondContact O-N 3.01Å; F163-E166 PolarHBondContact O-N 3.3Å; E166-L168 VanDerWaalsContact C-N 3.34Å; E166-L168 PolarHBondContact O-N 2.81Å; E166-E169 PolarHBondContact O-N 3.19Å; E166-K170 VanDerWaalsContact O-CB 3.3Å; E166-K170 WeakPolarHBondContact O-CB 3.47Å; E166-K170 PolarHBondContact O-N 2.82Å
167E98.6Very high97.5Very high40 Ų4083.1 Ų83.119%0.18740%0.402CS..Hα-helixtrans-68-32.9179.5-70.2-58.9-8900112.6F163 K170 V171 L186 T190F163-E167 HydrophobicContact CE2-CG 4.15Å; F163-E167 HydrophobicContact CZ-CG 4.28Å; F163-E167 PolarHBondContact O-N 3.47Å; E167-K170 IonicContact OE1-NZ 2.69Å; E167-K170 PolarHBondContact OE1-NZ 2.63Å; E167-K170 WeakPolarHBondContact OE2-CD 3.47Å; E167-K170 WeakPolarHBondContact OE2-CE 3.47Å; E167-K170 IonicContact OE2-NZ 3.16Å; E167-K170 PolarHBondContact OE2-NZ 3.11Å; E167-V171 PolarHBondContact O-N 3.38Å; E167-L186 HydrophobicContact CB-CD2 4.48Å; E167-T190 HydrophobicContact CB-CG2 4.19Å
168L98.6Very high97.9Very high0 Ų073.3 Ų73.30%037%0.366CS..Hα-helixtrans-64.6-41.9172.4-70.9169.4000111.8Q164 E166 F172 L186 L192 V197 W200 F201Q164-L168 VanDerWaalsContact O-CB 3.31Å; Q164-L168 WeakPolarHBondContact O-CB 3.33Å; Q164-L168 VanDerWaalsContact O-CD1 3.25Å; Q164-L168 WeakPolarHBondContact O-CD1 3.25Å; Q164-L168 WeakPolarHBondContact O-CG 3.31Å; Q164-L168 PolarHBondContact O-N 2.82Å; E166-L168 VanDerWaalsContact C-N 3.34Å; E166-L168 PolarHBondContact O-N 2.81Å; L168-F172 WeakPolarHBondContact O-CB 3.49Å; L168-F172 PolarHBondContact O-N 3.15Å; L168-L186 HydrophobicContact CD2-CD1 4.27Å; L168-L186 HydrophobicContact CD2-CD2 4.41Å; L168-L192 HydrophobicContact CD1-CD1 4.2Å; L168-V197 HydrophobicContact CD2-CG1 3.82Å; L168-V197 HydrophobicContact CD2-CG2 4.32Å; L168-W200 HydrophobicContact CB-CD2 4.05Å; L168-W200 HydrophobicContact CB-CE3 3.99Å; L168-W200 HydrophobicContact CB-CH2 3.78Å; L168-W200 HydrophobicContact CB-CZ2 3.8Å; L168-W200 HydrophobicContact CB-CZ3 3.86Å; L168-W200 HydrophobicContact CD1-CB 4.47Å; L168-W200 HydrophobicContact CD1-CD2 3.9Å; L168-W200 HydrophobicContact CD1-CE3 4.5Å; L168-W200 HydrophobicContact CD1-CG 3.84Å; L168-W200 HydrophobicContact CD2-CE3 4.46Å; L168-W200 HydrophobicContact CG-CD2 4.41Å; L168-F201 HydrophobicContact CD2-CD2 4.43Å; L168-F201 HydrophobicContact CD2-CE2 3.8Å
169E98.6Very high98.2Very high40 Ų4075.4 Ų75.419%0.18738%0.376CS..Hα-helixtrans-71.8-39.4178.3-166.267.3-143.400112.3L165 E166 V171 F172 Q173 W200 R204L165-E169 VanDerWaalsContact O-CB 3.28Å; L165-E169 WeakPolarHBondContact O-CB 3.43Å; L165-E169 PolarHBondContact O-N 2.95Å; E166-E169 PolarHBondContact O-N 3.19Å; E169-V171 VanDerWaalsContact C-N 3.29Å; E169-V171 PolarHBondContact O-N 3.12Å; E169-F172 CarbonylContact O-C 3.56Å; E169-F172 WeakPolarHBondContact O-CA 3.5Å; E169-F172 WeakPolarHBondContact O-CB 3.45Å; E169-F172 PolarHBondContact O-N 3.18Å; E169-F172 WeakPolarHBondContact OE1-CD1 3.36Å; E169-Q173 WeakPolarHBondContact O-CG 3.29Å; E169-Q173 PolarHBondContact O-N 3.08Å; E169-W200 HydrophobicContact CB-CH2 4.48Å; E169-R204 IonicContact OE1-CZ 2.78Å; E169-R204 IonicContact OE1-NE 2.9Å; E169-R204 PolarHBondContact OE1-NE 3.19Å; E169-R204 VanDerWaalsContact OE1-NE 3.16Å; E169-R204 IonicContact OE1-NH2 3.1Å; E169-R204 PolarHBondContact OE1-NH2 2.94Å; E169-R204 WeakPolarHBondContact OE2-CD 3.48Å; E169-R204 IonicContact OE2-CZ 2.73Å; E169-R204 IonicContact OE2-NE 3.15Å; E169-R204 PolarHBondContact OE2-NE 3.32Å; E169-R204 IonicContact OE2-NH1 3.1Å; E169-R204 PolarHBondContact OE2-NH1 3.48Å; E169-R204 VanDerWaalsContact OE2-NH1 3.15Å; E169-R204 IonicContact OE2-NH2 2.65Å; E169-R204 PolarHBondContact OE2-NH2 3.22Å; E169-R204 VanDerWaalsContact OE2-NH2 3.1Å
170K98.4Very high98.3Very high91 Ų9173.2 Ų73.240%0.39636%0.362SS..Hα-helixtrans-58.7-37.3174.5176.5-171.5-176.3-178.20112.7E166 E167E166-K170 VanDerWaalsContact O-CB 3.3Å; E166-K170 WeakPolarHBondContact O-CB 3.47Å; E166-K170 PolarHBondContact O-N 2.82Å; E167-K170 IonicContact OE1-NZ 2.69Å; E167-K170 PolarHBondContact OE1-NZ 2.63Å; E167-K170 WeakPolarHBondContact OE2-CD 3.47Å; E167-K170 WeakPolarHBondContact OE2-CE 3.47Å; E167-K170 IonicContact OE2-NZ 3.16Å; E167-K170 PolarHBondContact OE2-NZ 3.11Å
171V98.4Very high98.4Very high32 Ų3277 Ų7719%0.19438%0.375CS..Hα-helixtrans-75.6-37.6170.8175.60000111.2E167 E169 Q173 K174 T175 L186 F201E167-V171 PolarHBondContact O-N 3.38Å; E169-V171 VanDerWaalsContact C-N 3.29Å; E169-V171 PolarHBondContact O-N 3.12Å; V171-Q173 VanDerWaalsContact C-N 3.27Å; V171-Q173 PolarHBondContact O-N 3.4Å; V171-K174 WeakPolarHBondContact O-CB 3.38Å; V171-K174 PolarHBondContact O-N 2.94Å; V171-T175 HydrophobicContact CG1-CG2 4.36Å; V171-T175 PolarHBondContact O-N 2.86Å; V171-L186 HydrophobicContact CB-CD1 3.95Å; V171-L186 HydrophobicContact CB-CD2 4.45Å; V171-L186 HydrophobicContact CG1-CD1 3.9Å; V171-L186 HydrophobicContact CG2-CD1 4.01Å; V171-L186 HydrophobicContact CG2-CD2 3.83Å; V171-L186 HydrophobicContact CG2-CG 4.13Å; V171-F201 HydrophobicContact CB-CZ 4.22Å; V171-F201 HydrophobicContact CG1-CZ 4.04Å
172F98.6Very high98.4Very high5 Ų575 Ų752%0.02236%0.364CS..Hα-helixtrans-57.7-38175.3-169.4-99.3000113L168 E169 K174 T175 H176 W200 F201 R204 R205 W208L168-F172 WeakPolarHBondContact O-CB 3.49Å; L168-F172 PolarHBondContact O-N 3.15Å; E169-F172 CarbonylContact O-C 3.56Å; E169-F172 WeakPolarHBondContact O-CA 3.5Å; E169-F172 WeakPolarHBondContact O-CB 3.45Å; E169-F172 PolarHBondContact O-N 3.18Å; E169-F172 WeakPolarHBondContact OE1-CD1 3.36Å; F172-K174 VanDerWaalsContact C-N 3.27Å; F172-K174 PolarHBondContact O-N 3.06Å; F172-T175 WeakPolarHBondContact CA-O 3.3Å; F172-T175 CarbonylContact O-C 3.34Å; F172-T175 PolarHBondContact O-N 3.12Å; F172-H176 AromaticContact CD1-CD2 3.67Å; F172-H176 AromaticContact CD2-CD2 3.96Å; F172-H176 AromaticContact CE1-CD2 3.26Å; F172-H176 WeakPolarHBondContact CE1-CD2 3.42Å; F172-H176 AromaticContact CE1-NE2 3.55Å; F172-H176 HydrophobicContact CE2-CB 3.96Å; F172-H176 AromaticContact CE2-CD2 3.58Å; F172-H176 AromaticContact CG-CD2 4Å; F172-H176 HydrophobicContact CZ-CB 4.24Å; F172-H176 AromaticContact CZ-CD2 3.19Å; F172-H176 WeakPolarHBondContact CZ-CD2 3.46Å; F172-H176 AromaticContact CZ-CG 3.85Å; F172-H176 AromaticContact CZ-NE2 3.83Å; F172-H176 PolarHBondContact O-CD2 3.29Å; F172-W200 HydrophobicContact CB-CH2 4.43Å; F172-W200 HydrophobicContact CB-CZ3 4.25Å; F172-W200 HydrophobicContact CD2-CZ3 4.4Å; F172-F201 HydrophobicContact CB-CE1 4.01Å; F172-F201 HydrophobicContact CB-CZ 4.43Å; F172-F201 AromaticContact CD2-CD1 3.8Å; F172-F201 HydrophobicContact CD2-CD1 3.8Å; F172-F201 AromaticContact CD2-CE1 3.75Å; F172-F201 HydrophobicContact CD2-CE1 3.75Å; F172-F201 HydrophobicContact CG-CE1 4.39Å; F172-R204 HydrophobicContact CD1-CG 3.83Å; F172-R204 HydrophobicContact CD2-CB 4.19Å; F172-R204 HydrophobicContact CD2-CG 3.55Å; F172-R204 HydrophobicContact CE1-CG 3.72Å; F172-R204 HydrophobicContact CE2-CB 3.96Å; F172-R204 HydrophobicContact CE2-CG 3.43Å; F172-R204 VanDerWaalsContact CE2-CG 3.43Å; F172-R204 HydrophobicContact CG-CG 3.77Å; F172-R204 HydrophobicContact CZ-CB 4.38Å; F172-R204 HydrophobicContact CZ-CG 3.53Å; F172-R205 HydrophobicContact CE2-CG 3.84Å; F172-R205 HydrophobicContact CZ-CG 4.39Å; F172-W208 HydrophobicContact CZ-CB 4.26Å; F172-W208 HydrophobicContact CZ-CG 4.39Å
173Q98.3Very high98.4Very high149 Ų14972.2 Ų72.270%0.69634%0.342SS*.Hα-helixtrans-61.9-30.9173.4-71.8171.2-0.400113.4E169 V171E169-Q173 WeakPolarHBondContact O-CG 3.29Å; E169-Q173 PolarHBondContact O-N 3.08Å; V171-Q173 VanDerWaalsContact C-N 3.27Å; V171-Q173 PolarHBondContact O-N 3.4Å
174K98Very high98.4Very high168 Ų16871.1 Ų71.173%0.7334%0.339SS*.Hα-helixtrans-84.4-42.8177.2-63.1177.9-178.9-1730112V171 F172V171-K174 WeakPolarHBondContact O-CB 3.38Å; V171-K174 PolarHBondContact O-N 2.94Å; F172-K174 VanDerWaalsContact C-N 3.27Å; F172-K174 PolarHBondContact O-N 3.06Å
175T98.1Very high98.4Very high57 Ų5772.7 Ų72.735%0.3535%0.346SS..  trans-150.3128.1175.1176.90000111.6V171 F172 Y177 P178V171-T175 HydrophobicContact CG1-CG2 4.36Å; V171-T175 PolarHBondContact O-N 2.86Å; F172-T175 WeakPolarHBondContact CA-O 3.3Å; F172-T175 CarbonylContact O-C 3.34Å; F172-T175 PolarHBondContact O-N 3.12Å; T175-Y177 PolarHBondContact O-N 3.17Å; T175-Y177 VanDerWaalsContact OG1-C 3.26Å; T175-Y177 PolarHBondContact OG1-N 3.33Å; T175-Y177 PolarHBondContact OG1-O 2.76Å; T175-P178 HydrophobicContact CG2-CB 4.3Å
176H98.2Very high98.4Very high61 Ų6169.7 Ų69.728%0.28233%0.33SS..SBendtrans-69.6-18.7171-59.1147.4000112.7F172 R205 W208F172-H176 AromaticContact CD1-CD2 3.67Å; F172-H176 AromaticContact CD2-CD2 3.96Å; F172-H176 AromaticContact CE1-CD2 3.26Å; F172-H176 WeakPolarHBondContact CE1-CD2 3.42Å; F172-H176 AromaticContact CE1-NE2 3.55Å; F172-H176 HydrophobicContact CE2-CB 3.96Å; F172-H176 AromaticContact CE2-CD2 3.58Å; F172-H176 AromaticContact CG-CD2 4Å; F172-H176 HydrophobicContact CZ-CB 4.24Å; F172-H176 AromaticContact CZ-CD2 3.19Å; F172-H176 WeakPolarHBondContact CZ-CD2 3.46Å; F172-H176 AromaticContact CZ-CG 3.85Å; F172-H176 AromaticContact CZ-NE2 3.83Å; F172-H176 PolarHBondContact O-CD2 3.29Å; H176-R205 HydrophobicContact CB-CG 4.32Å; H176-R205 VanDerWaalsContact O-CD 3.25Å; H176-R205 WeakPolarHBondContact O-CD 3.45Å; H176-R205 PolarHBondContact O-NH1 3.39Å; H176-W208 AromaticContact CE1-CE2 3.8Å; H176-W208 AromaticContact CE1-CZ2 3.96Å; H176-W208 AromaticContact CE1-NE1 3.78Å; H176-W208 AromaticContact NE2-NE1 3.96Å
177Y98.5Very high98.4Very high151 Ų15164.9 Ų64.959%0.59231%0.309SS*.SBendtrans-128.175.8-176.4-63.2-91.7000109.9T175T175-Y177 PolarHBondContact O-N 3.17Å; T175-Y177 VanDerWaalsContact OG1-C 3.26Å; T175-Y177 PolarHBondContact OG1-N 3.33Å; T175-Y177 PolarHBondContact OG1-O 2.76Å
178P98.3Very high98.4Very high14 Ų1469 Ų699%0.09133%0.332CS..  trans-63.8144.8169.729.8-36.5000110.1T175 A182 R183 F201T175-P178 HydrophobicContact CG2-CB 4.3Å; P178-A182 HydrophobicContact CB-CB 4.04Å; P178-R183 HydrophobicContact CB-CG 4.08Å; P178-R183 HydrophobicContact CG-CG 3.84Å; P178-F201 HydrophobicContact CG-CD1 3.61Å; P178-F201 HydrophobicContact CG-CD2 4.1Å; P178-F201 HydrophobicContact CG-CE1 3.58Å; P178-F201 HydrophobicContact CG-CE2 4.09Å; P178-F201 HydrophobicContact CG-CG 3.89Å; P178-F201 HydrophobicContact CG-CZ 3.85Å
179D98.5Very high98.4Very high92 Ų9276 Ų7649%0.49236%0.359SS..  trans-74.2-167.7177.175.4-41.9000111.3Y181 A182 R183D179-Y181 WeakPolarHBondContact OD2-CB 3.45Å; D179-Y181 PolarHBondContact OD2-N 3.04Å; D179-A182 WeakPolarHBondContact OD1-CB 3.43Å; D179-A182 PolarHBondContact OD1-N 3.29Å; D179-R183 VanDerWaalsContact O-CG 3.29Å; D179-R183 WeakPolarHBondContact O-CG 3.43Å; D179-R183 PolarHBondContact O-N 2.82Å; D179-R183 PolarHBondContact O-NE 3.46Å
180V98.3Very high98.4Very high81 Ų8174.2 Ų74.249%0.49135%0.35SS..Hα-helixtrans-68.9-48.9177.2-178.40000110.2A182 R183 E184V180-A182 PolarHBondContact O-N 3.29Å; V180-R183 WeakPolarHBondContact O-CB 3.45Å; V180-R183 PolarHBondContact O-N 3.1Å; V180-R183 VanDerWaalsContact O-N 3.1Å; V180-E184 HydrophobicContact CG1-CG 4.47Å; V180-E184 PolarHBondContact O-N 3.38Å
181Y98.4Very high98.4Very high145 Ų14576.9 Ų76.957%0.56937%0.369SS*.Hα-helixtrans-64-44.5-175179.5-106.7000112.6D179 R183 E184 Q185D179-Y181 WeakPolarHBondContact OD2-CB 3.45Å; D179-Y181 PolarHBondContact OD2-N 3.04Å; Y181-R183 PolarHBondContact O-N 3.49Å; Y181-E184 PolarHBondContact O-N 3Å; Y181-Q185 HydrophobicContact CD1-CG 4.3Å; Y181-Q185 HydrophobicContact CD2-CG 4.47Å; Y181-Q185 HydrophobicContact CE1-CG 3.91Å; Y181-Q185 HydrophobicContact CE2-CG 4.1Å; Y181-Q185 WeakPolarHBondContact O-CG 3.07Å; Y181-Q185 PolarHBondContact O-N 3.4Å
182A98.4Very high98.3Very high30 Ų3076.5 Ų76.525%0.24837%0.365CS..Hα-helixtrans-64-29.517600000112.9P178 D179 V180 L186P178-A182 HydrophobicContact CB-CB 4.04Å; D179-A182 WeakPolarHBondContact OD1-CB 3.43Å; D179-A182 PolarHBondContact OD1-N 3.29Å; V180-A182 PolarHBondContact O-N 3.29Å; A182-L186 WeakPolarHBondContact O-CB 3.41Å; A182-L186 WeakPolarHBondContact O-CG 3.46Å; A182-L186 PolarHBondContact O-N 2.93Å
183R98.8Very high98.3Very high38 Ų3880.4 Ų80.414%0.14339%0.39CS..Hα-helixtrans-72.9-37.8174.1-75.7-177.8-74.5151.1-5112.3P178 D179 V180 Y181 L186 A187 E194 V197 Q198P178-R183 HydrophobicContact CB-CG 4.08Å; P178-R183 HydrophobicContact CG-CG 3.84Å; D179-R183 VanDerWaalsContact O-CG 3.29Å; D179-R183 WeakPolarHBondContact O-CG 3.43Å; D179-R183 PolarHBondContact O-N 2.82Å; D179-R183 PolarHBondContact O-NE 3.46Å; V180-R183 WeakPolarHBondContact O-CB 3.45Å; V180-R183 PolarHBondContact O-N 3.1Å; V180-R183 VanDerWaalsContact O-N 3.1Å; Y181-R183 PolarHBondContact O-N 3.49Å; R183-L186 PolarHBondContact O-N 3.17Å; R183-A187 VanDerWaalsContact O-CB 3.3Å; R183-A187 WeakPolarHBondContact O-CB 3.43Å; R183-A187 PolarHBondContact O-N 3.3Å; R183-E194 HydrophobicContact CB-CG 4.15Å; R183-E194 WeakPolarHBondContact CD-OE1 3.44Å; R183-E194 IonicContact CZ-OE1 3.29Å; R183-E194 VanDerWaalsContact CZ-OE1 3.29Å; R183-E194 IonicContact NE-OE1 3.57Å; R183-E194 IonicContact NH1-OE1 2.63Å; R183-E194 PolarHBondContact NH1-OE1 2.87Å; R183-V197 HydrophobicContact CB-CG1 4.23Å; R183-V197 HydrophobicContact CG-CG1 3.99Å; R183-Q198 VanDerWaalsContact NH1-CG 3.31Å
184E98.6Very high98.3Very high89 Ų8975.7 Ų75.742%0.41637%0.368SS..Hα-helixtrans-64.6-44.4172.9-68.9171166.200111.3V180 Y181 L186 A187 L188 E194V180-E184 HydrophobicContact CG1-CG 4.47Å; V180-E184 PolarHBondContact O-N 3.38Å; Y181-E184 PolarHBondContact O-N 3Å; E184-L186 VanDerWaalsContact C-N 3.29Å; E184-L186 PolarHBondContact O-N 3.2Å; E184-A187 WeakPolarHBondContact O-CB 3.46Å; E184-A187 PolarHBondContact O-N 3.36Å; E184-L188 WeakPolarHBondContact O-CG 3.45Å; E184-L188 PolarHBondContact O-N 3Å; E184-E194 HydrophobicContact CG-CG 4.18Å
185Q98.6Very high98.3Very high62 Ų6269.8 Ų69.829%0.2935%0.35SS..Hα-helixtrans-63.8-32.6175.6-68.4-60.3-44.100113.2Y181 R189Y181-Q185 HydrophobicContact CD1-CG 4.3Å; Y181-Q185 HydrophobicContact CD2-CG 4.47Å; Y181-Q185 HydrophobicContact CE1-CG 3.91Å; Y181-Q185 HydrophobicContact CE2-CG 4.1Å; Y181-Q185 WeakPolarHBondContact O-CG 3.07Å; Y181-Q185 PolarHBondContact O-N 3.4Å; Q185-R189 WeakPolarHBondContact O-CB 3.25Å; Q185-R189 WeakPolarHBondContact O-CG 3.4Å; Q185-R189 PolarHBondContact O-N 3.07Å
186L98.4Very high98.3Very high7 Ų771.4 Ų71.44%0.03735%0.35CS..Hα-helixtrans-72.1-41.7171-87.4170000112.5E167 L168 V171 A182 R183 E184 L188 R189 T190 V197 F201E167-L186 HydrophobicContact CB-CD2 4.48Å; L168-L186 HydrophobicContact CD2-CD1 4.27Å; L168-L186 HydrophobicContact CD2-CD2 4.41Å; V171-L186 HydrophobicContact CB-CD1 3.95Å; V171-L186 HydrophobicContact CB-CD2 4.45Å; V171-L186 HydrophobicContact CG1-CD1 3.9Å; V171-L186 HydrophobicContact CG2-CD1 4.01Å; V171-L186 HydrophobicContact CG2-CD2 3.83Å; V171-L186 HydrophobicContact CG2-CG 4.13Å; A182-L186 WeakPolarHBondContact O-CB 3.41Å; A182-L186 WeakPolarHBondContact O-CG 3.46Å; A182-L186 PolarHBondContact O-N 2.93Å; R183-L186 PolarHBondContact O-N 3.17Å; E184-L186 VanDerWaalsContact C-N 3.29Å; E184-L186 PolarHBondContact O-N 3.2Å; L186-L188 VanDerWaalsContact C-N 3.33Å; L186-L188 PolarHBondContact O-N 3.2Å; L186-R189 PolarHBondContact O-N 2.86Å; L186-T190 WeakPolarHBondContact O-CB 3.31Å; L186-T190 PolarHBondContact O-N 3.23Å; L186-T190 PolarHBondContact O-OG1 2.75Å; L186-V197 HydrophobicContact CB-CG1 4.14Å; L186-V197 HydrophobicContact CB-CG2 4.49Å; L186-V197 HydrophobicContact CD1-CG1 4.11Å; L186-F201 HydrophobicContact CD1-CE2 3.8Å; L186-F201 HydrophobicContact CD1-CZ 4.06Å
187A98.6Very high98.3Very high10 Ų1068.5 Ų68.58%0.08334%0.337CS..Hα-helixtrans-56.7-48.3177.600000110.8R183 E184 T190 D191 L192 E194 V197R183-A187 VanDerWaalsContact O-CB 3.3Å; R183-A187 WeakPolarHBondContact O-CB 3.43Å; R183-A187 PolarHBondContact O-N 3.3Å; E184-A187 WeakPolarHBondContact O-CB 3.46Å; E184-A187 PolarHBondContact O-N 3.36Å; A187-T190 PolarHBondContact O-N 2.66Å; A187-D191 PolarHBondContact O-N 2.92Å; A187-D191 VanDerWaalsContact O-N 3.12Å; A187-L192 CarbonylContact C-O 3.44Å; A187-L192 WeakPolarHBondContact CA-O 3.5Å; A187-L192 WeakPolarHBondContact CB-O 3.21Å; A187-L192 PolarHBondContact O-N 3.38Å; A187-L192 VanDerWaalsContact O-N 3.11Å; A187-E194 HydrophobicContact CB-CB 4.42Å; A187-V197 HydrophobicContact CB-CG2 4.18Å
188L98.5Very high98.3Very high126 Ų12665.2 Ų65.266%0.6633%0.326SS*.Hα-helixtrans-62.1-41.3174.2-66.4172.3000113.1E184 L186 T190E184-L188 WeakPolarHBondContact O-CG 3.45Å; E184-L188 PolarHBondContact O-N 3Å; L186-L188 VanDerWaalsContact C-N 3.33Å; L186-L188 PolarHBondContact O-N 3.2Å; L188-T190 VanDerWaalsContact C-N 3.32Å; L188-T190 PolarHBondContact O-N 3.45Å
189R98.1Very high98.3Very high149 Ų14967.6 Ų67.656%0.56234%0.341SS*.Hα-helixtrans-72.9-19.8-179.8-84.4-176.8166.275.33.2115Q185 L186Q185-R189 WeakPolarHBondContact O-CB 3.25Å; Q185-R189 WeakPolarHBondContact O-CG 3.4Å; Q185-R189 PolarHBondContact O-N 3.07Å; L186-R189 PolarHBondContact O-N 2.86Å
190T98Very high98.3Very high1 Ų164.4 Ų64.41%0.00632%0.322CS..Hα-helixtrans-116.82.9-172.457.60000113.3Q164 E167 L186 A187 L188 L192Q164-T190 WeakPolarHBondContact CG-O 3.48Å; Q164-T190 PolarHBondContact NE2-O 3.41Å; E167-T190 HydrophobicContact CB-CG2 4.19Å; L186-T190 WeakPolarHBondContact O-CB 3.31Å; L186-T190 PolarHBondContact O-N 3.23Å; L186-T190 PolarHBondContact O-OG1 2.75Å; A187-T190 PolarHBondContact O-N 2.66Å; L188-T190 VanDerWaalsContact C-N 3.32Å; L188-T190 PolarHBondContact O-N 3.45Å; T190-L192 VanDerWaalsContact C-N 3.26Å; T190-L192 PolarHBondContact O-N 2.82Å
191D98.3Very high98.3Very high148 Ų14860.7 Ų60.779%0.79130%0.299SS*.THydrogen-bonded Turntrans52.643.6-173.8-59.2-52.3000112.9A187A187-D191 PolarHBondContact O-N 2.92Å; A187-D191 VanDerWaalsContact O-N 3.12Å
192L97.4Very high98.3Very high23 Ų2358 Ų5812%0.1229%0.292CS..  trans-119.6156.7177.8-66.6176.7000109.8T158 F160 L168 A187 T190 R196 V197T158-L192 HydrophobicContact CG2-CD2 4.37Å; F160-L192 HydrophobicContact CD1-CD1 3.77Å; F160-L192 HydrophobicContact CD1-CD2 4.09Å; F160-L192 HydrophobicContact CE1-CD1 3.68Å; F160-L192 HydrophobicContact CE1-CD2 3.99Å; L168-L192 HydrophobicContact CD1-CD1 4.2Å; A187-L192 CarbonylContact C-O 3.44Å; A187-L192 WeakPolarHBondContact CA-O 3.5Å; A187-L192 WeakPolarHBondContact CB-O 3.21Å; A187-L192 PolarHBondContact O-N 3.38Å; A187-L192 VanDerWaalsContact O-N 3.11Å; T190-L192 VanDerWaalsContact C-N 3.26Å; T190-L192 PolarHBondContact O-N 2.82Å; L192-R196 HydrophobicContact CB-CB 4.29Å; L192-V197 HydrophobicContact CB-CG2 4.24Å
193T98.2Very high98.3Very high87 Ų8761 Ų6153%0.53430%0.303SS..  trans-76.9148.2166.873.30000110.4A195 R196 V197T193-A195 PolarHBondContact O-N 3.13Å; T193-A195 VanDerWaalsContact O-N 3.15Å; T193-R196 WeakPolarHBondContact O-CA 3.04Å; T193-R196 VanDerWaalsContact O-CB 3.3Å; T193-R196 WeakPolarHBondContact O-CB 3.25Å; T193-R196 PolarHBondContact O-N 3.14Å; T193-V197 PolarHBondContact O-N 2.93Å
194E98.4Very high98.3Very high50 Ų5062.7 Ų62.723%0.23431%0.31CS..Hα-helixtrans-46.4-46174.7-175.5-66.6132.200111R183 E184 A187 R196 V197 Q198R183-E194 HydrophobicContact CB-CG 4.15Å; R183-E194 WeakPolarHBondContact CD-OE1 3.44Å; R183-E194 IonicContact CZ-OE1 3.29Å; R183-E194 VanDerWaalsContact CZ-OE1 3.29Å; R183-E194 IonicContact NE-OE1 3.57Å; R183-E194 IonicContact NH1-OE1 2.63Å; R183-E194 PolarHBondContact NH1-OE1 2.87Å; E184-E194 HydrophobicContact CG-CG 4.18Å; A187-E194 HydrophobicContact CB-CB 4.42Å; E194-R196 VanDerWaalsContact C-N 3.27Å; E194-R196 PolarHBondContact O-N 3.17Å; E194-V197 CarbonylContact O-C 3.55Å; E194-V197 WeakPolarHBondContact O-CA 3.45Å; E194-V197 WeakPolarHBondContact O-CB 3.19Å; E194-V197 PolarHBondContact O-N 3.29Å; E194-Q198 PolarHBondContact O-N 3.38Å
195A97.9Very high98.3Very high44 Ų4460.5 Ų60.536%0.36430%0.298SS..Hα-helixtrans-61.5-2817800000114.1T193 V199T193-A195 PolarHBondContact O-N 3.13Å; T193-A195 VanDerWaalsContact O-N 3.15Å; A195-V199 WeakPolarHBondContact O-CB 3.49Å; A195-V199 VanDerWaalsContact O-CG2 3.25Å; A195-V199 WeakPolarHBondContact O-CG2 3.5Å; A195-V199 PolarHBondContact O-N 3.06Å; A195-V199 VanDerWaalsContact O-N 3.17Å
196R98Very high98.2Very high92 Ų9259.5 Ų59.535%0.34730%0.3SS..Hα-helixtrans-69.9-44.4170-64.1-62.487154.310110.9T158 L192 T193 E194 V199 W200T158-R196 WeakPolarHBondContact OG1-CD 3.48Å; T158-R196 PolarHBondContact OG1-NH1 3.37Å; L192-R196 HydrophobicContact CB-CB 4.29Å; T193-R196 WeakPolarHBondContact O-CA 3.04Å; T193-R196 VanDerWaalsContact O-CB 3.3Å; T193-R196 WeakPolarHBondContact O-CB 3.25Å; T193-R196 PolarHBondContact O-N 3.14Å; E194-R196 VanDerWaalsContact C-N 3.27Å; E194-R196 PolarHBondContact O-N 3.17Å; R196-V199 PolarHBondContact O-N 3.49Å; R196-W200 WeakPolarHBondContact O-CB 3.35Å; R196-W200 PolarHBondContact O-N 3.41Å
197V98.5Very high98.1Very high0 Ų066.3 Ų66.30%033%0.329CS..Hα-helixtrans-59.6-48.8175.9-178.60000109.9L168 R183 L186 A187 L192 T193 E194 V199 W200 F201L168-V197 HydrophobicContact CD2-CG1 3.82Å; L168-V197 HydrophobicContact CD2-CG2 4.32Å; R183-V197 HydrophobicContact CB-CG1 4.23Å; R183-V197 HydrophobicContact CG-CG1 3.99Å; L186-V197 HydrophobicContact CB-CG1 4.14Å; L186-V197 HydrophobicContact CB-CG2 4.49Å; L186-V197 HydrophobicContact CD1-CG1 4.11Å; A187-V197 HydrophobicContact CB-CG2 4.18Å; L192-V197 HydrophobicContact CB-CG2 4.24Å; T193-V197 PolarHBondContact O-N 2.93Å; E194-V197 CarbonylContact O-C 3.55Å; E194-V197 WeakPolarHBondContact O-CA 3.45Å; E194-V197 WeakPolarHBondContact O-CB 3.19Å; E194-V197 PolarHBondContact O-N 3.29Å; V197-V199 VanDerWaalsContact C-N 3.34Å; V197-V199 PolarHBondContact O-N 3.06Å; V197-W200 WeakPolarHBondContact O-CB 3.28Å; V197-W200 PolarHBondContact O-N 3.11Å; V197-W200 VanDerWaalsContact O-N 3.12Å; V197-F201 HydrophobicContact CG1-CD2 3.8Å; V197-F201 HydrophobicContact CG1-CE2 3.88Å; V197-F201 WeakPolarHBondContact O-CD2 3.49Å; V197-F201 PolarHBondContact O-N 3.36Å
198Q98.5Very high97.9Very high81 Ų8171 Ų7138%0.37935%0.345SS..Hα-helixtrans-55.5-45.4175.5-171.2-174.8-55.100112.4R183 E194 Q202R183-Q198 VanDerWaalsContact NH1-CG 3.31Å; E194-Q198 PolarHBondContact O-N 3.38Å; Q198-Q202 VanDerWaalsContact O-CG 3.31Å; Q198-Q202 WeakPolarHBondContact O-CG 3.49Å; Q198-Q202 PolarHBondContact O-N 2.94Å; Q198-Q202 PolarHBondContact O-NE2 2.92Å
199V98.3Very high97.8Very high64 Ų6469.9 Ų69.939%0.38833%0.332SS..Hα-helixtrans-68.7-36.3178.2169.30000111.6A195 R196 V197 N203A195-V199 WeakPolarHBondContact O-CB 3.49Å; A195-V199 VanDerWaalsContact O-CG2 3.25Å; A195-V199 WeakPolarHBondContact O-CG2 3.5Å; A195-V199 PolarHBondContact O-N 3.06Å; A195-V199 VanDerWaalsContact O-N 3.17Å; R196-V199 PolarHBondContact O-N 3.49Å; V197-V199 VanDerWaalsContact C-N 3.34Å; V197-V199 PolarHBondContact O-N 3.06Å; V199-N203 WeakPolarHBondContact CG1-ND2 3.42Å; V199-N203 WeakPolarHBondContact O-CB 3.42Å; V199-N203 PolarHBondContact O-N 3.4Å; V199-N203 VanDerWaalsContact O-N 3.08Å; V199-N203 PolarHBondContact O-ND2 3.02Å
200W98.4Very high97.5Very high26 Ų2668.4 Ų68.410%0.09833%0.329CS..Hα-helixtrans-62-50.2174.2-172.3103.9000111.1F160 L165 L168 E169 F172 R196 V197 Q202 N203 R204F160-W200 AromaticContact CD2-CD1 3.93Å; F160-W200 AromaticContact CE2-CD1 3.69Å; F160-W200 HydrophobicContact CZ-CB 4.41Å; F160-W200 AromaticContact CZ-CD1 3.96Å; L165-W200 HydrophobicContact CD2-CZ2 4.4Å; L165-W200 VanDerWaalsContact CD2-NE1 3.25Å; L168-W200 HydrophobicContact CB-CD2 4.05Å; L168-W200 HydrophobicContact CB-CE3 3.99Å; L168-W200 HydrophobicContact CB-CH2 3.78Å; L168-W200 HydrophobicContact CB-CZ2 3.8Å; L168-W200 HydrophobicContact CB-CZ3 3.86Å; L168-W200 HydrophobicContact CD1-CB 4.47Å; L168-W200 HydrophobicContact CD1-CD2 3.9Å; L168-W200 HydrophobicContact CD1-CE3 4.5Å; L168-W200 HydrophobicContact CD1-CG 3.84Å; L168-W200 HydrophobicContact CD2-CE3 4.46Å; L168-W200 HydrophobicContact CG-CD2 4.41Å; E169-W200 HydrophobicContact CB-CH2 4.48Å; F172-W200 HydrophobicContact CB-CH2 4.43Å; F172-W200 HydrophobicContact CB-CZ3 4.25Å; F172-W200 HydrophobicContact CD2-CZ3 4.4Å; R196-W200 WeakPolarHBondContact O-CB 3.35Å; R196-W200 PolarHBondContact O-N 3.41Å; V197-W200 WeakPolarHBondContact O-CB 3.28Å; V197-W200 PolarHBondContact O-N 3.11Å; V197-W200 VanDerWaalsContact O-N 3.12Å; W200-Q202 PolarHBondContact O-N 3Å; W200-N203 PolarHBondContact O-N 3.3Å; W200-N203 VanDerWaalsContact O-N 3.14Å; W200-R204 HydrophobicContact CE3-CB 4Å; W200-R204 HydrophobicContact CH2-CB 4.12Å; W200-R204 HydrophobicContact CH2-CG 3.79Å; W200-R204 HydrophobicContact CZ3-CB 3.77Å; W200-R204 HydrophobicContact CZ3-CG 3.79Å; W200-R204 WeakPolarHBondContact O-CB 3.42Å; W200-R204 PolarHBondContact O-N 3.15Å
201F98.8Very high97.1Very high2 Ų277 Ų771%0.00936%0.362CS..Hα-helixtrans-62.6-39.3179.4-90.2-92.3000112.7L168 V171 F172 P178 L186 V197 R204 R205L168-F201 HydrophobicContact CD2-CD2 4.43Å; L168-F201 HydrophobicContact CD2-CE2 3.8Å; V171-F201 HydrophobicContact CB-CZ 4.22Å; V171-F201 HydrophobicContact CG1-CZ 4.04Å; F172-F201 HydrophobicContact CB-CE1 4.01Å; F172-F201 HydrophobicContact CB-CZ 4.43Å; F172-F201 AromaticContact CD2-CD1 3.8Å; F172-F201 HydrophobicContact CD2-CD1 3.8Å; F172-F201 AromaticContact CD2-CE1 3.75Å; F172-F201 HydrophobicContact CD2-CE1 3.75Å; F172-F201 HydrophobicContact CG-CE1 4.39Å; P178-F201 HydrophobicContact CG-CD1 3.61Å; P178-F201 HydrophobicContact CG-CD2 4.1Å; P178-F201 HydrophobicContact CG-CE1 3.58Å; P178-F201 HydrophobicContact CG-CE2 4.09Å; P178-F201 HydrophobicContact CG-CG 3.89Å; P178-F201 HydrophobicContact CG-CZ 3.85Å; L186-F201 HydrophobicContact CD1-CE2 3.8Å; L186-F201 HydrophobicContact CD1-CZ 4.06Å; V197-F201 HydrophobicContact CG1-CD2 3.8Å; V197-F201 HydrophobicContact CG1-CE2 3.88Å; V197-F201 WeakPolarHBondContact O-CD2 3.49Å; V197-F201 PolarHBondContact O-N 3.36Å; F201-R204 PolarHBondContact O-N 3.05Å; F201-R205 WeakPolarHBondContact O-CB 3.49Å; F201-R205 WeakPolarHBondContact O-CG 3.42Å; F201-R205 PolarHBondContact O-N 2.73Å
202Q98.6Very high96.1Very high89 Ų8975.4 Ų75.442%0.41635%0.35SS..Hα-helixtrans-58.7-48.2171.9-76.3174.585.400112.1Q198 W200 R205 A206Q198-Q202 VanDerWaalsContact O-CG 3.31Å; Q198-Q202 WeakPolarHBondContact O-CG 3.49Å; Q198-Q202 PolarHBondContact O-N 2.94Å; Q198-Q202 PolarHBondContact O-NE2 2.92Å; W200-Q202 PolarHBondContact O-N 3Å; Q202-R205 PolarHBondContact O-N 3.22Å; Q202-A206 WeakPolarHBondContact O-CB 3.43Å; Q202-A206 PolarHBondContact O-N 2.94Å
203N98.1Very high95Very high93 Ų9382.1 Ų82.150%0.49737%0.373SS..Hα-helixtrans-65.5-38.4178.4-74.4-44.1000112.3V199 W200 A206 K207V199-N203 WeakPolarHBondContact CG1-ND2 3.42Å; V199-N203 WeakPolarHBondContact O-CB 3.42Å; V199-N203 PolarHBondContact O-N 3.4Å; V199-N203 VanDerWaalsContact O-N 3.08Å; V199-N203 PolarHBondContact O-ND2 3.02Å; W200-N203 PolarHBondContact O-N 3.3Å; W200-N203 VanDerWaalsContact O-N 3.14Å; N203-A206 PolarHBondContact O-N 3.21Å; N203-K207 WeakPolarHBondContact O-CG 3.32Å; N203-K207 PolarHBondContact O-N 3.42Å
204R98.1Very high93.4Very high73 Ų7383.8 Ų83.828%0.27537%0.371SS..Hα-helixtrans-63.7-49.8176.2-172.271.5-168.4178.11.5111E169 F172 W200 F201 A206 K207 W208E169-R204 IonicContact OE1-CZ 2.78Å; E169-R204 IonicContact OE1-NE 2.9Å; E169-R204 PolarHBondContact OE1-NE 3.19Å; E169-R204 VanDerWaalsContact OE1-NE 3.16Å; E169-R204 IonicContact OE1-NH2 3.1Å; E169-R204 PolarHBondContact OE1-NH2 2.94Å; E169-R204 WeakPolarHBondContact OE2-CD 3.48Å; E169-R204 IonicContact OE2-CZ 2.73Å; E169-R204 IonicContact OE2-NE 3.15Å; E169-R204 PolarHBondContact OE2-NE 3.32Å; E169-R204 IonicContact OE2-NH1 3.1Å; E169-R204 PolarHBondContact OE2-NH1 3.48Å; E169-R204 VanDerWaalsContact OE2-NH1 3.15Å; E169-R204 IonicContact OE2-NH2 2.65Å; E169-R204 PolarHBondContact OE2-NH2 3.22Å; E169-R204 VanDerWaalsContact OE2-NH2 3.1Å; F172-R204 HydrophobicContact CD1-CG 3.83Å; F172-R204 HydrophobicContact CD2-CB 4.19Å; F172-R204 HydrophobicContact CD2-CG 3.55Å; F172-R204 HydrophobicContact CE1-CG 3.72Å; F172-R204 HydrophobicContact CE2-CB 3.96Å; F172-R204 HydrophobicContact CE2-CG 3.43Å; F172-R204 VanDerWaalsContact CE2-CG 3.43Å; F172-R204 HydrophobicContact CG-CG 3.77Å; F172-R204 HydrophobicContact CZ-CB 4.38Å; F172-R204 HydrophobicContact CZ-CG 3.53Å; W200-R204 HydrophobicContact CE3-CB 4Å; W200-R204 HydrophobicContact CH2-CB 4.12Å; W200-R204 HydrophobicContact CH2-CG 3.79Å; W200-R204 HydrophobicContact CZ3-CB 3.77Å; W200-R204 HydrophobicContact CZ3-CG 3.79Å; W200-R204 WeakPolarHBondContact O-CB 3.42Å; W200-R204 PolarHBondContact O-N 3.15Å; F201-R204 PolarHBondContact O-N 3.05Å; R204-A206 VanDerWaalsContact C-N 3.31Å; R204-A206 PolarHBondContact O-N 3.05Å; R204-K207 PolarHBondContact O-N 2.9Å; R204-W208 PolarHBondContact O-N 3.1Å
205R98Very high91.6Very high44 Ų4484 Ų8417%0.16639%0.386CS..Hα-helixtrans-59.4-37.8173.6-72.8-164.3-64.2-91.27112.9F172 H176 F201 Q202 W208 R209F172-R205 HydrophobicContact CE2-CG 3.84Å; F172-R205 HydrophobicContact CZ-CG 4.39Å; H176-R205 HydrophobicContact CB-CG 4.32Å; H176-R205 VanDerWaalsContact O-CD 3.25Å; H176-R205 WeakPolarHBondContact O-CD 3.45Å; H176-R205 PolarHBondContact O-NH1 3.39Å; F201-R205 WeakPolarHBondContact O-CB 3.49Å; F201-R205 WeakPolarHBondContact O-CG 3.42Å; F201-R205 PolarHBondContact O-N 2.73Å; Q202-R205 PolarHBondContact O-N 3.22Å; R205-W208 PolarHBondContact O-N 2.93Å; R205-R209 WeakPolarHBondContact O-CB 3.26Å; R205-R209 WeakPolarHBondContact O-CG 3.47Å; R205-R209 PolarHBondContact O-N 3.21Å
206A97.5Very high89.6Confident40 Ų4090.1 Ų90.133%0.33141%0.405SS..Hα-helixtrans-63.9-43176.500000112.1Q202 N203 R204 K210Q202-A206 WeakPolarHBondContact O-CB 3.43Å; Q202-A206 PolarHBondContact O-N 2.94Å; N203-A206 PolarHBondContact O-N 3.21Å; R204-A206 VanDerWaalsContact C-N 3.31Å; R204-A206 PolarHBondContact O-N 3.05Å; A206-K210 WeakPolarHBondContact O-CB 2.93Å; A206-K210 PolarHBondContact O-N 3.15Å
207K96.1Very high87.5Confident150 Ų15092.1 Ų92.165%0.65242%0.419SS*.Hα-helixtrans-64-43173.3-70.3-179.5-178.1-1760112.1N203 R204 K210 R211N203-K207 WeakPolarHBondContact O-CG 3.32Å; N203-K207 PolarHBondContact O-N 3.42Å; R204-K207 PolarHBondContact O-N 2.9Å; K207-K210 WeakPolarHBondContact O-CB 3.43Å; K207-K210 PolarHBondContact O-N 3.13Å; K207-R211 PolarHBondContact O-N 3.16Å
208W95.3Very high85.2Confident109 Ų10996.8 Ų96.841%0.41344%0.441SS..Hα-helixtrans-58.7-53.6177.6-17791.6000111.4F172 H176 R204 R205 K210 R211 E212F172-W208 HydrophobicContact CZ-CB 4.26Å; F172-W208 HydrophobicContact CZ-CG 4.39Å; H176-W208 AromaticContact CE1-CE2 3.8Å; H176-W208 AromaticContact CE1-CZ2 3.96Å; H176-W208 AromaticContact CE1-NE1 3.78Å; H176-W208 AromaticContact NE2-NE1 3.96Å; R204-W208 PolarHBondContact O-N 3.1Å; R205-W208 PolarHBondContact O-N 2.93Å; W208-K210 PolarHBondContact O-N 3.02Å; W208-R211 PolarHBondContact O-N 3.17Å; W208-R211 VanDerWaalsContact O-N 3.11Å; W208-E212 PolarHBondContact O-N 2.95Å
209R95.4Very high82.9Confident102 Ų102102.3 Ų102.339%0.38547%0.467SS..Hα-helixtrans-61.5-24.9174.6-72.4-169.9-75.597-7.7113.9R205 R213R205-R209 WeakPolarHBondContact O-CB 3.26Å; R205-R209 WeakPolarHBondContact O-CG 3.47Å; R205-R209 PolarHBondContact O-N 3.21Å; R209-R213 WeakPolarHBondContact O-CG 3.39Å
210K92.1Very high80.7Confident118 Ų118102.2 Ų102.251%0.51348%0.479SS..Hα-helixtrans-74.8-44.7174.1-168.8175.6-177.3-179.50110.8A206 K207 W208 E212 R213 Y214A206-K210 WeakPolarHBondContact O-CB 2.93Å; A206-K210 PolarHBondContact O-N 3.15Å; K207-K210 WeakPolarHBondContact O-CB 3.43Å; K207-K210 PolarHBondContact O-N 3.13Å; W208-K210 PolarHBondContact O-N 3.02Å; K210-E212 VanDerWaalsContact C-N 3.33Å; K210-E212 PolarHBondContact O-N 2.86Å; K210-R213 PolarHBondContact O-N 3.5Å; K210-Y214 HydrophobicContact CD-CD2 4.45Å; K210-Y214 HydrophobicContact CD-CE2 4.01Å; K210-Y214 VanDerWaalsContact CE-OH 3.32Å; K210-Y214 WeakPolarHBondContact CE-OH 3.44Å; K210-Y214 HydrophobicContact CG-CD2 3.6Å; K210-Y214 HydrophobicContact CG-CE2 3.53Å; K210-Y214 VanDerWaalsContact O-CD2 3.24Å; K210-Y214 WeakPolarHBondContact O-CD2 3.3Å; K210-Y214 PolarHBondContact O-N 3.39Å
211R88.7Confident78.8Confident181 Ų181111.7 Ų111.768%0.68352%0.515SS*.Hα-helixtrans-56.9-46.8178.9-175-178.8-70154.3-5.9111.6K207 W208 R213 Y214 G215K207-R211 PolarHBondContact O-N 3.16Å; W208-R211 PolarHBondContact O-N 3.17Å; W208-R211 VanDerWaalsContact O-N 3.11Å; R211-R213 PolarHBondContact O-N 2.98Å; R211-Y214 PolarHBondContact O-N 3.31Å; R211-G215 PolarHBondContact O-N 2.81Å
212E78.8Confident76.3Confident116 Ų116113.8 Ų113.854%0.54253%0.526SS..Hα-helixtrans-58.6-45.2178.4-173.6-176.3-162.600112.9W208 K210W208-E212 PolarHBondContact O-N 2.95Å; K210-E212 VanDerWaalsContact C-N 3.33Å; K210-E212 PolarHBondContact O-N 2.86Å
213R74.3Confident74.3Confident163 Ų163115.2 Ų115.262%0.61554%0.543SS*.Hα-helixtrans-69.3-37.8178.3-70.4-175-139.7-162.1-6.1113.5R209 K210 R211 M217R209-R213 WeakPolarHBondContact O-CG 3.39Å; K210-R213 PolarHBondContact O-N 3.5Å; R211-R213 PolarHBondContact O-N 2.98Å; R213-M217 WeakPolarHBondContact O-CG 3.46Å
214Y63.1Low72.2Confident123 Ų123119.8 Ų119.848%0.48256%0.559SS.*Hα-helixtrans-71.5-37.3-179.9-83.9-109.7000110.9K210 R211 K216 M217 Q218K210-Y214 HydrophobicContact CD-CD2 4.45Å; K210-Y214 HydrophobicContact CD-CE2 4.01Å; K210-Y214 VanDerWaalsContact CE-OH 3.32Å; K210-Y214 WeakPolarHBondContact CE-OH 3.44Å; K210-Y214 HydrophobicContact CG-CD2 3.6Å; K210-Y214 HydrophobicContact CG-CE2 3.53Å; K210-Y214 VanDerWaalsContact O-CD2 3.24Å; K210-Y214 WeakPolarHBondContact O-CD2 3.3Å; K210-Y214 PolarHBondContact O-N 3.39Å; R211-Y214 PolarHBondContact O-N 3.31Å; Y214-K216 PolarHBondContact O-N 3.18Å; Y214-K216 VanDerWaalsContact O-N 3.14Å; Y214-M217 PolarHBondContact O-N 2.69Å; Y214-Q218 WeakPolarHBondContact O-CG 3.24Å; Y214-Q218 PolarHBondContact O-N 3.37Å
215G61.1Low70.1Confident53 Ų53118.8 Ų118.855%0.54656%0.56SS.*Hα-helixtrans-52.8-35.9176.300000114.2R211R211-G215 PolarHBondContact O-N 2.81Å
216K56.6Low68Low174 Ų174119.2 Ų119.276%0.75757%0.573SS**THydrogen-bonded Turntrans-82-11.4175.9-68.6-171.9174.1-175.40115.3Y214Y214-K216 PolarHBondContact O-N 3.18Å; Y214-K216 VanDerWaalsContact O-N 3.14Å
217M53.9Low65.9Low134 Ų134121.2 Ų121.266%0.6659%0.59SS**THydrogen-bonded Turntrans-105.1-16.2178.6-61.4-78.294.700112.3R213 Y214 E219 G220R213-M217 WeakPolarHBondContact O-CG 3.46Å; Y214-M217 PolarHBondContact O-N 2.69Å; M217-E219 VanDerWaalsContact C-N 3.29Å; M217-E219 PolarHBondContact O-N 3.2Å; M217-G220 PolarHBondContact O-N 2.86Å; M217-G220 VanDerWaalsContact O-N 3.15Å
218Q49.8Very low63.9Low98 Ų98121.7 Ų121.746%0.45859%0.589SS.*THydrogen-bonded Turntrans-69.1-23.4-177.2-71.6-131.9-4100113.9Y214 G220 N222Y214-Q218 WeakPolarHBondContact O-CG 3.24Å; Y214-Q218 PolarHBondContact O-N 3.37Å; Q218-G220 PolarHBondContact O-N 3.03Å; Q218-N222 WeakPolarHBondContact CA-ND2 3.18Å; Q218-N222 WeakPolarHBondContact CB-ND2 3.22Å; Q218-N222 VanDerWaalsContact CG-ND2 3.32Å; Q218-N222 WeakPolarHBondContact CG-ND2 3.1Å; Q218-N222 WeakPolarHBondContact CG-OD1 3.45Å; Q218-N222 VanDerWaalsContact NE2-CG 3.29Å; Q218-N222 PolarHBondContact NE2-ND2 3.25Å; Q218-N222 PolarHBondContact NE2-OD1 3.11Å; Q218-N222 PolarHBondContact O-ND2 2.86Å; Q218-N222 VanDerWaalsContact O-ND2 3.1Å
219E50.5Low61.5Low196 Ų196122.2 Ų122.292%0.91660%0.6SS**THydrogen-bonded Turntrans-69.8-16.6173.6-166.8158.9-14700112.6M217M217-E219 VanDerWaalsContact C-N 3.29Å; M217-E219 PolarHBondContact O-N 3.2Å
220G51.4Low59.4Low62 Ų62123.8 Ų123.864%0.63961%0.614SS**THydrogen-bonded Turntrans-99.9-35.7-178.100000116.3M217 Q218M217-G220 PolarHBondContact O-N 2.86Å; M217-G220 VanDerWaalsContact O-N 3.15Å; Q218-G220 PolarHBondContact O-N 3.03Å
221R58.5Low57.4Low226 Ų226123.3 Ų123.385%0.85363%0.626SS**  trans-177.3119.2179.2-106.4151.5-178.3-1341112.8
222N46.8Very low55.7Low46 Ų46121 Ų12125%0.24663%0.631CS.*  trans-125.894.2160.3-63-71.4000111.1Q218 F224 T225Q218-N222 WeakPolarHBondContact CA-ND2 3.18Å; Q218-N222 WeakPolarHBondContact CB-ND2 3.22Å; Q218-N222 VanDerWaalsContact CG-ND2 3.32Å; Q218-N222 WeakPolarHBondContact CG-ND2 3.1Å; Q218-N222 WeakPolarHBondContact CG-OD1 3.45Å; Q218-N222 VanDerWaalsContact NE2-CG 3.29Å; Q218-N222 PolarHBondContact NE2-ND2 3.25Å; Q218-N222 PolarHBondContact NE2-OD1 3.11Å; Q218-N222 PolarHBondContact O-ND2 2.86Å; Q218-N222 VanDerWaalsContact O-ND2 3.1Å; N222-F224 PolarHBondContact O-N 3.19Å; N222-T225 VanDerWaalsContact CB-OG1 3.31Å; N222-T225 WeakPolarHBondContact CB-OG1 3.32Å
223P56.8Low54.3Low118 Ų118122.9 Ų122.977%0.76664%0.644SS**THydrogen-bonded Turntrans-71.8-8177.829.3-34.9000113.9
224F52.8Low52.8Low190 Ų190120.8 Ų120.883%0.83365%0.652SS**THydrogen-bonded Turntrans-90.4-18.2-178.9-156.8-95.1000113.9N222N222-F224 PolarHBondContact O-N 3.19Å
225T54.1Low51.7Low51 Ų51126.4 Ų126.431%0.31367%0.672SS.*THydrogen-bonded Turntrans-105.5-18.3-176.753.80000113.6N222 A227 Y228N222-T225 VanDerWaalsContact CB-OG1 3.31Å; N222-T225 WeakPolarHBondContact CB-OG1 3.32Å; T225-A227 VanDerWaalsContact C-N 3.29Å; T225-A227 PolarHBondContact O-N 2.65Å; T225-Y228 VanDerWaalsContact CB-OH 3.3Å; T225-Y228 WeakPolarHBondContact CB-OH 3.31Å; T225-Y228 HydrophobicContact CG2-CE1 4.11Å; T225-Y228 VanDerWaalsContact CG2-OH 3.23Å; T225-Y228 WeakPolarHBondContact CG2-OH 3.37Å; T225-Y228 WeakPolarHBondContact O-CE2 3.23Å
226A53.8Low50.8Low53 Ų53129.8 Ų129.844%0.43868%0.683SS.*G310 helixtrans-70.9-21.6176.300000113.8Y228A226-Y228 VanDerWaalsContact C-N 3.31Å; A226-Y228 PolarHBondContact O-N 3.34Å
227A54.5Low50.1Low82 Ų82129 Ų12968%0.67869%0.687SS**G310 helixtrans-73.1-18-173.600000114.7T225T225-A227 VanDerWaalsContact C-N 3.29Å; T225-A227 PolarHBondContact O-N 2.65Å
228Y54Low49.1Very low161 Ų161127.9 Ų127.963%0.63169%0.692SS**G310 helixtrans-106.9-2.7-179.357.1-114.4000114.2T225 A226T225-Y228 VanDerWaalsContact CB-OH 3.3Å; T225-Y228 WeakPolarHBondContact CB-OH 3.31Å; T225-Y228 HydrophobicContact CG2-CE1 4.11Å; T225-Y228 VanDerWaalsContact CG2-OH 3.23Å; T225-Y228 WeakPolarHBondContact CG2-OH 3.37Å; T225-Y228 WeakPolarHBondContact O-CE2 3.23Å; A226-Y228 VanDerWaalsContact C-N 3.31Å; A226-Y228 PolarHBondContact O-N 3.34Å
229D45.4Very low48.8Very low119 Ų119130.2 Ų130.264%0.63670%0.703SS**THydrogen-bonded Turntrans-97-21.3178.8-152.7-99.4000112.1S231D229-S231 PolarHBondContact O-N 3.01Å
230I51Low48.8Very low135 Ų135126.6 Ų126.669%0.69270%0.696SS**THydrogen-bonded Turntrans-74.867.8173.4-56.5168.9000109.8
231S50.4Low48.5Very low108 Ų108130.8 Ų130.876%0.75570%0.699SS**THydrogen-bonded Turntrans-153.2-2.1173.8-72.70000114.3D229D229-S231 PolarHBondContact O-N 3.01Å
232V52.2Low47.7Very low132 Ų132128.1 Ų128.180%0.870%0.701SS**  trans-114.218.8-176.5-155.90000113.1
233L49.6Very low47.3Very low156 Ų156133.5 Ų133.582%0.81773%0.725SS**SBendtrans-89.8127.8167.9-78.9168.5000110R235L233-R235 PolarHBondContact O-N 3.28Å
234P43.2Very low46.6Very low120 Ų120135.6 Ų135.678%0.77973%0.729SS**  trans-61.1110.8175.2-22.233.3000110.7T236P234-T236 PolarHBondContact O-N 3.46Å
235R39.6Very low46Very low240 Ų240130.1 Ų130.191%0.90672%0.715SS**  trans-76.7102.4176.3-170.2177.3-171.9153.31.5108.7L233L233-R235 PolarHBondContact O-N 3.28Å
236T41.3Very low45.2Very low125 Ų125133.9 Ų133.977%0.76773%0.732SS**  trans-61.1136170.147.80000110.1P234P234-T236 PolarHBondContact O-N 3.46Å
237D41.7Very low44.9Very low156 Ų156142 Ų14283%0.83475%0.752SS**  trans-66.3130.4-173.4-164.6-87.6000112.7
238S34.2Very low44Very low112 Ų112142.9 Ų142.978%0.78376%0.759SS**  trans179.297.8154.825.30000109.4
239H44Very low43.2Very low146 Ų146140 Ų14068%0.67676%0.763SS**  trans-134.2125.8166.3-177.6-107.2000107.4
240P50.3Low43.7Very low120 Ų120140.9 Ų140.978%0.77978%0.775SS**  -133.6169.1102.29.813.2000110.9
241Q43.8Very low42.8Very low151 Ų151138 Ų13871%0.70678%0.778SS**  cis-169.9116.9-10.5159.4-172.946.500105.8
242L43.3Very low42.5Very low169 Ų169139.4 Ų139.489%0.88579%0.788SS**  trans-137.4128.3154.4-85.1-175.5000111.1N244L242-N244 PolarHBondContact O-N 3.4Å
243Q37.8Very low41.7Very low159 Ų159136.5 Ų136.574%0.74379%0.785SS**  trans-83.7106.5-167.8179.4-179.5-4300110.4S245Q243-S245 VanDerWaalsContact C-N 3.34Å; Q243-S245 PolarHBondContact NE2-OG 2.89Å; Q243-S245 VanDerWaalsContact NE2-OG 3.11Å; Q243-S245 PolarHBondContact O-N 3Å
244N41.8Very low41.1Very low162 Ų162134.9 Ų134.987%0.86679%0.787SS**  trans-7881.9173.2-175.941.2000110.7L242L242-N244 PolarHBondContact O-N 3.4Å
245S39Very low41.7Very low75 Ų75135.3 Ų135.352%0.52479%0.789SS.*  trans-93.7101172.3-70.60000111Q243Q243-S245 VanDerWaalsContact C-N 3.34Å; Q243-S245 PolarHBondContact NE2-OG 2.89Å; Q243-S245 VanDerWaalsContact NE2-OG 3.11Å; Q243-S245 PolarHBondContact O-N 3Å
246L39.3Very low41.4Very low131 Ų131127.6 Ų127.669%0.68679%0.785SS**  trans33113.1135.7-60.7162.1000117.5A248L246-A248 PolarHBondContact O-N 2.92Å
247W45.7Very low41.2Very low223 Ų223125.4 Ų125.485%0.84579%0.787SS**  trans-6.3113151.156.2-79.5000116
248A35.7Very low41.6Very low101 Ų101124 Ų12484%0.83579%0.786SS**  trans-119.5127.7165.400000109.6L246L246-A248 PolarHBondContact O-N 2.92Å
249S37Very low42.3Very low101 Ų101124.4 Ų124.471%0.70679%0.788SS**  trans-79.2177.9175.3-57.90000110.5
250P56.6Low42.3Very low136 Ų136125.6 Ų125.688%0.88380%0.798SS**  trans-75.3143.8-144.932.4-37.7000114.8
251G33.2Very low42.1Very low75 Ų75126.6 Ų126.677%0.77380%0.802SS**  trans-142.2139.1170.900000111.1
252S42.5Very low42Very low137 Ų137124.1 Ų124.196%0.95880%0.801SS**  trans-71.8148-178.5-177.60000112.8
253G35.2Very low42.5Very low71 Ų71121.5 Ų121.573%0.73280%0.795SS**  trans133.4103160.700000116.3
254S37.7Very low42.8Very low122 Ų122122.6 Ų122.685%0.85380%0.8SS**  trans-78.8172.6148.3-116.90000109.2
255P55.8Low42.5Very low129 Ų129118.3 Ų118.384%0.83879%0.793SS**  cis-138.4179.815.341.3-23.1000116
256G34.5Very low42.7Very low78 Ų78122.7 Ų122.780%0.80481%0.809SS**  trans144.4122.6160.500000114.2
257G36Very low43Very low79 Ų79122.1 Ų122.181%0.81481%0.813SS**  trans-88.1-145.5174.600000112.7
258P50.4Low42.8Very low127 Ų127116.5 Ų116.583%0.82581%0.808SS**  cis-121.9173.27.240.9-27.5000114.9
259C49.3Very low43.6Very low121 Ų121118.2 Ų118.282%0.81881%0.811SS**  trans-68.2142.4173-49.30000112
260L42.5Very low44.1Very low171 Ų171118.5 Ų118.590%0.89581%0.812SS**  trans-128.2148.2157.7-78.9174.4000109.8
261V47.6Very low43.5Very low140 Ų140120 Ų12085%0.84881%0.809SS**  trans-91.4167-160.6-66.90000114
262S41.6Very low43.8Very low99 Ų99122.6 Ų122.669%0.69282%0.815SS**  trans-65.4171.4178-157.60000113.1
263P53.4Low44.2Very low115 Ų115121.7 Ų121.775%0.74781%0.806SS**  -144.1157.594.437.3-22.1000117
264E44.5Very low44.5Very low182 Ų182127.7 Ų127.785%0.8581%0.808SS**  trans18.1128.9153.6-95.375.1122.300121.5
265G35.9Very low44.5Very low71 Ų71127.5 Ų127.573%0.73281%0.806SS**  trans-175.848.7172.400000119
266I43.3Very low44Very low167 Ų167128.9 Ų128.986%0.85680%0.801SS**  trans74.7131.5163.2-53.4166.6000116.3
267P45.4Very low44.8Very low119 Ų119131.1 Ų131.177%0.77380%0.802SS**  trans-85.5146.9-172.733.5-36.6000115.5
268S41.1Very low45.1Very low105 Ų105137 Ų13773%0.73481%0.807SS**  trans-73.6143.9166.1-62.60000112.2C270S268-C270 PolarHBondContact O-N 3.14Å; S268-C270 VanDerWaalsContact O-N 3.13Å
269P52.3Low44.6Very low137 Ų137134.5 Ų134.589%0.8981%0.805SS**  trans-76.7101.1174.330.7-32.9000110.8
270C46.8Very low44.2Very low108 Ų108134 Ų13473%0.7380%0.803SS**  trans-87.5143168.954.50000111.6S268S268-C270 PolarHBondContact O-N 3.14Å; S268-C270 VanDerWaalsContact O-N 3.13Å
271M45.4Very low44.3Very low168 Ų168131.5 Ų131.583%0.82880%0.795SS**  trans35.5104.5152.1-56-6792.500118.4P273M271-P273 WeakPolarHBondContact O-CD 3.3Å
272S38.1Very low44.3Very low129 Ų129131.8 Ų131.890%0.90280%0.796SS**PPolyproline II helixtrans-81116.2156.1-66.50000110.8
273P51.6Low44.2Very low117 Ų117130.7 Ų130.776%0.7680%0.801SS**PPolyproline II helixtrans-78.3158.2159.234.3-33.3000110.7M271M271-P273 WeakPolarHBondContact O-CD 3.3Å
274Y42Very low43.4Very low198 Ų198134 Ų13478%0.77680%0.804SS**PPolyproline II helixtrans-66.1152.3174.7-105.6-111.7000112.6H276Y274-H276 AromaticContact CD1-CE1 3.79Å; Y274-H276 AromaticContact CD1-NE2 3.62Å; Y274-H276 AromaticContact CE1-CE1 3.91Å
275S37.7Very low43.5Very low117 Ų117133.2 Ų133.282%0.81880%0.803SS**  trans-138.6122.3154.8-76.60000110
276H45.4Very low43.6Very low159 Ų159133.5 Ų133.574%0.73681%0.806SS**PPolyproline II helixtrans-92.7145.1169.4-59.4-90.6000109.8Y274Y274-H276 AromaticContact CD1-CE1 3.79Å; Y274-H276 AromaticContact CD1-NE2 3.62Å; Y274-H276 AromaticContact CE1-CE1 3.91Å
277P50.8Low43.6Very low125 Ų125132.3 Ų132.381%0.81281%0.805SS**PPolyproline II helixtrans-103.2118.216032.7-24.1000111.1
278H41.6Very low43.6Very low201 Ų201132.4 Ų132.493%0.93181%0.806SS**PPolyproline II helixtrans-86.1138154.7-124.6-104.7000107.6
279G41.4Very low43.2Very low75 Ų75132.1 Ų132.177%0.77381%0.81SS**  trans-94.4178.3-163.300000116.5
280S39Very low42.4Very low110 Ų110131.5 Ų131.577%0.76981%0.809SS**  trans-160.8125159.4-158.40000113
281V46.3Very low42Very low120 Ų120131.5 Ų131.573%0.72781%0.81SS**  trans52.3146.6150-55.20000125.3
282T45.8Very low41.5Very low145 Ų145129.9 Ų129.989%0.8981%0.809SS**  trans74.8133.8155.548.60000122.2
283G40.5Very low41.7Very low77 Ų77128 Ų12879%0.79480%0.802SS**  trans119.878.9172.700000113.3
284F37.1Very low41.3Very low184 Ų184131.1 Ų131.181%0.80781%0.806SS**  79.9107.471.5-169.1-95.8000115.4
285M47.1Very low41.7Very low166 Ų166127.5 Ų127.582%0.81881%0.807SS**  trans54130.3163.2-63.5-166.378.600121.3
286G36.9Very low41.6Very low77 Ų77125.7 Ų125.779%0.79481%0.806SS**  trans171.145.8168.600000117.8
287V43.4Very low41.5Very low141 Ų141125.9 Ų125.986%0.85581%0.811SS**  trans-137.3127.9169.3-164.60000110
288P45.2Very low41.2Very low122 Ų122130.6 Ų130.679%0.79281%0.814SS**  trans-79161.1-177.332-35.1000113.4
289A32.1Very low41Very low98 Ų98125.3 Ų125.381%0.8180%0.8SS**  trans-68.7150.5-166.200000115.5
290S37Very low41.1Very low124 Ų124128.7 Ų128.787%0.86780%0.799SS**  trans-120.2134.5154.2-172.70000108.2
291S37.3Very low41.3Very low108 Ų108132.1 Ų132.176%0.75580%0.802SS**  trans-145.590.4-174.6-63.60000111.7
292V35.8Very low40.6Very low134 Ų134129.3 Ų129.381%0.81280%0.798SS**  trans-145.7127.4145.4177.90000107.5
293A41.1Very low40.3Very low91 Ų91132.7 Ų132.775%0.75280%0.801SS**  trans-133138.7169.400000108.9
294H43.5Very low40.8Very low181 Ų181134.5 Ų134.584%0.83880%0.799SS**  trans-140.7142.4161.2-79-63.4000110.1
295P51.3Low41.6Very low123 Ų123131.4 Ų131.480%0.79980%0.797SS**  trans-95.2161.1-17537.8-35.3000112.9
296G34.6Very low41.1Very low78 Ų78129.7 Ų129.780%0.80480%0.796SS**  trans-157.8127.2169.700000111.2
297I43.3Very low41.4Very low163 Ų163134.7 Ų134.784%0.83680%0.804SS**  trans-129.4112.7-170.1-55168.5000110
298Y44.7Very low41.1Very low224 Ų224130.5 Ų130.588%0.87879%0.789SS**  trans174.6162.1153.361.2-99.8000108.2
299S38.7Very low40.6Very low91 Ų91128.7 Ų128.764%0.63679%0.793SS**  cis-165.9129.5-32.9-176.90000107.9
300I41.9Very low41.1Very low145 Ų145132.5 Ų132.574%0.74479%0.793SS**  trans27.7115.8135.8-54162.6000115.5
301H43.9Very low41Very low182 Ų182132.3 Ų132.384%0.84379%0.792SS**  -172.5157.175.145.3-81.5000110
302G32.6Very low41Very low62 Ų62136.6 Ų136.664%0.63980%0.797SS**  cis158.2129-8.400000111.4
303F38.1Very low41.4Very low215 Ų215137.3 Ų137.394%0.94379%0.792SS**  trans-166.1146.7158.6-91.4-64.1000109.9
304P52.1Low41.3Very low116 Ų116138.9 Ų138.975%0.75379%0.794SS**  trans-120.3-160.6-16651.1-38.2000111.8
305P54.3Low40.9Very low118 Ų118135.2 Ų135.277%0.76679%0.789SS**  -130.5151.7-117.332.8-10.2000116.6
306T35.7Very low40.6Very low131 Ų131133.5 Ų133.580%0.80478%0.78SS**  trans-145.5123.4164.946.40000113.2
307L43.2Very low41Very low182 Ų182138.1 Ų138.195%0.95378%0.781SS**  trans58.6132155.3-51170.9000117.4
308G36.9Very low40.9Very low52 Ų52133.8 Ų133.854%0.53678%0.776SS.*  cis158.495.94.200000107.6H310G308-H310 PolarHBondContact O-CE1 2.81Å; G308-H310 PolarHBondContact O-N 3.15Å; G308-H310 PolarHBondContact O-ND1 3.38Å
309G34.8Very low40.9Very low85 Ų85130 Ų13088%0.87677%0.771SS**  trans-69.8127.4-169.200000113.4
310H41.9Very low41.4Very low177 Ų177135.1 Ų135.182%0.81978%0.778SS**  trans-89105.4171.8-23.4-54.9000108.7G308 F312G308-H310 PolarHBondContact O-CE1 2.81Å; G308-H310 PolarHBondContact O-N 3.15Å; G308-H310 PolarHBondContact O-ND1 3.38Å; H310-F312 PolarHBondContact O-N 3.1Å
311S35.5Very low41.5Very low121 Ų121136.8 Ų136.885%0.84678%0.78SS**  trans-65.9125.1161.3-175.30000108
312F36.8Very low41.4Very low197 Ų197132.4 Ų132.486%0.86477%0.77SS**  trans-102.2113.9174.6-144.5-88.3000110.5H310H310-F312 PolarHBondContact O-N 3.1Å
313E43.8Very low42.2Very low150 Ų150134.7 Ų134.770%0.70177%0.773SS**  trans-67.9140.1173.8-178.7-167.8110.900110.9S315E313-S315 PolarHBondContact O-N 3.43Å
314P39.9Very low42.8Very low123 Ų123129.6 Ų129.680%0.79977%0.765SS**  trans-78.999.1172.431.3-31.7000110.6
315S34.2Very low42.9Very low104 Ų104131.7 Ų131.773%0.72777%0.769SS**  trans-60.8139.3171.6-176.60000111.8E313E313-S315 PolarHBondContact O-N 3.43Å
316S45.8Very low43Very low88 Ų88131.6 Ų131.662%0.61577%0.766SS**  trans-76.3176.2171.656.20000113
317E43.3Very low43.8Very low175 Ų175130.8 Ų130.882%0.81877%0.765SS**  trans55.7108174-91.969.4111.100119.1
318G41Very low44.5Very low72 Ų72129.2 Ų129.274%0.74276%0.757SS**  trans-158.696.9161.800000110.9Y320G318-Y320 PolarHBondContact O-N 3.43Å
319D45Very low46Very low144 Ų144138.1 Ų138.177%0.7777%0.774SS**  trans-55.189.1178.9-88.2-94.9000113.2K321D319-K321 VanDerWaalsContact C-N 3.31Å; D319-K321 PolarHBondContact O-N 3.02Å
320Y47.9Very low47.4Very low198 Ų198140.5 Ų140.578%0.77677%0.771SS**  trans-76.583.8171.3-165.9-94.9000110.1G318 S322G318-Y320 PolarHBondContact O-N 3.43Å; Y320-S322 PolarHBondContact O-N 3.36Å
321K44Very low48.2Very low180 Ų180141.1 Ų141.178%0.78377%0.772SS**  trans-69.295.6171.4-68.5-164.7178.4-1730110.2D319D319-K321 VanDerWaalsContact C-N 3.31Å; D319-K321 PolarHBondContact O-N 3.02Å
322S43.2Very low49.2Very low91 Ų91140.7 Ų140.764%0.63677%0.766SS**  trans-45.4130.7169.5-66.50000111.2Y320 S324Y320-S322 PolarHBondContact O-N 3.36Å; S322-S324 PolarHBondContact O-N 3.15Å
323P48.1Very low50.2Low110 Ų110140.6 Ų140.671%0.71477%0.765SS**  trans-65.3111.6178.325.8-32.8000109.6L325P323-L325 PolarHBondContact O-N 3.36Å
324S52Low50.6Low108 Ų108141.3 Ų141.376%0.75577%0.769SS**  trans-58.9122-179.8-176.10000110.8S322 V326S322-S324 PolarHBondContact O-N 3.15Å; S324-V326 PolarHBondContact O-N 2.8Å
325L53.1Low51.3Low160 Ų160140.9 Ų140.984%0.83877%0.766SS**  trans-69.196.6175.1-70.1174.6000109.5P323 S327P323-L325 PolarHBondContact O-N 3.36Å; L325-S327 PolarHBondContact O-N 3.05Å
326V55.8Low52.2Low116 Ų116141.7 Ų141.770%0.70377%0.769SS**  trans-64.3105.1169.5173.10000108.8S324 L328S324-V326 PolarHBondContact O-N 2.8Å; V326-L328 HydrophobicContact CG1-CD2 4.28Å; V326-L328 PolarHBondContact O-N 3.17Å
327S54.6Low52.2Low114 Ų114140.8 Ų140.880%0.79777%0.773SS**  trans-62.596.3169.1-710000110L325 R329L325-S327 PolarHBondContact O-N 3.05Å; S327-R329 PolarHBondContact O-N 3.27Å
328L57.1Low52.3Low149 Ų149140.8 Ų140.878%0.7878%0.778SS**  trans-65.894.1174.1-70176.5000109.8V326 V330V326-L328 HydrophobicContact CG1-CD2 4.28Å; V326-L328 PolarHBondContact O-N 3.17Å; L328-V330 PolarHBondContact O-N 3.03Å
329R68.4Low53.2Low239 Ų239145.1 Ų145.190%0.90278%0.783SS**  trans-65.794.8172.1-166.8177.5-145.4130.24.9109.2S327 K331S327-R329 PolarHBondContact O-N 3.27Å; R329-K331 PolarHBondContact O-N 3.2Å
330V63.4Low53.5Low134 Ų134145.4 Ų145.481%0.81279%0.785SS**  trans-61.799.7172-730000109.1L328L328-V330 PolarHBondContact O-N 3.03Å
331K60.1Low53.2Low190 Ų190146.5 Ų146.583%0.82679%0.788SS**  trans-74.9125174.9-161158.283.2159.40107.9R329 K333R329-K331 PolarHBondContact O-N 3.2Å; K331-K333 PolarHBondContact O-N 3Å
332P55.1Low53.5Low113 Ų113144 Ų14473%0.73479%0.788SS**  trans-57127.8179.921.4-32000109.8E334P332-E334 PolarHBondContact O-N 3.19Å
333K58Low54.1Low194 Ų194148.4 Ų148.484%0.84381%0.811SS**  trans-8099.5174.9175.367.3170.4173.50106.5K331K331-K333 PolarHBondContact O-N 3Å
334E53.2Low54.4Low166 Ų166150.3 Ų150.378%0.77682%0.816SS**PPolyproline II helixtrans-54.8138.1174.7-63.8-159.613400110.3P332P332-E334 PolarHBondContact O-N 3.19Å
335P54.2Low54.6Low113 Ų113152.5 Ų152.573%0.73482%0.819SS**PPolyproline II helixtrans-64.4137.4173.728.2-32.9000108.8G337P335-G337 PolarHBondContact O-N 3.24Å
336P52.5Low54.6Low122 Ų122152.1 Ų152.179%0.79282%0.818SS**PPolyproline II helixtrans-58.4134.7170.326.7-33000108.9
337G46Very low54.6Low69 Ų69154.2 Ų154.271%0.71183%0.825SS**PPolyproline II helixtrans-52.2142.2-170.300000113.3P335 L339P335-G337 PolarHBondContact O-N 3.24Å; G337-L339 PolarHBondContact O-N 3.46Å
338L45.5Very low54.6Low174 Ų174156.8 Ų156.891%0.91183%0.826SS**  trans-60.8107173.5-66.6170.3000108.7
339L59.3Low54.4Low164 Ų164157.3 Ų157.386%0.85983%0.829SS**  trans-69.3129.6166.2-76.6165.3000108.2G337 W341G337-L339 PolarHBondContact O-N 3.46Å; L339-W341 PolarHBondContact O-N 3.1Å
340N52Low53.4Low149 Ų149151.4 Ų151.480%0.79782%0.824SS**  trans-59.1130.2-172.3-45.3-54.4000110.9
341W41.9Very low52.6Low221 Ų221152.8 Ų152.884%0.83783%0.825SS**  trans-106.911515261.1-83.2000106.8L339L339-W341 PolarHBondContact O-N 3.1Å
342T51Low52Low129 Ų129149.7 Ų149.779%0.79183%0.825SS**  trans-90.6135.9175.3-44.90000107.9
343T55.7Low51.7Low182 Ų182153 Ų153100%1.11783%0.833SS**  trans-840167.4-60.10000109.9

Retrieved 343 of 343 residues in 340.5 ms (Link to these results)