A0A060XWB5_ONCMY Loading...

Homeobox C13a

AlphaFold DB , UniProt , Accession A0A060XWB5, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene LOC110533032, Length 307 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
1M38.6Very low46.1Very low243 Ų243147.6 Ų147.6100%1.19777%0.768SS**  0125.60-65.5171.8178.400107.7
2T38Very low46.3Very low143 Ų143138.8 Ų138.888%0.87773%0.733SS**  trans-134.6105.6-178.535.50000109.2S4T2-S4 PolarHBondContact O-N 2.68Å
3T43.7Very low46.1Very low129 Ų129134.2 Ų134.279%0.79171%0.709SS**  trans-82.2104.6-176.938.20000110.6L5T3-L5 PolarHBondContact O-N 2.99Å; T3-L5 VanDerWaalsContact O-N 3.08Å
4S37.1Very low46.7Very low112 Ų112131.1 Ų131.178%0.78370%0.698SS**  trans-72.8101176.6-165.90000110.4T2 V6T2-S4 PolarHBondContact O-N 2.68Å; S4-V6 PolarHBondContact O-N 3Å; S4-V6 VanDerWaalsContact O-N 3.08Å
5L49.2Very low47.3Very low151 Ų151127.9 Ų127.979%0.79168%0.68SS**  trans-73.897.9178-69.8177000110.5T3 L7T3-L5 PolarHBondContact O-N 2.99Å; T3-L5 VanDerWaalsContact O-N 3.08Å; L5-L7 PolarHBondContact O-N 3.16Å
6V49.8Very low47.9Very low113 Ų113128.3 Ų128.369%0.68568%0.68SS**  trans-65.198.7173-179.60000109.3S4 H8S4-V6 PolarHBondContact O-N 3Å; S4-V6 VanDerWaalsContact O-N 3.08Å; V6-H8 PolarHBondContact O-CD2 3.23Å; V6-H8 PolarHBondContact O-N 3.28Å
7L48.5Very low47.9Very low162 Ų162131.8 Ų131.885%0.84868%0.683SS**  trans-70.490.3175.4-78.6169.8000110.7L5 P9L5-L7 PolarHBondContact O-N 3.16Å; L7-P9 WeakPolarHBondContact O-CD 3.5Å
8H50.7Low48.3Very low145 Ų145130.4 Ų130.467%0.67168%0.681SS**  trans-56.7122.6173.8-83.5-101.9000111.2V6 R10V6-H8 PolarHBondContact O-CD2 3.23Å; V6-H8 PolarHBondContact O-N 3.28Å; H8-R10 PolarHBondContact O-N 3.46Å; H8-R10 VanDerWaalsContact O-N 3.08Å
9P50.6Low48.2Very low73 Ų73134 Ų13447%0.47469%0.686SS.*  trans-69.4107178.5-22.435.4000111.7L7 W11 A12L7-P9 WeakPolarHBondContact O-CD 3.5Å; P9-W11 HydrophobicContact CB-CG 4.48Å; P9-W11 VanDerWaalsContact CB-NE1 3.28Å; P9-W11 PolarHBondContact O-N 2.98Å; P9-A12 PolarHBondContact O-N 3.28Å
10R52.5Low47.9Very low206 Ų206135.4 Ų135.478%0.77769%0.689SS**THydrogen-bonded Turntrans-58.93.5-174.5-53.1-169.3731724.5116.9H8 D13 T14H8-R10 PolarHBondContact O-N 3.46Å; H8-R10 VanDerWaalsContact O-N 3.08Å; R10-D13 WeakPolarHBondContact CA-OD2 3.38Å; R10-T14 PolarHBondContact O-OG1 3.49Å
11W48.6Very low47.6Very low147 Ų147137.8 Ų137.856%0.55770%0.695SS**Hα-helixtrans-80.5-18.8167.966.2-99.2000112.8P9 L15 F294P9-W11 HydrophobicContact CB-CG 4.48Å; P9-W11 VanDerWaalsContact CB-NE1 3.28Å; P9-W11 PolarHBondContact O-N 2.98Å; W11-L15 HydrophobicContact CE3-CD1 3.88Å; W11-L15 HydrophobicContact CZ3-CD1 3.85Å; W11-F294 AromaticContact CH2-CE1 3.78Å; W11-F294 HydrophobicContact CH2-CE1 3.78Å; W11-F294 HydrophobicContact CH2-CZ 4.36Å; W11-F294 AromaticContact CZ3-CE1 3.84Å; W11-F294 HydrophobicContact CZ3-CE1 3.84Å; W11-F294 HydrophobicContact CZ3-CZ 4.01Å
12A47.9Very low47.4Very low41 Ų41130.5 Ų130.534%0.33967%0.668SS.*Hα-helixtrans-67.2-49.4175.900000111.2P9 T14 L15 M16P9-A12 PolarHBondContact O-N 3.28Å; A12-T14 PolarHBondContact O-N 3.26Å; A12-L15 WeakPolarHBondContact O-CB 3.47Å; A12-L15 PolarHBondContact O-N 3.42Å; A12-M16 PolarHBondContact O-N 3.12Å; A12-M16 VanDerWaalsContact O-N 3.16Å
13D44.4Very low47.7Very low79 Ų79129.4 Ų129.442%0.42266%0.663SS.*Hα-helixtrans-52.5-41.3179.4-35-27.6000111.6R10 L15 M16 Y17R10-D13 WeakPolarHBondContact CA-OD2 3.38Å; D13-L15 VanDerWaalsContact C-N 3.25Å; D13-L15 PolarHBondContact O-N 3.05Å; D13-M16 PolarHBondContact O-N 3.34Å; D13-Y17 PolarHBondContact O-N 3.09Å
14T54.2Low47.5Very low92 Ų92129.9 Ų129.956%0.56466%0.661SS**Hα-helixtrans-65.1-26.6179.6-52.20000112.8R10 A12 V18R10-T14 PolarHBondContact O-OG1 3.49Å; A12-T14 PolarHBondContact O-N 3.26Å; T14-V18 WeakPolarHBondContact O-CG2 3.38Å
15L55.6Low47.6Very low82 Ų82133 Ų13343%0.42966%0.664SS.*Hα-helixtrans-84.7-37.3176.4-66.4174000111.8W11 A12 D13 V18 Y19W11-L15 HydrophobicContact CE3-CD1 3.88Å; W11-L15 HydrophobicContact CZ3-CD1 3.85Å; A12-L15 WeakPolarHBondContact O-CB 3.47Å; A12-L15 PolarHBondContact O-N 3.42Å; D13-L15 VanDerWaalsContact C-N 3.25Å; D13-L15 PolarHBondContact O-N 3.05Å; L15-V18 PolarHBondContact O-N 3.45Å; L15-Y19 PolarHBondContact O-N 3.45Å; L15-Y19 VanDerWaalsContact O-N 3.17Å
16M56.7Low47.2Very low135 Ų135132.3 Ų132.367%0.66566%0.661SS**Hα-helixtrans-61.6-47.7174.9-65.5-59-65.900111.1A12 D13 V18 Y19 E20A12-M16 PolarHBondContact O-N 3.12Å; A12-M16 VanDerWaalsContact O-N 3.16Å; D13-M16 PolarHBondContact O-N 3.34Å; M16-V18 PolarHBondContact O-N 2.85Å; M16-V18 VanDerWaalsContact O-N 3.1Å; M16-Y19 PolarHBondContact O-N 2.91Å; M16-E20 PolarHBondContact O-N 3.36Å
17Y47.7Very low46.6Very low187 Ų187133.4 Ų133.473%0.73366%0.663SS**Hα-helixtrans-64.4-17.2-179.3-136.3-88.8000114.4D13D13-Y17 PolarHBondContact O-N 3.09Å
18V56.3Low46.8Very low108 Ų108131.1 Ų131.166%0.65566%0.657SS**Hα-helixtrans-91.6-26.6173.8171.90000111.6T14 L15 M16T14-V18 WeakPolarHBondContact O-CG2 3.38Å; L15-V18 PolarHBondContact O-N 3.45Å; M16-V18 PolarHBondContact O-N 2.85Å; M16-V18 VanDerWaalsContact O-N 3.1Å
19Y45.6Very low46.5Very low198 Ų198130.9 Ų130.978%0.77666%0.661SS**Hα-helixtrans-81.3-34.7178-155.5-99.9000112.5L15 M16 K21L15-Y19 PolarHBondContact O-N 3.45Å; L15-Y19 VanDerWaalsContact O-N 3.17Å; M16-Y19 PolarHBondContact O-N 2.91Å; Y19-K21 VanDerWaalsContact C-N 3.32Å; Y19-K21 PolarHBondContact O-N 3.17Å
20E43.3Very low46Very low161 Ų161137.1 Ų137.175%0.75268%0.681SS**SBendtrans-67.9-29.6-179.8-163.2174.8-16200112.9M16 S22M16-E20 PolarHBondContact O-N 3.36Å; E20-S22 VanDerWaalsContact C-N 3.32Å; E20-S22 PolarHBondContact O-N 3.43Å; E20-S22 VanDerWaalsContact O-N 3.17Å
21K40.8Very low45.5Very low187 Ų187135 Ų13581%0.81368%0.684SS**SBendtrans-91.553.7-179-160.1168.6-176.4165.60113.4Y19Y19-K21 VanDerWaalsContact C-N 3.32Å; Y19-K21 PolarHBondContact O-N 3.17Å
22S34.3Very low45.1Very low90 Ų90136.9 Ų136.963%0.62970%0.7SS**  trans-142.684.5173.3-171.10000111.5E20 N24E20-S22 VanDerWaalsContact C-N 3.32Å; E20-S22 PolarHBondContact O-N 3.43Å; E20-S22 VanDerWaalsContact O-N 3.17Å; S22-N24 PolarHBondContact O-N 3Å
23P44.8Very low44.5Very low119 Ų119141 Ų14177%0.77372%0.721SS**  trans-61.6130.3171.227.3-33.5000109.9E25P23-E25 PolarHBondContact O-N 3.34Å
24N39.8Very low44.6Very low139 Ų139146.1 Ų146.174%0.74374%0.744SS**  trans-87.5102.5-179.917266.4000109.9S22S22-N24 PolarHBondContact O-N 3Å
25E38.3Very low43.9Very low179 Ų179150.7 Ų150.784%0.83676%0.759SS**  trans-115.4115.8171.5-92.6-58.5147.700110.2P23P23-E25 PolarHBondContact O-N 3.34Å
26N41.5Very low42.9Very low136 Ų136150 Ų15073%0.72777%0.772SS**  trans-163.381.9-166.9-164.219.8000112.2
27N36.8Very low42.1Very low136 Ų136152.1 Ų152.173%0.72779%0.785SS**  trans-175.7117.1146.4-168.81.4000112.2N29N27-N29 PolarHBondContact O-N 3.04Å
28P53.5Low41.4Very low114 Ų114148.8 Ų148.874%0.7479%0.789SS**  trans-89.895.3171.434.1-30.4000111.9
29N43.3Very low40.4Very low139 Ų139146.4 Ų146.474%0.74379%0.786SS**  trans-174.6114.3154.5-104-43000113.6N27N27-N29 PolarHBondContact O-N 3.04Å
30K40.8Very low40Very low205 Ų205144.7 Ų144.789%0.89179%0.791SS**  trans-175.5123146.2-106.2159.4-174.6177.90110.2
31N41.7Very low39.8Very low160 Ų160143.2 Ų143.286%0.85680%0.796SS**  trans-80.8131.5171.4-63.3-20.5000109.3
32Q40.7Very low40Very low188 Ų188140.5 Ų140.588%0.87980%0.798SS**  trans-133.3116.5158.8-86.3-175.6-21.400110.4
33T35.1Very low40.3Very low127 Ų127140.6 Ų140.678%0.77980%0.804SS**  trans7.5126.5149.1-41.70000117.8
34M46Very low40.1Very low186 Ų186141.6 Ų141.692%0.91681%0.808SS**  trans-73.9124.6158.5-68.2-157.7-55.100110
35E38.5Very low40.1Very low189 Ų189142.5 Ų142.588%0.88381%0.808SS**  trans-82.6163.3156.2-62.2-170.3144.900109.8
36G36.5Very low40Very low67 Ų67139.3 Ų139.369%0.69180%0.804SS**  trans-161.4-171.3179.400000113.3
37L38Very low40Very low179 Ų179142.4 Ų142.494%0.93781%0.805SS**  trans80.9142-177.5-52.6174000116.5
38S33.6Very low40.1Very low118 Ų118141.8 Ų141.883%0.82580%0.802SS**  trans56.8128.3172.4-131.90000117.6
39G36.5Very low39.5Very low57 Ų57144.7 Ų144.759%0.58881%0.81SS**  cis106104.34.100000112.1
40N35.7Very low39.7Very low163 Ų163146.9 Ų146.987%0.87282%0.818SS**  trans171.3125.7138.9-89.9-5.6000110.4
41C38.8Very low39.4Very low129 Ų129142.8 Ų142.887%0.87282%0.815SS**  trans-99.3153.3158.3-56.90000108.7
42P46.9Very low39.5Very low131 Ų131144.3 Ų144.385%0.85182%0.817SS**  trans-113.8141.4139.133.7-28.5000110.1
43A40.2Very low39.9Very low91 Ų91141.5 Ų141.575%0.75282%0.815SS**  trans-98161.7176.700000111.1
44T40.8Very low40.2Very low140 Ų140138.5 Ų138.586%0.85981%0.81SS**  trans-165138.613526.70000113.2
45H38.3Very low40Very low159 Ų159138.6 Ų138.674%0.73681%0.813SS**  trans85.8153.7147.9-129.7-98.5000121.7
46C37.2Very low39.7Very low112 Ų112133.3 Ų133.376%0.75781%0.809SS**  trans6284.3-179.7-58.70000114.6
47R40.8Very low39.7Very low201 Ų201141.6 Ų141.676%0.75882%0.819SS**  cis90.811731.6-158.3-157.4168.3135.16.9114.3
48D39.8Very low39.9Very low122 Ų122141.9 Ų141.965%0.65282%0.816SS**  trans62.7145.8168-54.7-28.3000116.6
49L41.3Very low40.2Very low175 Ų175142 Ų14292%0.91682%0.816SS**  cis-131.6163.225.4-74.1160.4000114.8
50M46.5Very low40.1Very low185 Ų185142.1 Ų142.191%0.91182%0.818SS**  trans-108140.1176.4-98.6154.540.400112.3
51S33.5Very low40.1Very low119 Ų119140.8 Ų140.883%0.83282%0.816SS**  trans-167.8105.6151.149.60000115.8
52H44.2Very low40.1Very low192 Ų192142 Ų14289%0.88981%0.812SS**  trans-126.1145.6149-75.6-41.2000105.9
53P50Low39.6Very low130 Ų130140.4 Ų140.484%0.84481%0.81SS**  -133.4-167.661.221.93.2000112.3
54G40.3Very low39.7Very low64 Ų64142.7 Ų142.766%0.6682%0.815SS**  cis132.8142.1-6.800000114.6
55L42.9Very low39.4Very low187 Ų187144.8 Ų144.898%0.97981%0.814SS**  trans90.7147.7169.8-52.2178.1000120.7
56G32.7Very low39.3Very low78 Ų78145.5 Ų145.580%0.80482%0.818SS**  trans93.3106.6169.600000115.5
57R34.7Very low39.1Very low241 Ų241143.9 Ų143.991%0.90982%0.82SS**  cis98.696.721.6-163.5-170-167.8-121.33.3115.9
58H42.6Very low38.8Very low186 Ų186139 Ų13986%0.86182%0.817SS**  trans-172177.4141.658.6-89.8000110
59S40.2Very low38.5Very low119 Ų119140.7 Ų140.783%0.83282%0.823SS**  -173.7146.9-65.3-165.50000109
60G34.9Very low38.3Very low61 Ų61142.1 Ų142.163%0.62982%0.817SS**  trans113.4114.8-176.100000111.9
61T36.2Very low37.9Very low134 Ų134137.2 Ų137.282%0.82280%0.802SS**  cis67.9119.540.2-27.20000110.2
62I38.5Very low37.8Very low156 Ų156138 Ų13880%0.880%0.797SS**  -158.2128.760.2-76.1168.3000107.3
63A36.6Very low37.6Very low97 Ų97136 Ų13680%0.80279%0.79SS**  80.715881.300000117.3
64T41.5Very low36.8Very low139 Ų139135.3 Ų135.385%0.85379%0.789SS**  trans-107144-161.2-33.30000113.9
65H34.4Very low36.8Very low183 Ų183137.2 Ų137.285%0.84779%0.792SS**  trans-159.8171.7147.9-149-105.2000114.8
66Q36.9Very low37.3Very low174 Ų174133.7 Ų133.781%0.81378%0.781SS**  trans-113.5154.1173.3-62.2-17249.600112.7
67G32.1Very low37.3Very low79 Ų79136.4 Ų136.481%0.81478%0.777SS**  trans66.6177.6161.900000116.7
68S35.4Very low37.4Very low98 Ų98130.9 Ų130.969%0.68577%0.77SS**  cis-167.3162.3-17.2-164.20000109.4
69M34Very low37Very low157 Ų157125.5 Ų125.577%0.77377%0.765SS**  trans65.5152.1177-50.8-60.8158.500114.5
70Y35.5Very low36.8Very low205 Ų205131.8 Ų131.880%0.80477%0.77SS**  cis-148.8168.11.3-138.1-154.1000107.3
71S38.4Very low36.8Very low83 Ų83137.8 Ų137.858%0.5878%0.782SS**  cis-129.7-138.911.6-55.10000109.2
72D32.3Very low36.8Very low136 Ų136137 Ų13773%0.72778%0.781SS**  cis-155.7-170.7-0.7-141-70.6000111.8
73I38.9Very low37.2Very low148 Ų148135.2 Ų135.276%0.75978%0.779SS**  trans-75.1132.7-171.8-63.7160.7000111.6
74S33.6Very low37.1Very low116 Ų116135 Ų13581%0.81178%0.778SS**  -161.6-179.660.6-155.60000114.7
75S39.7Very low37.6Very low104 Ų104134.1 Ų134.173%0.72777%0.774SS**  trans-131.5176.2-174.1-151.20000110.6
76P54.9Low37.7Very low114 Ų114134.2 Ų134.274%0.7478%0.775SS**  cis-124.4-151.1-7.238.1-15.7000110.6
77D32.8Very low37.7Very low134 Ų134131.7 Ų131.772%0.71777%0.772SS**  cis-157.5165.4-0.5-160.37.8000112.5
78T35.5Very low37.8Very low126 Ų126133 Ų13377%0.77377%0.768SS**  trans62.8140.616872.20000118.2
79G35Very low37.8Very low73 Ų73133.5 Ų133.575%0.75377%0.772SS**  cis126.378.6-8.300000114.4
80R36.2Very low38Very low250 Ų250131.4 Ų131.494%0.94377%0.773SS**  trans-143.1120.2169-73.7-165.8175.3-87.7-6.1113.9
81Q33.8Very low38.3Very low187 Ų187128 Ų12887%0.87478%0.776SS**  trans-91.3152.8164.7-164.580.9-1.700109.3
82C36.6Very low38.3Very low118 Ų118129 Ų12980%0.79778%0.783SS**  trans-73.2160.5168-52.20000111.3
83P48.3Very low38.5Very low119 Ų119131.2 Ų131.277%0.77379%0.794SS**  -152.3163.493.340-23.3000117.5
84A34.3Very low38.3Very low93 Ų93129.3 Ų129.377%0.76979%0.793SS**  trans64149.6150.500000121.3
85P51.9Low38.5Very low120 Ų120135 Ų13578%0.77980%0.799SS**  trans-93.8158.1176.937.7-34.9000113.7
86Q35.2Very low38.1Very low185 Ų185133.2 Ų133.286%0.86480%0.797SS**  trans-136.4164.7168.7-81.2-66.4-9.800110.6
87T36.4Very low37.5Very low121 Ų121137.7 Ų137.774%0.74280%0.801SS**  trans-109.4162.6-162.754.20000115.5
88S36.1Very low38.6Very low106 Ų106136.6 Ų136.674%0.74180%0.801SS**  trans88.615715284.10000120.7
89S35.5Very low39Very low108 Ų108140.3 Ų140.376%0.75581%0.807SS**  trans85.7111.4159.1-48.80000119.7
90S37.7Very low38.8Very low114 Ų114140.7 Ų140.780%0.79781%0.811SS**  trans-50.4172.3168.2-37.50000116.2
91P42.2Very low39Very low133 Ų133134.3 Ų134.386%0.86480%0.796SS**  -121.5172.5108.636.4-35.6000114
92S37.1Very low39.7Very low105 Ų105130.9 Ų130.973%0.73479%0.789SS**  trans-99.6149.5-167.649.90000114.8
93L36.6Very low40Very low182 Ų182133.8 Ų133.895%0.95379%0.785SS**  trans-131.2153.4144.6-75.1178.5000108
94S35.8Very low39.7Very low108 Ų108139.8 Ų139.876%0.75579%0.794SS**  trans-135.3167.4-164.4-167.20000112.7
95Y36.4Very low39.7Very low234 Ų234138.3 Ų138.392%0.91879%0.788SS**  trans80.4143.8164.6-122.2-101.1000119.7
96G31.8Very low39Very low68 Ų68139.1 Ų139.170%0.70180%0.795SS**  trans111.576.615400000118.1
97Y42.5Very low39.2Very low208 Ų208141.5 Ų141.582%0.81680%0.796SS**  trans-120.9125.2163.8-165.7-79.6000110.9
98P55.7Low39.2Very low111 Ų111142.8 Ų142.872%0.72180%0.797SS**  trans-121.4161.4159.833.7-20.7000113.3
99F44.1Very low39Very low203 Ų203142.7 Ų142.789%0.8980%0.797SS**  trans-80.6156.4-173.5-74.7-117.2000113.4
100G31.4Very low39.1Very low82 Ų82145.3 Ų145.385%0.84580%0.797SS**  trans173.790.9167.800000115.2
101N39.9Very low38.9Very low116 Ų116145.5 Ų145.562%0.6280%0.798SS**  trans-99.2151.8169.2-161.69.2000108.3Y103N101-Y103 WeakPolarHBondContact ND2-CE2 3.48Å; N101-Y103 PolarHBondContact OD1-N 3.47Å
102P48.6Very low38.7Very low114 Ų114147.5 Ų147.574%0.7480%0.796SS**  -149.9131.488.735.3-15.6000117.2
103Y42.8Very low38.6Very low180 Ų180149.3 Ų149.371%0.70680%0.797SS**  trans33.8117.2131.7-61.6-78.3000121.2N101N101-Y103 WeakPolarHBondContact ND2-CE2 3.48Å; N101-Y103 PolarHBondContact OD1-N 3.47Å
104Y41.4Very low38.7Very low244 Ų244147.7 Ų147.796%0.95780%0.795SS**  -143.775.4129.6-94.8-70000110.8
105G34.8Very low38.8Very low63 Ų63149.6 Ų149.665%0.64980%0.796SS**  trans-96.9110174.700000111.7R107G105-R107 PolarHBondContact O-N 3.2Å
106C36.1Very low38.9Very low136 Ų136145.9 Ų145.992%0.91979%0.791SS**  trans-66.299.9177.6-63.80000111.7
107R41.2Very low39.2Very low235 Ų235150.6 Ų150.689%0.88780%0.795SS**  trans-74.1130.5164-72-66.1-169.9-147.11.9109.6G105 S109G105-R107 PolarHBondContact O-N 3.2Å; R107-S109 PolarHBondContact O-N 3.45Å
108L35.8Very low38.8Very low148 Ų148149.7 Ų149.778%0.77580%0.798SS**  trans-84.899.5174.6-177.568.9000109.4H110L108-H110 PolarHBondContact O-N 2.96Å; L108-H110 PolarHBondContact O-ND1 3.22Å
109S30.8Very low38Very low105 Ų105152.7 Ų152.773%0.73480%0.8SS**  trans-60.3115.7179.8-55.20000111.7R107 S111R107-S109 PolarHBondContact O-N 3.45Å; S109-S111 PolarHBondContact O-N 3.41Å
110H38.6Very low37.6Very low162 Ų162148.9 Ų148.975%0.7580%0.796SS**  trans-81.199.2168-77.857.5000108.8L108 H112L108-H110 PolarHBondContact O-N 2.96Å; L108-H110 PolarHBondContact O-ND1 3.22Å; H110-H112 PolarHBondContact O-N 2.86Å; H110-H112 VanDerWaalsContact O-N 3.09Å
111S33.5Very low37.7Very low118 Ų118150.9 Ų150.983%0.82580%0.795SS**  trans-77.790.1178.856.60000111.5S109 N113S109-S111 PolarHBondContact O-N 3.41Å; S111-N113 PolarHBondContact O-N 3.29Å
112H38.8Very low37.2Very low176 Ų176150.7 Ų150.782%0.81580%0.803SS**  trans-68.6104.5160.7-94.8-101000109.6H110H110-H112 PolarHBondContact O-N 2.86Å; H110-H112 VanDerWaalsContact O-N 3.09Å
113N34.9Very low36.3Very low143 Ų143155.9 Ų155.977%0.76581%0.81SS**  trans-175.4116.1133.4-111.2-75.9000112.2S111S111-N113 PolarHBondContact O-N 3.29Å
114V38.2Very low36.1Very low148 Ų148155.4 Ų155.490%0.89781%0.813SS**  trans-141.889.3150.8-83.80000107.7L116V114-L116 PolarHBondContact O-N 3.29Å
115N36.7Very low35.9Very low148 Ų148149.3 Ų149.379%0.79180%0.803SS**  trans-81.3109.6165.2-173.8-25.2000108
116L38.5Very low35.8Very low155 Ų155151.4 Ų151.481%0.81282%0.815SS**  trans-139.7135.3165.7-163.968.9000108.3V114 Q118V114-L116 PolarHBondContact O-N 3.29Å; L116-Q118 PolarHBondContact O-N 3.14Å
117Q38Very low35.7Very low167 Ų167152.7 Ų152.778%0.7881%0.807SS**  trans-44.2115.4-164.4-63.1178.911.900114.6
118Q35.9Very low35.5Very low189 Ų189149.6 Ų149.688%0.88380%0.8SS**  trans-87110.9153.9-69.3-174-4.700108.1L116 P120L116-Q118 PolarHBondContact O-N 3.14Å; Q118-P120 WeakPolarHBondContact O-CD 3.33Å
119K37.4Very low35.5Very low174 Ų174153.1 Ų153.176%0.75781%0.805SS**PPolyproline II helixtrans-71123.7163.4-71.3-178.3176.3-178.80108.1C121K119-C121 PolarHBondContact O-N 2.99Å
120P36.7Very low35.6Very low124 Ų124152 Ų15281%0.80581%0.809SS**PPolyproline II helixtrans-65.5124.3163.9-15.730.9000108.5Q118Q118-P120 WeakPolarHBondContact O-CD 3.33Å
121C32.4Very low35.4Very low123 Ų123151.7 Ų151.783%0.83181%0.813SS**PPolyproline II helixtrans-74.9133.6166.9-67.60000108.8K119 Y123K119-C121 PolarHBondContact O-N 2.99Å; C121-Y123 PolarHBondContact O-N 2.8Å
122S29.3Very low36.6Very low112 Ų112150.6 Ų150.678%0.78380%0.803SS**PPolyproline II helixtrans-60.1125180-55.70000111.5
123Y31.3Very low36.4Very low224 Ų224148 Ų14888%0.87880%0.8SS**PPolyproline II helixtrans-77.2129.5162.6-133.2-95000108.1C121C121-Y123 PolarHBondContact O-N 2.8Å
124H37.8Very low36.4Very low169 Ų169146.1 Ų146.178%0.78280%0.798SS**PPolyproline II helixtrans-73.2132.3176.2-81.4-102.1000110.4
125P37.7Very low36.2Very low116 Ų116145.8 Ų145.875%0.75380%0.796SS**PPolyproline II helixtrans-65.9137.2161.9-15.430.2000109.7
126A33.3Very low36Very low107 Ų107142.4 Ų142.488%0.88479%0.789SS**  trans-92.8112.8171.700000109.9
127E33.2Very low36Very low163 Ų163142.9 Ų142.976%0.76279%0.792SS**  trans-118122.4163.3-70.7-165.2-173.100109.9
128K37.7Very low36.4Very low171 Ų171139.9 Ų139.974%0.74379%0.787SS**  168.9137.8101.9-86-153.9177.7-169.30113
129Y34.1Very low36.3Very low222 Ų222137.3 Ų137.387%0.87178%0.784SS**  trans31.6137.4138.8-74.5-99.7000121.9
130G34.4Very low36.1Very low80 Ų80136.5 Ų136.583%0.82578%0.783SS**  trans137116.5138.700000115.1
131D32.8Very low36.2Very low156 Ų156140 Ų14083%0.83479%0.789SS**  trans-111.3-168.4173.6-161.433.4000109.7
132P60.3Low36.3Very low95 Ų95141 Ų14162%0.61779%0.785SS**  -106-178.4-100.736.9-23.4000114.5
133T34.6Very low36.5Very low123 Ų123140.8 Ų140.876%0.75578%0.784SS**  153.7154.8129.3-65.90000113.6
134S35.2Very low36.8Very low103 Ų103136 Ų13672%0.7278%0.783SS**  trans78.5122.3171.366.10000116.5
135T33.9Very low36.7Very low140 Ų140137.8 Ų137.886%0.85978%0.783SS**  cis91.5121.646.1-65.60000111.1
136A32.5Very low36.8Very low78 Ų78137.2 Ų137.265%0.64579%0.788SS**  cis-167158.4-2.300000113.4
137L37.2Very low37.2Very low164 Ų164140.6 Ų140.686%0.85978%0.783SS**  trans50.4165.8144.8-65.4175.9000121.8
138P46.1Very low37.6Very low105 Ų105140.8 Ų140.868%0.68278%0.784SS**  cis-130.1-179.7-37.538.4-23.6000112.7
139T34.5Very low37.4Very low135 Ų135141.8 Ų141.883%0.82879%0.788SS**  172141.7128.9-70.90000111.8
140E34Very low37.6Very low157 Ų157135.7 Ų135.773%0.73478%0.784SS**  trans-41138.6172.9-60.4-69.611400117.2
141E37.3Very low37.7Very low196 Ų196140.5 Ų140.592%0.91678%0.783SS**  -162.2147106-165.8166.4-174.800110.2
142L36Very low38.2Very low145 Ų145143.5 Ų143.576%0.75978%0.784SS**  trans-110.1124.4-164.2-81.9170.1000116.2
143S32.9Very low37.5Very low108 Ų108143.1 Ų143.176%0.75578%0.781SS**  trans36.5108133-167.50000120.5
144S36.9Very low37.5Very low124 Ų124143 Ų14387%0.86779%0.785SS**  trans-166.7139.8141.2-85.60000109.7
145R35.7Very low37.8Very low205 Ų205147.1 Ų147.177%0.77479%0.791SS**  cis-153.2119.5-1.9162.2-171.7165.5117-9.1107.7
146A41Very low38.3Very low105 Ų105145.3 Ų145.387%0.86879%0.79SS**  trans-99.396.1-178.400000112.6
147K40.3Very low38.3Very low177 Ų177146.9 Ų146.977%0.7780%0.796SS**  trans-173.1122.4160-119170.7-177.6173.50111.6
148E41.8Very low38.7Very low168 Ų168144.4 Ų144.479%0.78579%0.793SS**  trans-178.292.1138-98.7148.9-128.800107.7
149F33.4Very low38.4Very low191 Ų191149.3 Ų149.384%0.83880%0.799SS**  85.891.696-130.3-82.8000112.7
150A38Very low38.9Very low94 Ų94150.1 Ų150.178%0.77779%0.794SS**  trans-82.3135.3176.200000111.3
151F36.4Very low39.6Very low181 Ų181147.3 Ų147.379%0.79480%0.797SS**  trans-148.268.8164.6-153.8-90.3000111.8
152Y45.1Very low40Very low219 Ų219144 Ų14486%0.85979%0.79SS**  trans-98.9122.6164.3-93.3-80.4000109.4S154Y152-S154 PolarHBondContact O-N 3.24Å; Y152-S154 VanDerWaalsContact O-N 3.1Å
153P45.4Very low40.8Very low87 Ų87142.6 Ų142.657%0.56579%0.79SS**  trans-67.6106.2176.8-22.634.7000112.2F155P153-F155 HydrophobicContact CB-CD2 4.47Å; P153-F155 HydrophobicContact CB-CE2 4.25Å; P153-F155 PolarHBondContact O-N 3.06Å
154S32.7Very low41.4Very low120 Ų120141.4 Ų141.484%0.83979%0.794SS**  trans-72.292.7172.9-66.30000111.4Y152 A156Y152-S154 PolarHBondContact O-N 3.24Å; Y152-S154 VanDerWaalsContact O-N 3.1Å; S154-A156 PolarHBondContact O-N 3.47Å
155F43Very low41.8Very low191 Ų191144.5 Ų144.584%0.83879%0.788SS**  trans-76.597.9162.4-78.4-80.7000109.8P153 S157P153-F155 HydrophobicContact CB-CD2 4.47Å; P153-F155 HydrophobicContact CB-CE2 4.25Å; P153-F155 PolarHBondContact O-N 3.06Å; F155-S157 PolarHBondContact O-N 2.97Å
156A43Very low42.5Very low102 Ų102142.9 Ų142.984%0.84379%0.794SS**  trans-67.1110.116800000109.5S154S154-A156 PolarHBondContact O-N 3.47Å
157S33.4Very low42.8Very low110 Ų110143 Ų14377%0.76978%0.78SS**  trans-118.292.8171.3-170.20000109.5F155 Y159F155-S157 PolarHBondContact O-N 2.97Å; S157-Y159 PolarHBondContact O-N 2.91Å
158S46.4Very low43.7Very low113 Ų113141.9 Ų141.979%0.7978%0.779SS**  trans-93.479.7-176.755.70000111.1
159Y39.9Very low43.8Very low208 Ų208138.4 Ų138.482%0.81677%0.773SS**  trans-132.7107174-101.8-84.5000114.1S157S157-Y159 PolarHBondContact O-N 2.91Å
160Q44.4Very low44.4Very low152 Ų152135.4 Ų135.471%0.7177%0.771SS**  trans39.6105.9141.5-60.3-64.4-2000118.2V162Q160-V162 PolarHBondContact O-N 3.28Å
161A48.1Very low44.8Very low97 Ų97137 Ų13780%0.80277%0.771SS**  trans-70.8111.2154.300000108.9P163A161-P163 WeakPolarHBondContact O-CD 3.24Å
162V47.1Very low45.2Very low128 Ų128133.3 Ų133.378%0.77676%0.764SS**PPolyproline II helixtrans-82.2119.9-178.1177.90000110.2Q160Q160-V162 PolarHBondContact O-N 3.28Å
163P50.9Low45Very low115 Ų115126.7 Ų126.775%0.74776%0.763SS**PPolyproline II helixtrans-64.8152.6172.3-20.334.4000111.9A161A161-P163 WeakPolarHBondContact O-CD 3.24Å
164G46.7Very low44.6Very low82 Ų82129.7 Ų129.785%0.84577%0.772SS**PPolyproline II helixtrans-67.6139.7-169.500000114.8
165Y44.7Very low44.6Very low189 Ų189129 Ų12974%0.74177%0.768SS**  trans-132.682.4163.4-168.7-121.6000109.6D167Y165-D167 HydrophobicContact CD1-CB 4.39Å; Y165-D167 HydrophobicContact CE1-CB 3.79Å; Y165-D167 HydrophobicContact CE2-CB 4.09Å; Y165-D167 PolarHBondContact OH-OD1 2.87Å
166L50.6Low44.2Very low172 Ų172128.8 Ų128.890%0.90177%0.769SS**  trans-91.792.4158.5-80176.4000107.1M168L166-M168 PolarHBondContact O-N 2.63Å
167D48.5Very low44.1Very low107 Ų107128.8 Ų128.857%0.57276%0.76SS**  trans-68.1102.2174.8-164.247000109.6Y165Y165-D167 HydrophobicContact CD1-CB 4.39Å; Y165-D167 HydrophobicContact CE1-CB 3.79Å; Y165-D167 HydrophobicContact CE2-CB 4.09Å; Y165-D167 PolarHBondContact OH-OD1 2.87Å
168M57.9Low44.1Very low153 Ų153131.1 Ų131.175%0.75476%0.759SS**  trans-100.4111.4167.8-86-94.46100108L166 V170L166-M168 PolarHBondContact O-N 2.63Å; M168-V170 PolarHBondContact O-N 3.49Å
169S44.4Very low44.4Very low95 Ų95129.7 Ų129.766%0.66475%0.747SS**  trans-63.492.1-175.137.60000112.5V171S169-V171 PolarHBondContact O-N 3.29Å
170V46.3Very low44.2Very low129 Ų129128.5 Ų128.578%0.78274%0.741SS**  trans-66.8113.2165.7174.70000108.3M168 P172M168-V170 PolarHBondContact O-N 3.49Å; V170-P172 WeakPolarHBondContact O-CD 3.41Å
171V46.8Very low43.9Very low128 Ų128129.4 Ų129.478%0.77675%0.745SS**  trans-83.9115.8165.9-1790000108.4S169 G173S169-V171 PolarHBondContact O-N 3.29Å; V171-G173 PolarHBondContact O-N 3.38Å
172P43.6Very low43.6Very low102 Ų102131.7 Ų131.766%0.66274%0.744SS**  trans-72.4127.4175-14.931.5000110.2V170V170-P172 WeakPolarHBondContact O-CD 3.41Å
173G42.3Very low43.2Very low80 Ų80130 Ų13083%0.82574%0.744SS**  trans-75.8136.8176.100000112.3V171V171-G173 PolarHBondContact O-N 3.38Å
174I36.8Very low43.1Very low150 Ų150132.5 Ų132.577%0.76975%0.75SS**  trans-129.7105.2177.2-63.9-179.5000110.9
175S31.7Very low43.1Very low106 Ų106135.9 Ų135.974%0.74175%0.747SS**  trans66.9152.9150.676.60000122.9
176H35Very low43.1Very low187 Ų187132.4 Ų132.487%0.86675%0.747SS**  trans89.9144.4157.4-113.3-110.6000119.9
177P41.7Very low43.1Very low101 Ų101133 Ų13366%0.65675%0.748SS**  trans-128.5-168.2-150.446.7-32.2000116.1
178E31.9Very low43Very low159 Ų159136.9 Ų136.974%0.74376%0.763SS**  trans79.3154.3169-89.7-135.474.100119.4R180E178-R180 IonicContact OE1-CZ 2.67Å; E178-R180 IonicContact OE1-NH1 3.46Å; E178-R180 PolarHBondContact OE1-NH1 2.59Å; E178-R180 IonicContact OE1-NH2 3.92Å
179P54.2Low42.5Very low84 Ų84132.8 Ų132.855%0.54576%0.759SS.*  trans-123.1-169.8-157.944.5-30.3000114.6
180R34.2Very low42.1Very low182 Ų182138.8 Ų138.869%0.68777%0.769SS**  trans85.2141.4-174.4-47157.6-167.292.3-3.5110.4E178E178-R180 IonicContact OE1-CZ 2.67Å; E178-R180 IonicContact OE1-NH1 3.46Å; E178-R180 PolarHBondContact OE1-NH1 2.59Å; E178-R180 IonicContact OE1-NH2 3.92Å
181H37.9Very low41.9Very low171 Ų171141.4 Ų141.479%0.79277%0.773SS**  cis-132.3174.223-82.2-88.2000115
182D41.8Very low41.4Very low145 Ų145141.2 Ų141.278%0.77576%0.763SS**  trans-59146-178.6-52.5-106.5000116.1
183A38.9Very low41.7Very low94 Ų94145 Ų14578%0.77776%0.764SS**  trans-154.287.5153.700000110.5I185A183-I185 PolarHBondContact O-N 3.06Å
184L48.9Very low42.1Very low166 Ų166145 Ų14587%0.86976%0.757SS**  trans-74.5116.4172.8-73.7172.2000110.7
185I46.6Very low42.7Very low153 Ų153144.3 Ų144.379%0.78575%0.754SS**  trans-115.6115164.4-59.4-64.9000108.1A183 M187A183-I185 PolarHBondContact O-N 3.06Å; I185-M187 PolarHBondContact O-N 3.16Å
186P46.1Very low43.1Very low116 Ų116144.4 Ų144.475%0.75375%0.754SS**  trans-64.2124.6177.7-2435.1000112.7E188P186-E188 PolarHBondContact O-N 2.69Å
187M49.8Very low43.7Very low186 Ų186141.7 Ų141.792%0.91675%0.746SS**  trans-89.274.7177-176.878.68000110.5I185I185-M187 PolarHBondContact O-N 3.16Å
188E46.9Very low43.4Very low188 Ų188140.2 Ų140.288%0.87975%0.75SS**  trans-122.1114.7179.7-155.665.7-106.900110.3P186P186-E188 PolarHBondContact O-N 2.69Å
189G46.1Very low44.2Very low66 Ų66143.7 Ų143.768%0.6876%0.756SS**  trans149.1-1.5176.900000119.3Q191G189-Q191 PolarHBondContact O-N 2.96Å
190Y37.4Very low44Very low222 Ų222147 Ų14787%0.87177%0.77SS**  trans-90.579.3178.4-136-89.7000112.6H192Y190-H192 VanDerWaalsContact C-N 3.31Å; Y190-H192 PolarHBondContact O-N 3.1Å
191Q41.3Very low44Very low184 Ų184141.4 Ų141.486%0.8677%0.768SS**  trans-67.184.1175.9-80.5-74-51.300111.8G189G189-Q191 PolarHBondContact O-N 2.96Å
192H37.4Very low44.2Very low123 Ų123142.1 Ų142.157%0.56977%0.771SS**  trans-66.4132.5174.6-167.9-96.2000110.5Y190 A194Y190-H192 VanDerWaalsContact C-N 3.31Å; Y190-H192 PolarHBondContact O-N 3.1Å; H192-A194 PolarHBondContact O-N 3.17Å
193W48.8Very low44.5Very low181 Ų181141.4 Ų141.469%0.68677%0.772SS**  trans-48.794.3-171.344.4-82.4000114.3L195W193-L195 HydrophobicContact CE3-CD1 4.09Å; W193-L195 HydrophobicContact CE3-CG 4.03Å; W193-L195 HydrophobicContact CZ3-CD1 3.85Å; W193-L195 HydrophobicContact CZ3-CG 4.24Å; W193-L195 PolarHBondContact O-N 3.3Å
194A50Low44.4Very low81 Ų81146.9 Ų146.967%0.66977%0.774SS**  trans-73.296.7179.100000112H192 S196H192-A194 PolarHBondContact O-N 3.17Å; A194-S196 PolarHBondContact O-N 3.16Å
195L50.3Low44Very low135 Ų135145.2 Ų145.271%0.70778%0.775SS**  trans-74.875.9164.4-74.9178.4000110.2W193 N197W193-L195 HydrophobicContact CE3-CD1 4.09Å; W193-L195 HydrophobicContact CE3-CG 4.03Å; W193-L195 HydrophobicContact CZ3-CD1 3.85Å; W193-L195 HydrophobicContact CZ3-CG 4.24Å; W193-L195 PolarHBondContact O-N 3.3Å; L195-N197 VanDerWaalsContact C-N 3.26Å; L195-N197 PolarHBondContact O-N 3.3Å
196S40.5Very low43.4Very low108 Ų108142.9 Ų142.976%0.75577%0.773SS**  trans-68.578.9178.1-60.80000112.5A194A194-S196 PolarHBondContact O-N 3.16Å
197N47.3Very low43.1Very low130 Ų130145.8 Ų145.870%0.69577%0.773SS**  trans-11054.9163.2-77.3-51.4000109.7L195 W199L195-N197 VanDerWaalsContact C-N 3.26Å; L195-N197 PolarHBondContact O-N 3.3Å; N197-W199 PolarHBondContact O-NE1 2.9Å; N197-W199 VanDerWaalsContact O-NE1 3.1Å
198G35.1Very low42.8Very low71 Ų71144.3 Ų144.373%0.73276%0.764SS**  trans-98.2121.2163.400000109.2
199W48.6Very low42.2Very low231 Ų231144.6 Ų144.688%0.87577%0.765SS**  trans-131.245.9-173.624.9-68.2000112.1N197N197-W199 PolarHBondContact O-NE1 2.9Å; N197-W199 VanDerWaalsContact O-NE1 3.1Å
200D49.4Very low41.8Very low155 Ų155147.1 Ų147.183%0.82977%0.768SS**  trans-144.9154.5144.7-161-4.7000108.3
201G35.8Very low42.3Very low63 Ų63144.5 Ų144.565%0.64976%0.763SS**  trans161.233.8-170.700000115.6V203G201-V203 PolarHBondContact O-N 3.18Å
202Q42.4Very low42.1Very low186 Ų186141.6 Ų141.687%0.86976%0.763SS**  trans-76.380.6179.1-169.3-164.5-89.500112.4
203V47.5Very low42.1Very low131 Ų131140.2 Ų140.279%0.79476%0.764SS**  trans-132.3115.7169.6-74.50000113.8G201G201-V203 PolarHBondContact O-N 3.18Å
204Y36.5Very low42.2Very low208 Ų208136.8 Ų136.882%0.81676%0.755SS**  trans55.6101.4149.3-151.3-96.7000119.7S206Y204-S206 PolarHBondContact O-N 3.39Å
205C40.1Very low42.1Very low132 Ų132142 Ų14289%0.89277%0.771SS**  trans-74.8110.4160.4-72.40000111
206S34.3Very low42.1Very low104 Ų104145.8 Ų145.873%0.72778%0.776SS**  trans-75152.5159.4-85.90000111.7Y204Y204-S206 PolarHBondContact O-N 3.39Å
207K39.8Very low42.1Very low176 Ų176147.5 Ų147.577%0.76577%0.77SS**  trans-83.8154.8-170.8-170.9175.9176.7-177.80112.9
208E42.9Very low42.1Very low155 Ų155145 Ų14572%0.72476%0.762SS**  trans19113.3173.9-89.383.8124.400119.6
209Q34.9Very low42.6Very low194 Ų194147.2 Ų147.291%0.90777%0.767SS**  trans-149.4141.4132.4-140.7170.321.300115.3
210T37.7Very low42.5Very low119 Ų119144.5 Ų144.573%0.7376%0.761SS**  trans-23.7132.9178.3-51.80000120.4
211Q46.9Very low42.7Very low167 Ų167142.6 Ų142.678%0.7876%0.757SS**  trans5.9119.2153.7-53-176.127.500119.4
212S37.8Very low43.3Very low123 Ų123146.9 Ų146.986%0.8677%0.765SS**  trans-130.868.4157.355.90000111.6H214S212-H214 PolarHBondContact O-N 3.34Å
213T38.8Very low43.6Very low95 Ų95143.8 Ų143.858%0.58376%0.759SS**  trans-80.6113.8-174.837.90000113.6
214H48.8Very low43.8Very low109 Ų109143.2 Ų143.251%0.50576%0.756SS.*  trans71.748.4150.1-48.6-45.7000120.6S212 W216 K217S212-H214 PolarHBondContact O-N 3.34Å; H214-W216 PolarHBondContact O-N 3.39Å; H214-K217 HydrophobicContact CB-CB 4.39Å; H214-K217 PolarHBondContact O-N 2.88Å
215L49.7Very low44.8Very low189 Ų189138.9 Ų138.999%0.9975%0.753SS**THydrogen-bonded Turntrans-61.4-2.4169.6-68.3178.2000116.4
216W49.1Very low45.2Very low215 Ų215140.2 Ų140.281%0.81475%0.75SS**THydrogen-bonded Turntrans-111.7-0179.364.7-96.2000115.4H214H214-W216 PolarHBondContact O-N 3.39Å
217K41.1Very low45.5Very low145 Ų145143.1 Ų143.163%0.6375%0.753SS**  trans-89.6107173.4-100.3-179.2168.6-1780109.7H214 S219H214-K217 HydrophobicContact CB-CB 4.39Å; H214-K217 PolarHBondContact O-N 2.88Å; K217-S219 PolarHBondContact O-N 2.67Å
218S46.2Very low46Very low76 Ų76140.9 Ų140.953%0.53176%0.756SS.*  trans-61.2126.7169.7560000110.6F220S218-F220 PolarHBondContact O-N 2.89Å
219S47.2Very low46.3Very low119 Ų119140.4 Ų140.483%0.83275%0.754SS**  trans-69120.2174.9-166.70000110.6K217K217-S219 PolarHBondContact O-N 2.67Å
220F44.8Very low47.3Very low173 Ų173135.6 Ų135.676%0.75974%0.737SS**  trans-133.7134.2160.5-72.3-75.2000106.4S218S218-F220 PolarHBondContact O-N 2.89Å
221P54.4Low47.9Very low115 Ų115134.5 Ų134.575%0.74774%0.735SS**  trans-67.3149.8-176.727.8-34.4000111.8
222D48.8Very low48.4Very low153 Ų153131.9 Ų131.982%0.81873%0.726SS**  trans-71.5125.3-179.8-178.120000111.6
223V47.9Very low49Very low122 Ų122136 Ų13674%0.73972%0.724SS**  trans-143.794.7169.3-173.80000109.8
224V51.7Low50Low119 Ų119141.7 Ų141.772%0.72174%0.735SS**  trans51.5106.9150.5-170.10000117.8
225P57.6Low50.4Low117 Ų117147.9 Ų147.976%0.7675%0.754SS**  trans-92.7103.3-174.934.6-34.2000115
226L49.7Very low51.1Low159 Ų159142.5 Ų142.583%0.83274%0.744SS**  trans-146.683.4164.2-78.4-177.8000113.6
227Q40.4Very low52.5Low166 Ų166143.5 Ų143.578%0.77675%0.748SS**  trans-171.6126.4149.9-97.5-49.3-29.300109.9E229Q227-E229 PolarHBondContact O-N 3.23Å; Q227-E229 VanDerWaalsContact O-N 3.09Å
228P50.3Low54.6Low128 Ų128146.4 Ų146.483%0.83176%0.76SS**  trans-82.343.1172.935.5-37.4000113.3
229E47.9Very low56.6Low146 Ų146151.4 Ų151.468%0.68277%0.773SS**  trans-76.8139.3173.4-112.9-59156.600111.4Q227 S231Q227-E229 PolarHBondContact O-N 3.23Å; Q227-E229 VanDerWaalsContact O-N 3.09Å; E229-S231 PolarHBondContact O-N 3.46Å; E229-S231 VanDerWaalsContact O-N 3.16Å
230V56.5Low58.8Low93 Ų93157.1 Ų157.156%0.56478%0.776SS**  trans-80.7101.9-169.8-850000110.7N232V230-N232 PolarHBondContact O-N 3.02Å; V230-N232 PolarHBondContact O-ND2 3.5Å
231S50Low61.1Low96 Ų96155 Ų15567%0.67178%0.777SS**  trans-60.774.9178.5-167.20000113.8E229 Y233E229-S231 PolarHBondContact O-N 3.46Å; E229-S231 VanDerWaalsContact O-N 3.16Å; S231-Y233 VanDerWaalsContact C-N 3.25Å; S231-Y233 PolarHBondContact O-N 3.3Å
232N58.2Low63.1Low111 Ų111154.6 Ų154.659%0.59477%0.774SS**THydrogen-bonded Turntrans-81.7-1.1-179.9-72-52.6000112.9V230 R234V230-N232 PolarHBondContact O-N 3.02Å; V230-N232 PolarHBondContact O-ND2 3.5Å; N232-R234 VanDerWaalsContact C-N 3.32Å; N232-R234 PolarHBondContact O-N 2.93Å
233Y50Low65.4Low209 Ų209150.7 Ų150.782%0.8275%0.748SS**THydrogen-bonded Turntrans-80.1-5.2-170.3-59.3-72.8000114.6S231 R235S231-Y233 VanDerWaalsContact C-N 3.25Å; S231-Y233 PolarHBondContact O-N 3.3Å; Y233-R235 PolarHBondContact O-N 3.37Å
234R58.6Low67.8Low215 Ų215148.5 Ų148.581%0.81174%0.735SS**SBendtrans-77.580.9172.4-67-59.1-147.5-161.77.5111.6N232N232-R234 VanDerWaalsContact C-N 3.32Å; N232-R234 PolarHBondContact O-N 2.93Å
235R58.7Low70Confident239 Ų239152.1 Ų152.190%0.90274%0.742SS**SBendtrans60.192.1-178.9-88.3-177.5-85.5-112.50.4113.5Y233 R237Y233-R235 PolarHBondContact O-N 3.37Å; R235-R237 VanDerWaalsContact C-N 3.32Å; R235-R237 PolarHBondContact O-N 3.03Å
236G63.4Low71.9Confident77 Ų77152.1 Ų152.179%0.79474%0.735SS**  trans-64.567.7-173.500000117.3
237R78.7Confident74.2Confident236 Ų236146 Ų14689%0.89170%0.702SS**PPolyproline II helixtrans-85.3121.5156.8-79-161.8-88-130.81.8109.2R235 K239R235-R237 VanDerWaalsContact C-N 3.32Å; R235-R237 PolarHBondContact O-N 3.03Å; R237-K239 PolarHBondContact O-N 2.85Å
238K85.2Confident77Confident205 Ų205141 Ų14189%0.89168%0.68SS**PPolyproline II helixtrans-52.8124.5178.8-171.1155.8-175.9163.50110.6R240K238-R240 PolarHBondContact O-N 3.35Å
239K88.9Confident79.3Confident182 Ų182141.4 Ų141.479%0.79167%0.668SS**PPolyproline II helixtrans-51131-177.4-173.8175.1-179.1177.10110.1R237 V241R237-K239 PolarHBondContact O-N 2.85Å; K239-V241 PolarHBondContact O-N 3.48Å
240R92.4Very high81.6Confident239 Ų239137.1 Ų137.190%0.90265%0.649SS**PPolyproline II helixtrans-66.3120.7177.4-82.5-176.5161.1131.5-3109.7K238K238-R240 PolarHBondContact O-N 3.35Å
241V93.9Very high83.6Confident127 Ų127132.7 Ų132.777%0.7762%0.622SS**PPolyproline II helixtrans-88.5127.3170.7-176.40000108.1K239K239-V241 PolarHBondContact O-N 3.48Å
242P96.2Very high85.9Confident107 Ų107132 Ų13270%0.69561%0.608SS**PPolyproline II helixtrans-72.7150.4173.730.9-34000111
243Y97.9Very high87.8Confident71 Ų71132.5 Ų132.528%0.27861%0.605SS.*PPolyproline II helixtrans-71.6143.5172.5-59.2-56000110.9L248 L275 W283Y243-L248 HydrophobicContact CD2-CD2 4.3Å; Y243-L275 HydrophobicContact CD1-CD1 3.85Å; Y243-L275 HydrophobicContact CD1-CD2 3.77Å; Y243-L275 HydrophobicContact CD1-CG 4.49Å; Y243-L275 HydrophobicContact CE1-CD1 3.85Å; Y243-L275 HydrophobicContact CE1-CD2 3.67Å; Y243-L275 HydrophobicContact CE1-CG 4.43Å; Y243-W283 AromaticContact CD2-CD1 3.88Å; Y243-W283 AromaticContact CE2-CD1 3.74Å
244T98.3Very high90.1Very high76 Ų76124.3 Ų124.347%0.46657%0.574SS.*PPolyproline II helixtrans-73.3160.6178.976.70000111.5L246 Q247 L248T244-L246 PolarHBondContact O-N 2.88Å; T244-Q247 PolarHBondContact O-N 2.69Å; T244-Q247 VanDerWaalsContact O-N 3.16Å; T244-Q247 WeakPolarHBondContact OG1-CG 3.44Å; T244-Q247 PolarHBondContact OG1-N 3.26Å; T244-L248 WeakPolarHBondContact O-CG 3.46Å; T244-L248 PolarHBondContact O-N 3.39Å
245K97.8Very high91.9Very high196 Ų196114.2 Ų114.285%0.85254%0.536SS*.Hα-helixtrans-55.3-37176.4-66.3-174.3179.1-178.20112.5K249K245-K249 WeakPolarHBondContact O-CB 3.4Å; K245-K249 PolarHBondContact O-N 3.23Å
246L97.3Very high93.8Very high117 Ų117106.6 Ų106.661%0.61352%0.524SS*.Hα-helixtrans-69.3-43.8177.7-177.461.9000112.2T244 L248 K249 E250T244-L246 PolarHBondContact O-N 2.88Å; L246-L248 VanDerWaalsContact C-N 3.33Å; L246-L248 PolarHBondContact O-N 3.04Å; L246-K249 PolarHBondContact O-N 3.36Å; L246-E250 PolarHBondContact O-N 2.93Å
247Q98.1Very high95.3Very high31 Ų31106 Ų10615%0.14552%0.517CS..Hα-helixtrans-60.1-44.4175.5-70174.5-29.100111.2T244 L251 T273 L275T244-Q247 PolarHBondContact O-N 2.69Å; T244-Q247 VanDerWaalsContact O-N 3.16Å; T244-Q247 WeakPolarHBondContact OG1-CG 3.44Å; T244-Q247 PolarHBondContact OG1-N 3.26Å; Q247-L251 WeakPolarHBondContact O-CB 3.33Å; Q247-L251 WeakPolarHBondContact O-CD1 3.32Å; Q247-L251 VanDerWaalsContact O-CG 3.23Å; Q247-L251 WeakPolarHBondContact O-CG 3.44Å; Q247-L251 PolarHBondContact O-N 2.76Å; Q247-L251 VanDerWaalsContact O-N 3.14Å; Q247-T273 WeakPolarHBondContact CG-O 3.46Å; Q247-T273 PolarHBondContact NE2-O 3.48Å; Q247-L275 HydrophobicContact CB-CD1 4.31Å; Q247-L275 HydrophobicContact CG-CD1 4.42Å; Q247-L275 HydrophobicContact CG-CG 4.47Å
248L98.2Very high96.2Very high59 Ų5996.8 Ų96.831%0.30949%0.489SS..Hα-helixtrans-63.2-43176.6-67.8174.3000112Y243 T244 L246 E250 L251 E252Y243-L248 HydrophobicContact CD2-CD2 4.3Å; T244-L248 WeakPolarHBondContact O-CG 3.46Å; T244-L248 PolarHBondContact O-N 3.39Å; L246-L248 VanDerWaalsContact C-N 3.33Å; L246-L248 PolarHBondContact O-N 3.04Å; L248-E250 PolarHBondContact O-N 2.97Å; L248-L251 PolarHBondContact O-N 3.23Å; L248-E252 WeakPolarHBondContact O-CB 3.23Å; L248-E252 WeakPolarHBondContact O-CG 3.42Å; L248-E252 PolarHBondContact O-N 3.42Å
249K98.1Very high96.7Very high137 Ų13791.1 Ų91.160%0.59647%0.465SS*.Hα-helixtrans-55.8-50.4178.1-176.7-174.3175.9-173.30112.5K245 L246 E252 K253K245-K249 WeakPolarHBondContact O-CB 3.4Å; K245-K249 PolarHBondContact O-N 3.23Å; L246-K249 PolarHBondContact O-N 3.36Å; K249-E252 PolarHBondContact O-N 3.38Å; K249-K253 VanDerWaalsContact O-CB 3.24Å; K249-K253 WeakPolarHBondContact O-CB 3.35Å; K249-K253 PolarHBondContact O-N 2.95Å
250E97.8Very high97.2Very high57 Ų5789 Ų8927%0.26646%0.456SS..Hα-helixtrans-70.5-34.2-179.1-70.5-61.6119.800112.4L246 L248 K253 E254 T273L246-E250 PolarHBondContact O-N 2.93Å; L248-E250 PolarHBondContact O-N 2.97Å; E250-K253 WeakPolarHBondContact OE1-CD 3.42Å; E250-K253 IonicContact OE1-NZ 2.99Å; E250-K253 PolarHBondContact OE1-NZ 3.38Å; E250-K253 WeakPolarHBondContact OE2-CD 3.2Å; E250-K253 IonicContact OE2-NZ 2.68Å; E250-K253 PolarHBondContact OE2-NZ 2.8Å; E250-E254 PolarHBondContact O-N 3.5Å; E250-T273 HydrophobicContact CB-CG2 4.01Å
251L98.3Very high97.4Very high0 Ų078.6 Ų78.60%042%0.418CS..Hα-helixtrans-64.6-41.4172.7-74164.7000112.3Q247 L248 Y255 I269 L275 V280 W283 F284Q247-L251 WeakPolarHBondContact O-CB 3.33Å; Q247-L251 WeakPolarHBondContact O-CD1 3.32Å; Q247-L251 VanDerWaalsContact O-CG 3.23Å; Q247-L251 WeakPolarHBondContact O-CG 3.44Å; Q247-L251 PolarHBondContact O-N 2.76Å; Q247-L251 VanDerWaalsContact O-N 3.14Å; L248-L251 PolarHBondContact O-N 3.23Å; L251-Y255 VanDerWaalsContact O-CB 3.31Å; L251-Y255 WeakPolarHBondContact O-CB 3.49Å; L251-Y255 PolarHBondContact O-N 2.67Å; L251-I269 HydrophobicContact CD2-CG2 3.77Å; L251-I269 HydrophobicContact CG-CG2 4.41Å; L251-L275 HydrophobicContact CD1-CD1 3.94Å; L251-V280 HydrophobicContact CD2-CG1 4.07Å; L251-V280 HydrophobicContact CD2-CG2 4.47Å; L251-W283 HydrophobicContact CB-CD2 3.94Å; L251-W283 HydrophobicContact CB-CE3 3.96Å; L251-W283 HydrophobicContact CB-CH2 3.81Å; L251-W283 HydrophobicContact CB-CZ2 3.78Å; L251-W283 HydrophobicContact CB-CZ3 3.9Å; L251-W283 HydrophobicContact CD1-CB 4.5Å; L251-W283 HydrophobicContact CD1-CD2 3.96Å; L251-W283 HydrophobicContact CD1-CG 3.85Å; L251-W283 HydrophobicContact CD2-CD2 4.15Å; L251-W283 HydrophobicContact CD2-CE3 4.04Å; L251-W283 HydrophobicContact CD2-CG 4.38Å; L251-W283 HydrophobicContact CG-CD2 4.25Å; L251-W283 HydrophobicContact CG-CE3 4.44Å; L251-W283 WeakPolarHBondContact O-CZ3 3.2Å; L251-F284 HydrophobicContact CD2-CD2 4.46Å; L251-F284 HydrophobicContact CD2-CE2 4.06Å
252E98.1Very high97.6Very high80 Ų8076.7 Ų76.737%0.37441%0.406SS..Hα-helixtrans-75.5-35.8-179.7-70.5-169.4135.200112.9L248 K249 Y255 A256 W283 R287L248-E252 WeakPolarHBondContact O-CB 3.23Å; L248-E252 WeakPolarHBondContact O-CG 3.42Å; L248-E252 PolarHBondContact O-N 3.42Å; K249-E252 PolarHBondContact O-N 3.38Å; E252-Y255 PolarHBondContact O-N 3.17Å; E252-A256 PolarHBondContact O-N 3.18Å; E252-W283 HydrophobicContact CB-CH2 4.48Å; E252-W283 HydrophobicContact CG-CH2 3.61Å; E252-W283 HydrophobicContact CG-CZ2 3.56Å; E252-R287 IonicContact OE1-NE 3.91Å; E252-R287 PolarHBondContact OE1-NE 3.08Å
253K97.8Very high97.7Very high123 Ų12378.4 Ų78.454%0.53540%0.403SS..Hα-helixtrans-56-50.3170.2171.2-172.5171.4-166.80112.2K249 E250 A256 G257K249-K253 VanDerWaalsContact O-CB 3.24Å; K249-K253 WeakPolarHBondContact O-CB 3.35Å; K249-K253 PolarHBondContact O-N 2.95Å; E250-K253 WeakPolarHBondContact OE1-CD 3.42Å; E250-K253 IonicContact OE1-NZ 2.99Å; E250-K253 PolarHBondContact OE1-NZ 3.38Å; E250-K253 WeakPolarHBondContact OE2-CD 3.2Å; E250-K253 IonicContact OE2-NZ 2.68Å; E250-K253 PolarHBondContact OE2-NZ 2.8Å; K253-A256 PolarHBondContact O-N 3.37Å; K253-G257 PolarHBondContact O-N 3.34Å
254E97.8Very high97.7Very high36 Ų3679 Ų7917%0.16841%0.411CS..Hα-helixtrans-71.2-29.7176.6-82.3-76.9177.500112.5E250 G257 S258 K265 I269 F284E250-E254 PolarHBondContact O-N 3.5Å; E254-G257 PolarHBondContact O-N 3.03Å; E254-S258 PolarHBondContact O-N 3.17Å; E254-K265 IonicContact OE1-NZ 3.38Å; E254-K265 WeakPolarHBondContact OE2-CD 3.3Å; E254-K265 VanDerWaalsContact OE2-CE 3.31Å; E254-K265 WeakPolarHBondContact OE2-CE 3.38Å; E254-K265 IonicContact OE2-NZ 3.69Å; E254-K265 PolarHBondContact OE2-NZ 3.23Å; E254-I269 HydrophobicContact CB-CD1 3.68Å; E254-I269 HydrophobicContact CG-CD1 3.76Å; E254-I269 HydrophobicContact CG-CG1 4.09Å; E254-F284 HydrophobicContact CB-CZ 4.25Å
255Y98Very high97.6Very high3 Ų377.9 Ų77.91%0.01240%0.4CS..Hα-helixtrans-68.9-30.3173.1-168.3-96.1000114L251 E252 S258 K259 W283 F284 R287 R288 E291L251-Y255 VanDerWaalsContact O-CB 3.31Å; L251-Y255 WeakPolarHBondContact O-CB 3.49Å; L251-Y255 PolarHBondContact O-N 2.67Å; E252-Y255 PolarHBondContact O-N 3.17Å; Y255-S258 WeakPolarHBondContact CA-O 3.28Å; Y255-S258 CarbonylContact O-C 3.42Å; Y255-K259 HydrophobicContact CD1-CD 4.19Å; Y255-K259 HydrophobicContact CE1-CD 3.54Å; Y255-K259 HydrophobicContact CE2-CB 4.44Å; Y255-K259 HydrophobicContact CE2-CD 4.24Å; Y255-W283 HydrophobicContact CD2-CZ3 4.04Å; Y255-W283 HydrophobicContact CG-CH2 4.36Å; Y255-W283 HydrophobicContact CG-CZ3 4.17Å; Y255-F284 AromaticContact CD2-CD1 3.76Å; Y255-F284 HydrophobicContact CD2-CD1 3.76Å; Y255-F284 AromaticContact CD2-CE1 3.75Å; Y255-F284 HydrophobicContact CD2-CE1 3.75Å; Y255-F284 HydrophobicContact CE2-CD1 4.32Å; Y255-R287 HydrophobicContact CD1-CG 3.68Å; Y255-R287 HydrophobicContact CD2-CB 4.11Å; Y255-R287 HydrophobicContact CD2-CG 3.69Å; Y255-R287 HydrophobicContact CE1-CG 3.62Å; Y255-R287 HydrophobicContact CE2-CB 3.87Å; Y255-R287 HydrophobicContact CE2-CG 3.62Å; Y255-R287 HydrophobicContact CG-CG 3.73Å; Y255-R288 HydrophobicContact CE2-CG 3.89Å; Y255-R288 WeakPolarHBondContact OH-CA 3.41Å; Y255-R288 WeakPolarHBondContact OH-CG 3.31Å; Y255-E291 WeakPolarHBondContact CE1-OE1 3.44Å; Y255-E291 WeakPolarHBondContact CE1-OE2 3.43Å; Y255-E291 PolarHBondContact OH-OE2 3.25Å
256A97.3Very high97.7Very high80 Ų8071.9 Ų71.966%0.66137%0.372SS*.Hα-helixtrans-66.8-45.1172.200000110.7E252 K253E252-A256 PolarHBondContact O-N 3.18Å; K253-A256 PolarHBondContact O-N 3.37Å
257G96.3Very high97.7Very high63 Ų6372.6 Ų72.665%0.64937%0.366SS*.Hα-helixtrans-72.8-25.6176.800000115K253 E254K253-G257 PolarHBondContact O-N 3.34Å; E254-G257 PolarHBondContact O-N 3.03Å
258S96.6Very high97.7Very high43 Ų4378.8 Ų78.830%0.30139%0.388SS..  trans-158.7131.3169.7178.20000112.5E254 Y255 F260E254-S258 PolarHBondContact O-N 3.17Å; Y255-S258 WeakPolarHBondContact CA-O 3.28Å; Y255-S258 CarbonylContact O-C 3.42Å; S258-F260 WeakPolarHBondContact CB-O 3.35Å; S258-F260 PolarHBondContact O-N 3.37Å; S258-F260 PolarHBondContact OG-N 3.35Å; S258-F260 VanDerWaalsContact OG-N 3.17Å; S258-F260 PolarHBondContact OG-O 2.98Å
259K96.9Very high97.7Very high87 Ų8776.5 Ų76.538%0.37838%0.376SS..SBendtrans-67.5-13.8174.1-51.7-61.5-177.8175.40113.4Y255 R288 E291Y255-K259 HydrophobicContact CD1-CD 4.19Å; Y255-K259 HydrophobicContact CE1-CD 3.54Å; Y255-K259 HydrophobicContact CE2-CB 4.44Å; Y255-K259 HydrophobicContact CE2-CD 4.24Å; K259-R288 WeakPolarHBondContact O-CD 3.41Å; K259-E291 IonicContact NZ-OE1 2.8Å; K259-E291 PolarHBondContact NZ-OE1 3.2Å; K259-E291 IonicContact NZ-OE2 3.9Å; K259-E291 PolarHBondContact NZ-OE2 2.79Å
260F97.6Very high97.7Very high137 Ų13771.1 Ų71.160%0.60136%0.356SS*.SBendtrans-128.8140.7-178.1-67.2-101.9000111.6S258S258-F260 WeakPolarHBondContact CB-O 3.35Å; S258-F260 PolarHBondContact O-N 3.37Å; S258-F260 PolarHBondContact OG-N 3.35Å; S258-F260 VanDerWaalsContact OG-N 3.17Å; S258-F260 PolarHBondContact OG-O 2.98Å
261I97.4Very high97.7Very high20 Ų2072 Ų7210%0.10337%0.373CS..  trans-108.6113-171.2-16569.1000113.2K265 R266 I269 F284I261-K265 HydrophobicContact CD1-CB 3.43Å; I261-K265 VanDerWaalsContact CD1-CB 3.43Å; I261-K265 HydrophobicContact CD1-CD 4.35Å; I261-K265 HydrophobicContact CG1-CB 4.28Å; I261-R266 HydrophobicContact CG1-CB 3.89Å; I261-R266 PolarHBondContact O-NH2 2.9Å; I261-I269 HydrophobicContact CD1-CD1 3.54Å; I261-I269 HydrophobicContact CG1-CD1 4.33Å; I261-F284 HydrophobicContact CB-CD1 3.86Å; I261-F284 HydrophobicContact CB-CD2 4.16Å; I261-F284 HydrophobicContact CB-CE1 3.91Å; I261-F284 HydrophobicContact CB-CE2 4.22Å; I261-F284 HydrophobicContact CB-CG 4Å; I261-F284 HydrophobicContact CB-CZ 4.1Å; I261-F284 HydrophobicContact CD1-CE1 4.27Å; I261-F284 HydrophobicContact CD1-CE2 4.18Å; I261-F284 HydrophobicContact CD1-CZ 3.83Å; I261-F284 HydrophobicContact CG1-CE2 4.23Å; I261-F284 HydrophobicContact CG1-CZ 4.24Å; I261-F284 HydrophobicContact CG2-CB 4.12Å; I261-F284 HydrophobicContact CG2-CD1 4.16Å; I261-F284 HydrophobicContact CG2-CD2 4.09Å; I261-F284 HydrophobicContact CG2-CG 3.86Å
262T98.1Very high97.7Very high87 Ų8775 Ų7553%0.53440%0.404SS..  trans-67.5161.9174.461.30000111.7D264 K265 R266T262-D264 PolarHBondContact O-N 3.21Å; T262-K265 PolarHBondContact O-N 2.71Å; T262-R266 VanDerWaalsContact O-CB 3.24Å; T262-R266 WeakPolarHBondContact O-CB 3.31Å; T262-R266 PolarHBondContact O-N 3.26Å
263K97.9Very high97.6Very high144 Ų14471.7 Ų71.763%0.62639%0.389SS*.Hα-helixtrans-54.4-48.6-177.8-170.5-179.5179.7-175.30112R266 R267K263-R266 WeakPolarHBondContact O-CB 3.49Å; K263-R266 PolarHBondContact O-N 3.46Å; K263-R267 WeakPolarHBondContact O-CG 3.41Å; K263-R267 PolarHBondContact O-N 3.35Å
264D97.8Very high97.6Very high82 Ų8272.8 Ų72.844%0.43940%0.401SS..Hα-helixtrans-81.2-29.1-173.2-58.2-71.8000114T262 R267 R268T262-D264 PolarHBondContact O-N 3.21Å; D264-R267 IonicContact OD1-CZ 2.8Å; D264-R267 IonicContact OD1-NH1 3.5Å; D264-R267 PolarHBondContact OD1-NH1 3.3Å; D264-R268 WeakPolarHBondContact O-CG 3.44Å; D264-R268 PolarHBondContact O-N 2.76Å
265K97.4Very high97.6Very high54 Ų5471.5 Ų71.524%0.23540%0.395CS..Hα-helixtrans-65-41.8165.6-75.3-170.2158.2-153.90110.9E254 I261 T262 R267 R268 I269E254-K265 IonicContact OE1-NZ 3.38Å; E254-K265 WeakPolarHBondContact OE2-CD 3.3Å; E254-K265 VanDerWaalsContact OE2-CE 3.31Å; E254-K265 WeakPolarHBondContact OE2-CE 3.38Å; E254-K265 IonicContact OE2-NZ 3.69Å; E254-K265 PolarHBondContact OE2-NZ 3.23Å; I261-K265 HydrophobicContact CD1-CB 3.43Å; I261-K265 VanDerWaalsContact CD1-CB 3.43Å; I261-K265 HydrophobicContact CD1-CD 4.35Å; I261-K265 HydrophobicContact CG1-CB 4.28Å; T262-K265 PolarHBondContact O-N 2.71Å; K265-R267 PolarHBondContact O-N 2.92Å; K265-R268 PolarHBondContact O-N 2.98Å; K265-I269 WeakPolarHBondContact O-CG1 3.37Å; K265-I269 PolarHBondContact O-N 3.49Å
266R98.4Very high97.6Very high69 Ų6974 Ų7426%0.2641%0.413SS..Hα-helixtrans-59.4-45.5176.5-170.7-170.2-56170.85.3112.2I261 T262 K263 I269 S270 E277 V280 T281I261-R266 HydrophobicContact CG1-CB 3.89Å; I261-R266 PolarHBondContact O-NH2 2.9Å; T262-R266 VanDerWaalsContact O-CB 3.24Å; T262-R266 WeakPolarHBondContact O-CB 3.31Å; T262-R266 PolarHBondContact O-N 3.26Å; K263-R266 WeakPolarHBondContact O-CB 3.49Å; K263-R266 PolarHBondContact O-N 3.46Å; R266-I269 PolarHBondContact O-N 3.32Å; R266-S270 WeakPolarHBondContact O-CB 3.43Å; R266-S270 PolarHBondContact O-N 3.08Å; R266-E277 VanDerWaalsContact CD-OE2 3.3Å; R266-E277 WeakPolarHBondContact CD-OE2 3.36Å; R266-E277 HydrophobicContact CG-CB 4.04Å; R266-E277 HydrophobicContact CG-CG 4.08Å; R266-V280 HydrophobicContact CG-CB 4.22Å; R266-V280 HydrophobicContact CG-CG1 4.07Å; R266-T281 WeakPolarHBondContact CD-OG1 3.24Å; R266-T281 PolarHBondContact NE-OG1 3.32Å
267R98.4Very high97.6Very high133 Ų13373.6 Ų73.650%0.50240%0.397SS..Hα-helixtrans-58.8-47.4173.2-74.1172.462.4-123.3-6.1112.2K263 D264 K265 S270 A271 E277K263-R267 WeakPolarHBondContact O-CG 3.41Å; K263-R267 PolarHBondContact O-N 3.35Å; D264-R267 IonicContact OD1-CZ 2.8Å; D264-R267 IonicContact OD1-NH1 3.5Å; D264-R267 PolarHBondContact OD1-NH1 3.3Å; K265-R267 PolarHBondContact O-N 2.92Å; R267-S270 WeakPolarHBondContact O-CB 3.34Å; R267-S270 PolarHBondContact O-N 2.58Å; R267-A271 PolarHBondContact O-N 2.94Å; R267-E277 VanDerWaalsContact CG-OE1 3.3Å; R267-E277 WeakPolarHBondContact CG-OE1 3.3Å
268R98.2Very high97.7Very high160 Ų16079.8 Ų79.860%0.60440%0.401SS*.Hα-helixtrans-61.8-46177.7-75.5-170.6-73.3143.8-14.7112.9D264 K265 S270 A271 G272D264-R268 WeakPolarHBondContact O-CG 3.44Å; D264-R268 PolarHBondContact O-N 2.76Å; K265-R268 PolarHBondContact O-N 2.98Å; R268-S270 VanDerWaalsContact C-N 3.34Å; R268-A271 PolarHBondContact O-N 3.04Å; R268-G272 PolarHBondContact O-N 3.29Å
269I97.7Very high97.8Very high11 Ų1181.2 Ų81.26%0.05640%0.403CS..Hα-helixtrans-62.8-43.1174.9-63.7170.6000110.4L251 E254 I261 K265 R266 A271 G272 T273 V280 F284L251-I269 HydrophobicContact CD2-CG2 3.77Å; L251-I269 HydrophobicContact CG-CG2 4.41Å; E254-I269 HydrophobicContact CB-CD1 3.68Å; E254-I269 HydrophobicContact CG-CD1 3.76Å; E254-I269 HydrophobicContact CG-CG1 4.09Å; I261-I269 HydrophobicContact CD1-CD1 3.54Å; I261-I269 HydrophobicContact CG1-CD1 4.33Å; K265-I269 WeakPolarHBondContact O-CG1 3.37Å; K265-I269 PolarHBondContact O-N 3.49Å; R266-I269 PolarHBondContact O-N 3.32Å; I269-A271 PolarHBondContact O-N 3.31Å; I269-G272 PolarHBondContact O-N 3.37Å; I269-T273 HydrophobicContact CG2-CG2 3.96Å; I269-T273 WeakPolarHBondContact O-CB 3.47Å; I269-T273 WeakPolarHBondContact O-CG2 3.38Å; I269-T273 PolarHBondContact O-N 3.36Å; I269-T273 PolarHBondContact O-OG1 3.08Å; I269-V280 HydrophobicContact CB-CG1 4.34Å; I269-V280 HydrophobicContact CD1-CG1 4.4Å; I269-V280 HydrophobicContact CG2-CG1 4.03Å; I269-V280 HydrophobicContact CG2-CG2 3.92Å; I269-F284 HydrophobicContact CD1-CE2 4.14Å; I269-F284 HydrophobicContact CD1-CZ 4.34Å
270S98.4Very high97.9Very high25 Ų2577.1 Ų77.118%0.17539%0.385CS..Hα-helixtrans-56-49-180-179.10000111.5R266 R267 R268 N274 L275 E277R266-S270 WeakPolarHBondContact O-CB 3.43Å; R266-S270 PolarHBondContact O-N 3.08Å; R267-S270 WeakPolarHBondContact O-CB 3.34Å; R267-S270 PolarHBondContact O-N 2.58Å; R268-S270 VanDerWaalsContact C-N 3.34Å; S270-N274 PolarHBondContact O-N 3.45Å; S270-N274 VanDerWaalsContact O-N 3.12Å; S270-L275 CarbonylContact C-O 3.59Å; S270-L275 WeakPolarHBondContact CA-O 3.32Å; S270-L275 VanDerWaalsContact CB-O 3.28Å; S270-L275 WeakPolarHBondContact CB-O 3.43Å; S270-L275 PolarHBondContact O-N 3.11Å; S270-L275 PolarHBondContact OG-O 3.49Å; S270-E277 PolarHBondContact OG-N 3.1Å
271A97.9Very high97.9Very high75 Ų7572.1 Ų72.162%0.6237%0.366SS*.Hα-helixtrans-63.5-50.1174.600000112.5R267 R268 I269 T273R267-A271 PolarHBondContact O-N 2.94Å; R268-A271 PolarHBondContact O-N 3.04Å; I269-A271 PolarHBondContact O-N 3.31Å; A271-T273 VanDerWaalsContact C-N 3.27Å; A271-T273 PolarHBondContact O-N 3.12Å
272G97.1Very high97.9Very high64 Ų6474.1 Ų74.166%0.6638%0.376SS*.Hα-helixtrans-68.9-18.3-176.700000115.4R268 I269R268-G272 PolarHBondContact O-N 3.29Å; I269-G272 PolarHBondContact O-N 3.37Å
273T97Very high98Very high9 Ų971 Ų716%0.05536%0.355CS..Hα-helixtrans-112-5.7-17861.10000114.2Q247 E250 I269 A271 L275Q247-T273 WeakPolarHBondContact CG-O 3.46Å; Q247-T273 PolarHBondContact NE2-O 3.48Å; E250-T273 HydrophobicContact CB-CG2 4.01Å; I269-T273 HydrophobicContact CG2-CG2 3.96Å; I269-T273 WeakPolarHBondContact O-CB 3.47Å; I269-T273 WeakPolarHBondContact O-CG2 3.38Å; I269-T273 PolarHBondContact O-N 3.36Å; I269-T273 PolarHBondContact O-OG1 3.08Å; A271-T273 VanDerWaalsContact C-N 3.27Å; A271-T273 PolarHBondContact O-N 3.12Å; T273-L275 PolarHBondContact O-N 2.96Å
274N97.8Very high98Very high146 Ų14664.4 Ų64.478%0.78133%0.326SS*.THydrogen-bonded Turntrans52.438.4-170-66.4-66.5000113S270S270-N274 PolarHBondContact O-N 3.45Å; S270-N274 VanDerWaalsContact O-N 3.12Å
275L97.4Very high98Very high10 Ų1065 Ų655%0.05233%0.326CS..  trans-113.2141.8174-64.8-178.7000109.4Y243 Q247 L251 S270 T273 Q279 V280Y243-L275 HydrophobicContact CD1-CD1 3.85Å; Y243-L275 HydrophobicContact CD1-CD2 3.77Å; Y243-L275 HydrophobicContact CD1-CG 4.49Å; Y243-L275 HydrophobicContact CE1-CD1 3.85Å; Y243-L275 HydrophobicContact CE1-CD2 3.67Å; Y243-L275 HydrophobicContact CE1-CG 4.43Å; Q247-L275 HydrophobicContact CB-CD1 4.31Å; Q247-L275 HydrophobicContact CG-CD1 4.42Å; Q247-L275 HydrophobicContact CG-CG 4.47Å; L251-L275 HydrophobicContact CD1-CD1 3.94Å; S270-L275 CarbonylContact C-O 3.59Å; S270-L275 WeakPolarHBondContact CA-O 3.32Å; S270-L275 VanDerWaalsContact CB-O 3.28Å; S270-L275 WeakPolarHBondContact CB-O 3.43Å; S270-L275 PolarHBondContact O-N 3.11Å; S270-L275 PolarHBondContact OG-O 3.49Å; T273-L275 PolarHBondContact O-N 2.96Å; L275-Q279 HydrophobicContact CB-CB 4.31Å; L275-V280 HydrophobicContact CB-CG2 4.21Å
276S98.3Very high98Very high54 Ų5467.1 Ų67.138%0.37834%0.34SS..  trans-62.3148.6173.263.30000111.7R278 Q279 V280S276-R278 PolarHBondContact O-N 2.92Å; S276-Q279 WeakPolarHBondContact O-CA 3.18Å; S276-Q279 WeakPolarHBondContact O-CB 3.36Å; S276-Q279 PolarHBondContact O-N 3.39Å; S276-Q279 WeakPolarHBondContact OG-CG 3.35Å; S276-Q279 PolarHBondContact OG-N 3.33Å; S276-Q279 PolarHBondContact OG-OE1 2.85Å; S276-V280 PolarHBondContact O-N 3.38Å
277E98.3Very high98Very high72 Ų7266.5 Ų66.534%0.33634%0.338SS..Hα-helixtrans-51.1-32.1173.1-73.5-164.2-129.900112.9R266 R267 S270 T281R266-E277 VanDerWaalsContact CD-OE2 3.3Å; R266-E277 WeakPolarHBondContact CD-OE2 3.36Å; R266-E277 HydrophobicContact CG-CB 4.04Å; R266-E277 HydrophobicContact CG-CG 4.08Å; R267-E277 VanDerWaalsContact CG-OE1 3.3Å; R267-E277 WeakPolarHBondContact CG-OE1 3.3Å; S270-E277 PolarHBondContact OG-N 3.1Å; E277-T281 WeakPolarHBondContact O-CB 3.43Å; E277-T281 PolarHBondContact O-N 3.11Å; E277-T281 PolarHBondContact O-OG1 3.35Å
278R97.9Very high98Very high193 Ų19364.4 Ų64.473%0.72833%0.33SS*.Hα-helixtrans-66.8-43.6174.3-170.6-178.9-179.4-160.12.3112.1S276 T281 I282S276-R278 PolarHBondContact O-N 2.92Å; R278-T281 PolarHBondContact O-N 3.2Å; R278-I282 HydrophobicContact CG-CD1 3.93Å; R278-I282 WeakPolarHBondContact O-CB 3.44Å; R278-I282 VanDerWaalsContact O-CG1 3.27Å; R278-I282 WeakPolarHBondContact O-CG1 3.37Å; R278-I282 PolarHBondContact O-N 3.24Å
279Q98.1Very high98Very high74 Ų7460.3 Ų60.335%0.34632%0.323SS..Hα-helixtrans-63.6-42.9174.5-76.6161.6-70.500111.7L275 S276 T281 I282 W283L275-Q279 HydrophobicContact CB-CB 4.31Å; S276-Q279 WeakPolarHBondContact O-CA 3.18Å; S276-Q279 WeakPolarHBondContact O-CB 3.36Å; S276-Q279 PolarHBondContact O-N 3.39Å; S276-Q279 WeakPolarHBondContact OG-CG 3.35Å; S276-Q279 PolarHBondContact OG-N 3.33Å; S276-Q279 PolarHBondContact OG-OE1 2.85Å; Q279-T281 VanDerWaalsContact C-N 3.35Å; Q279-T281 PolarHBondContact O-N 3.48Å; Q279-I282 PolarHBondContact O-N 3.23Å; Q279-W283 WeakPolarHBondContact O-CB 3.27Å; Q279-W283 PolarHBondContact O-N 3.34Å
280V98.3Very high97.9Very high0 Ų064.2 Ų64.20%034%0.339CS..Hα-helixtrans-58.3-47.7173.7179.60000110.2L251 R266 I269 L275 S276 I282 W283 F284L251-V280 HydrophobicContact CD2-CG1 4.07Å; L251-V280 HydrophobicContact CD2-CG2 4.47Å; R266-V280 HydrophobicContact CG-CB 4.22Å; R266-V280 HydrophobicContact CG-CG1 4.07Å; I269-V280 HydrophobicContact CB-CG1 4.34Å; I269-V280 HydrophobicContact CD1-CG1 4.4Å; I269-V280 HydrophobicContact CG2-CG1 4.03Å; I269-V280 HydrophobicContact CG2-CG2 3.92Å; L275-V280 HydrophobicContact CB-CG2 4.21Å; S276-V280 PolarHBondContact O-N 3.38Å; V280-I282 PolarHBondContact O-N 3.3Å; V280-W283 PolarHBondContact O-N 2.95Å; V280-F284 HydrophobicContact CG1-CD2 4.04Å; V280-F284 HydrophobicContact CG1-CE2 4.12Å; V280-F284 WeakPolarHBondContact O-CD2 3.49Å; V280-F284 PolarHBondContact O-N 3.14Å
281T98.3Very high97.8Very high32 Ų3265.5 Ų65.520%0.19634%0.343CS..Hα-helixtrans-60.5-45.9178.3-55.60000112.3R266 E277 R278 Q279 W283 F284 Q285R266-T281 WeakPolarHBondContact CD-OG1 3.24Å; R266-T281 PolarHBondContact NE-OG1 3.32Å; E277-T281 WeakPolarHBondContact O-CB 3.43Å; E277-T281 PolarHBondContact O-N 3.11Å; E277-T281 PolarHBondContact O-OG1 3.35Å; R278-T281 PolarHBondContact O-N 3.2Å; Q279-T281 VanDerWaalsContact C-N 3.35Å; Q279-T281 PolarHBondContact O-N 3.48Å; T281-W283 VanDerWaalsContact C-N 3.34Å; T281-W283 PolarHBondContact O-N 3Å; T281-F284 PolarHBondContact O-N 2.97Å; T281-Q285 WeakPolarHBondContact O-CG 3.39Å; T281-Q285 PolarHBondContact O-N 3.44Å
282I98.3Very high97.7Very high63 Ų6369.6 Ų69.632%0.32335%0.346SS..Hα-helixtrans-64.3-38.5177-71.2167.2000111R278 Q279 V280 Q285 N286R278-I282 HydrophobicContact CG-CD1 3.93Å; R278-I282 WeakPolarHBondContact O-CB 3.44Å; R278-I282 VanDerWaalsContact O-CG1 3.27Å; R278-I282 WeakPolarHBondContact O-CG1 3.37Å; R278-I282 PolarHBondContact O-N 3.24Å; Q279-I282 PolarHBondContact O-N 3.23Å; V280-I282 PolarHBondContact O-N 3.3Å; I282-Q285 PolarHBondContact O-N 3.32Å; I282-N286 WeakPolarHBondContact O-CB 3.38Å; I282-N286 VanDerWaalsContact O-CG 3.27Å; I282-N286 PolarHBondContact O-N 3.43Å; I282-N286 PolarHBondContact O-ND2 3.33Å
283W98.4Very high97.5Very high22 Ų2273.4 Ų73.48%0.08335%0.345CS..Hα-helixtrans-63.5-45.5175.8-172.6103.2000111.2Y243 L251 E252 Y255 Q279 V280 T281 Q285 N286 R287Y243-W283 AromaticContact CD2-CD1 3.88Å; Y243-W283 AromaticContact CE2-CD1 3.74Å; L251-W283 HydrophobicContact CB-CD2 3.94Å; L251-W283 HydrophobicContact CB-CE3 3.96Å; L251-W283 HydrophobicContact CB-CH2 3.81Å; L251-W283 HydrophobicContact CB-CZ2 3.78Å; L251-W283 HydrophobicContact CB-CZ3 3.9Å; L251-W283 HydrophobicContact CD1-CB 4.5Å; L251-W283 HydrophobicContact CD1-CD2 3.96Å; L251-W283 HydrophobicContact CD1-CG 3.85Å; L251-W283 HydrophobicContact CD2-CD2 4.15Å; L251-W283 HydrophobicContact CD2-CE3 4.04Å; L251-W283 HydrophobicContact CD2-CG 4.38Å; L251-W283 HydrophobicContact CG-CD2 4.25Å; L251-W283 HydrophobicContact CG-CE3 4.44Å; L251-W283 WeakPolarHBondContact O-CZ3 3.2Å; E252-W283 HydrophobicContact CB-CH2 4.48Å; E252-W283 HydrophobicContact CG-CH2 3.61Å; E252-W283 HydrophobicContact CG-CZ2 3.56Å; Y255-W283 HydrophobicContact CD2-CZ3 4.04Å; Y255-W283 HydrophobicContact CG-CH2 4.36Å; Y255-W283 HydrophobicContact CG-CZ3 4.17Å; Q279-W283 WeakPolarHBondContact O-CB 3.27Å; Q279-W283 PolarHBondContact O-N 3.34Å; V280-W283 PolarHBondContact O-N 2.95Å; T281-W283 VanDerWaalsContact C-N 3.34Å; T281-W283 PolarHBondContact O-N 3Å; W283-Q285 VanDerWaalsContact C-N 3.31Å; W283-Q285 PolarHBondContact O-N 3.12Å; W283-N286 PolarHBondContact O-N 3.45Å; W283-R287 HydrophobicContact CD2-CB 4.43Å; W283-R287 HydrophobicContact CE3-CB 4Å; W283-R287 HydrophobicContact CH2-CB 3.92Å; W283-R287 HydrophobicContact CH2-CG 3.57Å; W283-R287 HydrophobicContact CZ2-CB 4.36Å; W283-R287 HydrophobicContact CZ2-CG 4.17Å; W283-R287 HydrophobicContact CZ3-CB 3.73Å; W283-R287 HydrophobicContact CZ3-CG 3.79Å; W283-R287 WeakPolarHBondContact O-CB 3.27Å; W283-R287 PolarHBondContact O-N 3.32Å
284F98.6Very high97.2Very high4 Ų476.9 Ų76.92%0.01836%0.359CS..Hα-helixtrans-65.3-28.9176.2-90.7-100.6000113.5L251 E254 Y255 I261 I269 V280 T281 R288L251-F284 HydrophobicContact CD2-CD2 4.46Å; L251-F284 HydrophobicContact CD2-CE2 4.06Å; E254-F284 HydrophobicContact CB-CZ 4.25Å; Y255-F284 AromaticContact CD2-CD1 3.76Å; Y255-F284 HydrophobicContact CD2-CD1 3.76Å; Y255-F284 AromaticContact CD2-CE1 3.75Å; Y255-F284 HydrophobicContact CD2-CE1 3.75Å; Y255-F284 HydrophobicContact CE2-CD1 4.32Å; I261-F284 HydrophobicContact CB-CD1 3.86Å; I261-F284 HydrophobicContact CB-CD2 4.16Å; I261-F284 HydrophobicContact CB-CE1 3.91Å; I261-F284 HydrophobicContact CB-CE2 4.22Å; I261-F284 HydrophobicContact CB-CG 4Å; I261-F284 HydrophobicContact CB-CZ 4.1Å; I261-F284 HydrophobicContact CD1-CE1 4.27Å; I261-F284 HydrophobicContact CD1-CE2 4.18Å; I261-F284 HydrophobicContact CD1-CZ 3.83Å; I261-F284 HydrophobicContact CG1-CE2 4.23Å; I261-F284 HydrophobicContact CG1-CZ 4.24Å; I261-F284 HydrophobicContact CG2-CB 4.12Å; I261-F284 HydrophobicContact CG2-CD1 4.16Å; I261-F284 HydrophobicContact CG2-CD2 4.09Å; I261-F284 HydrophobicContact CG2-CG 3.86Å; I269-F284 HydrophobicContact CD1-CE2 4.14Å; I269-F284 HydrophobicContact CD1-CZ 4.34Å; V280-F284 HydrophobicContact CG1-CD2 4.04Å; V280-F284 HydrophobicContact CG1-CE2 4.12Å; V280-F284 WeakPolarHBondContact O-CD2 3.49Å; V280-F284 PolarHBondContact O-N 3.14Å; T281-F284 PolarHBondContact O-N 2.97Å; F284-R288 PolarHBondContact O-N 3.31Å; F284-R288 PolarHBondContact O-NE 3.02Å
285Q98.4Very high96.6Very high94 Ų9474.5 Ų74.544%0.43935%0.35SS..Hα-helixtrans-68.4-51.9169.2-70.4169-2.200110.9T281 I282 W283 R287 R288 V289T281-Q285 WeakPolarHBondContact O-CG 3.39Å; T281-Q285 PolarHBondContact O-N 3.44Å; I282-Q285 PolarHBondContact O-N 3.32Å; W283-Q285 VanDerWaalsContact C-N 3.31Å; W283-Q285 PolarHBondContact O-N 3.12Å; Q285-R287 VanDerWaalsContact C-N 3.32Å; Q285-R287 PolarHBondContact O-N 3.31Å; Q285-R288 PolarHBondContact O-N 3.25Å; Q285-V289 WeakPolarHBondContact O-CG2 3.48Å; Q285-V289 PolarHBondContact O-N 2.79Å; Q285-V289 VanDerWaalsContact O-N 3.12Å
286N98.1Very high95.8Very high100 Ų10077.4 Ų77.454%0.53537%0.371SS..Hα-helixtrans-61-38179.3-71.4-26.8000112.6I282 W283 V289 K290I282-N286 WeakPolarHBondContact O-CB 3.38Å; I282-N286 VanDerWaalsContact O-CG 3.27Å; I282-N286 PolarHBondContact O-N 3.43Å; I282-N286 PolarHBondContact O-ND2 3.33Å; W283-N286 PolarHBondContact O-N 3.45Å; N286-V289 PolarHBondContact O-N 2.98Å; N286-K290 WeakPolarHBondContact O-CB 3.36Å; N286-K290 PolarHBondContact O-N 2.99Å
287R98.1Very high94.7Very high56 Ų5682.6 Ų82.621%0.21139%0.387CS..Hα-helixtrans-67.1-38.2-178.9-17263-18068.7-2112.4E252 Y255 W283 Q285 K290 E291E252-R287 IonicContact OE1-NE 3.91Å; E252-R287 PolarHBondContact OE1-NE 3.08Å; Y255-R287 HydrophobicContact CD1-CG 3.68Å; Y255-R287 HydrophobicContact CD2-CB 4.11Å; Y255-R287 HydrophobicContact CD2-CG 3.69Å; Y255-R287 HydrophobicContact CE1-CG 3.62Å; Y255-R287 HydrophobicContact CE2-CB 3.87Å; Y255-R287 HydrophobicContact CE2-CG 3.62Å; Y255-R287 HydrophobicContact CG-CG 3.73Å; W283-R287 HydrophobicContact CD2-CB 4.43Å; W283-R287 HydrophobicContact CE3-CB 4Å; W283-R287 HydrophobicContact CH2-CB 3.92Å; W283-R287 HydrophobicContact CH2-CG 3.57Å; W283-R287 HydrophobicContact CZ2-CB 4.36Å; W283-R287 HydrophobicContact CZ2-CG 4.17Å; W283-R287 HydrophobicContact CZ3-CB 3.73Å; W283-R287 HydrophobicContact CZ3-CG 3.79Å; W283-R287 WeakPolarHBondContact O-CB 3.27Å; W283-R287 PolarHBondContact O-N 3.32Å; Q285-R287 VanDerWaalsContact C-N 3.32Å; Q285-R287 PolarHBondContact O-N 3.31Å; R287-K290 PolarHBondContact O-N 2.94Å; R287-E291 IonicContact NH1-OE1 2.95Å; R287-E291 PolarHBondContact NH1-OE1 3.37Å; R287-E291 WeakPolarHBondContact O-CB 3.48Å; R287-E291 PolarHBondContact O-N 3.45Å
288R97.7Very high93.4Very high88 Ų8882.2 Ų82.233%0.33239%0.392SS..Hα-helixtrans-66.2-41.5170.9-74.7-178.7-67.31450.6112.4Y255 K259 F284 Q285 K290 E291 K292Y255-R288 HydrophobicContact CE2-CG 3.89Å; Y255-R288 WeakPolarHBondContact OH-CA 3.41Å; Y255-R288 WeakPolarHBondContact OH-CG 3.31Å; K259-R288 WeakPolarHBondContact O-CD 3.41Å; F284-R288 PolarHBondContact O-N 3.31Å; F284-R288 PolarHBondContact O-NE 3.02Å; Q285-R288 PolarHBondContact O-N 3.25Å; R288-K290 VanDerWaalsContact C-N 3.35Å; R288-E291 PolarHBondContact O-N 3.1Å; R288-K292 PolarHBondContact O-N 3.19Å
289V97.8Very high91.7Very high74 Ų7481.3 Ų81.345%0.44839%0.393SS..Hα-helixtrans-64.1-40.3175.3173.90000111.3Q285 N286 K293Q285-V289 WeakPolarHBondContact O-CG2 3.48Å; Q285-V289 PolarHBondContact O-N 2.79Å; Q285-V289 VanDerWaalsContact O-N 3.12Å; N286-V289 PolarHBondContact O-N 2.98Å; V289-K293 HydrophobicContact CG1-CD 4.43Å; V289-K293 WeakPolarHBondContact O-CG 3.42Å; V289-K293 PolarHBondContact O-N 2.9Å; V289-K293 VanDerWaalsContact O-N 3.12Å
290K96.2Very high89.8Confident93 Ų9382.5 Ų82.540%0.40441%0.406SS..Hα-helixtrans-62.8-45.6175-160.6-166.3-175.6-164.80111.2N286 R287 R288 K293 F294N286-K290 WeakPolarHBondContact O-CB 3.36Å; N286-K290 PolarHBondContact O-N 2.99Å; R287-K290 PolarHBondContact O-N 2.94Å; R288-K290 VanDerWaalsContact C-N 3.35Å; K290-K293 PolarHBondContact O-N 2.98Å; K290-F294 HydrophobicContact CD-CE2 3.84Å; K290-F294 HydrophobicContact CD-CZ 4.42Å; K290-F294 HydrophobicContact CG-CD2 4.22Å; K290-F294 HydrophobicContact CG-CE2 3.65Å; K290-F294 HydrophobicContact CG-CZ 4.26Å; K290-F294 VanDerWaalsContact O-CD2 3.27Å; K290-F294 WeakPolarHBondContact O-CD2 3.41Å; K290-F294 PolarHBondContact O-N 2.99Å; K290-F294 VanDerWaalsContact O-N 3.1Å
291E95.8Very high87.9Confident53 Ų5386 Ų8625%0.24843%0.43CS..Hα-helixtrans-60.8-49.2177.4-169161.6-106.800112Y255 K259 R287 R288 K293 F294 V295Y255-E291 WeakPolarHBondContact CE1-OE1 3.44Å; Y255-E291 WeakPolarHBondContact CE1-OE2 3.43Å; Y255-E291 PolarHBondContact OH-OE2 3.25Å; K259-E291 IonicContact NZ-OE1 2.8Å; K259-E291 PolarHBondContact NZ-OE1 3.2Å; K259-E291 IonicContact NZ-OE2 3.9Å; K259-E291 PolarHBondContact NZ-OE2 2.79Å; R287-E291 IonicContact NH1-OE1 2.95Å; R287-E291 PolarHBondContact NH1-OE1 3.37Å; R287-E291 WeakPolarHBondContact O-CB 3.48Å; R287-E291 PolarHBondContact O-N 3.45Å; R288-E291 PolarHBondContact O-N 3.1Å; E291-K293 VanDerWaalsContact C-N 3.29Å; E291-K293 PolarHBondContact O-N 3.35Å; E291-F294 PolarHBondContact O-N 3.3Å; E291-F294 VanDerWaalsContact O-N 3.11Å; E291-V295 WeakPolarHBondContact O-CG2 3.38Å; E291-V295 PolarHBondContact O-N 3.02Å
292K95.3Very high85.9Confident161 Ų16190.1 Ų90.170%0.745%0.451SS*.Hα-helixtrans-57.2-41.7176-169173.775.9164.10112.2R288 F294 V295 S296R288-K292 PolarHBondContact O-N 3.19Å; K292-F294 VanDerWaalsContact C-N 3.35Å; K292-F294 PolarHBondContact O-N 3.19Å; K292-V295 PolarHBondContact O-N 3.09Å; K292-S296 PolarHBondContact O-N 3.25Å; K292-S296 PolarHBondContact O-OG 3.1Å
293K93.8Very high83.7Confident144 Ų14493.9 Ų93.963%0.62647%0.467SS*.Hα-helixtrans-65.3-33.2177.9-76.4-177.5176.3-167.40113.4V289 K290 E291 S296 K297V289-K293 HydrophobicContact CG1-CD 4.43Å; V289-K293 WeakPolarHBondContact O-CG 3.42Å; V289-K293 PolarHBondContact O-N 2.9Å; V289-K293 VanDerWaalsContact O-N 3.12Å; K290-K293 PolarHBondContact O-N 2.98Å; E291-K293 VanDerWaalsContact C-N 3.29Å; E291-K293 PolarHBondContact O-N 3.35Å; K293-S296 WeakPolarHBondContact CA-OG 3.36Å; K293-S296 PolarHBondContact O-OG 3.05Å; K293-K297 PolarHBondContact O-N 3.36Å
294F90.5Very high81.6Confident82 Ų8299.4 Ų99.436%0.3650%0.495SS..Hα-helixtrans-71.7-47.9173.9-71.5-50.9000111.6W11 K290 E291 K292 S296 K297 S298W11-F294 AromaticContact CH2-CE1 3.78Å; W11-F294 HydrophobicContact CH2-CE1 3.78Å; W11-F294 HydrophobicContact CH2-CZ 4.36Å; W11-F294 AromaticContact CZ3-CE1 3.84Å; W11-F294 HydrophobicContact CZ3-CE1 3.84Å; W11-F294 HydrophobicContact CZ3-CZ 4.01Å; K290-F294 HydrophobicContact CD-CE2 3.84Å; K290-F294 HydrophobicContact CD-CZ 4.42Å; K290-F294 HydrophobicContact CG-CD2 4.22Å; K290-F294 HydrophobicContact CG-CE2 3.65Å; K290-F294 HydrophobicContact CG-CZ 4.26Å; K290-F294 VanDerWaalsContact O-CD2 3.27Å; K290-F294 WeakPolarHBondContact O-CD2 3.41Å; K290-F294 PolarHBondContact O-N 2.99Å; K290-F294 VanDerWaalsContact O-N 3.1Å; E291-F294 PolarHBondContact O-N 3.3Å; E291-F294 VanDerWaalsContact O-N 3.11Å; K292-F294 VanDerWaalsContact C-N 3.35Å; K292-F294 PolarHBondContact O-N 3.19Å; F294-S296 VanDerWaalsContact C-N 3.29Å; F294-S296 PolarHBondContact O-N 2.84Å; F294-K297 PolarHBondContact O-N 3.21Å; F294-S298 PolarHBondContact O-N 3.45Å; F294-S298 PolarHBondContact O-OG 3.19Å
295V85.8Confident79.2Confident96 Ų96106.8 Ų106.858%0.58253%0.53SS*.Hα-helixtrans-59.7-38.2178.8175.40000112E291 K292 S298 K299E291-V295 WeakPolarHBondContact O-CG2 3.38Å; E291-V295 PolarHBondContact O-N 3.02Å; K292-V295 PolarHBondContact O-N 3.09Å; V295-S298 PolarHBondContact O-OG 3.39Å; V295-K299 PolarHBondContact O-N 3.4Å
296S80Confident76.7Confident70 Ų70108 Ų10849%0.4954%0.544SS..Hα-helixtrans-66.1-36.8173.454.60000112.9K292 K293 F294 T300K292-S296 PolarHBondContact O-N 3.25Å; K292-S296 PolarHBondContact O-OG 3.1Å; K293-S296 WeakPolarHBondContact CA-OG 3.36Å; K293-S296 PolarHBondContact O-OG 3.05Å; F294-S296 VanDerWaalsContact C-N 3.29Å; F294-S296 PolarHBondContact O-N 2.84Å; S296-T300 PolarHBondContact O-OG1 3.19Å
297K76.3Confident73.9Confident164 Ų164113.4 Ų113.471%0.71358%0.58SS**Hα-helixtrans-78.9-35.7-176.1-171.7166.7-178.5173.60112.9K293 F294 T300 S301K293-K297 PolarHBondContact O-N 3.36Å; F294-K297 PolarHBondContact O-N 3.21Å; K297-T300 PolarHBondContact O-N 3.34Å; K297-S301 PolarHBondContact O-N 3.29Å
298S70.1Confident72.7Confident64 Ų64116.3 Ų116.345%0.44860%0.599SS.*Hα-helixtrans-66-39.3173.8550000111.9F294 V295 T300 S301 N302F294-S298 PolarHBondContact O-N 3.45Å; F294-S298 PolarHBondContact O-OG 3.19Å; V295-S298 PolarHBondContact O-OG 3.39Å; S298-T300 VanDerWaalsContact C-N 3.29Å; S298-T300 PolarHBondContact O-N 3.19Å; S298-S301 PolarHBondContact O-N 3.29Å; S298-S301 VanDerWaalsContact O-N 3.11Å; S298-N302 PolarHBondContact O-N 2.92Å; S298-N302 PolarHBondContact O-OD1 2.87Å
299K62.3Low71.3Confident173 Ų173117.7 Ų117.775%0.75261%0.613SS**Hα-helixtrans-62.4-32.5177.6-170.4164.3-176.9172.10113.2V295V295-K299 PolarHBondContact O-N 3.4Å
300T58.9Low69.9Low100 Ų100120.2 Ų120.261%0.61362%0.622SS**Hα-helixtrans-72.5-39.8172.2-46.80000112.2S296 K297 S298 N302 H303S296-T300 PolarHBondContact O-OG1 3.19Å; K297-T300 PolarHBondContact O-N 3.34Å; S298-T300 VanDerWaalsContact C-N 3.29Å; S298-T300 PolarHBondContact O-N 3.19Å; T300-N302 VanDerWaalsContact C-N 3.3Å; T300-N302 PolarHBondContact O-N 3.24Å; T300-H303 PolarHBondContact O-N 3.48Å
301S57.3Low68.3Low72 Ų72121.8 Ų121.850%0.50363%0.634SS.*Hα-helixtrans-61.6-36.6-177.2-155.80000113.1K297 S298 H303K297-S301 PolarHBondContact O-N 3.29Å; S298-S301 PolarHBondContact O-N 3.29Å; S298-S301 VanDerWaalsContact O-N 3.11Å; S301-H303 VanDerWaalsContact C-N 3.29Å; S301-H303 PolarHBondContact O-N 3.07Å
302N55.5Low66.6Low120 Ų120126.1 Ų126.164%0.64266%0.659SS**G310 helixtrans-75.2-14.3-176-67.97.5000113.9S298 T300 M304S298-N302 PolarHBondContact O-N 2.92Å; S298-N302 PolarHBondContact O-OD1 2.87Å; T300-N302 VanDerWaalsContact C-N 3.3Å; T300-N302 PolarHBondContact O-N 3.24Å; N302-M304 VanDerWaalsContact C-N 3.34Å
303H53.3Low64.7Low142 Ų142123.7 Ų123.766%0.65766%0.656SS**G310 helixtrans-78.2-20-179.9-162.8-15.1000112.7T300 S301 H305T300-H303 PolarHBondContact O-N 3.48Å; S301-H303 VanDerWaalsContact C-N 3.29Å; S301-H303 PolarHBondContact O-N 3.07Å; H303-H305 VanDerWaalsContact C-N 3.33Å; H303-H305 PolarHBondContact O-N 2.95Å
304M53Low62.6Low138 Ų138122.3 Ų122.368%0.6866%0.658SS**G310 helixtrans-89.99.7-173.3-56.3-7286.600114.2N302N302-M304 VanDerWaalsContact C-N 3.34Å
305H49.6Very low60.5Low159 Ų159125.4 Ų125.474%0.73668%0.681SS**SBendtrans-131.442.1-178.9-67.6-65.8000111.8H303H303-H305 VanDerWaalsContact C-N 3.33Å; H303-H305 PolarHBondContact O-N 2.95Å
306T44.8Very low58.4Low120 Ų120127.8 Ų127.874%0.73669%0.689SS**  trans-147.559.1175.9-45.70000110.4
307T39.5Very low56.4Low212 Ų212133.1 Ų133.1100%1.30171%0.707SS**  trans-1460163-42.30000107.2

Retrieved 307 of 307 residues in 309.4 ms (Link to these results)