A0A087XPY4_POEFO Loading...

Empty spiracles homeobox 2

AlphaFold DB , UniProt , Accession A0A087XPY4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 248 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
1T46.8Very low52.4Low192 Ų192168.4 Ų168.4100%1.17886%0.857SS**  0107.3034.60000108.5
2M40.9Very low54.1Low193 Ų193160.3 Ų160.395%0.95182%0.822SS**  trans-73.7124.7-178.1-117173.6-165.400109.7Q4M2-Q4 PolarHBondContact O-N 3.16Å
3F52.9Low54.5Low205 Ų205159.5 Ų159.590%0.89982%0.818SS**  trans-78111.2169.3-102.4-92.6000109.3
4Q48.2Very low55Low168 Ų168159.7 Ų159.779%0.78581%0.814SS**PPolyproline II helixtrans-80126.4166.9-77.2-103.431.600109.1M2 T6M2-Q4 PolarHBondContact O-N 3.16Å; Q4-T6 PolarHBondContact O-N 3Å
5P52.8Low55.5Low112 Ų112154.5 Ų154.573%0.72780%0.798SS**PPolyproline II helixtrans-72.9125.9173.228-30.7000110.2
6T53.2Low55.9Low128 Ų128153.5 Ų153.579%0.78579%0.793SS**PPolyproline II helixtrans-70.2130.1174.850.30000110.3Q4 K8Q4-T6 PolarHBondContact O-N 3Å; T6-K8 PolarHBondContact O-N 3.36Å
7P53.5Low56.1Low117 Ų117150.9 Ų150.976%0.7679%0.785SS**PPolyproline II helixtrans-70.5123177.226.5-31.7000109.9R9P7-R9 PolarHBondContact O-N 3.05Å; P7-R9 VanDerWaalsContact O-N 3.13Å
8K57.9Low56Low200 Ų200148 Ų14887%0.8779%0.787SS**  trans-63.8112.6171.9-67.4-177.4180174.80108.3T6 C10T6-K8 PolarHBondContact O-N 3.36Å; K8-C10 PolarHBondContact O-N 2.98Å
9R56.8Low55.7Low247 Ų247149.2 Ų149.293%0.93278%0.784SS**  trans-60109.1178.5-70-174.5-176.2160.51.1109.7P7 F11P7-R9 PolarHBondContact O-N 3.05Å; P7-R9 VanDerWaalsContact O-N 3.13Å; R9-F11 PolarHBondContact O-N 3.37Å
10C58.7Low55.3Low111 Ų111148.2 Ų148.275%0.7578%0.78SS**  trans-67.5125.4168.8-55.80000108.2K8 T12K8-C10 PolarHBondContact O-N 2.98Å; C10-T12 PolarHBondContact O-N 3.48Å; C10-T12 VanDerWaalsContact O-N 3.12Å
11F55.3Low54.5Low179 Ų179148.3 Ų148.379%0.78578%0.781SS**  trans-66.6109.1177.8-134.8-92.2000109.1R9 L16R9-F11 PolarHBondContact O-N 3.37Å; F11-L16 HydrophobicContact CE1-CD1 4.02Å
12T72.4Confident54.6Low72 Ų72144.6 Ų144.644%0.44276%0.76SS.*  trans-95.6147.2173.459.60000109.8C10 E14 S15C10-T12 PolarHBondContact O-N 3.48Å; C10-T12 VanDerWaalsContact O-N 3.12Å; T12-E14 PolarHBondContact O-N 3Å; T12-E14 VanDerWaalsContact O-N 3.13Å; T12-S15 PolarHBondContact O-N 3.25Å
13I59.6Low54.7Low149 Ų149141.7 Ų141.776%0.76475%0.753SS**G310 helixtrans-61.7-23-177.3-56.5171000111.2S15 L16I13-S15 VanDerWaalsContact C-N 3.26Å; I13-S15 PolarHBondContact O-N 3.26Å; I13-L16 WeakPolarHBondContact O-CB 3.46Å; I13-L16 PolarHBondContact O-N 2.97Å; I13-L16 VanDerWaalsContact O-N 3.1Å
14E60.8Low54.3Low163 Ų163137.6 Ų137.676%0.76275%0.747SS**G310 helixtrans-65.5-25.2176.4-63.3179.5157.600113.2T12 L16 V17T12-E14 PolarHBondContact O-N 3Å; T12-E14 VanDerWaalsContact O-N 3.13Å; E14-L16 PolarHBondContact O-N 3.5Å; E14-V17 PolarHBondContact O-N 2.95Å
15S62.9Low54Low82 Ų82134.2 Ų134.257%0.57375%0.748SS**G310 helixtrans-67.9-16.8173.1-71.70000113.4T12 I13T12-S15 PolarHBondContact O-N 3.25Å; I13-S15 VanDerWaalsContact C-N 3.26Å; I13-S15 PolarHBondContact O-N 3.26Å
16L62.6Low53.4Low138 Ų138134.6 Ų134.672%0.72375%0.753SS**G310 helixtrans-83.2-13.4176.4-111.991.4000113.5F11 I13 E14F11-L16 HydrophobicContact CE1-CD1 4.02Å; I13-L16 WeakPolarHBondContact O-CB 3.46Å; I13-L16 PolarHBondContact O-N 2.97Å; I13-L16 VanDerWaalsContact O-N 3.1Å; E14-L16 PolarHBondContact O-N 3.5Å
17V59.6Low52.6Low110 Ų110139.9 Ų139.967%0.66776%0.759SS**  trans-112.113-171.1-1780000112.2E14 K19E14-V17 PolarHBondContact O-N 2.95Å; V17-K19 PolarHBondContact O-N 3.2Å
18A53Low52.2Low98 Ų98139.5 Ų139.581%0.8176%0.758SS**  trans-7179.9168.900000110.4
19K51.2Low51.2Low170 Ų170139 Ų13974%0.73976%0.759SS**  trans-86.4112.5169.2-177.975.5169.7169.20106.8V17V17-K19 PolarHBondContact O-N 3.2Å
20D46.8Very low50.7Low130 Ų130136 Ų13670%0.69576%0.756SS**  trans59.2108.8156.3-51.4-42.8000118.4
21N39.7Very low50.2Low150 Ų150135.7 Ų135.780%0.80275%0.752SS**  trans-126.8126.2152.5-160.133.5000108.3
22P48Very low49.7Very low114 Ų114134.4 Ų134.474%0.7475%0.752SS**PPolyproline II helixtrans-77.7132.2-178.330.9-31.8000110.6
23V43.8Very low48.4Very low133 Ų133142.3 Ų142.381%0.80677%0.774SS**PPolyproline II helixtrans-97133.5170.1-179.40000108.1
24P43.9Very low47.6Very low119 Ų119141.1 Ų141.177%0.77378%0.776SS**PPolyproline II helixtrans-72.4147175.930.5-32.9000111.2
25A40.8Very low46.7Very low96 Ų96138 Ų13879%0.79378%0.778SS**PPolyproline II helixtrans-55.3132.9-179.300000113.3
26S41.6Very low45.4Very low120 Ų120138.7 Ų138.784%0.83979%0.788SS**  166.3149.6117.543.30000111.7
27R35Very low44.4Very low240 Ų240139.2 Ų139.291%0.90679%0.791SS**  trans10794.9162.1-135169.9-171.3179.90.5116.6
28S45.5Very low43.8Very low108 Ų108139 Ų13976%0.75580%0.795SS**  trans-14.7122.7153.852.60000118
29E37.3Very low43.1Very low190 Ų190144.2 Ų144.289%0.88880%0.795SS**  -171.9128.4128.7-119.2-178.110700109.6
30E46.8Very low42.4Very low184 Ų184140.3 Ų140.386%0.8679%0.794SS**  trans-94.1135.2176.1-177.2162.7-17500109.4
31P47.6Very low41.9Very low104 Ų104141.4 Ų141.468%0.67580%0.8SS**  trans-140126.1138.825.7-5.9000114.7
32I44.9Very low41.7Very low153 Ų153140 Ų14079%0.78580%0.802SS**  trans60.994.8130.6-51.5158.9000116.2
33R44.8Very low41.2Very low237 Ų237137.5 Ų137.589%0.89480%0.797SS**PPolyproline II helixtrans-87.5130.8156.3-72.4-177.2155.4168.7-4.1109.6A35R33-A35 PolarHBondContact O-N 3.25Å
34P43.9Very low40.9Very low125 Ų125139.3 Ų139.381%0.81280%0.797SS**PPolyproline II helixtrans-69.8126.8168.627.6-30.5000109.7A36P34-A36 PolarHBondContact O-N 3.43Å
35A41Very low40.7Very low96 Ų96139 Ų13979%0.79379%0.786SS**PPolyproline II helixtrans-55.4126.8178.800000111.8R33 L37R33-A35 PolarHBondContact O-N 3.25Å; A35-L37 PolarHBondContact O-N 2.97Å
36A34.9Very low40.9Very low97 Ų97141.4 Ų141.480%0.80279%0.786SS**PPolyproline II helixtrans-70.7119160.400000107.8P34 S38P34-A36 PolarHBondContact O-N 3.43Å; A36-S38 PolarHBondContact O-N 3.42Å
37L43.2Very low41.4Very low149 Ų149139.9 Ų139.978%0.7877%0.773SS**  trans-57.8104.7172.5-83.1143000109.4A35 Y39A35-L37 PolarHBondContact O-N 2.97Å; L37-Y39 HydrophobicContact CD2-CD2 4.18Å; L37-Y39 HydrophobicContact CD2-CE2 3.49Å; L37-Y39 VanDerWaalsContact CD2-CE2 3.49Å
38S45.8Very low41.6Very low106 Ų106138.9 Ų138.974%0.74178%0.776SS**  trans-85.3117.1164.3-166.10000107.4A36A36-S38 PolarHBondContact O-N 3.42Å
39Y38.3Very low41.3Very low208 Ų208141 Ų14182%0.81678%0.778SS**  trans-124.6102.1159.6-79.8-69.2000108.8L37L37-Y39 HydrophobicContact CD2-CD2 4.18Å; L37-Y39 HydrophobicContact CD2-CE2 3.49Å; L37-Y39 VanDerWaalsContact CD2-CE2 3.49Å
40A37Very low41.3Very low88 Ų88139.5 Ų139.573%0.72778%0.776SS**  trans-80.5120.7161.300000109.2
41N35.7Very low40.6Very low153 Ų153133.5 Ų133.582%0.81876%0.764SS**  trans24.1113.5130.6-164.331.7000119.6
42S36.3Very low40Very low119 Ų119137.1 Ų137.183%0.83277%0.769SS**  trans-161.4120.213653.60000105.3
43G37.9Very low39.8Very low62 Ų62137.3 Ų137.364%0.63977%0.766SS**  cis102.882.926.200000107.5
44Q37.1Very low39.4Very low172 Ų172132.2 Ų132.280%0.80477%0.767SS**  trans-170.8111.5158-105.9-148.4-30.700112.4
45M38.8Very low38.9Very low112 Ų112129.8 Ų129.855%0.55276%0.764SS**  trans-2.2150.2159.971.1-70.1111.100121.1
46N46.2Very low38.5Very low147 Ų147128.8 Ų128.879%0.78676%0.763SS**  177.3-176.361.2-124.3-17.4000110.6
47P51.8Low38.5Very low87 Ų87136.5 Ų136.557%0.56577%0.772SS**  -120.4158.7-123.341.5-26.7000115.1
48F39Very low38.1Very low220 Ų220132.7 Ų132.797%0.96577%0.769SS**  trans-148.1112.3144.3-93-73.7000111
49L39.7Very low37.9Very low153 Ų153133.8 Ų133.880%0.80177%0.771SS**  trans-72.6139.4161.7-108.883.4000110.2
50N37Very low38.1Very low157 Ų157135.1 Ų135.184%0.8478%0.776SS**  trans172.1121133.7-1029.5000106.6
51G31.3Very low38.2Very low59 Ų59135.4 Ų135.461%0.60877%0.772SS**  72.412750.500000108.9
52F34.2Very low38.4Very low180 Ų180135.4 Ų135.479%0.78977%0.772SS**  cis-164147.114.6-110.6-110.4000106.6
53H42.5Very low39.1Very low157 Ų157134.6 Ų134.673%0.72777%0.765SS**  trans37.8125.9135.7-56.7-117.3000122.7
54S35.9Very low38.9Very low129 Ų129138.2 Ų138.290%0.90277%0.769SS**  trans-178136131-90.40000107.6
55G32.8Very low39.7Very low74 Ų74138.3 Ų138.376%0.76378%0.775SS**  cis120.2119.346.300000105.9
56G32.5Very low40Very low75 Ų75137.9 Ų137.977%0.77378%0.778SS**  trans-77-163.7-167.400000117
57R35.8Very low39.6Very low259 Ų259139.7 Ų139.798%0.97778%0.779SS**  trans85.6114.9-178.7-57-168.6172-144.3-0.9113.1
58G35Very low39.2Very low70 Ų70140 Ų14072%0.72279%0.789SS**  136.4154.768.900000103.9
59V41Very low38.9Very low128 Ų128137.6 Ų137.678%0.77678%0.781SS**  cis-164.2120.337.3-177.60000104.8
60Y42.2Very low38.8Very low236 Ų236134.6 Ų134.693%0.92578%0.778SS**  trans-91.5115.6162-127-94.1000106.4
61S39.5Very low39Very low94 Ų94133.5 Ų133.566%0.65778%0.777SS**  trans-88.6112.5169.1-65.70000108.8
62N39.1Very low39.4Very low153 Ų153134.6 Ų134.682%0.81878%0.775SS**  trans-174.7116.6140.5-118.2-64.6000110.9
63P51.3Low39.9Very low103 Ų103134.5 Ų134.567%0.66978%0.777SS**  trans-92.2138.7163.633.5-27.7000111.9
64D34Very low40.4Very low138 Ų138132 Ų13274%0.73877%0.774SS**  trans48115.8145.3-71.2-57000121.2
65L53.2Low40.9Very low174 Ų174131.7 Ų131.791%0.91177%0.77SS**  -135.9112.9124-79.7-176.7000111.1
66V46.7Very low41.1Very low103 Ų103135.9 Ų135.962%0.62477%0.774SS**  trans-37140.3158.6-67.30000115
67F37.6Very low41.4Very low184 Ų184137.6 Ų137.681%0.80777%0.774SS**  -171.6124.1110-116.3-92.7000110.3
68A43.5Very low41.5Very low95 Ų95129.5 Ų129.579%0.78576%0.763SS**  trans-89.8133.7161.800000107.5
69E32.4Very low41.9Very low168 Ų168132.4 Ų132.479%0.78577%0.767SS**  trans-144.1112.2156.9-159.1168.512200109.5
70A38.1Very low42.1Very low90 Ų90131.7 Ų131.774%0.74477%0.765SS**  trans-85.4128.2170.500000108.2
71V41.3Very low42.3Very low134 Ų134127 Ų12781%0.81276%0.76SS**  trans-120.9118.6159.2148.80000108.2
72S37.9Very low42.9Very low82 Ų82130.5 Ų130.557%0.57377%0.766SS**  trans-87.5165.4179.2-63.40000112.1
73H45.2Very low43.4Very low179 Ų179129.2 Ų129.283%0.82977%0.766SS**  trans96.2151.7161.8-47.2100.9000117.3
74P53.4Low42.9Very low103 Ų103131.1 Ų131.167%0.66978%0.775SS**  cis-130.8172.9-41.134.6-18.1000112.5
75P45.6Very low43.5Very low124 Ų124128.7 Ų128.781%0.80578%0.775SS**  trans-88134.3177.533.9-29.8000111.6
76N37.3Very low43.5Very low161 Ų161126.2 Ų126.286%0.86177%0.769SS**  trans-106.9120175-91.9-16.4000112.8
77S39.2Very low43.7Very low111 Ų111126 Ų12678%0.77677%0.769SS**  trans15.9114.9148.1-79.30000121.2
78A37.2Very low43.8Very low90 Ų90125.7 Ų125.774%0.74477%0.77SS**  37.8111.4108.500000119.3
79V44.9Very low43.5Very low130 Ų130126.2 Ų126.279%0.78877%0.774SS**  trans-146.3122.7136.8-161.80000108.6
80P44.8Very low44Very low113 Ų113126.5 Ų126.573%0.73478%0.78SS**  trans-92.7127.1169.932-24.6000109.9
81V46Very low44Very low137 Ų137127 Ų12783%0.8379%0.785SS**  trans-116122.8167.7179.20000108.3
82H52.8Low43.9Very low169 Ų169124.5 Ų124.578%0.78278%0.778SS**PPolyproline II helixtrans-58.7148.7-172.7-65.7-100.6000114.1
83P48.9Very low44.5Very low126 Ų126129.5 Ų129.582%0.81879%0.792SS**PPolyproline II helixtrans-84.7129.8163.431.6-27.7000110.9
84V40.5Very low44.6Very low142 Ų142126.4 Ų126.486%0.86179%0.787SS**PPolyproline II helixtrans-79.8124.8165.8142.30000108.9
85A47.2Very low43.9Very low88 Ų88130 Ų13073%0.72780%0.8SS**PPolyproline II helixtrans-84.4150.8168.400000110.7
86P52.3Low43.6Very low121 Ų121129.8 Ų129.879%0.78680%0.801SS**  trans-105.3150.1150.123-8.6000111.6
87P50.7Low43.6Very low98 Ų98127.6 Ų127.664%0.63680%0.799SS**  trans-105.4163.3-164.537.9-27.1000114.2
88H39.6Very low43.7Very low179 Ų179126.8 Ų126.883%0.82979%0.793SS**  trans77.9110.4161.5-50.3-67000119.4
89A39.2Very low43.7Very low105 Ų105131.3 Ų131.387%0.86880%0.798SS**  -159.4108.2122.100000109.4
90L41.9Very low43.6Very low175 Ų175130.5 Ų130.592%0.91680%0.799SS**  trans-78.2132.4165.1-67.3167.3000108.4
91A38.7Very low44Very low101 Ų101129.6 Ų129.684%0.83579%0.793SS**  trans-175.4116.1139.100000110
92A38.2Very low44Very low80 Ų80132.2 Ų132.266%0.66180%0.796SS**  trans-69152.8164.700000110.5
93H50Low44Very low188 Ų188129.2 Ų129.287%0.8779%0.791SS**  175129.3123.1-81.8-56.8000109.9
94P48.5Very low44.1Very low114 Ų114130.8 Ų130.874%0.7479%0.792SS**  trans-99.9130.2169.634.1-24.7000110.3
95L39.4Very low44.4Very low177 Ų177134.1 Ų134.193%0.92780%0.795SS**  trans-145.1125.3157.6-77-179.3000111.6
96S38.7Very low44.3Very low120 Ų120134.5 Ų134.584%0.83980%0.798SS**  trans-46.7140.4163.8-68.10000112.7
97S36.1Very low44Very low116 Ų116133.9 Ų133.981%0.81180%0.797SS**  trans-147.2107.4139.4-150.50000109.9
98S42.1Very low43.6Very low94 Ų94137.2 Ų137.266%0.65780%0.804SS**  trans-37.5141.4157.6155.50000111.5
99H37Very low43.8Very low184 Ų184136.5 Ų136.585%0.85280%0.801SS**  trans-175.2113.4130.2-89.794.2000109.5
100S43.7Very low44Very low113 Ų113142.4 Ų142.479%0.7980%0.801SS**  trans-151.9156.9155.6-159.90000105
101P52Low43.8Very low95 Ų95140 Ų14062%0.61779%0.789SS**  cis-135164.38.437.6-19.6000113.8
102H45.5Very low44.5Very low191 Ų191141.2 Ų141.288%0.88479%0.788SS**  trans-136.5120.5148.9-87.4-65000110.5
103P53.8Low45.3Very low106 Ų106141.6 Ų141.669%0.68879%0.786SS**  trans-96.3113.2-179.334.4-26.2000109.4
104L51.1Low45.7Very low159 Ų159137.4 Ų137.483%0.83277%0.774SS**  trans-143.677.5168.4-68.6177.3000108.7
105F47.7Very low46Very low213 Ų213138.9 Ų138.993%0.93477%0.769SS**  trans172.989.6141.1-99-73.1000107.1
106A44.7Very low47.1Very low95 Ų95136.2 Ų136.279%0.78575%0.747SS**  trans-70.2148.1165.300000109.9
107S44.9Very low48.3Very low109 Ų109133.7 Ų133.776%0.76273%0.728SS**  trans76.992.3160.7-158.10000117.4
108Q42.5Very low49.7Very low167 Ų167136.1 Ų136.178%0.7872%0.719SS**  -148.3106.8119.8-95.7-76.547.600106.4R110Q108-R110 PolarHBondContact O-N 2.9Å
109Q43.2Very low50.9Low165 Ų165134.5 Ų134.577%0.77170%0.703SS**  trans-43.599.9160.3-91.2-85.913.600108.7D111Q109-D111 PolarHBondContact O-N 3.18Å
110R44.3Very low52.1Low229 Ų229129 Ų12986%0.86468%0.68SS**  trans-8597.6165.9-76-157.3-174.5173.74.5106.5Q108Q108-R110 PolarHBondContact O-N 2.9Å
111D38.2Very low52.8Low123 Ų123129.2 Ų129.266%0.65867%0.668SS**  trans-33.7122.6164.8-97.4-50.7000110.8Q109 S113Q109-D111 PolarHBondContact O-N 3.18Å; D111-S113 PolarHBondContact O-N 3.15Å
112P51.9Low52.9Low128 Ų128134.3 Ų134.383%0.83168%0.675SS**THydrogen-bonded Turntrans-64.47.2172.9-20.632.3000114.2
113S57Low53.3Low87 Ų87132.5 Ų132.561%0.60866%0.662SS**THydrogen-bonded Turntrans-12136.2-161.7-56.40000112.9D111 F115D111-S113 PolarHBondContact O-N 3.15Å; S113-F115 PolarHBondContact O-N 3.43Å
114T56.7Low53.4Low101 Ų101135.4 Ų135.462%0.6266%0.659SS**  trans-72.277153.8-54.90000107.5Y116T114-Y116 HydrophobicContact CG2-CE1 4.38Å; T114-Y116 HydrophobicContact CG2-CE2 3.93Å; T114-Y116 VanDerWaalsContact O-CD2 3.29Å; T114-Y116 WeakPolarHBondContact O-CD2 3.48Å; T114-Y116 PolarHBondContact O-N 2.94Å
115F54.8Low53.5Low144 Ų144136.6 Ų136.663%0.63265%0.654SS**  trans-59.8100178.9-164.4-101000107.4S113 P117 L120S113-F115 PolarHBondContact O-N 3.43Å; F115-P117 HydrophobicContact CD1-CB 4.15Å; F115-P117 HydrophobicContact CE1-CB 4.05Å; F115-P117 WeakPolarHBondContact O-CD 3.33Å; F115-L120 HydrophobicContact CD2-CD1 3.73Å; F115-L120 HydrophobicContact CE1-CD1 4.44Å; F115-L120 HydrophobicContact CE2-CD1 3.58Å; F115-L120 HydrophobicContact CG-CD1 4.24Å; F115-L120 HydrophobicContact CZ-CD1 3.97Å
116Y63.6Low53.8Low122 Ų122132.9 Ų132.948%0.47864%0.643SS.*  trans-86.292.8165.7-67.9-72.5000107.5T114 W118 L119 L120T114-Y116 HydrophobicContact CG2-CE1 4.38Å; T114-Y116 HydrophobicContact CG2-CE2 3.93Å; T114-Y116 VanDerWaalsContact O-CD2 3.29Å; T114-Y116 WeakPolarHBondContact O-CD2 3.48Å; T114-Y116 PolarHBondContact O-N 2.94Å; Y116-W118 AromaticContact CD1-CE2 3.81Å; Y116-W118 AromaticContact CD1-CZ2 3.78Å; Y116-W118 HydrophobicContact CD1-CZ2 3.78Å; Y116-W118 AromaticContact CD1-NE1 3.45Å; Y116-W118 HydrophobicContact CE1-CZ2 4.39Å; Y116-W118 HydrophobicContact CG-CZ2 4.05Å; Y116-W118 PolarHBondContact O-N 3.38Å; Y116-W118 VanDerWaalsContact O-N 3.14Å; Y116-L119 WeakPolarHBondContact O-CB 3.42Å; Y116-L119 PolarHBondContact O-N 3.28Å; Y116-L120 PolarHBondContact O-N 3.17Å
117P63.2Low54.1Low67 Ų67130.9 Ų130.944%0.43563%0.631SS.*Hα-helixtrans-60.3-29.7-175.323.6-35.2000112.3F115 L119 H121F115-P117 HydrophobicContact CD1-CB 4.15Å; F115-P117 HydrophobicContact CE1-CB 4.05Å; F115-P117 WeakPolarHBondContact O-CD 3.33Å; P117-L119 VanDerWaalsContact C-N 3.33Å; P117-L119 PolarHBondContact O-N 3.06Å; P117-H121 PolarHBondContact O-N 3Å; P117-H121 VanDerWaalsContact O-N 3.13Å
118W65.9Low54.3Low166 Ų166134.6 Ų134.663%0.62964%0.636SS**Hα-helixtrans-69.1-30.4175.858.3-96.8000113.2Y116 R122Y116-W118 AromaticContact CD1-CE2 3.81Å; Y116-W118 AromaticContact CD1-CZ2 3.78Å; Y116-W118 HydrophobicContact CD1-CZ2 3.78Å; Y116-W118 AromaticContact CD1-NE1 3.45Å; Y116-W118 HydrophobicContact CE1-CZ2 4.39Å; Y116-W118 HydrophobicContact CG-CZ2 4.05Å; Y116-W118 PolarHBondContact O-N 3.38Å; Y116-W118 VanDerWaalsContact O-N 3.14Å; W118-R122 PolarHBondContact O-N 3.15Å
119L67.1Low54.6Low61 Ų61137.9 Ų137.932%0.31964%0.642SS.*Hα-helixtrans-76.3-44.3-179.2-163.869.6000109.6Y116 P117 H121 R122 Y123Y116-L119 WeakPolarHBondContact O-CB 3.42Å; Y116-L119 PolarHBondContact O-N 3.28Å; P117-L119 VanDerWaalsContact C-N 3.33Å; P117-L119 PolarHBondContact O-N 3.06Å; L119-H121 VanDerWaalsContact C-N 3.35Å; L119-H121 PolarHBondContact O-N 3.09Å; L119-R122 PolarHBondContact O-N 3.36Å; L119-Y123 HydrophobicContact CD1-CD2 4.35Å; L119-Y123 HydrophobicContact CD1-CE2 3.58Å; L119-Y123 HydrophobicContact CD2-CE2 4.24Å; L119-Y123 HydrophobicContact CG-CD2 3.94Å; L119-Y123 HydrophobicContact CG-CE2 3.53Å; L119-Y123 WeakPolarHBondContact O-CD2 3.44Å; L119-Y123 PolarHBondContact O-N 3.44Å; L119-Y123 VanDerWaalsContact O-N 3.15Å
120L62.2Low54.4Low68 Ų68139.7 Ų139.736%0.35665%0.647SS.*Hα-helixtrans-62.3-36.1174.3-77.5152.7000113.1F115 Y116 Y123 R124F115-L120 HydrophobicContact CD2-CD1 3.73Å; F115-L120 HydrophobicContact CE1-CD1 4.44Å; F115-L120 HydrophobicContact CE2-CD1 3.58Å; F115-L120 HydrophobicContact CG-CD1 4.24Å; F115-L120 HydrophobicContact CZ-CD1 3.97Å; Y116-L120 PolarHBondContact O-N 3.17Å; L120-Y123 PolarHBondContact O-N 3.32Å; L120-R124 WeakPolarHBondContact O-CB 3.32Å; L120-R124 WeakPolarHBondContact O-CG 3.37Å; L120-R124 PolarHBondContact O-N 3.41Å
121H58Low54.3Low118 Ų118138 Ų13855%0.54665%0.649SS.*Hα-helixtrans-71.9-27.2176.9-77.1-9.6000113.8P117 L119 Y125P117-H121 PolarHBondContact O-N 3Å; P117-H121 VanDerWaalsContact O-N 3.13Å; L119-H121 VanDerWaalsContact C-N 3.35Å; L119-H121 PolarHBondContact O-N 3.09Å; H121-Y125 WeakPolarHBondContact O-CD2 3.44Å
122R54.4Low54.6Low201 Ų201135.7 Ų135.776%0.75865%0.654SS**Hα-helixtrans-75.2-35.4172.3-175.3174.7-81.7-150.5-1.1111.6W118 L119W118-R122 PolarHBondContact O-N 3.15Å; L119-R122 PolarHBondContact O-N 3.36Å
123Y53.9Low54.1Low154 Ų154136.2 Ų136.260%0.60465%0.65SS**Hα-helixtrans-82.2-29.6-179.8-68.3-61.2000114.3L119 L120 Y125 L126 G127L119-Y123 HydrophobicContact CD1-CD2 4.35Å; L119-Y123 HydrophobicContact CD1-CE2 3.58Å; L119-Y123 HydrophobicContact CD2-CE2 4.24Å; L119-Y123 HydrophobicContact CG-CD2 3.94Å; L119-Y123 HydrophobicContact CG-CE2 3.53Å; L119-Y123 WeakPolarHBondContact O-CD2 3.44Å; L119-Y123 PolarHBondContact O-N 3.44Å; L119-Y123 VanDerWaalsContact O-N 3.15Å; L120-Y123 PolarHBondContact O-N 3.32Å; Y123-Y125 VanDerWaalsContact C-N 3.27Å; Y123-Y125 PolarHBondContact O-N 3.02Å; Y123-L126 PolarHBondContact O-N 3.28Å; Y123-L126 VanDerWaalsContact O-N 3.07Å; Y123-G127 PolarHBondContact O-N 2.92Å
124R55.5Low53.7Low166 Ų166141.2 Ų141.263%0.62666%0.664SS**Hα-helixtrans-64.4-23.8178.4-85.5-161-150.3-158.87.1115L120 L126L120-R124 WeakPolarHBondContact O-CB 3.32Å; L120-R124 WeakPolarHBondContact O-CG 3.37Å; L120-R124 PolarHBondContact O-N 3.41Å; R124-L126 VanDerWaalsContact C-N 3.34Å
125Y54Low53.2Low185 Ų185141.1 Ų141.173%0.72566%0.663SS**THydrogen-bonded Turntrans-89.82.2175.6-62-70.8000113.8H121 Y123 K149H121-Y125 WeakPolarHBondContact O-CD2 3.44Å; Y123-Y125 VanDerWaalsContact C-N 3.27Å; Y123-Y125 PolarHBondContact O-N 3.02Å; Y125-K149 PolarHBondContact O-NZ 3.46Å
126L54.7Low52.9Low135 Ų135138 Ų13871%0.70766%0.659SS**THydrogen-bonded Turntrans-122.60.4-179.5-122.481.3000115Y123 R124Y123-L126 PolarHBondContact O-N 3.28Å; Y123-L126 VanDerWaalsContact O-N 3.07Å; R124-L126 VanDerWaalsContact C-N 3.34Å
127G50.1Low52.5Low53 Ų53137.5 Ų137.555%0.54667%0.671SS.*SBendtrans-135.519-162.300000119.2Y123Y123-G127 PolarHBondContact O-N 2.92Å
128H48.4Very low51.7Low187 Ų187141.4 Ų141.487%0.86668%0.683SS**SBendtrans-133.761.4177.9-93.1-71.7000114.5
129R49Very low50.9Low236 Ų236136.6 Ų136.689%0.89168%0.675SS**SBendtrans-165.284.7141.6-168.3167.6-170.8156.20.9109.5
130F39.5Very low50.3Low203 Ų203141.3 Ų141.389%0.8969%0.693SS**  trans-163.9101.3140.3-117.9-84.1000107.2
131Q42.1Very low49.9Very low193 Ų193144.8 Ų144.890%0.90271%0.711SS**  trans-69.5139.5163.5-162153.646.700106.7
132G45.5Very low49.7Very low74 Ų74146 Ų14676%0.76372%0.721SS**  trans-53.3147.6-157.100000117.6
133N41Very low49.5Very low140 Ų140142.8 Ų142.875%0.74971%0.714SS**  trans-146.1131.8138.4-161.628000107.6T135N133-T135 PolarHBondContact O-N 2.99Å
134E47.7Very low49.2Very low191 Ų191141 Ų14189%0.89372%0.715SS**  trans-64.597.7-174.6-59.8-82.9109.700110.2
135T46.8Very low49Very low100 Ų100136.1 Ų136.161%0.61371%0.71SS**  trans-134.6106.2169.259.60000110.7N133N133-T135 PolarHBondContact O-N 2.99Å
136S48.8Very low49Very low77 Ų77135 Ų13554%0.53872%0.716SS.*  trans31.7125.1154.2-169.80000119.4E138 S139S136-E138 PolarHBondContact O-N 2.94Å; S136-S139 PolarHBondContact O-N 3.13Å
137P54.9Low49Very low113 Ų113131.4 Ų131.473%0.73471%0.706SS**THydrogen-bonded Turntrans-62.7-11.417925.1-32.5000115.2S139P137-S139 VanDerWaalsContact C-N 3.33Å; P137-S139 PolarHBondContact O-N 3.48Å
138E45.8Very low49.6Very low149 Ų149138 Ų13870%0.69671%0.714SS**THydrogen-bonded Turntrans-68.7-25.5174.8-82.5-96.6135.800113.6S136 F140S136-E138 PolarHBondContact O-N 2.94Å; E138-F140 VanDerWaalsContact C-N 3.3Å; E138-F140 PolarHBondContact O-N 2.99Å
139S49.4Very low50.3Low64 Ų64135.3 Ų135.345%0.44870%0.7SS.*Hα-helixtrans-73.3-21.3-176-159.10000113.6S136 P137 L141S136-S139 PolarHBondContact O-N 3.13Å; P137-S139 VanDerWaalsContact C-N 3.33Å; P137-S139 PolarHBondContact O-N 3.48Å; S139-L141 PolarHBondContact O-N 2.86Å
140F53.7Low51.2Low160 Ų160130.1 Ų130.170%0.70270%0.697SS**Hα-helixtrans-73.3-25-176.9-79-85.6000114.1E138E138-F140 VanDerWaalsContact C-N 3.3Å; E138-F140 PolarHBondContact O-N 2.99Å
141L55.8Low52.8Low141 Ų141129.9 Ų129.974%0.73870%0.696SS**Hα-helixtrans-81.4-32-175.6-64.1-177.9000112.8S139S139-L141 PolarHBondContact O-N 2.86Å
142L52.5Low54.2Low145 Ų145132.1 Ų132.176%0.75970%0.696SS**Hα-helixtrans-88-24.1-178.8-63.8179.3000113.5N144L142-N144 VanDerWaalsContact C-N 3.34Å; L142-N144 PolarHBondContact O-N 3.07Å
143H50.2Low55.7Low132 Ų132136.1 Ų136.161%0.61170%0.698SS**THydrogen-bonded Turntrans-79.7-11.3-177.2-131.2100.2000114.5A147H143-A147 VanDerWaalsContact O-CB 3.24Å; H143-A147 WeakPolarHBondContact O-CB 3.31Å; H143-A147 PolarHBondContact O-N 3.38Å
144N48.2Very low57.7Low116 Ų116140.8 Ų140.862%0.6271%0.705SS**THydrogen-bonded Turntrans-82.4-19.4-174.8-161.77.8000113.9L142L142-N144 VanDerWaalsContact C-N 3.34Å; L142-N144 PolarHBondContact O-N 3.07Å
145A52.1Low59.4Low64 Ų64136.2 Ų136.253%0.52969%0.691SS.*THydrogen-bonded Turntrans-74.9-32.6178.800000112.7
146L52.5Low61.6Low161 Ų161136.1 Ų136.184%0.84370%0.7SS**THydrogen-bonded Turntrans-102.4-22.2-175.2-60.3177.8000113.8R148L146-R148 PolarHBondContact O-N 2.92Å
147A54.2Low63.9Low60 Ų60134.9 Ų134.950%0.49669%0.685SS.*  trans-83.613.9179.400000114.8H143 K149H143-A147 VanDerWaalsContact O-CB 3.24Å; H143-A147 WeakPolarHBondContact O-CB 3.31Å; H143-A147 PolarHBondContact O-N 3.38Å; A147-K149 PolarHBondContact O-N 3.12Å
148R63.1Low65.9Low191 Ų191131.9 Ų131.972%0.72167%0.667SS**  trans-72.198.2174.2-63.6-164.9-70.9-146.30.1108.3L146L146-R148 PolarHBondContact O-N 2.92Å
149K63.8Low68.4Low132 Ų132130 Ų13057%0.57467%0.667SS**  trans-31.9127.5168.8-84.890151.9175.30109.5Y125 A147 K151Y125-K149 PolarHBondContact O-NZ 3.46Å; A147-K149 PolarHBondContact O-N 3.12Å; K149-K151 PolarHBondContact O-N 2.94Å
150P67.1Low70.7Confident126 Ų126130.5 Ų130.582%0.81867%0.671SS**PPolyproline II helixtrans-48.3116-179.2-29.434.6000110.5R152P150-R152 PolarHBondContact O-N 3.23Å
151K73.7Confident72.8Confident198 Ų198124.6 Ų124.686%0.86165%0.645SS**PPolyproline II helixtrans-61.5122.4176.9-146.6114.9172.9-172.10105.7K149 I153K149-K151 PolarHBondContact O-N 2.94Å; K151-I153 PolarHBondContact O-N 3.38Å
152R71.8Confident74.8Confident241 Ų241121.1 Ų121.191%0.90963%0.627SS**PPolyproline II helixtrans-49.6117.7177.1-76.4-172.5-173.3167.22.2108.4P150 R154P150-R152 PolarHBondContact O-N 3.23Å; R152-R154 PolarHBondContact O-N 2.99Å
153I76.5Confident77Confident157 Ų157120.4 Ų120.481%0.80562%0.623SS**PPolyproline II helixtrans-61125.4177.9-61.6174.9000106.8K151 T155K151-I153 PolarHBondContact O-N 3.38Å; I153-T155 PolarHBondContact O-N 2.89Å
154R83.3Confident79.2Confident238 Ų238121.5 Ų121.590%0.89862%0.622SS**PPolyproline II helixtrans-73.9118173.5-70.7-176.4176.3-179.6-1107.5R152R152-R154 PolarHBondContact O-N 2.99Å
155T83.4Confident81.6Confident96 Ų96116 Ų11659%0.58959%0.592SS**PPolyproline II helixtrans-74.7124.3170.654.90000109I153I153-T155 PolarHBondContact O-N 2.89Å
156A92.6Very high83.8Confident97 Ų97115.4 Ų115.480%0.80258%0.579SS**PPolyproline II helixtrans-92.8143.6170.500000109.9
157F96.8Very high86Confident51 Ų51111.9 Ų111.922%0.22456%0.558CS.*PPolyproline II helixtrans-89.3143.8172.4-58.9-52.4000109.9Q161 L162 L189 Q193 W197F157-Q161 HydrophobicContact CB-CB 4.38Å; F157-L162 HydrophobicContact CB-CD2 3.85Å; F157-L162 HydrophobicContact CB-CG 4.03Å; F157-L162 HydrophobicContact CD2-CD2 4.1Å; F157-L162 HydrophobicContact CG-CD2 4.44Å; F157-L189 HydrophobicContact CD1-CD1 4.07Å; F157-L189 HydrophobicContact CD1-CD2 3.8Å; F157-L189 HydrophobicContact CE1-CD1 4.02Å; F157-L189 HydrophobicContact CE1-CD2 3.74Å; F157-Q193 HydrophobicContact CE1-CB 4.2Å; F157-Q193 HydrophobicContact CE1-CG 4.38Å; F157-Q193 HydrophobicContact CZ-CB 4.07Å; F157-Q193 HydrophobicContact CZ-CG 4.39Å; F157-W197 AromaticContact CD2-CD1 3.64Å; F157-W197 HydrophobicContact CE2-CB 4.26Å; F157-W197 AromaticContact CE2-CD1 3.56Å; F157-W197 HydrophobicContact CE2-CG 4.28Å
158S97.6Very high88.1Confident51 Ų51110.1 Ų110.136%0.35754%0.543SS..PPolyproline II helixtrans-63149.7173170.80000110.9S160 Q161 L162S158-S160 PolarHBondContact O-N 3.11Å; S158-S160 PolarHBondContact OG-N 2.96Å; S158-S160 PolarHBondContact OG-OG 3.29Å; S158-S160 VanDerWaalsContact OG-OG 3.11Å; S158-Q161 WeakPolarHBondContact O-CB 3.41Å; S158-Q161 PolarHBondContact O-N 3.34Å; S158-L162 PolarHBondContact O-N 3.13Å
159P97.3Very high89.7Confident108 Ų108101.2 Ų101.270%0.70151%0.51SS*.Hα-helixtrans-51.8-39173.3-27.535.4000113.7Q161 L162 L163P159-Q161 PolarHBondContact O-N 3.23Å; P159-L162 PolarHBondContact O-N 3.45Å; P159-L163 PolarHBondContact O-N 3.47Å
160S97.6Very high91.4Very high75 Ų75101.2 Ų101.252%0.52451%0.512SS..Hα-helixtrans-66.4-37.3178.459.90000112.6S158 R164S158-S160 PolarHBondContact O-N 3.11Å; S158-S160 PolarHBondContact OG-N 2.96Å; S158-S160 PolarHBondContact OG-OG 3.29Å; S158-S160 VanDerWaalsContact OG-OG 3.11Å; S160-R164 WeakPolarHBondContact O-CG 3.37Å; S160-R164 PolarHBondContact O-N 2.97Å
161Q98Very high92.8Very high36 Ų36102.6 Ų102.617%0.16851%0.505CS..Hα-helixtrans-66-44.4174.8-68172.7-37.400110.6F157 S158 P159 L163 R164 L165 L187F157-Q161 HydrophobicContact CB-CB 4.38Å; S158-Q161 WeakPolarHBondContact O-CB 3.41Å; S158-Q161 PolarHBondContact O-N 3.34Å; P159-Q161 PolarHBondContact O-N 3.23Å; Q161-L163 VanDerWaalsContact C-N 3.35Å; Q161-L163 PolarHBondContact O-N 2.98Å; Q161-R164 PolarHBondContact O-N 3.34Å; Q161-L165 WeakPolarHBondContact O-CB 3.45Å; Q161-L165 WeakPolarHBondContact O-CD1 3.5Å; Q161-L165 VanDerWaalsContact O-CG 3.22Å; Q161-L165 WeakPolarHBondContact O-CG 3.45Å; Q161-L165 PolarHBondContact O-N 2.67Å; Q161-L187 PolarHBondContact NE2-O 2.91Å
162L98.1Very high93.9Very high69 Ų6996.3 Ų96.336%0.36148%0.481SS..Hα-helixtrans-60.3-44.1177.6-67.6175.5000111.9F157 S158 P159 R164 L165 E166F157-L162 HydrophobicContact CB-CD2 3.85Å; F157-L162 HydrophobicContact CB-CG 4.03Å; F157-L162 HydrophobicContact CD2-CD2 4.1Å; F157-L162 HydrophobicContact CG-CD2 4.44Å; S158-L162 PolarHBondContact O-N 3.13Å; P159-L162 PolarHBondContact O-N 3.45Å; L162-R164 PolarHBondContact O-N 2.87Å; L162-L165 PolarHBondContact O-N 2.81Å; L162-E166 WeakPolarHBondContact O-CB 3.49Å; L162-E166 PolarHBondContact O-N 3.17Å
163L98.2Very high95.1Very high129 Ų12988 Ų8868%0.67545%0.452SS*.Hα-helixtrans-58.3-47.5177.9-170.4101.3000111.7P159 Q161 E166 H167P159-L163 PolarHBondContact O-N 3.47Å; Q161-L163 VanDerWaalsContact C-N 3.35Å; Q161-L163 PolarHBondContact O-N 2.98Å; L163-E166 PolarHBondContact O-N 2.87Å; L163-H167 WeakPolarHBondContact O-CB 3.31Å; L163-H167 PolarHBondContact O-N 2.85Å
164R97.9Very high96.1Very high155 Ų15587.2 Ų87.259%0.58544%0.44SS*.Hα-helixtrans-66.3-38.5179.1-68-71.2-163.3172.64.1112.3S160 Q161 L162 A168 L187S160-R164 WeakPolarHBondContact O-CG 3.37Å; S160-R164 PolarHBondContact O-N 2.97Å; Q161-R164 PolarHBondContact O-N 3.34Å; L162-R164 PolarHBondContact O-N 2.87Å; R164-A168 WeakPolarHBondContact O-CB 3.49Å; R164-A168 PolarHBondContact O-N 3.43Å; R164-L187 HydrophobicContact CB-CD1 4.2Å; R164-L187 HydrophobicContact CB-CD2 3.51Å; R164-L187 HydrophobicContact CB-CG 4.46Å; R164-L187 HydrophobicContact CG-CD2 3.8Å
165L98.4Very high96.7Very high0 Ų076.5 Ų76.50%040%0.401CS..Hα-helixtrans-64.3-41.2175-72.6165.1000111.5Q161 L162 A168 F169 L183 L187 L189 V194 W197 F198Q161-L165 WeakPolarHBondContact O-CB 3.45Å; Q161-L165 WeakPolarHBondContact O-CD1 3.5Å; Q161-L165 VanDerWaalsContact O-CG 3.22Å; Q161-L165 WeakPolarHBondContact O-CG 3.45Å; Q161-L165 PolarHBondContact O-N 2.67Å; L162-L165 PolarHBondContact O-N 2.81Å; L165-A168 PolarHBondContact O-N 2.92Å; L165-F169 WeakPolarHBondContact O-CB 3.21Å; L165-F169 PolarHBondContact O-N 3.02Å; L165-L183 HydrophobicContact CD2-CD2 3.97Å; L165-L183 HydrophobicContact CD2-CG 4.3Å; L165-L187 HydrophobicContact CD1-CD1 4.39Å; L165-L187 HydrophobicContact CD2-CD1 3.68Å; L165-L187 HydrophobicContact CG-CD1 3.61Å; L165-L189 HydrophobicContact CD1-CD1 4.21Å; L165-V194 HydrophobicContact CD2-CG1 4.42Å; L165-W197 VanDerWaalsContact C-CH2 3.48Å; L165-W197 HydrophobicContact CB-CD2 3.89Å; L165-W197 HydrophobicContact CB-CE3 3.86Å; L165-W197 HydrophobicContact CB-CH2 3.61Å; L165-W197 HydrophobicContact CB-CZ2 3.59Å; L165-W197 HydrophobicContact CB-CZ3 3.74Å; L165-W197 HydrophobicContact CD1-CD2 3.84Å; L165-W197 HydrophobicContact CD1-CE3 4.48Å; L165-W197 HydrophobicContact CD1-CG 3.83Å; L165-W197 HydrophobicContact CD2-CD2 4.33Å; L165-W197 HydrophobicContact CD2-CE3 4.21Å; L165-W197 HydrophobicContact CG-CD2 4.23Å; L165-W197 HydrophobicContact CG-CE3 4.4Å; L165-F198 HydrophobicContact CD2-CE2 4.04Å
166E98.4Very high97.4Very high52 Ų5276.2 Ų76.224%0.24340%0.399CS..Hα-helixtrans-65.5-47.3177.4-163.566-152.500111.4L162 L163 A168 F169 E170 W197 R201L162-E166 WeakPolarHBondContact O-CB 3.49Å; L162-E166 PolarHBondContact O-N 3.17Å; L163-E166 PolarHBondContact O-N 2.87Å; E166-A168 VanDerWaalsContact C-N 3.29Å; E166-A168 PolarHBondContact O-N 3.3Å; E166-F169 WeakPolarHBondContact O-CA 3.34Å; E166-F169 VanDerWaalsContact O-CB 3.3Å; E166-F169 WeakPolarHBondContact O-CB 3.29Å; E166-F169 PolarHBondContact O-N 3.19Å; E166-E170 WeakPolarHBondContact O-CG 3.47Å; E166-E170 PolarHBondContact O-N 3.12Å; E166-W197 WeakPolarHBondContact OE2-CH2 3.34Å; E166-R201 VanDerWaalsContact CD-NE 3.28Å; E166-R201 IonicContact OE1-CZ 3.15Å; E166-R201 IonicContact OE1-NE 2.81Å; E166-R201 PolarHBondContact OE1-NE 2.88Å; E166-R201 IonicContact OE1-NH2 2.67Å; E166-R201 PolarHBondContact OE1-NH2 3.32Å; E166-R201 WeakPolarHBondContact OE2-CD 3.5Å; E166-R201 IonicContact OE2-CZ 3.79Å; E166-R201 IonicContact OE2-NE 2.89Å; E166-R201 PolarHBondContact OE2-NE 3.49Å; E166-R201 IonicContact OE2-NH2 3.93Å
167H98.2Very high97.5Very high88 Ų8873.6 Ų73.641%0.40738%0.381SS..Hα-helixtrans-61.1-36.7175.9174.5-108.7000112.7L163 F169 K171L163-H167 WeakPolarHBondContact O-CB 3.31Å; L163-H167 PolarHBondContact O-N 2.85Å; H167-F169 VanDerWaalsContact C-N 3.34Å; H167-K171 WeakPolarHBondContact CE1-CE 3.44Å; H167-K171 PolarHBondContact CE1-NZ 3.38Å; H167-K171 WeakPolarHBondContact NE2-CE 3.25Å
168A97.4Very high97.5Very high22 Ų2274.5 Ų74.518%0.18240%0.398CS..Hα-helixtrans-67.3-37.1172.600000111.9R164 L165 E166 K171 N172 L183 F198R164-A168 WeakPolarHBondContact O-CB 3.49Å; R164-A168 PolarHBondContact O-N 3.43Å; L165-A168 PolarHBondContact O-N 2.92Å; E166-A168 VanDerWaalsContact C-N 3.29Å; E166-A168 PolarHBondContact O-N 3.3Å; A168-K171 PolarHBondContact O-N 3.34Å; A168-N172 PolarHBondContact O-N 2.96Å; A168-N172 VanDerWaalsContact O-N 3.09Å; A168-L183 HydrophobicContact CB-CD1 4.27Å; A168-L183 HydrophobicContact CB-CD2 3.88Å; A168-F198 HydrophobicContact CB-CZ 4.17Å
169F98.3Very high97.5Very high4 Ų476.4 Ų76.42%0.01840%0.401CS..Hα-helixtrans-65.1-42.4177.8-175.4-98.1000112.3L165 E166 H167 K171 N172 H173 W197 F198 R201 R202 F205L165-F169 WeakPolarHBondContact O-CB 3.21Å; L165-F169 PolarHBondContact O-N 3.02Å; E166-F169 WeakPolarHBondContact O-CA 3.34Å; E166-F169 VanDerWaalsContact O-CB 3.3Å; E166-F169 WeakPolarHBondContact O-CB 3.29Å; E166-F169 PolarHBondContact O-N 3.19Å; H167-F169 VanDerWaalsContact C-N 3.34Å; F169-K171 PolarHBondContact O-N 3.18Å; F169-N172 CarbonylContact O-C 3.1Å; F169-N172 PolarHBondContact O-N 3.37Å; F169-N172 VanDerWaalsContact O-N 3.15Å; F169-H173 AromaticContact CD1-CD2 3.57Å; F169-H173 AromaticContact CD1-NE2 3.99Å; F169-H173 HydrophobicContact CD2-CB 4.47Å; F169-H173 AromaticContact CE1-CD2 3.19Å; F169-H173 WeakPolarHBondContact CE1-CD2 3.39Å; F169-H173 AromaticContact CE1-NE2 3.46Å; F169-H173 WeakPolarHBondContact CE1-NE2 3.43Å; F169-H173 HydrophobicContact CE2-CB 3.86Å; F169-H173 AromaticContact CE2-CD2 3.69Å; F169-H173 AromaticContact CG-CD2 3.97Å; F169-H173 HydrophobicContact CZ-CB 4.04Å; F169-H173 AromaticContact CZ-CD2 3.25Å; F169-H173 WeakPolarHBondContact CZ-CD2 3.22Å; F169-H173 AromaticContact CZ-CG 3.72Å; F169-H173 AromaticContact CZ-NE2 3.85Å; F169-H173 PolarHBondContact O-CD2 3.45Å; F169-H173 PolarHBondContact O-N 2.85Å; F169-W197 HydrophobicContact CB-CH2 4.3Å; F169-W197 HydrophobicContact CB-CZ3 4.08Å; F169-W197 HydrophobicContact CD2-CZ3 4.44Å; F169-W197 HydrophobicContact CG-CZ3 4.47Å; F169-F198 HydrophobicContact CB-CE1 4.18Å; F169-F198 HydrophobicContact CB-CZ 4.45Å; F169-F198 AromaticContact CD2-CD1 3.83Å; F169-F198 HydrophobicContact CD2-CD1 3.83Å; F169-F198 AromaticContact CD2-CE1 3.87Å; F169-F198 HydrophobicContact CD2-CE1 3.87Å; F169-R201 HydrophobicContact CD1-CG 3.78Å; F169-R201 HydrophobicContact CD2-CB 4.16Å; F169-R201 HydrophobicContact CD2-CG 3.66Å; F169-R201 HydrophobicContact CE1-CG 3.77Å; F169-R201 HydrophobicContact CE2-CB 4.04Å; F169-R201 HydrophobicContact CE2-CG 3.66Å; F169-R201 HydrophobicContact CG-CG 3.73Å; F169-R201 HydrophobicContact CZ-CB 4.44Å; F169-R201 HydrophobicContact CZ-CG 3.72Å; F169-R202 HydrophobicContact CE2-CG 3.79Å; F169-R202 HydrophobicContact CZ-CG 4.22Å; F169-F205 HydrophobicContact CE1-CB 4.37Å; F169-F205 HydrophobicContact CE1-CD2 4.3Å; F169-F205 HydrophobicContact CE1-CG 4.37Å; F169-F205 HydrophobicContact CZ-CB 4.18Å; F169-F205 HydrophobicContact CZ-CG 4.4Å
170E97.7Very high97.6Very high133 Ų13374 Ų7462%0.62138%0.378SS*.Hα-helixtrans-57-37176-72169.4-179.900112.3E166E166-E170 WeakPolarHBondContact O-CG 3.47Å; E166-E170 PolarHBondContact O-N 3.12Å
171K97Very high97.6Very high155 Ų15576.1 Ų76.167%0.67438%0.378SS*.Hα-helixtrans-71.9-43.9175.6-64.9-179-179.6-169.90112.2H167 A168 F169H167-K171 WeakPolarHBondContact CE1-CE 3.44Å; H167-K171 PolarHBondContact CE1-NZ 3.38Å; H167-K171 WeakPolarHBondContact NE2-CE 3.25Å; A168-K171 PolarHBondContact O-N 3.34Å; F169-K171 PolarHBondContact O-N 3.18Å
172N96.7Very high97.6Very high66 Ų6681.1 Ų81.135%0.35340%0.402SS..  trans-151.9123.1179.6-172.1-6.7000111.3A168 F169 Y174 F198A168-N172 PolarHBondContact O-N 2.96Å; A168-N172 VanDerWaalsContact O-N 3.09Å; F169-N172 CarbonylContact O-C 3.1Å; F169-N172 PolarHBondContact O-N 3.37Å; F169-N172 VanDerWaalsContact O-N 3.15Å; N172-Y174 VanDerWaalsContact CG-O 3.28Å; N172-Y174 PolarHBondContact ND2-O 3.22Å; N172-Y174 PolarHBondContact O-N 2.79Å; N172-Y174 VanDerWaalsContact O-N 3.17Å; N172-Y174 PolarHBondContact OD1-N 2.91Å; N172-Y174 PolarHBondContact OD1-O 3.49Å; N172-F198 WeakPolarHBondContact O-CE1 3.42Å
173H97.2Very high97.6Very high66 Ų6678.9 Ų78.931%0.30639%0.39SS..SBendtrans-70.5-8.3178.8-63.6158.9000114.3F169 R202 F205F169-H173 AromaticContact CD1-CD2 3.57Å; F169-H173 AromaticContact CD1-NE2 3.99Å; F169-H173 HydrophobicContact CD2-CB 4.47Å; F169-H173 AromaticContact CE1-CD2 3.19Å; F169-H173 WeakPolarHBondContact CE1-CD2 3.39Å; F169-H173 AromaticContact CE1-NE2 3.46Å; F169-H173 WeakPolarHBondContact CE1-NE2 3.43Å; F169-H173 HydrophobicContact CE2-CB 3.86Å; F169-H173 AromaticContact CE2-CD2 3.69Å; F169-H173 AromaticContact CG-CD2 3.97Å; F169-H173 HydrophobicContact CZ-CB 4.04Å; F169-H173 AromaticContact CZ-CD2 3.25Å; F169-H173 WeakPolarHBondContact CZ-CD2 3.22Å; F169-H173 AromaticContact CZ-CG 3.72Å; F169-H173 AromaticContact CZ-NE2 3.85Å; F169-H173 PolarHBondContact O-CD2 3.45Å; F169-H173 PolarHBondContact O-N 2.85Å; H173-R202 WeakPolarHBondContact O-CD 3.19Å; H173-R202 PolarHBondContact O-NH1 3.41Å; H173-F205 AromaticContact CE1-CE1 3.92Å; H173-F205 AromaticContact CE1-CZ 3.84Å
174Y97.8Very high97.6Very high140 Ų14073 Ų7355%0.54936%0.36SS..  trans-133.1112.1179.6-63.8-91.3000111.8N172 R202N172-Y174 VanDerWaalsContact CG-O 3.28Å; N172-Y174 PolarHBondContact ND2-O 3.22Å; N172-Y174 PolarHBondContact O-N 2.79Å; N172-Y174 VanDerWaalsContact O-N 3.17Å; N172-Y174 PolarHBondContact OD1-N 2.91Å; N172-Y174 PolarHBondContact OD1-O 3.49Å; Y174-R202 VanDerWaalsContact CD1-NH1 3.3Å; Y174-R202 VanDerWaalsContact CE1-CZ 3.48Å; Y174-R202 VanDerWaalsContact CE1-NE 3.29Å
175V96.8Very high97.6Very high13 Ų1373.5 Ų73.58%0.07937%0.368CS..  trans-93.4129.2172-690000112.1R180 L183 V194 F198V175-R180 HydrophobicContact CB-CB 4.44Å; V175-R180 HydrophobicContact CG2-CB 4.43Å; V175-R180 HydrophobicContact CG2-CG 4.5Å; V175-R180 PolarHBondContact O-NE 3.48Å; V175-R180 PolarHBondContact O-NH2 3.28Å; V175-L183 HydrophobicContact CG1-CD2 4.41Å; V175-V194 HydrophobicContact CG2-CG1 4Å; V175-F198 HydrophobicContact CB-CD1 4.44Å; V175-F198 HydrophobicContact CB-CE1 4.24Å; V175-F198 HydrophobicContact CB-CE2 4.49Å; V175-F198 HydrophobicContact CB-CZ 4.27Å; V175-F198 HydrophobicContact CG1-CD1 4.09Å; V175-F198 HydrophobicContact CG1-CE1 3.43Å; V175-F198 VanDerWaalsContact CG1-CE1 3.43Å; V175-F198 HydrophobicContact CG1-CE2 3.93Å; V175-F198 HydrophobicContact CG1-CZ 3.33Å; V175-F198 HydrophobicContact CG2-CB 4.31Å; V175-F198 HydrophobicContact CG2-CD1 3.79Å; V175-F198 HydrophobicContact CG2-CD2 3.56Å; V175-F198 HydrophobicContact CG2-CE1 3.96Å; V175-F198 HydrophobicContact CG2-CE2 3.75Å; V175-F198 HydrophobicContact CG2-CG 3.6Å; V175-F198 HydrophobicContact CG2-CZ 3.94Å
176V96.4Very high97.5Very high90 Ų9077.4 Ų77.455%0.54540%0.396SS..  trans-124.6152.9-175-80.90000111.9A178 E179 R180V176-A178 PolarHBondContact O-N 3.49Å; V176-E179 PolarHBondContact O-N 3.36Å; V176-R180 PolarHBondContact O-N 3.05Å
177G96.2Very high97.5Very high42 Ų4275.8 Ų75.843%0.43339%0.389SS..Hα-helixtrans33.9-100.2169.300000116K181G177-K181 WeakPolarHBondContact O-CG 3.39Å; G177-K181 PolarHBondContact O-N 3.32Å
178A96.9Very high97.5Very high70 Ų7076.9 Ų76.958%0.57941%0.406SS*.Hα-helixtrans-67.9-45.5-175.600000113.4V176 R180 K181 Q182V176-A178 PolarHBondContact O-N 3.49Å; A178-R180 VanDerWaalsContact C-N 3.28Å; A178-R180 PolarHBondContact O-N 3.44Å; A178-K181 WeakPolarHBondContact O-CB 3.48Å; A178-K181 PolarHBondContact O-N 3.21Å; A178-K181 VanDerWaalsContact O-N 3.16Å; A178-Q182 WeakPolarHBondContact O-CG 3.3Å; A178-Q182 PolarHBondContact O-N 3.02Å
179E97Very high97.4Very high91 Ų9176.8 Ų76.843%0.42540%0.403SS..Hα-helixtrans-61.4-40.8179.7-62.3-178.7158.200111.2V176 K181 Q182 L183V176-E179 PolarHBondContact O-N 3.36Å; E179-K181 PolarHBondContact O-N 2.89Å; E179-Q182 PolarHBondContact O-N 2.95Å; E179-L183 WeakPolarHBondContact O-CB 3.25Å; E179-L183 PolarHBondContact O-N 3.2Å
180R98.4Very high97.4Very high57 Ų5780.3 Ų80.322%0.21542%0.424CS..Hα-helixtrans-61.8-44.4176.5-174.4-171.7-59157.25.6111.4V175 V176 A178 L183 A184 E191 V194V175-R180 HydrophobicContact CB-CB 4.44Å; V175-R180 HydrophobicContact CG2-CB 4.43Å; V175-R180 HydrophobicContact CG2-CG 4.5Å; V175-R180 PolarHBondContact O-NE 3.48Å; V175-R180 PolarHBondContact O-NH2 3.28Å; V176-R180 PolarHBondContact O-N 3.05Å; A178-R180 VanDerWaalsContact C-N 3.28Å; A178-R180 PolarHBondContact O-N 3.44Å; R180-L183 PolarHBondContact O-N 3.15Å; R180-A184 WeakPolarHBondContact O-CB 3.42Å; R180-A184 PolarHBondContact O-N 2.97Å; R180-E191 HydrophobicContact CG-CB 4.22Å; R180-E191 HydrophobicContact CG-CG 4.33Å; R180-V194 HydrophobicContact CG-CB 4.33Å; R180-V194 HydrophobicContact CG-CG1 4.13Å
181K98.3Very high97.4Very high121 Ų12177.6 Ų77.653%0.52641%0.412SS..Hα-helixtrans-61.1-45.5178-76.2175.1179.7-173.40111.5G177 A178 E179 A184 H185 E191G177-K181 WeakPolarHBondContact O-CG 3.39Å; G177-K181 PolarHBondContact O-N 3.32Å; A178-K181 WeakPolarHBondContact O-CB 3.48Å; A178-K181 PolarHBondContact O-N 3.21Å; A178-K181 VanDerWaalsContact O-N 3.16Å; E179-K181 PolarHBondContact O-N 2.89Å; K181-A184 PolarHBondContact O-N 3.39Å; K181-H185 WeakPolarHBondContact O-CB 3.47Å; K181-H185 PolarHBondContact O-N 3.36Å; K181-E191 WeakPolarHBondContact CE-OE1 3.41Å; K181-E191 VanDerWaalsContact CG-CD 3.41Å; K181-E191 HydrophobicContact CG-CG 4.17Å; K181-E191 VanDerWaalsContact CG-OE1 3.32Å; K181-E191 WeakPolarHBondContact CG-OE1 3.45Å
182Q98.1Very high97.5Very high141 Ų14174.3 Ų74.366%0.65941%0.405SS*.Hα-helixtrans-64.5-42.3178.2-71.1-179.2-24.300112.4A178 E179 H185 S186A178-Q182 WeakPolarHBondContact O-CG 3.3Å; A178-Q182 PolarHBondContact O-N 3.02Å; E179-Q182 PolarHBondContact O-N 2.95Å; Q182-H185 PolarHBondContact O-N 2.99Å; Q182-S186 WeakPolarHBondContact O-CB 3.46Å; Q182-S186 PolarHBondContact O-N 3.18Å; Q182-S186 PolarHBondContact O-OG 3.49Å; Q182-S186 VanDerWaalsContact O-OG 3.06Å
183L97.7Very high97.5Very high22 Ų2273.5 Ų73.512%0.11540%0.399CS..Hα-helixtrans-68.5-38.4178.3-169.759.7000111.9L165 A168 V175 E179 R180 S186 L187 V194 F198L165-L183 HydrophobicContact CD2-CD2 3.97Å; L165-L183 HydrophobicContact CD2-CG 4.3Å; A168-L183 HydrophobicContact CB-CD1 4.27Å; A168-L183 HydrophobicContact CB-CD2 3.88Å; V175-L183 HydrophobicContact CG1-CD2 4.41Å; E179-L183 WeakPolarHBondContact O-CB 3.25Å; E179-L183 PolarHBondContact O-N 3.2Å; R180-L183 PolarHBondContact O-N 3.15Å; L183-S186 PolarHBondContact O-OG 3.49Å; L183-L187 HydrophobicContact CD1-CD1 3.72Å; L183-L187 HydrophobicContact CD1-CG 4.16Å; L183-L187 HydrophobicContact CG-CD1 4.02Å; L183-L187 WeakPolarHBondContact O-CB 3.48Å; L183-L187 VanDerWaalsContact O-CG 3.31Å; L183-L187 WeakPolarHBondContact O-CG 3.29Å; L183-L187 PolarHBondContact O-N 3.49Å; L183-V194 HydrophobicContact CD2-CG1 3.95Å; L183-V194 HydrophobicContact CG-CG1 4.42Å; L183-F198 HydrophobicContact CD2-CE2 3.66Å; L183-F198 HydrophobicContact CD2-CZ 3.98Å
184A98.1Very high97.5Very high6 Ų670.4 Ų70.45%0.0539%0.385CS..Hα-helixtrans-61.2-48.5174.200000111R180 K181 L187 S188 L189 E191 V194R180-A184 WeakPolarHBondContact O-CB 3.42Å; R180-A184 PolarHBondContact O-N 2.97Å; K181-A184 PolarHBondContact O-N 3.39Å; A184-L187 PolarHBondContact O-N 3.44Å; A184-S188 PolarHBondContact O-N 3.06Å; A184-S188 VanDerWaalsContact O-N 3.12Å; A184-L189 CarbonylContact C-O 3.37Å; A184-L189 WeakPolarHBondContact CA-O 3.47Å; A184-L189 VanDerWaalsContact CB-O 3.31Å; A184-L189 WeakPolarHBondContact CB-O 3.48Å; A184-L189 PolarHBondContact O-N 3.11Å; A184-L189 VanDerWaalsContact O-O 3.04Å; A184-E191 HydrophobicContact CB-CG 4.11Å; A184-V194 HydrophobicContact CB-CG2 4.02Å
185H98.2Very high97.5Very high164 Ų16468.5 Ų68.576%0.75938%0.379SS*.Hα-helixtrans-62.7-49.5179.1-17269.8000112.3K181 Q182 L187 S188K181-H185 WeakPolarHBondContact O-CB 3.47Å; K181-H185 PolarHBondContact O-N 3.36Å; Q182-H185 PolarHBondContact O-N 2.99Å; H185-L187 VanDerWaalsContact C-N 3.26Å; H185-L187 PolarHBondContact O-N 3.08Å; H185-S188 PolarHBondContact O-N 3.37Å
186S97.6Very high97.5Very high82 Ų8271.2 Ų71.257%0.57340%0.396SS*.Hα-helixtrans-63.7-28.8-178.260.10000114Q182 L183Q182-S186 WeakPolarHBondContact O-CB 3.46Å; Q182-S186 PolarHBondContact O-N 3.18Å; Q182-S186 PolarHBondContact O-OG 3.49Å; Q182-S186 VanDerWaalsContact O-OG 3.06Å; L183-S186 PolarHBondContact O-OG 3.49Å
187L97.3Very high97.6Very high18 Ų1868.3 Ų68.39%0.09438%0.375CS..Hα-helixtrans-97.71.1-179.9-58.6-178.2000114Q161 R164 L165 L183 A184 H185 L189Q161-L187 PolarHBondContact NE2-O 2.91Å; R164-L187 HydrophobicContact CB-CD1 4.2Å; R164-L187 HydrophobicContact CB-CD2 3.51Å; R164-L187 HydrophobicContact CB-CG 4.46Å; R164-L187 HydrophobicContact CG-CD2 3.8Å; L165-L187 HydrophobicContact CD1-CD1 4.39Å; L165-L187 HydrophobicContact CD2-CD1 3.68Å; L165-L187 HydrophobicContact CG-CD1 3.61Å; L183-L187 HydrophobicContact CD1-CD1 3.72Å; L183-L187 HydrophobicContact CD1-CG 4.16Å; L183-L187 HydrophobicContact CG-CD1 4.02Å; L183-L187 WeakPolarHBondContact O-CB 3.48Å; L183-L187 VanDerWaalsContact O-CG 3.31Å; L183-L187 WeakPolarHBondContact O-CG 3.29Å; L183-L187 PolarHBondContact O-N 3.49Å; A184-L187 PolarHBondContact O-N 3.44Å; H185-L187 VanDerWaalsContact C-N 3.26Å; H185-L187 PolarHBondContact O-N 3.08Å; L187-L189 HydrophobicContact CB-CD1 4.05Å; L187-L189 HydrophobicContact CB-CG 3.99Å; L187-L189 HydrophobicContact CD1-CD1 4.41Å; L187-L189 PolarHBondContact O-N 3.27Å
188S97.7Very high97.7Very high111 Ų11166.4 Ų66.478%0.77636%0.355SS*.THydrogen-bonded Turntrans52.643.9-172-57.70000112.3A184 H185A184-S188 PolarHBondContact O-N 3.06Å; A184-S188 VanDerWaalsContact O-N 3.12Å; H185-S188 PolarHBondContact O-N 3.37Å
189L97.1Very high97.8Very high21 Ų2167.6 Ų67.611%0.1135%0.348CS..  trans-117.4160.8176.4-63.6-179.2000109.9F157 L165 A184 L187 Q193 V194F157-L189 HydrophobicContact CD1-CD1 4.07Å; F157-L189 HydrophobicContact CD1-CD2 3.8Å; F157-L189 HydrophobicContact CE1-CD1 4.02Å; F157-L189 HydrophobicContact CE1-CD2 3.74Å; L165-L189 HydrophobicContact CD1-CD1 4.21Å; A184-L189 CarbonylContact C-O 3.37Å; A184-L189 WeakPolarHBondContact CA-O 3.47Å; A184-L189 VanDerWaalsContact CB-O 3.31Å; A184-L189 WeakPolarHBondContact CB-O 3.48Å; A184-L189 PolarHBondContact O-N 3.11Å; A184-L189 VanDerWaalsContact O-O 3.04Å; L187-L189 HydrophobicContact CB-CD1 4.05Å; L187-L189 HydrophobicContact CB-CG 3.99Å; L187-L189 HydrophobicContact CD1-CD1 4.41Å; L187-L189 PolarHBondContact O-N 3.27Å; L189-Q193 HydrophobicContact CB-CB 4.46Å; L189-V194 HydrophobicContact CB-CG2 4.16Å; L189-V194 HydrophobicContact CD1-CG2 4.47Å
190T97.9Very high97.8Very high77 Ų7768.1 Ų68.147%0.47235%0.354SS..  trans-79.2150.6170.262.90000111.1T192 Q193 V194T190-T192 PolarHBondContact O-N 3.29Å; T190-T192 VanDerWaalsContact O-N 3.13Å; T190-Q193 WeakPolarHBondContact O-CB 3.36Å; T190-Q193 PolarHBondContact O-N 3.17Å; T190-Q193 WeakPolarHBondContact OG1-CB 3.41Å; T190-Q193 VanDerWaalsContact OG1-CG 3.25Å; T190-Q193 WeakPolarHBondContact OG1-CG 3.42Å; T190-Q193 PolarHBondContact OG1-N 2.9Å; T190-Q193 PolarHBondContact OG1-OE1 3.41Å; T190-V194 PolarHBondContact O-N 3.38Å
191E97.9Very high97.8Very high77 Ų7767 Ų6736%0.3635%0.35SS..Hα-helixtrans-53.1-35.3173-70.7-171.4-123.100112.2R180 K181 A184 V194 K195R180-E191 HydrophobicContact CG-CB 4.22Å; R180-E191 HydrophobicContact CG-CG 4.33Å; K181-E191 WeakPolarHBondContact CE-OE1 3.41Å; K181-E191 VanDerWaalsContact CG-CD 3.41Å; K181-E191 HydrophobicContact CG-CG 4.17Å; K181-E191 VanDerWaalsContact CG-OE1 3.32Å; K181-E191 WeakPolarHBondContact CG-OE1 3.45Å; A184-E191 HydrophobicContact CB-CG 4.11Å; E191-V194 PolarHBondContact O-N 3.01Å; E191-K195 VanDerWaalsContact O-CB 3.29Å; E191-K195 WeakPolarHBondContact O-CB 3.47Å; E191-K195 PolarHBondContact O-N 3.22Å
192T97.2Very high97.8Very high85 Ų8563.4 Ų63.452%0.52133%0.333SS..Hα-helixtrans-66.9-42.1177-64.20000111.9T190 K195 V196T190-T192 PolarHBondContact O-N 3.29Å; T190-T192 VanDerWaalsContact O-N 3.13Å; T192-K195 WeakPolarHBondContact O-CB 3.39Å; T192-K195 PolarHBondContact O-N 3.33Å; T192-V196 HydrophobicContact CG2-CG2 4.4Å; T192-V196 WeakPolarHBondContact O-CB 3.37Å; T192-V196 VanDerWaalsContact O-CG2 3.29Å; T192-V196 WeakPolarHBondContact O-CG2 3.39Å; T192-V196 PolarHBondContact O-N 3.25Å
193Q97.3Very high97.7Very high50 Ų5060.1 Ų60.123%0.23432%0.323CS..Hα-helixtrans-62.5-44.4175.4-77.5164.5-47.900111.3F157 L189 T190 V196 W197F157-Q193 HydrophobicContact CE1-CB 4.2Å; F157-Q193 HydrophobicContact CE1-CG 4.38Å; F157-Q193 HydrophobicContact CZ-CB 4.07Å; F157-Q193 HydrophobicContact CZ-CG 4.39Å; L189-Q193 HydrophobicContact CB-CB 4.46Å; T190-Q193 WeakPolarHBondContact O-CB 3.36Å; T190-Q193 PolarHBondContact O-N 3.17Å; T190-Q193 WeakPolarHBondContact OG1-CB 3.41Å; T190-Q193 VanDerWaalsContact OG1-CG 3.25Å; T190-Q193 WeakPolarHBondContact OG1-CG 3.42Å; T190-Q193 PolarHBondContact OG1-N 2.9Å; T190-Q193 PolarHBondContact OG1-OE1 3.41Å; Q193-V196 PolarHBondContact O-N 3.05Å; Q193-W197 WeakPolarHBondContact O-CB 3.44Å; Q193-W197 PolarHBondContact O-N 3.47Å
194V98Very high97.6Very high0 Ų063.7 Ų63.70%034%0.337CS..Hα-helixtrans-60.3-47.5174.8177.70000110.4L165 V175 R180 L183 A184 L189 T190 E191 V196 W197 F198L165-V194 HydrophobicContact CD2-CG1 4.42Å; V175-V194 HydrophobicContact CG2-CG1 4Å; R180-V194 HydrophobicContact CG-CB 4.33Å; R180-V194 HydrophobicContact CG-CG1 4.13Å; L183-V194 HydrophobicContact CD2-CG1 3.95Å; L183-V194 HydrophobicContact CG-CG1 4.42Å; A184-V194 HydrophobicContact CB-CG2 4.02Å; L189-V194 HydrophobicContact CB-CG2 4.16Å; L189-V194 HydrophobicContact CD1-CG2 4.47Å; T190-V194 PolarHBondContact O-N 3.38Å; E191-V194 PolarHBondContact O-N 3.01Å; V194-V196 PolarHBondContact O-N 3.4Å; V194-W197 PolarHBondContact O-N 2.96Å; V194-F198 HydrophobicContact CG1-CD2 3.85Å; V194-F198 HydrophobicContact CG1-CE2 3.92Å; V194-F198 WeakPolarHBondContact O-CD2 3.41Å; V194-F198 PolarHBondContact O-N 3.18Å
195K97.4Very high97.5Very high101 Ų10167.3 Ų67.344%0.43935%0.352SS..Hα-helixtrans-56.3-47.7176.8-177.1-177.771.1-179.70112.2E191 T192 F198 Q199E191-K195 VanDerWaalsContact O-CB 3.29Å; E191-K195 WeakPolarHBondContact O-CB 3.47Å; E191-K195 PolarHBondContact O-N 3.22Å; T192-K195 WeakPolarHBondContact O-CB 3.39Å; T192-K195 PolarHBondContact O-N 3.33Å; K195-F198 PolarHBondContact O-N 2.98Å; K195-Q199 WeakPolarHBondContact O-CB 3.28Å; K195-Q199 PolarHBondContact O-N 3.46Å
196V97.6Very high97.4Very high70 Ų7065.9 Ų65.942%0.42434%0.344SS..Hα-helixtrans-65.7-41.7179.2170.30000110.9T192 Q193 V194 Q199 N200T192-V196 HydrophobicContact CG2-CG2 4.4Å; T192-V196 WeakPolarHBondContact O-CB 3.37Å; T192-V196 VanDerWaalsContact O-CG2 3.29Å; T192-V196 WeakPolarHBondContact O-CG2 3.39Å; T192-V196 PolarHBondContact O-N 3.25Å; Q193-V196 PolarHBondContact O-N 3.05Å; V194-V196 PolarHBondContact O-N 3.4Å; V196-Q199 PolarHBondContact O-N 3.13Å; V196-N200 WeakPolarHBondContact O-CB 3.37Å; V196-N200 VanDerWaalsContact O-CG 3.3Å; V196-N200 PolarHBondContact O-N 3.3Å; V196-N200 PolarHBondContact O-ND2 3.21Å
197W97.9Very high97.1Very high28 Ų2868.9 Ų68.911%0.10634%0.342CS..Hα-helixtrans-60.6-48.3177.1-172.497.4000111.2F157 L165 E166 F169 Q193 V194 Q199 N200 R201F157-W197 AromaticContact CD2-CD1 3.64Å; F157-W197 HydrophobicContact CE2-CB 4.26Å; F157-W197 AromaticContact CE2-CD1 3.56Å; F157-W197 HydrophobicContact CE2-CG 4.28Å; L165-W197 VanDerWaalsContact C-CH2 3.48Å; L165-W197 HydrophobicContact CB-CD2 3.89Å; L165-W197 HydrophobicContact CB-CE3 3.86Å; L165-W197 HydrophobicContact CB-CH2 3.61Å; L165-W197 HydrophobicContact CB-CZ2 3.59Å; L165-W197 HydrophobicContact CB-CZ3 3.74Å; L165-W197 HydrophobicContact CD1-CD2 3.84Å; L165-W197 HydrophobicContact CD1-CE3 4.48Å; L165-W197 HydrophobicContact CD1-CG 3.83Å; L165-W197 HydrophobicContact CD2-CD2 4.33Å; L165-W197 HydrophobicContact CD2-CE3 4.21Å; L165-W197 HydrophobicContact CG-CD2 4.23Å; L165-W197 HydrophobicContact CG-CE3 4.4Å; E166-W197 WeakPolarHBondContact OE2-CH2 3.34Å; F169-W197 HydrophobicContact CB-CH2 4.3Å; F169-W197 HydrophobicContact CB-CZ3 4.08Å; F169-W197 HydrophobicContact CD2-CZ3 4.44Å; F169-W197 HydrophobicContact CG-CZ3 4.47Å; Q193-W197 WeakPolarHBondContact O-CB 3.44Å; Q193-W197 PolarHBondContact O-N 3.47Å; V194-W197 PolarHBondContact O-N 2.96Å; W197-Q199 VanDerWaalsContact C-N 3.32Å; W197-Q199 PolarHBondContact O-N 3.38Å; W197-N200 PolarHBondContact O-N 3.14Å; W197-R201 HydrophobicContact CE3-CB 4.04Å; W197-R201 HydrophobicContact CH2-CB 4.02Å; W197-R201 HydrophobicContact CH2-CG 3.73Å; W197-R201 HydrophobicContact CZ2-CG 4.43Å; W197-R201 HydrophobicContact CZ3-CB 3.76Å; W197-R201 HydrophobicContact CZ3-CG 3.84Å; W197-R201 WeakPolarHBondContact O-CB 3.43Å; W197-R201 PolarHBondContact O-N 2.97Å
198F98.5Very high96.8Very high2 Ų271.7 Ų71.71%0.00936%0.355CS..Hα-helixtrans-62-38.8177.2-90.1-101.7000112.3L165 A168 F169 N172 V175 L183 V194 K195 R201 R202L165-F198 HydrophobicContact CD2-CE2 4.04Å; A168-F198 HydrophobicContact CB-CZ 4.17Å; F169-F198 HydrophobicContact CB-CE1 4.18Å; F169-F198 HydrophobicContact CB-CZ 4.45Å; F169-F198 AromaticContact CD2-CD1 3.83Å; F169-F198 HydrophobicContact CD2-CD1 3.83Å; F169-F198 AromaticContact CD2-CE1 3.87Å; F169-F198 HydrophobicContact CD2-CE1 3.87Å; N172-F198 WeakPolarHBondContact O-CE1 3.42Å; V175-F198 HydrophobicContact CB-CD1 4.44Å; V175-F198 HydrophobicContact CB-CE1 4.24Å; V175-F198 HydrophobicContact CB-CE2 4.49Å; V175-F198 HydrophobicContact CB-CZ 4.27Å; V175-F198 HydrophobicContact CG1-CD1 4.09Å; V175-F198 HydrophobicContact CG1-CE1 3.43Å; V175-F198 VanDerWaalsContact CG1-CE1 3.43Å; V175-F198 HydrophobicContact CG1-CE2 3.93Å; V175-F198 HydrophobicContact CG1-CZ 3.33Å; V175-F198 HydrophobicContact CG2-CB 4.31Å; V175-F198 HydrophobicContact CG2-CD1 3.79Å; V175-F198 HydrophobicContact CG2-CD2 3.56Å; V175-F198 HydrophobicContact CG2-CE1 3.96Å; V175-F198 HydrophobicContact CG2-CE2 3.75Å; V175-F198 HydrophobicContact CG2-CG 3.6Å; V175-F198 HydrophobicContact CG2-CZ 3.94Å; L183-F198 HydrophobicContact CD2-CE2 3.66Å; L183-F198 HydrophobicContact CD2-CZ 3.98Å; V194-F198 HydrophobicContact CG1-CD2 3.85Å; V194-F198 HydrophobicContact CG1-CE2 3.92Å; V194-F198 WeakPolarHBondContact O-CD2 3.41Å; V194-F198 PolarHBondContact O-N 3.18Å; K195-F198 PolarHBondContact O-N 2.98Å; F198-R201 PolarHBondContact O-N 3.24Å; F198-R202 WeakPolarHBondContact O-CG 3.31Å; F198-R202 PolarHBondContact O-N 3.23Å
199Q98.1Very high96.4Very high96 Ų9672 Ų7245%0.44934%0.342SS..Hα-helixtrans-63-45175-174.958.658.300112K195 V196 W197 R201 T203K195-Q199 WeakPolarHBondContact O-CB 3.28Å; K195-Q199 PolarHBondContact O-N 3.46Å; V196-Q199 PolarHBondContact O-N 3.13Å; W197-Q199 VanDerWaalsContact C-N 3.32Å; W197-Q199 PolarHBondContact O-N 3.38Å; Q199-R201 VanDerWaalsContact C-N 3.34Å; Q199-T203 PolarHBondContact O-N 3.4Å; Q199-T203 PolarHBondContact O-OG1 3.13Å; Q199-T203 VanDerWaalsContact O-OG1 3.12Å
200N97.6Very high95.8Very high101 Ų10176.9 Ų76.954%0.5437%0.368SS..Hα-helixtrans-65.3-40.6176.6-71.3-19.7000111.3V196 W197 T203 K204V196-N200 WeakPolarHBondContact O-CB 3.37Å; V196-N200 VanDerWaalsContact O-CG 3.3Å; V196-N200 PolarHBondContact O-N 3.3Å; V196-N200 PolarHBondContact O-ND2 3.21Å; W197-N200 PolarHBondContact O-N 3.14Å; N200-T203 PolarHBondContact O-N 3.38Å; N200-K204 PolarHBondContact O-N 3.49Å
201R98.1Very high95Very high35 Ų3577.8 Ų77.813%0.13237%0.367CS..Hα-helixtrans-63.3-44.7179.3-172.665.4-169.4109.1-6.7111.7E166 F169 W197 F198 Q199 T203 K204 F205E166-R201 VanDerWaalsContact CD-NE 3.28Å; E166-R201 IonicContact OE1-CZ 3.15Å; E166-R201 IonicContact OE1-NE 2.81Å; E166-R201 PolarHBondContact OE1-NE 2.88Å; E166-R201 IonicContact OE1-NH2 2.67Å; E166-R201 PolarHBondContact OE1-NH2 3.32Å; E166-R201 WeakPolarHBondContact OE2-CD 3.5Å; E166-R201 IonicContact OE2-CZ 3.79Å; E166-R201 IonicContact OE2-NE 2.89Å; E166-R201 PolarHBondContact OE2-NE 3.49Å; E166-R201 IonicContact OE2-NH2 3.93Å; F169-R201 HydrophobicContact CD1-CG 3.78Å; F169-R201 HydrophobicContact CD2-CB 4.16Å; F169-R201 HydrophobicContact CD2-CG 3.66Å; F169-R201 HydrophobicContact CE1-CG 3.77Å; F169-R201 HydrophobicContact CE2-CB 4.04Å; F169-R201 HydrophobicContact CE2-CG 3.66Å; F169-R201 HydrophobicContact CG-CG 3.73Å; F169-R201 HydrophobicContact CZ-CB 4.44Å; F169-R201 HydrophobicContact CZ-CG 3.72Å; W197-R201 HydrophobicContact CE3-CB 4.04Å; W197-R201 HydrophobicContact CH2-CB 4.02Å; W197-R201 HydrophobicContact CH2-CG 3.73Å; W197-R201 HydrophobicContact CZ2-CG 4.43Å; W197-R201 HydrophobicContact CZ3-CB 3.76Å; W197-R201 HydrophobicContact CZ3-CG 3.84Å; W197-R201 WeakPolarHBondContact O-CB 3.43Å; W197-R201 PolarHBondContact O-N 2.97Å; F198-R201 PolarHBondContact O-N 3.24Å; Q199-R201 VanDerWaalsContact C-N 3.34Å; R201-T203 PolarHBondContact O-N 2.98Å; R201-K204 PolarHBondContact O-N 3.12Å; R201-F205 WeakPolarHBondContact O-CB 3.13Å; R201-F205 PolarHBondContact O-N 3.23Å
202R97.8Very high93.9Very high45 Ų4581.7 Ų81.717%0.1739%0.385CS..Hα-helixtrans-59.5-42.2173.6-74.4-167.5-62.9-91.12.5112.9F169 H173 Y174 F198 F205 K206F169-R202 HydrophobicContact CE2-CG 3.79Å; F169-R202 HydrophobicContact CZ-CG 4.22Å; H173-R202 WeakPolarHBondContact O-CD 3.19Å; H173-R202 PolarHBondContact O-NH1 3.41Å; Y174-R202 VanDerWaalsContact CD1-NH1 3.3Å; Y174-R202 VanDerWaalsContact CE1-CZ 3.48Å; Y174-R202 VanDerWaalsContact CE1-NE 3.29Å; F198-R202 WeakPolarHBondContact O-CG 3.31Å; F198-R202 PolarHBondContact O-N 3.23Å; R202-F205 PolarHBondContact O-N 3.45Å; R202-K206 WeakPolarHBondContact O-CB 2.93Å; R202-K206 PolarHBondContact O-N 2.79Å
203T97.3Very high92.5Very high72 Ų7285 Ų8544%0.44240%0.395SS..Hα-helixtrans-61.6-44.8176.2-58.90000111.2Q199 N200 R201 K206 R207Q199-T203 PolarHBondContact O-N 3.4Å; Q199-T203 PolarHBondContact O-OG1 3.13Å; Q199-T203 VanDerWaalsContact O-OG1 3.12Å; N200-T203 PolarHBondContact O-N 3.38Å; R201-T203 PolarHBondContact O-N 2.98Å; T203-K206 PolarHBondContact O-N 3.07Å; T203-R207 PolarHBondContact O-N 3.04Å; T203-R207 VanDerWaalsContact O-N 3.08Å
204K95.8Very high90.8Very high96 Ų9684.9 Ų84.942%0.41741%0.407SS..Hα-helixtrans-62.2-46.4175.9-175.4-177.5174.6-169.80111.2N200 R201 K206 R207 Q208N200-K204 PolarHBondContact O-N 3.49Å; R201-K204 PolarHBondContact O-N 3.12Å; K204-K206 PolarHBondContact O-N 2.88Å; K204-R207 PolarHBondContact O-N 3.41Å; K204-Q208 HydrophobicContact CG-CG 4.48Å; K204-Q208 WeakPolarHBondContact O-CG 3.4Å; K204-Q208 PolarHBondContact O-N 3.05Å
205F95.9Very high88.5Confident82 Ų8287.5 Ų87.536%0.3643%0.425SS..Hα-helixtrans-58.9-46.8178.5-179.9-98.6000111.9F169 H173 R201 R202 R207 Q208 K209F169-F205 HydrophobicContact CE1-CB 4.37Å; F169-F205 HydrophobicContact CE1-CD2 4.3Å; F169-F205 HydrophobicContact CE1-CG 4.37Å; F169-F205 HydrophobicContact CZ-CB 4.18Å; F169-F205 HydrophobicContact CZ-CG 4.4Å; H173-F205 AromaticContact CE1-CE1 3.92Å; H173-F205 AromaticContact CE1-CZ 3.84Å; R201-F205 WeakPolarHBondContact O-CB 3.13Å; R201-F205 PolarHBondContact O-N 3.23Å; R202-F205 PolarHBondContact O-N 3.45Å; F205-R207 VanDerWaalsContact C-N 3.31Å; F205-R207 PolarHBondContact O-N 3.15Å; F205-Q208 PolarHBondContact O-N 3.36Å; F205-K209 PolarHBondContact O-N 3.23Å
206K95.2Very high86.3Confident135 Ų13592.3 Ų92.359%0.58745%0.449SS*.Hα-helixtrans-59.6-41.1175.7-175.8174.963.9177.60112.2R202 T203 K204 L210R202-K206 WeakPolarHBondContact O-CB 2.93Å; R202-K206 PolarHBondContact O-N 2.79Å; T203-K206 PolarHBondContact O-N 3.07Å; K204-K206 PolarHBondContact O-N 2.88Å; K206-L210 HydrophobicContact CG-CD1 4.42Å; K206-L210 WeakPolarHBondContact O-CG 3.12Å; K206-L210 PolarHBondContact O-N 3.1Å; K206-L210 VanDerWaalsContact O-N 3.17Å
207R92.3Very high84Confident144 Ų14494.2 Ų94.254%0.54347%0.465SS..Hα-helixtrans-64.7-44.1176.3-177.8175.964.2-155.4-0.1111.5T203 K204 F205 K209 L210 E211T203-R207 PolarHBondContact O-N 3.04Å; T203-R207 VanDerWaalsContact O-N 3.08Å; K204-R207 PolarHBondContact O-N 3.41Å; F205-R207 VanDerWaalsContact C-N 3.31Å; F205-R207 PolarHBondContact O-N 3.15Å; R207-K209 PolarHBondContact O-N 2.94Å; R207-L210 PolarHBondContact O-N 3.26Å; R207-E211 VanDerWaalsContact CG-OE1 3.31Å; R207-E211 WeakPolarHBondContact CG-OE1 3.41Å; R207-E211 WeakPolarHBondContact O-CG 3Å; R207-E211 PolarHBondContact O-N 3.06Å
208Q90.6Very high81.6Confident77 Ų7798.8 Ų98.836%0.3649%0.488SS..Hα-helixtrans-59.9-45.3177.5-72.7175.1-52.200111.4K204 F205 L210 E211 E212K204-Q208 HydrophobicContact CG-CG 4.48Å; K204-Q208 WeakPolarHBondContact O-CG 3.4Å; K204-Q208 PolarHBondContact O-N 3.05Å; F205-Q208 PolarHBondContact O-N 3.36Å; Q208-L210 VanDerWaalsContact C-N 3.33Å; Q208-L210 PolarHBondContact O-N 3.13Å; Q208-E211 PolarHBondContact O-N 3.33Å; Q208-E211 VanDerWaalsContact O-N 3.11Å; Q208-E212 PolarHBondContact O-N 2.96Å
209K88.2Confident79.3Confident118 Ų118106.5 Ų106.551%0.51352%0.524SS..Hα-helixtrans-60.5-39.9176.6-170.9175.5-178.5176.50113F205 R207 E211 E212 E213F205-K209 PolarHBondContact O-N 3.23Å; R207-K209 PolarHBondContact O-N 2.94Å; K209-E211 VanDerWaalsContact C-N 3.31Å; K209-E211 PolarHBondContact O-N 3Å; K209-E212 PolarHBondContact O-N 3.26Å; K209-E213 VanDerWaalsContact O-CG 3.28Å; K209-E213 WeakPolarHBondContact O-CG 3.24Å; K209-E213 PolarHBondContact O-N 3.31Å; K209-E213 VanDerWaalsContact O-N 3.15Å
210L84.4Confident77.1Confident124 Ų124111.3 Ų111.365%0.64954%0.543SS*.Hα-helixtrans-70.7-26.2177-69.3172000113.3K206 R207 Q208 G214K206-L210 HydrophobicContact CG-CD1 4.42Å; K206-L210 WeakPolarHBondContact O-CG 3.12Å; K206-L210 PolarHBondContact O-N 3.1Å; K206-L210 VanDerWaalsContact O-N 3.17Å; R207-L210 PolarHBondContact O-N 3.26Å; Q208-L210 VanDerWaalsContact C-N 3.33Å; Q208-L210 PolarHBondContact O-N 3.13Å; L210-G214 PolarHBondContact O-N 3.34Å
211E81.2Confident75Confident95 Ų95113.8 Ų113.844%0.44455%0.549SS..Hα-helixtrans-77-38.1175.8-73.8168.9-173.700111.2R207 Q208 K209 G214R207-E211 VanDerWaalsContact CG-OE1 3.31Å; R207-E211 WeakPolarHBondContact CG-OE1 3.41Å; R207-E211 WeakPolarHBondContact O-CG 3Å; R207-E211 PolarHBondContact O-N 3.06Å; Q208-E211 PolarHBondContact O-N 3.33Å; Q208-E211 VanDerWaalsContact O-N 3.11Å; K209-E211 VanDerWaalsContact C-N 3.31Å; K209-E211 PolarHBondContact O-N 3Å; E211-G214 PolarHBondContact O-N 3.48Å
212E75.5Confident73Confident159 Ų159120.6 Ų120.674%0.74358%0.58SS**Hα-helixtrans-68.1-45.9178.1-171.6173.1-163.700112.4Q208 K209 G214Q208-E212 PolarHBondContact O-N 2.96Å; K209-E212 PolarHBondContact O-N 3.26Å; E212-G214 PolarHBondContact O-N 3.4Å
213E68.8Low70.9Confident156 Ų156120.7 Ų120.773%0.72960%0.595SS**THydrogen-bonded Turntrans-71.9-10174.9-61-73156.400112.7K209K209-E213 VanDerWaalsContact O-CG 3.28Å; K209-E213 WeakPolarHBondContact O-CG 3.24Å; K209-E213 PolarHBondContact O-N 3.31Å; K209-E213 VanDerWaalsContact O-N 3.15Å
214G60.3Low68.8Low47 Ų47120 Ų12049%0.48559%0.592SS.*THydrogen-bonded Turntrans-99.4-26.4-16400000116.3L210 E211 E212L210-G214 PolarHBondContact O-N 3.34Å; E211-G214 PolarHBondContact O-N 3.48Å; E212-G214 PolarHBondContact O-N 3.4Å
215S50.9Low67Low54 Ų54121.6 Ų121.638%0.37860%0.601SS.*  trans145.8131.7168.546.60000113.6S217S215-S217 PolarHBondContact O-N 2.98Å
216E51.6Low65.4Low203 Ų203123.9 Ų123.995%0.94961%0.613SS**THydrogen-bonded Turntrans-55.23.7157.6-91.1168.681.300114.6
217S48Very low64Low109 Ų109121.6 Ų121.676%0.76261%0.606SS**THydrogen-bonded Turntrans-117.50.4-170.5-64.10000116S215S215-S217 PolarHBondContact O-N 2.98Å
218Q48.5Very low62.8Low125 Ų125117.4 Ų117.458%0.58460%0.595SS**  trans-126.87.4-172.4-75.9-132.1-8.600117.3K220Q218-K220 VanDerWaalsContact C-N 3.31Å; Q218-K220 PolarHBondContact O-N 3.48Å
219Q49.8Very low61.8Low164 Ų164122.4 Ų122.477%0.76661%0.61SS**THydrogen-bonded Turntrans-67.7-20.6-173.9-78.9-179.5-38.100115.4
220K51.5Low61Low197 Ų197124.4 Ų124.486%0.85762%0.615SS**THydrogen-bonded Turntrans-90.9-14.3-176-111.9177.4176.8178.10116.5Q218Q218-K220 VanDerWaalsContact C-N 3.31Å; Q218-K220 PolarHBondContact O-N 3.48Å
221K53Low60.5Low153 Ų153123.9 Ų123.967%0.66560%0.604SS**THydrogen-bonded Turntrans-101-30-166.1-70.7-175.5175.9176.70115.7H225K221-H225 PolarHBondContact O-N 2.87Å
222K56.1Low59.8Low178 Ų178126.1 Ų126.177%0.77462%0.618SS**Hα-helixtrans-79.7-38.4-167.3-149.4169.7-176.1175.50114.2
223G53.3Low59.6Low47 Ų47122.7 Ų122.749%0.48562%0.617SS.*Hα-helixtrans-70.7-39.8171.400000112.2H225 H226 I227G223-H225 PolarHBondContact O-N 2.84Å; G223-H226 PolarHBondContact O-N 2.9Å; G223-I227 WeakPolarHBondContact O-CD1 3.48Å; G223-I227 PolarHBondContact O-N 3.37Å
224S54.6Low59.9Low56 Ų56118 Ų11839%0.39260%0.599SS.*Hα-helixtrans-60.6-43177.9-1720000112.1H226 I227 N228S224-H226 PolarHBondContact O-N 3.42Å; S224-I227 PolarHBondContact O-N 2.75Å; S224-N228 VanDerWaalsContact O-CB 3.27Å; S224-N228 WeakPolarHBondContact O-CB 3.21Å; S224-N228 PolarHBondContact O-N 2.94Å; S224-N228 PolarHBondContact O-ND2 2.72Å; S224-N228 VanDerWaalsContact O-ND2 3.1Å; S224-N228 PolarHBondContact OG-ND2 3.1Å
225H57.3Low60.3Low131 Ų131125 Ų12561%0.60662%0.616SS**Hα-helixtrans-63.1-38.1-179.8-107.9-66.7000114.6K221 G223 R229K221-H225 PolarHBondContact O-N 2.87Å; G223-H225 PolarHBondContact O-N 2.84Å; H225-R229 WeakPolarHBondContact O-CB 3.29Å; H225-R229 PolarHBondContact O-N 3.18Å
226H62Low60.5Low130 Ų130128.2 Ų128.260%0.60263%0.625SS**Hα-helixtrans-71.4-44.5177.5178.868.7000111.5G223 S224 N228 R229 W230G223-H226 PolarHBondContact O-N 2.9Å; S224-H226 PolarHBondContact O-N 3.42Å; H226-N228 VanDerWaalsContact C-N 3.35Å; H226-N228 PolarHBondContact O-N 3.49Å; H226-R229 PolarHBondContact O-N 3.48Å; H226-W230 WeakPolarHBondContact O-CB 3.39Å; H226-W230 PolarHBondContact O-N 3.12Å
227I65.3Low60.6Low86 Ų86122.6 Ų122.644%0.44161%0.613SS.*Hα-helixtrans-59.6-45.8175.4-87.486.2000110.7G223 S224 W230 R231G223-I227 WeakPolarHBondContact O-CD1 3.48Å; G223-I227 PolarHBondContact O-N 3.37Å; S224-I227 PolarHBondContact O-N 2.75Å; I227-W230 PolarHBondContact O-N 3.46Å; I227-R231 VanDerWaalsContact CG2-NH2 3.32Å; I227-R231 WeakPolarHBondContact O-CB 3.47Å; I227-R231 PolarHBondContact O-N 3.23Å
228N68.8Low60.6Low57 Ų57120.7 Ų120.731%0.30560%0.6SS.*Hα-helixtrans-68.6-39.7-178.9-64.3-21.1000111.7S224 H226 W230 R231 L232S224-N228 VanDerWaalsContact O-CB 3.27Å; S224-N228 WeakPolarHBondContact O-CB 3.21Å; S224-N228 PolarHBondContact O-N 2.94Å; S224-N228 PolarHBondContact O-ND2 2.72Å; S224-N228 VanDerWaalsContact O-ND2 3.1Å; S224-N228 PolarHBondContact OG-ND2 3.1Å; H226-N228 VanDerWaalsContact C-N 3.35Å; H226-N228 PolarHBondContact O-N 3.49Å; N228-W230 VanDerWaalsContact C-N 3.33Å; N228-W230 PolarHBondContact O-N 2.96Å; N228-R231 PolarHBondContact O-N 3.28Å; N228-R231 PolarHBondContact OD1-NH1 3.27Å; N228-L232 VanDerWaalsContact O-CG 3.32Å; N228-L232 WeakPolarHBondContact O-CG 3.27Å; N228-L232 PolarHBondContact O-N 3.29Å
229R68.8Low60.9Low182 Ų182120.5 Ų120.569%0.68761%0.61SS**Hα-helixtrans-62.2-40.5173.9-178.6179.7-70.4-94.61.2111.8H225 H226 A233H225-R229 WeakPolarHBondContact O-CB 3.29Å; H225-R229 PolarHBondContact O-N 3.18Å; H226-R229 PolarHBondContact O-N 3.48Å; R229-A233 WeakPolarHBondContact O-CB 3.35Å; R229-A233 PolarHBondContact O-N 2.87Å; R229-A233 VanDerWaalsContact O-N 3.12Å
230W72.4Confident61.2Low160 Ų160121 Ų12161%0.60661%0.612SS**Hα-helixtrans-65.3-44.3174.9-172.480.7000111.3H226 I227 N228 L232 A233 T234H226-W230 WeakPolarHBondContact O-CB 3.39Å; H226-W230 PolarHBondContact O-N 3.12Å; I227-W230 PolarHBondContact O-N 3.46Å; N228-W230 VanDerWaalsContact C-N 3.33Å; N228-W230 PolarHBondContact O-N 2.96Å; W230-L232 PolarHBondContact O-N 3.18Å; W230-A233 PolarHBondContact O-N 3.36Å; W230-T234 HydrophobicContact CD2-CG2 4.47Å; W230-T234 HydrophobicContact CE3-CG2 4.08Å; W230-T234 HydrophobicContact CH2-CG2 4.33Å; W230-T234 HydrophobicContact CZ3-CG2 4.01Å; W230-T234 WeakPolarHBondContact O-CG2 3.37Å; W230-T234 PolarHBondContact O-N 2.99Å
231R71.9Confident61.1Low113 Ų113119.9 Ų119.943%0.42661%0.61SS.*Hα-helixtrans-58-47.3177.6-165.3-178.5-62.6110.1-0.6112.6I227 N228 A233 T234 K235I227-R231 VanDerWaalsContact CG2-NH2 3.32Å; I227-R231 WeakPolarHBondContact O-CB 3.47Å; I227-R231 PolarHBondContact O-N 3.23Å; N228-R231 PolarHBondContact O-N 3.28Å; N228-R231 PolarHBondContact OD1-NH1 3.27Å; R231-A233 VanDerWaalsContact C-N 3.34Å; R231-A233 PolarHBondContact O-N 3.47Å; R231-T234 WeakPolarHBondContact O-CG2 3.32Å; R231-T234 PolarHBondContact O-N 3.3Å; R231-K235 PolarHBondContact O-N 3.02Å
232L68.5Low61.2Low142 Ų142119.6 Ų119.674%0.74361%0.614SS**Hα-helixtrans-62.7-40176.4-68.9168.3000111.9N228 W230 T234 K235N228-L232 VanDerWaalsContact O-CG 3.32Å; N228-L232 WeakPolarHBondContact O-CG 3.27Å; N228-L232 PolarHBondContact O-N 3.29Å; W230-L232 PolarHBondContact O-N 3.18Å; L232-T234 VanDerWaalsContact C-N 3.34Å; L232-T234 PolarHBondContact O-N 3.39Å; L232-K235 PolarHBondContact O-N 3.47Å
233A69.3Low60.8Low86 Ų86117.9 Ų117.971%0.71161%0.613SS**Hα-helixtrans-69.1-29.8177.600000113.2R229 W230 R231R229-A233 WeakPolarHBondContact O-CB 3.35Å; R229-A233 PolarHBondContact O-N 2.87Å; R229-A233 VanDerWaalsContact O-N 3.12Å; W230-A233 PolarHBondContact O-N 3.36Å; R231-A233 VanDerWaalsContact C-N 3.34Å; R231-A233 PolarHBondContact O-N 3.47Å
234T76.4Confident60.8Low57 Ų57121.3 Ų121.335%0.3563%0.625SS.*THydrogen-bonded Turntrans-912.5177.7-169.60000113.9W230 R231 L232 Q236W230-T234 HydrophobicContact CD2-CG2 4.47Å; W230-T234 HydrophobicContact CE3-CG2 4.08Å; W230-T234 HydrophobicContact CH2-CG2 4.33Å; W230-T234 HydrophobicContact CZ3-CG2 4.01Å; W230-T234 WeakPolarHBondContact O-CG2 3.37Å; W230-T234 PolarHBondContact O-N 2.99Å; R231-T234 WeakPolarHBondContact O-CG2 3.32Å; R231-T234 PolarHBondContact O-N 3.3Å; L232-T234 VanDerWaalsContact C-N 3.34Å; L232-T234 PolarHBondContact O-N 3.39Å; T234-Q236 HydrophobicContact CG2-CB 4.1Å; T234-Q236 HydrophobicContact CG2-CG 3.83Å; T234-Q236 PolarHBondContact O-N 3.04Å
235K67.8Low60.6Low194 Ų194124.4 Ų124.484%0.84364%0.641SS**THydrogen-bonded Turntrans44.535.6-178.2-70.7-173.7168.8-169.40113.6R231 L232 A237R231-K235 PolarHBondContact O-N 3.02Å; L232-K235 PolarHBondContact O-N 3.47Å; K235-A237 PolarHBondContact O-N 3.19Å
236Q55.3Low60.6Low123 Ų123123.3 Ų123.358%0.57565%0.648SS**  trans-80.2111.8170.3-73.9-158.44400107.7T234T234-Q236 HydrophobicContact CG2-CB 4.1Å; T234-Q236 HydrophobicContact CG2-CG 3.83Å; T234-Q236 PolarHBondContact O-N 3.04Å
237A53.9Low60.6Low85 Ų85124.7 Ų124.770%0.70266%0.66SS**  trans-60.7149.8174.900000110.5K235K235-A237 PolarHBondContact O-N 3.19Å
238S48.4Very low60.1Low68 Ų68131.5 Ų131.548%0.47670%0.698SS.*  trans-57.8148.9174.8-165.30000110.3E240S238-E240 PolarHBondContact O-N 3.01Å
239P55.1Low59.7Low122 Ų122135.3 Ų135.379%0.79272%0.717SS**THydrogen-bonded Turntrans-65.3-0.9172.2-15.629.3000114.7
240E56.2Low59.2Low173 Ų173132.8 Ų132.881%0.80872%0.719SS**THydrogen-bonded Turntrans-93.44.6-169.5-72.6172.3158.500114.9S238S238-E240 PolarHBondContact O-N 3.01Å
241E48.9Very low58.5Low175 Ų175131.3 Ų131.382%0.81873%0.725SS**  trans-116.351.6175.8-68.8-173.6170.400112.6
242I55.2Low57.7Low146 Ų146132.4 Ų132.475%0.74974%0.743SS**  trans-94.377.5153.447.5144000108.1V244I242-V244 PolarHBondContact O-N 3.1Å; I242-V244 VanDerWaalsContact O-N 3.1Å
243D48.6Very low57Low142 Ų142131.8 Ų131.876%0.75974%0.743SS**  trans-69.8101.8165.3-168.530.4000107.6T245D243-T245 PolarHBondContact O-N 3.32Å
244V52.8Low56.2Low120 Ų120134.8 Ų134.873%0.72775%0.745SS**  trans-78.277.3170.9-173.70000106.7I242 S246I242-V244 PolarHBondContact O-N 3.1Å; I242-V244 VanDerWaalsContact O-N 3.1Å; V244-S246 PolarHBondContact O-N 2.99Å
245T49.7Very low54.8Low120 Ų120140.4 Ų140.474%0.73677%0.773SS**  trans-78.7100.6158.7-176.50000107.2D243D243-T245 PolarHBondContact O-N 3.32Å
246S58.4Low53.8Low108 Ų108136.2 Ų136.276%0.75577%0.768SS**  trans-105117.6164.8-153.70000107.1V244V244-S246 PolarHBondContact O-N 2.99Å
247D61Low53.7Low159 Ų159137.3 Ų137.385%0.8578%0.784SS**  trans-46.4127.7168.8-156.1-115.6000112.5
248D55.7Low53.6Low230 Ų230142.1 Ų142.1100%1.2379%0.791SS**  trans-159.90135-165.5-114.8000109.7

Retrieved 248 of 248 residues in 50.5 ms (Link to these results)