A0A087X3M7_POEFO Loading...

GRAM domain-containing protein 3-like

AlphaFold DB , UniProt , Accession A0A087X3M7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 428 aa.

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(Predicted Aligned Error values between residue pairs)
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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
1M36.3Very low38.8Very low236 Ų236139 Ų139100%1.16380%0.801SS**  01220177.5170170.600106.2
2V35.6Very low38.2Very low131 Ų131141.2 Ų141.279%0.79481%0.806SS**  trans71.7140.7-172.6-1700000115.3
3P53.8Low38Very low110 Ų110140.2 Ų140.271%0.71480%0.804SS**  trans-87.9170.1176.3-0.423.2000112.3
4M37.6Very low38.6Very low169 Ų169137.6 Ų137.683%0.83380%0.796SS**  cis77.1130.745.6-114.4-57.5-174.800115.4
5S38Very low38Very low93 Ų93139.7 Ų139.765%0.6580%0.801SS**  trans65.6154.3167.1-71.90000119.5
6E36.9Very low37.5Very low157 Ų157137.5 Ų137.573%0.73480%0.797SS**  cis-171165.8-24.4-158.5157.8109.900111.2
7Q30.9Very low37.2Very low176 Ų176134.8 Ų134.882%0.82280%0.795SS**  trans64.4162.7158.9-132.966.2-15.300119.6
8A42.9Very low36.8Very low96 Ų96132.3 Ų132.379%0.79379%0.792SS**  trans-145.7159.6-175.600000111.3
9D32.2Very low36.4Very low165 Ų165132.5 Ų132.588%0.88279%0.789SS**  trans-159.4169.9159-149.2-14.3000112.1
10A36.8Very low36.1Very low84 Ų84134.5 Ų134.569%0.69479%0.789SS**  trans75.2142.517200000119
11P46.4Very low36.1Very low112 Ų112136.7 Ų136.773%0.72780%0.797SS**  trans-143.7-172.5-142.143.7-22.5000117.8
12L31.3Very low36.3Very low165 Ų165131.3 Ų131.386%0.86478%0.78SS**  trans73.6106.3157.9-66175000121.3
13T35.9Very low36Very low128 Ų128131.1 Ų131.179%0.78578%0.782SS**  trans-63.7178.9139.919.20000111.9
14P45.8Very low34.9Very low105 Ų105135.4 Ų135.468%0.68279%0.79SS**  cis-143.3-177.112.345.5-26.6000117.9
15L29.4Very low34.5Very low168 Ų168134.2 Ų134.288%0.8879%0.787SS**  trans40.9132.3136.3-75.6165.3000125
16S30.5Very low34.4Very low105 Ų105135 Ų13573%0.73479%0.793SS**  102.997.8123.2-172.20000123.2
17A31.5Very low34.1Very low92 Ų92139 Ų13976%0.7680%0.801SS**  84.7157.1124.100000123.9
18A29.9Very low34Very low90 Ų90133.6 Ų133.674%0.74479%0.793SS**  trans74.9101.6162.300000121.1
19D29.2Very low33.4Very low136 Ų136139.5 Ų139.573%0.72780%0.801SS**  -169.4131.2106.6-100.3-21.9000108.6
20Q30.6Very low33.2Very low172 Ų172136.2 Ų136.280%0.80479%0.791SS**  71.1102.565.3-63.9-165.6106.400115.1
21L37.7Very low32.8Very low180 Ų180139.6 Ų139.694%0.94280%0.796SS**  trans-107.7114.2168.7-84.2164.1000109.9
22P38.5Very low31.9Very low124 Ų124139.9 Ų139.981%0.80580%0.796SS**  trans-89.7134172.333-31.2000111.9
23C31Very low31.7Very low126 Ų126136.8 Ų136.885%0.85179%0.788SS**  trans-82.5159.4166.8-1640000110.6
24K29Very low31.4Very low201 Ų201135 Ų13587%0.87478%0.781SS**  trans-150.2113.6171.6-158.9169.7-173.2175.80114
25D30.3Very low30.7Very low143 Ų143139 Ų13977%0.76579%0.79SS**  trans-72.7154.2173.5-71.2-68.5000114.5
26S36.3Very low30.6Very low111 Ų111134.5 Ų134.578%0.77679%0.785SS**  trans-160.5117135.7-750000108.2
27R30.6Very low30.6Very low239 Ų239136.9 Ų136.990%0.90279%0.79SS**  65.2118.161.6-169.4-167.1-63.7-167.20.1111.2
28G28.3Very low30.5Very low64 Ų64139.2 Ų139.266%0.6679%0.79SS**  cis161.6-166.81.200000110.3
29K31.3Very low30.6Very low219 Ų219143.4 Ų143.495%0.95279%0.794SS**  trans77.5152177.6-58.2179.8-179.9-177.20115.4
30S26.4Very low30.9Very low97 Ų97145 Ų14568%0.67880%0.797SS**  cis-166.8163.4-14.91720000111.1
31L29.9Very low31.1Very low155 Ų155142.6 Ų142.681%0.81279%0.785SS**  trans-7.2152.1156.1-47.6165.2000118.3
32T27.6Very low30.8Very low118 Ų118141.7 Ų141.772%0.72477%0.769SS**  cis-164153.947.5500000116
33S27.1Very low30.5Very low100 Ų100145.1 Ų145.170%0.69977%0.767SS**  trans56142.4135.267.70000126.7
34S28.2Very low30.6Very low91 Ų91148.9 Ų148.964%0.63677%0.771SS**  trans87.2109.7142.4-69.90000122.9
35E30.9Very low30.6Very low187 Ų187148.1 Ų148.187%0.87477%0.768SS**  43.8131.1113.9-61.3159.9112.200121.4
36G28.7Very low30.7Very low75 Ų75152 Ų15277%0.77377%0.772SS**  trans177.9130.5163.700000112.3
37N30.6Very low30.2Very low155 Ų155158.6 Ų158.683%0.82978%0.78SS**  trans-109.2169.6179.4-75.8-33.2000111.9
38N29.5Very low30Very low141 Ų141150.6 Ų150.675%0.75477%0.772SS**  trans74.6115.7157-630.8000120.4
39E31.6Very low30Very low177 Ų177156 Ų15683%0.82779%0.785SS**  49.9150.1114.3-88.7-179143.500126
40E34.4Very low29.8Very low169 Ų169149.4 Ų149.479%0.7977%0.771SS**  trans87141.4154.8-70.8-145.5111.200124.5
41E34.5Very low30.7Very low122 Ų122151 Ų15157%0.5778%0.779SS**  trans38.3133156.6-73.8-143.6114.600120.9
42R33.1Very low30.6Very low161 Ų161147.5 Ų147.561%0.60877%0.772SS**  cis179.314642.4-132169.8-169.7164.729.4115.1
43R30.5Very low30.6Very low197 Ų197148.9 Ų148.974%0.74378%0.775SS**  trans42.1128.2142.3-72.1166.6-171.1-171.91.8122.1
44Q33Very low30.7Very low204 Ų204150.4 Ų150.495%0.95378%0.775SS**  -141170.3119.2-114.5176.111.700112
45K29.3Very low30.8Very low186 Ų186153.8 Ų153.881%0.80978%0.781SS**  trans-144.4121.4-144.3177.7-175.3174.4-1750116
46R32.5Very low30.6Very low225 Ų225152 Ų15285%0.84978%0.776SS**  trans38.5130.9150.6-61.9-174.5179.7-174.3-0.1121.7
47R27.2Very low30.5Very low248 Ų248155.4 Ų155.494%0.93678%0.776SS**  -166.3148.2126.6-94.3161.3-134.8-119.59.4106
48G26Very low30.5Very low71 Ų71154.3 Ų154.373%0.73277%0.77SS**  cis94.2130.917.500000110.4
49L26.7Very low30.3Very low178 Ų178153.6 Ų153.693%0.93277%0.766SS**  cis-161.3170.9-0.2-167.270.7000108.3
50A29.1Very low30.1Very low80 Ų80151 Ų15166%0.66177%0.768SS**  trans-88.9-179.5164.200000110.5
51P43.7Very low29.8Very low130 Ų130152 Ų15284%0.84477%0.772SS**  cis-138.7-143.712.544.4-22.2000115.6
52A28.7Very low29.5Very low82 Ų82152 Ų15268%0.67879%0.785SS**  trans-54.7175.2-173.300000116.8
53D26.9Very low29.1Very low147 Ų147152.3 Ų152.379%0.78679%0.794SS**  cis-173.1175.641.1-141.1-32.8000115.5
54L30.4Very low29.4Very low133 Ų133147.9 Ų147.970%0.69679%0.791SS**  trans77132.3154.9-70172.6000125.8
55Q29.6Very low29.1Very low162 Ų162142.2 Ų142.276%0.75777%0.773SS**  trans70.5159.6144.8-69.8-178.837.400121.5
56L27.4Very low29Very low148 Ų148142 Ų14278%0.77578%0.775SS**  cis175.6139.9-41.9-117.1-178.5000108.4
57L25.8Very low28.8Very low147 Ų147135.5 Ų135.577%0.7776%0.764SS**  trans167.2138.3136.1-111.572.6000116.1
58L30Very low28.8Very low132 Ų132133.4 Ų133.469%0.69176%0.756SS**  trans64.7123.5147.5-56.7-171.6000126.3
59D25.4Very low29.1Very low127 Ų127138.8 Ų138.868%0.67976%0.759SS**  68.6117.2123.8-55.4-9000124.9
60S28.7Very low29.5Very low123 Ų123139.6 Ų139.686%0.8676%0.756SS**  -164.7156.693.4-74.10000112.3
61E27.1Very low29.8Very low189 Ų189142.1 Ų142.188%0.88377%0.765SS**  trans-96.9159.3-168.1-56.7-174.396.900116.1
62S28.3Very low29.1Very low121 Ų121140.3 Ų140.385%0.84676%0.761SS**  trans-169.6102.3133.157.10000113
63E24.4Very low29.1Very low169 Ų169141 Ų14179%0.7976%0.761SS**  trans-88.5-178.2160.5-95.8-75.7120.500109S65E63-S65 PolarHBondContact OE2-N 3.41Å
64P38.1Very low29.5Very low104 Ų104141.9 Ų141.968%0.67576%0.764SS**  cis-144.9176.519.345-25.5000120.2
65S26.7Very low29.4Very low84 Ų84139.6 Ų139.659%0.58776%0.759SS**  trans95.6113.5131.669.10000122.9E63E63-S65 PolarHBondContact OE2-N 3.41Å
66E26.1Very low29.4Very low182 Ų182142.3 Ų142.385%0.8576%0.763SS**  65171.2123.9-63.4-155.6156.800123.6
67S27.9Very low29.7Very low88 Ų88143.7 Ų143.762%0.61577%0.765SS**  -160.9152.4-55.679.10000113.5
68R28.6Very low29.9Very low205 Ų205143.6 Ų143.677%0.77476%0.758SS**  trans58105132.1-164.2-179.2-119.7-158.22.3122.3
69K32Very low30.5Very low183 Ų183142.7 Ų142.780%0.79676%0.76SS**  trans83.4159.3138.2-67.5177.1-176.3-177.50121.6
70K35.5Very low30.7Very low196 Ų196142.7 Ų142.785%0.85277%0.765SS**  trans-83.4168.9179.3-53.8174.6178.2179.40112.7
71P34.8Very low30.8Very low132 Ų132143.5 Ų143.586%0.85776%0.755SS**  -133.7-172.2111.338-28.3000114.4
72A27.9Very low31.7Very low93 Ų93139.3 Ų139.377%0.76974%0.744SS**  trans-113.7173.8179.300000110.8
73S30.3Very low31.7Very low97 Ų97140.4 Ų140.468%0.67874%0.74SS**  166.1165.967.752.50000113
74I34.5Very low32.1Very low164 Ų164137.6 Ų137.684%0.84174%0.739SS**  trans71.1140.9151.7-70.9158.9000116.6
75S28Very low32Very low85 Ų85138.3 Ų138.359%0.59474%0.743SS**  cis-153.7160.710.5101.70000114.6
76R30Very low32.1Very low220 Ų220142.6 Ų142.683%0.8376%0.756SS**  trans65.9148.9156.1-71.1174.4172158.2-1.9117.9
77Q33.3Very low32.3Very low176 Ų176141.8 Ų141.882%0.82276%0.757SS**  cis-150.1160.87.5-135.4156-2800112.4
78K30.2Very low32.3Very low145 Ų145142.2 Ų142.263%0.6376%0.76SS**  trans-131.7164.9170.4-137.9-156.3174.8177.30107.1E81K78-E81 IonicContact NZ-OE2 2.69Å; K78-E81 PolarHBondContact NZ-OE2 2.93Å
79P42.7Very low33Very low113 Ų113140.5 Ų140.573%0.73477%0.765SS**  cis-130.3-168.649.733.6-10.5000112.2
80V30.8Very low33.5Very low128 Ų128135.9 Ų135.978%0.77676%0.756SS**  cis-138.8174.818.7-1790000109.8
81E30.7Very low33.4Very low139 Ų139132.9 Ų132.965%0.6575%0.749SS**  trans-131.7-173.8-173.9-111.4-178.388.500111.1K78K78-E81 IonicContact NZ-OE2 2.69Å; K78-E81 PolarHBondContact NZ-OE2 2.93Å
82P44.8Very low33.7Very low102 Ų102136.7 Ų136.766%0.66275%0.753SS**  cis-122.5-152.14.721.57000111.6
83L28.8Very low34.1Very low144 Ų144139.1 Ų139.175%0.75475%0.748SS**  cis-150.8139.213.8-84.7170.2000113.2
84S32Very low34.5Very low109 Ų109140 Ų14076%0.76275%0.749SS**  trans65.1171.9146.479.30000118.6
85P36.4Very low34.9Very low119 Ų119141.2 Ų141.277%0.77375%0.749SS**  -127.1156.6-86.535.6-19.1000116.8
86M28.5Very low35.9Very low175 Ų175141.6 Ų141.686%0.86274%0.744SS**  trans-15.2133.4164.8176.6179.3-179.500119.2
87L30.8Very low36.2Very low164 Ų164134.7 Ų134.786%0.85972%0.723SS**  -165.9167.5127.2-106.3172.8000114.5
88S28.3Very low36.9Very low98 Ų98136.4 Ų136.469%0.68572%0.722SS**  trans-34.7148.6-166-156.20000122
89L43.8Very low37.7Very low168 Ų168136.3 Ų136.388%0.8872%0.722SS**  trans-88.8101.6160-177.7172.4000109.8
90S41.7Very low37.8Very low86 Ų86135.7 Ų135.760%0.60171%0.707SS**  trans171.9114.6157.752.30000111.8
91D33.1Very low38.8Very low134 Ų134133.5 Ų133.572%0.71770%0.698SS**  trans-168.918.8152.3-117.8-25.2000118.3
92F42Very low39.9Very low212 Ų212132.1 Ų132.193%0.9369%0.691SS**SBendtrans-101.6-2.6-179.4-83.4-75.8000116.3
93E35.7Very low40.3Very low144 Ų144131 Ų13167%0.67368%0.682SS**  trans-104.511.2-172.1-76.8-100.784.600114.9K95E93-K95 PolarHBondContact O-N 3.43Å
94T39.2Very low41.6Very low114 Ų114129 Ų12970%0.69967%0.673SS**THydrogen-bonded Turntrans-87.1-0.7-176.752.80000115.3
95K42.4Very low43Very low191 Ų191130.3 Ų130.383%0.8367%0.667SS**THydrogen-bonded Turntrans-109-9.5179.1-93.3-179.8178.5170.80116.2E93E93-K95 PolarHBondContact O-N 3.43Å
96L48.2Very low44.4Very low93 Ų93127.9 Ų127.949%0.48765%0.647SS.*THydrogen-bonded Turntrans-92.8-50.5-176.3-158.177.3000113.4R98 K99 K100L96-R98 PolarHBondContact O-N 2.91Å; L96-K99 WeakPolarHBondContact O-CA 3.43Å; L96-K99 WeakPolarHBondContact O-CB 3.35Å; L96-K99 PolarHBondContact O-N 3.26Å; L96-K100 PolarHBondContact O-N 2.79Å
97D37Very low46.3Very low75 Ų75122.5 Ų122.540%0.40163%0.626SS.*Hα-helixtrans-74.4-29.6-165.6-86.7-96.1000115K99 K100 S101D97-K99 PolarHBondContact O-N 3.34Å; D97-K99 VanDerWaalsContact O-N 3.15Å; D97-K100 VanDerWaalsContact CG-NZ 3.31Å; D97-K100 PolarHBondContact O-N 2.89Å; D97-K100 VanDerWaalsContact O-N 3.14Å; D97-K100 WeakPolarHBondContact OD1-CD 3.48Å; D97-K100 IonicContact OD1-NZ 3.63Å; D97-K100 PolarHBondContact OD1-NZ 2.84Å; D97-K100 IonicContact OD2-NZ 2.63Å; D97-K100 PolarHBondContact OD2-NZ 2.86Å; D97-S101 PolarHBondContact O-N 3.31Å; D97-S101 VanDerWaalsContact O-N 3.16Å
98R48.9Very low48.3Very low212 Ų212122.3 Ų122.380%0.862%0.619SS**Hα-helixtrans-57.6-29.7167.8-173.2169.6176.4142.7-0.1111.9L96 Q102L96-R98 PolarHBondContact O-N 2.91Å; R98-Q102 WeakPolarHBondContact O-CB 3.3Å; R98-Q102 PolarHBondContact O-N 3.01Å
99K45.9Very low50.7Low143 Ų143119.7 Ų119.762%0.62260%0.599SS**Hα-helixtrans-79.4-35.4178-161177.6179.4-177.50112.4L96 D97 T103L96-K99 WeakPolarHBondContact O-CA 3.43Å; L96-K99 WeakPolarHBondContact O-CB 3.35Å; L96-K99 PolarHBondContact O-N 3.26Å; D97-K99 PolarHBondContact O-N 3.34Å; D97-K99 VanDerWaalsContact O-N 3.15Å; K99-T103 WeakPolarHBondContact O-CB 3.28Å; K99-T103 PolarHBondContact O-N 3.46Å; K99-T103 PolarHBondContact O-OG1 2.96Å
100K45.9Very low52.7Low99 Ų99112.9 Ų112.943%0.4356%0.563SS.*Hα-helixtrans-61.9-51.8173.9-68.6178.5-166.8145.80111L96 D97 Q102 T103 N104L96-K100 PolarHBondContact O-N 2.79Å; D97-K100 VanDerWaalsContact CG-NZ 3.31Å; D97-K100 PolarHBondContact O-N 2.89Å; D97-K100 VanDerWaalsContact O-N 3.14Å; D97-K100 WeakPolarHBondContact OD1-CD 3.48Å; D97-K100 IonicContact OD1-NZ 3.63Å; D97-K100 PolarHBondContact OD1-NZ 2.84Å; D97-K100 IonicContact OD2-NZ 2.63Å; D97-K100 PolarHBondContact OD2-NZ 2.86Å; K100-Q102 PolarHBondContact O-N 3Å; K100-T103 PolarHBondContact O-N 3.15Å; K100-N104 PolarHBondContact O-N 3.25Å
101S50.7Low54.7Low82 Ų82111.9 Ų111.957%0.57356%0.56SS**Hα-helixtrans-63.1-40.3179.8-64.90000112.8D97 N104 Q105D97-S101 PolarHBondContact O-N 3.31Å; D97-S101 VanDerWaalsContact O-N 3.16Å; S101-N104 PolarHBondContact O-N 3.22Å; S101-Q105 PolarHBondContact O-N 3.12Å
102Q53.6Low57.1Low110 Ų110110.2 Ų110.251%0.51455%0.548SS..Hα-helixtrans-64.9-40.1175.1-168.9172.26.600112.1R98 K100 N104 Q105 L106R98-Q102 WeakPolarHBondContact O-CB 3.3Å; R98-Q102 PolarHBondContact O-N 3.01Å; K100-Q102 PolarHBondContact O-N 3Å; Q102-N104 PolarHBondContact O-N 3.31Å; Q102-Q105 PolarHBondContact O-N 3.1Å; Q102-L106 HydrophobicContact CG-CD1 4.17Å; Q102-L106 WeakPolarHBondContact O-CB 3.34Å; Q102-L106 VanDerWaalsContact O-CG 3.3Å; Q102-L106 WeakPolarHBondContact O-CG 3.49Å; Q102-L106 PolarHBondContact O-N 3.24Å
103T53.4Low59.3Low78 Ų78100.1 Ų100.148%0.47950%0.503SS..Hα-helixtrans-62.1-43175.3-56.50000111.6K99 K100 Q105 L106 S107K99-T103 WeakPolarHBondContact O-CB 3.28Å; K99-T103 PolarHBondContact O-N 3.46Å; K99-T103 PolarHBondContact O-OG1 2.96Å; K100-T103 PolarHBondContact O-N 3.15Å; T103-Q105 VanDerWaalsContact C-N 3.32Å; T103-Q105 PolarHBondContact O-N 3.09Å; T103-L106 PolarHBondContact O-N 3.22Å; T103-S107 PolarHBondContact O-N 3.36Å; T103-S107 PolarHBondContact O-OG 2.9Å
104N56Low61.8Low102 Ų10294.8 Ų94.855%0.54548%0.479SS..Hα-helixtrans-69.5-24.2177.9-75.8-22.7000114.1K100 S101 Q102 S107 K108K100-N104 PolarHBondContact O-N 3.25Å; S101-N104 PolarHBondContact O-N 3.22Å; Q102-N104 PolarHBondContact O-N 3.31Å; N104-S107 PolarHBondContact O-OG 3.38Å; N104-K108 WeakPolarHBondContact O-CG 3.11Å
105Q61.3Low64Low137 Ų13797.7 Ų97.764%0.6448%0.482SS*.Hα-helixtrans-80.2-40.1170.8-168.3-178.261.900111.2S101 Q102 T103 T109S101-Q105 PolarHBondContact O-N 3.12Å; Q102-Q105 PolarHBondContact O-N 3.1Å; T103-Q105 VanDerWaalsContact C-N 3.32Å; T103-Q105 PolarHBondContact O-N 3.09Å; Q105-T109 WeakPolarHBondContact O-CB 3.47Å; Q105-T109 PolarHBondContact O-N 3.17Å; Q105-T109 PolarHBondContact O-OG1 3.41Å
106L66.2Low66Low69 Ų6989.8 Ų89.836%0.36145%0.448SS..Hα-helixtrans-62.9-43.6177.2-75168.3000112Q102 T103 T109 N110Q102-L106 HydrophobicContact CG-CD1 4.17Å; Q102-L106 WeakPolarHBondContact O-CB 3.34Å; Q102-L106 VanDerWaalsContact O-CG 3.3Å; Q102-L106 WeakPolarHBondContact O-CG 3.49Å; Q102-L106 PolarHBondContact O-N 3.24Å; T103-L106 PolarHBondContact O-N 3.22Å; L106-T109 PolarHBondContact O-N 3.47Å; L106-N110 VanDerWaalsContact O-CB 3.22Å; L106-N110 WeakPolarHBondContact O-CB 3.45Å; L106-N110 PolarHBondContact O-N 3.05Å
107S68.4Low67.9Low61 Ų6185.7 Ų85.743%0.42743%0.426SS..Hα-helixtrans-61.7-45.8177.961.50000112.5T103 N104 T109 N110 A111T103-S107 PolarHBondContact O-N 3.36Å; T103-S107 PolarHBondContact O-OG 2.9Å; N104-S107 PolarHBondContact O-OG 3.38Å; S107-T109 VanDerWaalsContact C-N 3.32Å; S107-T109 PolarHBondContact O-N 3.33Å; S107-N110 PolarHBondContact O-N 3.2Å; S107-A111 PolarHBondContact O-N 2.84Å
108K73.6Confident70Confident160 Ų16091.5 Ų91.570%0.69645%0.448SS*.Hα-helixtrans-59.8-40.7173.5-69.6176.5-178.4-179.10112.3N104 H112N104-K108 WeakPolarHBondContact O-CG 3.11Å; K108-H112 PolarHBondContact O-N 3.38Å
109T78.9Confident71.4Confident44 Ų4485.2 Ų85.227%0.2744%0.441SS..Hα-helixtrans-72.6-34.6179.2-48.60000111.9Q105 L106 S107 H112 Y113 L126Q105-T109 WeakPolarHBondContact O-CB 3.47Å; Q105-T109 PolarHBondContact O-N 3.17Å; Q105-T109 PolarHBondContact O-OG1 3.41Å; L106-T109 PolarHBondContact O-N 3.47Å; S107-T109 VanDerWaalsContact C-N 3.32Å; S107-T109 PolarHBondContact O-N 3.33Å; T109-H112 WeakPolarHBondContact O-CB 3.32Å; T109-H112 PolarHBondContact O-N 3.46Å; T109-Y113 PolarHBondContact O-N 3.22Å; T109-L126 HydrophobicContact CG2-CD2 3.6Å
110N84.5Confident73.1Confident24 Ų2478.7 Ų78.713%0.12841%0.414CS..Hα-helixtrans-69-41.1175.3173.6-105.6000112L106 S107 H112 Y113 H114 E124 L126L106-N110 VanDerWaalsContact O-CB 3.22Å; L106-N110 WeakPolarHBondContact O-CB 3.45Å; L106-N110 PolarHBondContact O-N 3.05Å; S107-N110 PolarHBondContact O-N 3.2Å; N110-H112 VanDerWaalsContact C-N 3.27Å; N110-H112 PolarHBondContact O-N 2.77Å; N110-Y113 WeakPolarHBondContact O-CA 3.07Å; N110-Y113 WeakPolarHBondContact O-CB 3.37Å; N110-Y113 PolarHBondContact O-N 2.81Å; N110-H114 PolarHBondContact ND2-CD2 3.45Å; N110-H114 PolarHBondContact ND2-NE2 2.79Å; N110-H114 PolarHBondContact O-CD2 2.78Å; N110-H114 PolarHBondContact O-N 3.24Å; N110-H114 PolarHBondContact OD1-NE2 2.91Å; N110-E124 PolarHBondContact ND2-O 2.92Å; N110-L126 HydrophobicContact CB-CB 4.29Å; N110-L126 PolarHBondContact ND2-N 3.47Å
111A83.1Confident74.8Confident65 Ų6576.6 Ų76.654%0.53741%0.411SS..Hα-helixtrans-59.1-38.3170.600000112.3S107 K115S107-A111 PolarHBondContact O-N 2.84Å; A111-K115 WeakPolarHBondContact O-CB 3.21Å; A111-K115 PolarHBondContact O-N 3.37Å
112H85.3Confident76.1Confident99 Ų9981.2 Ų81.246%0.45842%0.421SS..Hα-helixtrans-67.1-39.5172.2-174.275.4000112.4K108 T109 N110 K115 L116K108-H112 PolarHBondContact O-N 3.38Å; T109-H112 WeakPolarHBondContact O-CB 3.32Å; T109-H112 PolarHBondContact O-N 3.46Å; N110-H112 VanDerWaalsContact C-N 3.27Å; N110-H112 PolarHBondContact O-N 2.77Å; H112-K115 PolarHBondContact O-N 2.8Å; H112-L116 WeakPolarHBondContact O-CG 3.26Å; H112-L116 PolarHBondContact O-N 3.38Å
113Y87Confident77.3Confident0 Ų082.7 Ų82.70%043%0.432CS..Hα-helixtrans-59.5-52.3176.3171-103.6000112.4T109 N110 K115 L116 F117 V120 L126 F145 S147 C152T109-Y113 PolarHBondContact O-N 3.22Å; N110-Y113 WeakPolarHBondContact O-CA 3.07Å; N110-Y113 WeakPolarHBondContact O-CB 3.37Å; N110-Y113 PolarHBondContact O-N 2.81Å; Y113-K115 VanDerWaalsContact C-N 3.26Å; Y113-K115 PolarHBondContact O-N 3.03Å; Y113-L116 WeakPolarHBondContact O-CB 3.49Å; Y113-L116 PolarHBondContact O-N 3.23Å; Y113-F117 AromaticContact CD2-CD2 3.53Å; Y113-F117 HydrophobicContact CD2-CD2 3.53Å; Y113-F117 AromaticContact CD2-CE2 3.89Å; Y113-F117 HydrophobicContact CD2-CE2 3.89Å; Y113-F117 AromaticContact CE2-CD2 3.61Å; Y113-F117 HydrophobicContact CE2-CD2 3.61Å; Y113-F117 HydrophobicContact CE2-CE2 4.03Å; Y113-F117 HydrophobicContact CE2-CG 4.41Å; Y113-F117 HydrophobicContact CG-CD2 4.35Å; Y113-F117 WeakPolarHBondContact O-CD2 3.43Å; Y113-F117 PolarHBondContact O-N 3.17Å; Y113-V120 HydrophobicContact CE1-CB 4.38Å; Y113-V120 HydrophobicContact CE1-CG1 3.98Å; Y113-L126 HydrophobicContact CD2-CD1 4.17Å; Y113-L126 HydrophobicContact CE2-CD1 4.41Å; Y113-L126 HydrophobicContact CG-CD1 4.42Å; Y113-F145 HydrophobicContact CD2-CB 3.54Å; Y113-F145 HydrophobicContact CD2-CD1 4.07Å; Y113-F145 AromaticContact CD2-CG 3.85Å; Y113-F145 HydrophobicContact CD2-CG 3.85Å; Y113-F145 HydrophobicContact CE2-CB 3.54Å; Y113-F145 HydrophobicContact CE2-CG 4.32Å; Y113-S147 WeakPolarHBondContact CE1-OG 3.43Å; Y113-S147 VanDerWaalsContact CZ-OG 3.25Å; Y113-S147 PolarHBondContact OH-OG 3.21Å; Y113-S147 VanDerWaalsContact OH-OG 3.09Å; Y113-C152 HydrophobicContact CE2-CB 3.98Å; Y113-C152 PolarHBondContact OH-SG 2.78Å; Y113-C152 VanDerWaalsContact OH-SG 3.37Å
114H87.4Confident78.8Confident33 Ų3379.7 Ų79.715%0.15341%0.413CS..Hα-helixtrans-66.7-26.4176.9-61.1-68.4000112.9N110 L116 S121 E124N110-H114 PolarHBondContact ND2-CD2 3.45Å; N110-H114 PolarHBondContact ND2-NE2 2.79Å; N110-H114 PolarHBondContact O-CD2 2.78Å; N110-H114 PolarHBondContact O-N 3.24Å; N110-H114 PolarHBondContact OD1-NE2 2.91Å; H114-L116 VanDerWaalsContact C-N 3.34Å; H114-S121 PolarHBondContact CE1-O 2.87Å; H114-S121 PolarHBondContact ND1-O 2.86Å; H114-E124 PolarHBondContact CE1-O 2.63Å; H114-E124 VanDerWaalsContact CE1-O 3.23Å; H114-E124 PolarHBondContact NE2-O 3.29Å
115K86Confident80.3Confident175 Ų17580.2 Ų80.276%0.76142%0.415SS*.Hα-helixtrans-68.6-30.6171-174.6170.2-179.8173.20112.8A111 H112 Y113A111-K115 WeakPolarHBondContact O-CB 3.21Å; A111-K115 PolarHBondContact O-N 3.37Å; H112-K115 PolarHBondContact O-N 2.8Å; Y113-K115 VanDerWaalsContact C-N 3.26Å; Y113-K115 PolarHBondContact O-N 3.03Å
116L85.5Confident81.7Confident25 Ų2574.3 Ų74.313%0.13139%0.388CS..Hα-helixtrans-80-43.2173.7-70.1175.8000112.6H112 Y113 H114 F145 H154H112-L116 WeakPolarHBondContact O-CG 3.26Å; H112-L116 PolarHBondContact O-N 3.38Å; Y113-L116 WeakPolarHBondContact O-CB 3.49Å; Y113-L116 PolarHBondContact O-N 3.23Å; H114-L116 VanDerWaalsContact C-N 3.34Å; L116-F145 HydrophobicContact CD1-CE2 4.06Å; L116-F145 HydrophobicContact CD1-CZ 4.11Å; L116-H154 HydrophobicContact CD1-CB 4.21Å
117F86.3Confident82.9Confident6 Ų675.5 Ų75.53%0.02639%0.39CS..  trans-117.375-170.1-56.6-77.3000111.9Y113 A119 V120 F145 C152 F153 H154 K163 S165Y113-F117 AromaticContact CD2-CD2 3.53Å; Y113-F117 HydrophobicContact CD2-CD2 3.53Å; Y113-F117 AromaticContact CD2-CE2 3.89Å; Y113-F117 HydrophobicContact CD2-CE2 3.89Å; Y113-F117 AromaticContact CE2-CD2 3.61Å; Y113-F117 HydrophobicContact CE2-CD2 3.61Å; Y113-F117 HydrophobicContact CE2-CE2 4.03Å; Y113-F117 HydrophobicContact CE2-CG 4.41Å; Y113-F117 HydrophobicContact CG-CD2 4.35Å; Y113-F117 WeakPolarHBondContact O-CD2 3.43Å; Y113-F117 PolarHBondContact O-N 3.17Å; F117-A119 PolarHBondContact O-N 3.09Å; F117-V120 HydrophobicContact CB-CG2 4.05Å; F117-V120 PolarHBondContact O-N 3.03Å; F117-V120 VanDerWaalsContact O-N 3.09Å; F117-F145 AromaticContact CE2-CD2 3.75Å; F117-F145 HydrophobicContact CE2-CD2 3.75Å; F117-F145 HydrophobicContact CE2-CE2 4.24Å; F117-F145 HydrophobicContact CE2-CG 4.31Å; F117-F145 HydrophobicContact CZ-CD2 4.2Å; F117-C152 HydrophobicContact CD1-CB 3.9Å; F117-C152 HydrophobicContact CD2-CB 4.02Å; F117-C152 HydrophobicContact CE1-CB 3.66Å; F117-C152 HydrophobicContact CE2-CB 3.78Å; F117-C152 HydrophobicContact CG-CB 4.07Å; F117-C152 HydrophobicContact CZ-CB 3.58Å; F117-F153 WeakPolarHBondContact CE1-O 3.49Å; F117-H154 HydrophobicContact CE1-CB 4.33Å; F117-H154 HydrophobicContact CE2-CB 4.3Å; F117-H154 HydrophobicContact CZ-CB 3.6Å; F117-K163 HydrophobicContact CE1-CB 4.12Å; F117-K163 HydrophobicContact CE1-CG 4.08Å; F117-S165 WeakPolarHBondContact CD1-OG 3.34Å
118K82.4Confident83.9Confident198 Ų19876.6 Ų76.686%0.86139%0.388SS*.THydrogen-bonded Turntrans-58.7-16.3177.5-64.3-173.8179.4-177.20115
119A77.3Confident84.8Confident79 Ų7971.1 Ų71.165%0.65337%0.371SS*.THydrogen-bonded Turntrans-82.3-13.4178.900000113.8F117F117-A119 PolarHBondContact O-N 3.09Å
120V83.1Confident85.5Confident7 Ų770.3 Ų70.34%0.04236%0.363CS..SBendtrans-91.5137.7175.7-177.20000108.8Y113 F117 E124 W150Y113-V120 HydrophobicContact CE1-CB 4.38Å; Y113-V120 HydrophobicContact CE1-CG1 3.98Å; F117-V120 HydrophobicContact CB-CG2 4.05Å; F117-V120 PolarHBondContact O-N 3.03Å; F117-V120 VanDerWaalsContact O-N 3.09Å; V120-E124 HydrophobicContact CG1-CB 3.91Å; V120-W150 HydrophobicContact CG1-CG 4.28Å; V120-W150 HydrophobicContact CG2-CB 4.39Å; V120-W150 HydrophobicContact CG2-CD2 4.05Å; V120-W150 HydrophobicContact CG2-CE3 4.43Å; V120-W150 HydrophobicContact CG2-CG 4.03Å
121S80.4Confident86Confident54 Ų5472.5 Ų72.538%0.37838%0.377SS..  trans-56.2150178.153.60000111.8H114 D123 E124H114-S121 PolarHBondContact CE1-O 2.87Å; H114-S121 PolarHBondContact ND1-O 2.86Å; S121-D123 PolarHBondContact O-N 2.97Å; S121-E124 PolarHBondContact O-N 3.3Å
122K77.7Confident86.5Confident179 Ų17969.5 Ų69.578%0.77835%0.352SS*.THydrogen-bonded Turntrans-69.7-19.4-177.8-65.1178.4-176.5172.20112.8E124K122-E124 VanDerWaalsContact C-N 3.31Å
123D79.3Confident86.9Confident141 Ų14165.1 Ų65.175%0.75433%0.333SS*.THydrogen-bonded Turntrans-82.4-12.1-176.5-38.7-79.7000112S121 L125S121-D123 PolarHBondContact O-N 2.97Å; D123-L125 PolarHBondContact O-N 3.24Å
124E86.1Confident87.2Confident15 Ų1565.1 Ų65.17%0.0733%0.333CS..  trans-84.194.6-177.6-92.5-159.8-122.400114.2N110 H114 V120 S121 K122 L126 S147 Q148 N149 W150N110-E124 PolarHBondContact ND2-O 2.92Å; H114-E124 PolarHBondContact CE1-O 2.63Å; H114-E124 VanDerWaalsContact CE1-O 3.23Å; H114-E124 PolarHBondContact NE2-O 3.29Å; V120-E124 HydrophobicContact CG1-CB 3.91Å; S121-E124 PolarHBondContact O-N 3.3Å; K122-E124 VanDerWaalsContact C-N 3.31Å; E124-L126 PolarHBondContact O-N 2.89Å; E124-S147 VanDerWaalsContact OE2-CB 3.31Å; E124-S147 WeakPolarHBondContact OE2-CB 3.4Å; E124-Q148 PolarHBondContact OE2-N 2.99Å; E124-N149 WeakPolarHBondContact OE1-CB 3.3Å; E124-N149 PolarHBondContact OE1-ND2 2.98Å; E124-N149 PolarHBondContact OE2-N 3.18Å; E124-W150 PolarHBondContact OE1-NE1 3.14Å
125L87.3Confident87.4Confident114 Ų11467.2 Ų67.260%0.59734%0.343SS*.  trans-61.9122.6173.7-59.9178.8000112.3D123 K127D123-L125 PolarHBondContact O-N 3.24Å; L125-K127 PolarHBondContact O-N 2.89Å
126L90.3Very high87.5Confident12 Ų1264.4 Ų64.46%0.06333%0.328CS..  trans-59.9119.8171.1177.369.1000109.9T109 N110 Y113 E124 Q128 F145T109-L126 HydrophobicContact CG2-CD2 3.6Å; N110-L126 HydrophobicContact CB-CB 4.29Å; N110-L126 PolarHBondContact ND2-N 3.47Å; Y113-L126 HydrophobicContact CD2-CD1 4.17Å; Y113-L126 HydrophobicContact CE2-CD1 4.41Å; Y113-L126 HydrophobicContact CG-CD1 4.42Å; E124-L126 PolarHBondContact O-N 2.89Å; L126-Q128 WeakPolarHBondContact CD1-O 3.44Å; L126-F145 HydrophobicContact CD1-CB 3.71Å; L126-F145 HydrophobicContact CD1-CD1 3.95Å; L126-F145 HydrophobicContact CD1-CG 4.35Å; L126-F145 HydrophobicContact CD2-CD1 3.92Å
127K90.4Very high87.6Confident95 Ų9570.6 Ų70.641%0.41336%0.361SS..  trans-86.3-45.2-179.3-54.6-75.9170.8146.50111.5L125 V146 Q148 F210L125-K127 PolarHBondContact O-N 2.89Å; K127-V146 WeakPolarHBondContact CA-O 3.39Å; K127-V146 WeakPolarHBondContact CB-O 3.39Å; K127-V146 PolarHBondContact N-O 3.4Å; K127-Q148 VanDerWaalsContact CE-OE1 3.22Å; K127-F210 HydrophobicContact CB-CZ 3.84Å
128Q90.6Very high87.6Confident83 Ų8375.1 Ų75.139%0.38838%0.383SS..EExtended strand (participates in β ladder)trans-153.2151.4-175.2-173.256.458.600111.6L126 Y130 V146 F210L126-Q128 WeakPolarHBondContact CD1-O 3.44Å; Q128-Y130 HydrophobicContact CB-CE2 4.15Å; Q128-Y130 HydrophobicContact CG-CD2 4.14Å; Q128-Y130 HydrophobicContact CG-CE1 3.9Å; Q128-Y130 HydrophobicContact CG-CE2 3.49Å; Q128-Y130 VanDerWaalsContact CG-CE2 3.49Å; Q128-V146 PolarHBondContact N-O 3.13Å; Q128-V146 PolarHBondContact O-N 3.1Å; Q128-F210 HydrophobicContact CB-CD1 4.31Å; Q128-F210 HydrophobicContact CB-CE1 3.5Å; Q128-F210 VanDerWaalsContact CB-CE1 3.5Å; Q128-F210 HydrophobicContact CB-CE2 4.44Å; Q128-F210 HydrophobicContact CB-CZ 3.57Å; Q128-F210 HydrophobicContact CG-CE1 4.24Å; Q128-F210 HydrophobicContact CG-CZ 4.45Å
129S92.6Very high87.9Confident46 Ų4670 Ų7032%0.32237%0.365SS..EExtended strand (participates in β ladder)trans-122.6151.7168.465.50000111.8M144S129-M144 CarbonylContact C-O 3.53Å; S129-M144 VanDerWaalsContact CA-O 3.32Å; S129-M144 WeakPolarHBondContact CA-O 3.35Å
130Y93.9Very high88.7Confident27 Ų2767 Ų6711%0.10634%0.336CS..EExtended strand (participates in β ladder)trans-141.5125.6-179.1-60.3-79000110.8Q128 K143 M144 V146 T207 F210Q128-Y130 HydrophobicContact CB-CE2 4.15Å; Q128-Y130 HydrophobicContact CG-CD2 4.14Å; Q128-Y130 HydrophobicContact CG-CE1 3.9Å; Q128-Y130 HydrophobicContact CG-CE2 3.49Å; Q128-Y130 VanDerWaalsContact CG-CE2 3.49Å; Y130-K143 WeakPolarHBondContact O-CA 3.33Å; Y130-M144 HydrophobicContact CD2-CE 3.51Å; Y130-M144 HydrophobicContact CE2-CE 4.14Å; Y130-M144 HydrophobicContact CG-CE 4.23Å; Y130-M144 PolarHBondContact N-O 3.36Å; Y130-M144 PolarHBondContact O-N 3.11Å; Y130-V146 HydrophobicContact CD2-CG2 4.28Å; Y130-V146 HydrophobicContact CE2-CG2 4.23Å; Y130-T207 HydrophobicContact CD1-CG2 4.24Å; Y130-T207 VanDerWaalsContact CD1-OG1 3.27Å; Y130-T207 WeakPolarHBondContact CD1-OG1 3.19Å; Y130-T207 HydrophobicContact CD2-CG2 3.89Å; Y130-T207 HydrophobicContact CE1-CG2 4.15Å; Y130-T207 WeakPolarHBondContact CE1-OG1 3.48Å; Y130-T207 HydrophobicContact CE2-CG2 3.76Å; Y130-T207 HydrophobicContact CG-CG2 4.1Å; Y130-F210 HydrophobicContact CE2-CD1 4.02Å; Y130-F210 HydrophobicContact CE2-CE1 4.43Å; Y130-F210 WeakPolarHBondContact OH-CB 3.48Å; Y130-F210 VanDerWaalsContact OH-CD1 3.28Å; Y130-F210 WeakPolarHBondContact OH-CD1 3.43Å; Y130-F210 WeakPolarHBondContact OH-CG 3.3Å
131T94.3Very high89.2Confident69 Ų6973.1 Ų73.142%0.42337%0.365SS..EExtended strand (participates in β ladder)trans-69.7130.6166.4-53.20000109.4
132C93.6Very high89.8Confident3 Ų371.2 Ų71.22%0.0235%0.353CS..EExtended strand (participates in β ladder)trans-163174.1-179.153.20000109.8G142 M144 V199 F201C132-G142 PolarHBondContact N-O 3.36Å; C132-G142 CarbonylContact O-C 3.53Å; C132-G142 PolarHBondContact O-N 3.01Å; C132-M144 VanDerWaalsContact SG-CB 3.59Å; C132-V199 WeakPolarHBondContact CA-O 3.37Å; C132-V199 WeakPolarHBondContact CB-O 3.4Å; C132-F201 HydrophobicContact CB-CD1 3.76Å; C132-F201 HydrophobicContact CB-CE1 3.53Å; C132-F201 HydrophobicContact CB-CE2 4.31Å; C132-F201 HydrophobicContact CB-CG 4.25Å; C132-F201 HydrophobicContact CB-CZ 3.84Å
133A93.8Very high90.6Very high7 Ų767.8 Ų67.86%0.05834%0.338CS..EExtended strand (participates in β ladder)trans-119.4145168.600000110.8Y140 F198 V199A133-Y140 CarbonylContact C-O 3.59Å; A133-Y140 WeakPolarHBondContact CA-O 3.48Å; A133-F198 CarbonylContact O-C 3.58Å; A133-F198 WeakPolarHBondContact O-CA 3.46Å; A133-V199 HydrophobicContact CB-CG2 3.92Å; A133-V199 PolarHBondContact N-O 2.9Å; A133-V199 PolarHBondContact O-N 2.86Å
134L93.5Very high91.4Very high0 Ų061 Ų610%030%0.303CS..EExtended strand (participates in β ladder)trans-88.5132.7169.8174.476.6000109.1R136 Y140 F153 I162 I164 F198L134-R136 HydrophobicContact CD2-CG 4.12Å; L134-R136 HydrophobicContact CG-CG 4.24Å; L134-Y140 PolarHBondContact N-O 3.15Å; L134-Y140 PolarHBondContact O-N 2.96Å; L134-F153 HydrophobicContact CB-CD1 4.16Å; L134-F153 HydrophobicContact CB-CE1 3.6Å; L134-F153 HydrophobicContact CB-CZ 3.83Å; L134-F153 HydrophobicContact CD2-CD1 4.41Å; L134-F153 HydrophobicContact CD2-CE1 4.29Å; L134-I162 HydrophobicContact CD2-CG2 4.46Å; L134-I164 HydrophobicContact CD1-CD1 4.12Å; L134-I164 HydrophobicContact CD2-CD1 3.47Å; L134-I164 VanDerWaalsContact CD2-CD1 3.47Å; L134-I164 HydrophobicContact CG-CD1 4.43Å; L134-F198 HydrophobicContact CB-CD1 4.26Å; L134-F198 HydrophobicContact CB-CE1 4.24Å; L134-F198 HydrophobicContact CD1-CD1 3.97Å; L134-F198 HydrophobicContact CD1-CE1 3.62Å; L134-F198 HydrophobicContact CD1-CZ 3.94Å
135Q91.3Very high91.8Very high76 Ų7660.7 Ų60.736%0.35530%0.301SS..EExtended strand (participates in β ladder)trans-98.2114.5173.3-174.2172.50.400110L139 V197 V199Q135-L139 HydrophobicContact CB-CD2 3.8Å; Q135-L139 HydrophobicContact CG-CD2 3.98Å; Q135-V197 HydrophobicContact CB-CB 4.16Å; Q135-V197 HydrophobicContact CB-CG1 4.15Å; Q135-V197 PolarHBondContact N-O 2.77Å; Q135-V199 HydrophobicContact CB-CG1 4.3Å
136R88.4Confident92.1Very high117 Ų11755.2 Ų55.244%0.44227%0.272SS..SBendtrans-129.1-135.6163.2-66.6-179174.5175-1.5106.6L134 M138 Y140 I164L134-R136 HydrophobicContact CD2-CG 4.12Å; L134-R136 HydrophobicContact CG-CG 4.24Å; R136-M138 PolarHBondContact N-O 3.22Å; R136-M138 VanDerWaalsContact N-O 3.12Å; R136-M138 PolarHBondContact O-N 2.89Å; R136-M138 VanDerWaalsContact O-N 3.14Å; R136-Y140 HydrophobicContact CB-CE2 4.22Å; R136-I164 VanDerWaalsContact NH2-CD1 3.34Å
137D86.4Confident92.2Very high154 Ų15454.7 Ų54.782%0.82427%0.269SS*.SBendtrans-52.4-31.7172.4-29.1-39.2000112.7
138M86.5Confident92.3Very high101 Ų10154.3 Ų54.350%0.49827%0.269SS..SBendtrans-136.8171.1172.6-59.1-175.18100110.5R136 Y140 F158R136-M138 PolarHBondContact N-O 3.22Å; R136-M138 VanDerWaalsContact N-O 3.12Å; R136-M138 PolarHBondContact O-N 2.89Å; R136-M138 VanDerWaalsContact O-N 3.14Å; M138-Y140 HydrophobicContact CB-CE1 4.34Å; M138-Y140 HydrophobicContact CB-CE2 4.44Å; M138-F158 HydrophobicContact CE-CE2 4.1Å; M138-F158 HydrophobicContact CE-CZ 4.4Å
139L89.1Confident92.3Very high92 Ų9254.3 Ų54.348%0.48227%0.272SS..EExtended strand (participates in β ladder)trans-85.5113.8170.5-70176.8000110.8Q135 V199Q135-L139 HydrophobicContact CB-CD2 3.8Å; Q135-L139 HydrophobicContact CG-CD2 3.98Å; L139-V199 HydrophobicContact CD2-CG2 3.66Å
140Y93.4Very high92.4Very high14 Ų1455 Ų556%0.05527%0.267CS..EExtended strand (participates in β ladder)trans-100101.4178.2-62.8-65000109.9A133 L134 R136 M138 F153 I162A133-Y140 CarbonylContact C-O 3.59Å; A133-Y140 WeakPolarHBondContact CA-O 3.48Å; L134-Y140 PolarHBondContact N-O 3.15Å; L134-Y140 PolarHBondContact O-N 2.96Å; R136-Y140 HydrophobicContact CB-CE2 4.22Å; M138-Y140 HydrophobicContact CB-CE1 4.34Å; M138-Y140 HydrophobicContact CB-CE2 4.44Å; Y140-F153 WeakPolarHBondContact O-CZ 3.31Å; Y140-I162 HydrophobicContact CD1-CD1 3.47Å; Y140-I162 VanDerWaalsContact CD1-CD1 3.47Å; Y140-I162 HydrophobicContact CD2-CD1 3.74Å; Y140-I162 HydrophobicContact CE1-CD1 3.59Å; Y140-I162 HydrophobicContact CE2-CD1 3.82Å; Y140-I162 HydrophobicContact CG-CD1 3.55Å
141Q93.5Very high92.4Very high137 Ų13753.7 Ų53.764%0.6426%0.262SS*.EExtended strand (participates in β ladder)trans-72.2130.7179.5-175.3178.6-2.800111.5S155 V157Q141-S155 WeakPolarHBondContact O-CB 3.17Å; Q141-S155 PolarHBondContact O-OG 3.19Å; Q141-S155 VanDerWaalsContact O-OG 3.04Å; Q141-V157 HydrophobicContact CB-CG2 4.28Å; Q141-V157 VanDerWaalsContact O-CG2 3.23Å; Q141-V157 WeakPolarHBondContact O-CG2 3.48Å
142G94.6Very high92.4Very high13 Ų1350.5 Ų50.513%0.13424%0.242CC..EExtended strand (participates in β ladder)trans-165.5-153.9-175.600000114.2C132 H154C132-G142 PolarHBondContact N-O 3.36Å; C132-G142 CarbonylContact O-C 3.53Å; C132-G142 PolarHBondContact O-N 3.01Å; G142-H154 CarbonylContact C-O 3.47Å; G142-H154 VanDerWaalsContact CA-O 3.26Å; G142-H154 WeakPolarHBondContact CA-O 3.44Å
143K94.3Very high92.5Very high107 Ų10750.3 Ų50.347%0.46524%0.242SC..EExtended strand (participates in β ladder)trans-130.8130.8175.4-69.1-176.6178.7-179.10110.2Y130 F145 F153 H154Y130-K143 WeakPolarHBondContact O-CA 3.33Å; K143-F145 HydrophobicContact CB-CD2 4.34Å; K143-F145 HydrophobicContact CB-CE2 3.63Å; K143-F145 HydrophobicContact CB-CZ 3.86Å; K143-F145 HydrophobicContact CD-CZ 4.4Å; K143-F145 WeakPolarHBondContact O-CD2 3.43Å; K143-F145 WeakPolarHBondContact O-CE2 3.05Å; K143-F153 WeakPolarHBondContact O-CA 3.39Å; K143-F153 WeakPolarHBondContact O-CD2 3.36Å; K143-H154 PolarHBondContact N-O 2.93Å; K143-H154 PolarHBondContact O-N 2.84Å
144M95.3Very high92.5Very high0 Ų051.7 Ų51.70%025%0.246CC..EExtended strand (participates in β ladder)trans-87138.8165.2-174.81767500108.8S129 Y130 C132 V146 I151 C152 F153 I189 F201 T207 L211S129-M144 CarbonylContact C-O 3.53Å; S129-M144 VanDerWaalsContact CA-O 3.32Å; S129-M144 WeakPolarHBondContact CA-O 3.35Å; Y130-M144 HydrophobicContact CD2-CE 3.51Å; Y130-M144 HydrophobicContact CE2-CE 4.14Å; Y130-M144 HydrophobicContact CG-CE 4.23Å; Y130-M144 PolarHBondContact N-O 3.36Å; Y130-M144 PolarHBondContact O-N 3.11Å; C132-M144 VanDerWaalsContact SG-CB 3.59Å; M144-V146 HydrophobicContact CE-CG2 3.93Å; M144-V146 HydrophobicContact CG-CG2 4.18Å; M144-V146 HydrophobicContact SD-CG2 4.48Å; M144-I151 HydrophobicContact CG-CG2 4.07Å; M144-I151 HydrophobicContact SD-CG2 3.83Å; M144-C152 CarbonylContact C-O 3.6Å; M144-C152 VanDerWaalsContact CA-O 3.32Å; M144-C152 WeakPolarHBondContact CA-O 3.49Å; M144-C152 WeakPolarHBondContact CG-O 3.32Å; M144-F153 HydrophobicContact CB-CD2 4.26Å; M144-I189 HydrophobicContact SD-CD1 4.43Å; M144-F201 HydrophobicContact CE-CE1 3.76Å; M144-F201 HydrophobicContact CE-CZ 4.15Å; M144-F201 HydrophobicContact SD-CE1 4.44Å; M144-F201 HydrophobicContact SD-CZ 4.38Å; M144-T207 HydrophobicContact CE-CG2 3.63Å; M144-L211 HydrophobicContact CE-CD1 4.05Å; M144-L211 HydrophobicContact CE-CD2 4.18Å; M144-L211 HydrophobicContact CE-CG 4.43Å
145F94.6Very high92.6Very high7 Ų751.7 Ų51.73%0.03125%0.247CC..EExtended strand (participates in β ladder)trans-126.2126.5-178.7-65.6-88.6000107.4Y113 L116 F117 L126 K143 C152 H154Y113-F145 HydrophobicContact CD2-CB 3.54Å; Y113-F145 HydrophobicContact CD2-CD1 4.07Å; Y113-F145 AromaticContact CD2-CG 3.85Å; Y113-F145 HydrophobicContact CD2-CG 3.85Å; Y113-F145 HydrophobicContact CE2-CB 3.54Å; Y113-F145 HydrophobicContact CE2-CG 4.32Å; L116-F145 HydrophobicContact CD1-CE2 4.06Å; L116-F145 HydrophobicContact CD1-CZ 4.11Å; F117-F145 AromaticContact CE2-CD2 3.75Å; F117-F145 HydrophobicContact CE2-CD2 3.75Å; F117-F145 HydrophobicContact CE2-CE2 4.24Å; F117-F145 HydrophobicContact CE2-CG 4.31Å; F117-F145 HydrophobicContact CZ-CD2 4.2Å; L126-F145 HydrophobicContact CD1-CB 3.71Å; L126-F145 HydrophobicContact CD1-CD1 3.95Å; L126-F145 HydrophobicContact CD1-CG 4.35Å; L126-F145 HydrophobicContact CD2-CD1 3.92Å; K143-F145 HydrophobicContact CB-CD2 4.34Å; K143-F145 HydrophobicContact CB-CE2 3.63Å; K143-F145 HydrophobicContact CB-CZ 3.86Å; K143-F145 HydrophobicContact CD-CZ 4.4Å; K143-F145 WeakPolarHBondContact O-CD2 3.43Å; K143-F145 WeakPolarHBondContact O-CE2 3.05Å; F145-C152 PolarHBondContact N-O 3.22Å; F145-C152 PolarHBondContact O-N 3.12Å; F145-H154 HydrophobicContact CE2-CB 4.39Å
146V94.1Very high92.6Very high0 Ų055.7 Ų55.70%026%0.263CS..EExtended strand (participates in β ladder)trans-121.6117.4-174.2-1720000109K127 Q128 Y130 M144 I151 F210 L211 I214K127-V146 WeakPolarHBondContact CA-O 3.39Å; K127-V146 WeakPolarHBondContact CB-O 3.39Å; K127-V146 PolarHBondContact N-O 3.4Å; Q128-V146 PolarHBondContact N-O 3.13Å; Q128-V146 PolarHBondContact O-N 3.1Å; Y130-V146 HydrophobicContact CD2-CG2 4.28Å; Y130-V146 HydrophobicContact CE2-CG2 4.23Å; M144-V146 HydrophobicContact CE-CG2 3.93Å; M144-V146 HydrophobicContact CG-CG2 4.18Å; M144-V146 HydrophobicContact SD-CG2 4.48Å; V146-I151 HydrophobicContact CG1-CG1 4.29Å; V146-F210 HydrophobicContact CB-CE1 4.03Å; V146-F210 HydrophobicContact CG1-CD1 4.47Å; V146-F210 HydrophobicContact CG1-CE1 3.87Å; V146-L211 HydrophobicContact CG1-CD2 4.06Å; V146-L211 HydrophobicContact CG2-CD2 3.83Å; V146-I214 HydrophobicContact CG1-CD1 3.59Å
147S93.1Very high92.6Very high0 Ų052 Ų520%025%0.253CS..  trans-105.2-167.7175.1-650000109.9Y113 E124 W150Y113-S147 WeakPolarHBondContact CE1-OG 3.43Å; Y113-S147 VanDerWaalsContact CZ-OG 3.25Å; Y113-S147 PolarHBondContact OH-OG 3.21Å; Y113-S147 VanDerWaalsContact OH-OG 3.09Å; E124-S147 VanDerWaalsContact OE2-CB 3.31Å; E124-S147 WeakPolarHBondContact OE2-CB 3.4Å; S147-W150 PolarHBondContact N-O 3.34Å
148Q90.8Very high92.3Very high87 Ų8751.6 Ų51.641%0.40724%0.244SC..SBendtrans-72.6-38.6-178-168.362.354.800112.3E124 K127E124-Q148 PolarHBondContact OE2-N 2.99Å; K127-Q148 VanDerWaalsContact CE-OE1 3.22Å
149N91.5Very high92.1Very high84 Ų8450.3 Ų50.345%0.44926%0.257SS..SBendtrans-120.70.8-175.5-37.1-55000113.4E124 V168E124-N149 WeakPolarHBondContact OE1-CB 3.3Å; E124-N149 PolarHBondContact OE1-ND2 2.98Å; E124-N149 PolarHBondContact OE2-N 3.18Å; N149-V168 WeakPolarHBondContact O-CB 3.45Å; N149-V168 WeakPolarHBondContact O-CG2 3.48Å; N149-V168 PolarHBondContact O-N 3.41Å
150W93.5Very high91.9Very high60 Ų6052 Ų5223%0.22726%0.26CS..EExtended strand (participates in β ladder)trans-135.6142.4179-62.378000113.8V120 E124 S147 I166 P167V120-W150 HydrophobicContact CG1-CG 4.28Å; V120-W150 HydrophobicContact CG2-CB 4.39Å; V120-W150 HydrophobicContact CG2-CD2 4.05Å; V120-W150 HydrophobicContact CG2-CE3 4.43Å; V120-W150 HydrophobicContact CG2-CG 4.03Å; E124-W150 PolarHBondContact OE1-NE1 3.14Å; S147-W150 PolarHBondContact N-O 3.34Å; W150-I166 WeakPolarHBondContact CA-O 3.4Å; W150-P167 HydrophobicContact CE3-CG 4.08Å; W150-P167 HydrophobicContact CH2-CG 3.88Å; W150-P167 HydrophobicContact CZ2-CG 4.49Å; W150-P167 HydrophobicContact CZ3-CG 3.64Å
151I94.5Very high91.8Very high0 Ų055.5 Ų55.50%028%0.28CS..EExtended strand (participates in β ladder)trans-110.8108.3165.8-61.2158.3000106.8M144 V146 I166 V168 V171 I189 L211M144-I151 HydrophobicContact CG-CG2 4.07Å; M144-I151 HydrophobicContact SD-CG2 3.83Å; V146-I151 HydrophobicContact CG1-CG1 4.29Å; I151-I166 HydrophobicContact CB-CB 4.45Å; I151-I166 HydrophobicContact CG2-CD1 4.5Å; I151-I166 PolarHBondContact N-O 2.86Å; I151-I166 WeakPolarHBondContact O-CB 3.49Å; I151-I166 PolarHBondContact O-N 3.23Å; I151-V168 HydrophobicContact CD1-CG2 4.32Å; I151-V168 HydrophobicContact CG1-CG2 4.18Å; I151-V171 HydrophobicContact CD1-CG2 4.05Å; I151-I189 HydrophobicContact CD1-CD1 4.41Å; I151-I189 HydrophobicContact CG2-CD1 4.03Å; I151-L211 HydrophobicContact CD1-CD2 3.86Å; I151-L211 HydrophobicContact CG1-CD2 3.95Å; I151-L211 HydrophobicContact CG2-CD2 4.45Å
152C94.6Very high91.7Very high1 Ų150.1 Ų50.11%0.00726%0.255CS..EExtended strand (participates in β ladder)trans-111153-178.9-55.80000111.4Y113 F117 M144 F145 I164Y113-C152 HydrophobicContact CE2-CB 3.98Å; Y113-C152 PolarHBondContact OH-SG 2.78Å; Y113-C152 VanDerWaalsContact OH-SG 3.37Å; F117-C152 HydrophobicContact CD1-CB 3.9Å; F117-C152 HydrophobicContact CD2-CB 4.02Å; F117-C152 HydrophobicContact CE1-CB 3.66Å; F117-C152 HydrophobicContact CE2-CB 3.78Å; F117-C152 HydrophobicContact CG-CB 4.07Å; F117-C152 HydrophobicContact CZ-CB 3.58Å; M144-C152 CarbonylContact C-O 3.6Å; M144-C152 VanDerWaalsContact CA-O 3.32Å; M144-C152 WeakPolarHBondContact CA-O 3.49Å; M144-C152 WeakPolarHBondContact CG-O 3.32Å; F145-C152 PolarHBondContact N-O 3.22Å; F145-C152 PolarHBondContact O-N 3.12Å; C152-I164 CarbonylContact C-O 3.42Å; C152-I164 WeakPolarHBondContact CA-O 3.46Å; C152-I164 WeakPolarHBondContact CB-O 3.49Å
153F95.8Very high91.7Very high0 Ų053.8 Ų53.80%027%0.267CS..EExtended strand (participates in β ladder)trans-137.6136.7175.7175.1-94.5000110.5F117 L134 Y140 K143 M144 K163 I164 F198F117-F153 WeakPolarHBondContact CE1-O 3.49Å; L134-F153 HydrophobicContact CB-CD1 4.16Å; L134-F153 HydrophobicContact CB-CE1 3.6Å; L134-F153 HydrophobicContact CB-CZ 3.83Å; L134-F153 HydrophobicContact CD2-CD1 4.41Å; L134-F153 HydrophobicContact CD2-CE1 4.29Å; Y140-F153 WeakPolarHBondContact O-CZ 3.31Å; K143-F153 WeakPolarHBondContact O-CA 3.39Å; K143-F153 WeakPolarHBondContact O-CD2 3.36Å; M144-F153 HydrophobicContact CB-CD2 4.26Å; F153-K163 CarbonylContact O-C 3.42Å; F153-K163 WeakPolarHBondContact O-CA 3.43Å; F153-I164 HydrophobicContact CB-CB 4.33Å; F153-I164 PolarHBondContact N-O 3.34Å; F153-I164 PolarHBondContact O-N 3.27Å; F153-F198 HydrophobicContact CB-CE1 3.83Å; F153-F198 HydrophobicContact CB-CZ 4.28Å; F153-F198 HydrophobicContact CD1-CE1 4.31Å; F153-F198 HydrophobicContact CD2-CD1 4.19Å; F153-F198 AromaticContact CD2-CE1 3.79Å; F153-F198 HydrophobicContact CD2-CE1 3.79Å; F153-F198 HydrophobicContact CE2-CE1 4.45Å; F153-F198 AromaticContact CG-CE1 3.71Å; F153-F198 HydrophobicContact CG-CE1 3.71Å
154H94.9Very high91.7Very high35 Ų3549.4 Ų49.416%0.16225%0.249CC..EExtended strand (participates in β ladder)trans-132130.8176.2162.7-116.7000110.5L116 F117 G142 K143 F145 D161 I162 K163L116-H154 HydrophobicContact CD1-CB 4.21Å; F117-H154 HydrophobicContact CE1-CB 4.33Å; F117-H154 HydrophobicContact CE2-CB 4.3Å; F117-H154 HydrophobicContact CZ-CB 3.6Å; G142-H154 CarbonylContact C-O 3.47Å; G142-H154 VanDerWaalsContact CA-O 3.26Å; G142-H154 WeakPolarHBondContact CA-O 3.44Å; K143-H154 PolarHBondContact N-O 2.93Å; K143-H154 PolarHBondContact O-N 2.84Å; F145-H154 HydrophobicContact CE2-CB 4.39Å; H154-D161 IonicContact CD2-OD1 3.19Å; H154-D161 PolarHBondContact CD2-OD1 2.9Å; H154-D161 IonicContact NE2-OD1 3.81Å; H154-I162 WeakPolarHBondContact CA-O 3.18Å; H154-K163 HydrophobicContact CB-CG 4.36Å
155S94.6Very high91.6Very high1 Ų151.4 Ų51.41%0.00726%0.263CS..EExtended strand (participates in β ladder)trans-136.3135.4176.8161.30000109.5Q141 V157 I162Q141-S155 WeakPolarHBondContact O-CB 3.17Å; Q141-S155 PolarHBondContact O-OG 3.19Å; Q141-S155 VanDerWaalsContact O-OG 3.04Å; S155-V157 WeakPolarHBondContact OG-CG2 3.35Å; S155-I162 PolarHBondContact N-O 3.29Å; S155-I162 PolarHBondContact O-N 3.29Å
156K91.5Very high91.6Very high160 Ų16051.3 Ų51.370%0.69626%0.262SS*.EExtended strand (participates in β ladder)trans-126.988.5172.9-172.4-179.4178.8-178.60109.3K160K156-K160 WeakPolarHBondContact CA-O 3.49Å
157V87.2Confident91.5Very high38 Ų3853.5 Ų53.523%0.2328%0.277CS..EExtended strand (participates in β ladder)trans-137.1143.9-173.2-171.30000108.6Q141 S155 G159 K160Q141-V157 HydrophobicContact CB-CG2 4.28Å; Q141-V157 VanDerWaalsContact O-CG2 3.23Å; Q141-V157 WeakPolarHBondContact O-CG2 3.48Å; S155-V157 WeakPolarHBondContact OG-CG2 3.35Å; V157-G159 PolarHBondContact O-N 3.42Å; V157-K160 PolarHBondContact N-O 2.85Å; V157-K160 PolarHBondContact O-N 2.94Å; V157-K160 VanDerWaalsContact O-N 3.09Å
158F80.6Confident91.5Very high147 Ų14753.6 Ų53.665%0.64528%0.278SS*.THydrogen-bonded Turntrans52.536.8-174.5-52.5-66.4000113.5M138 K160M138-F158 HydrophobicContact CE-CE2 4.1Å; M138-F158 HydrophobicContact CE-CZ 4.4Å; F158-K160 PolarHBondContact O-N 2.87Å
159G82.1Confident91.6Very high73 Ų7355.9 Ų55.975%0.75329%0.29SS*.THydrogen-bonded Turntrans72.7-15.7-177.100000115.6V157V157-G159 PolarHBondContact O-N 3.42Å
160K86.1Confident91.7Very high129 Ų12952.8 Ų52.856%0.56128%0.275SS*.EExtended strand (participates in β ladder)trans-80.9128-179.7-63.5-179.6179.6-179.30110.7K156 V157 F158 I162K156-K160 WeakPolarHBondContact CA-O 3.49Å; V157-K160 PolarHBondContact N-O 2.85Å; V157-K160 PolarHBondContact O-N 2.94Å; V157-K160 VanDerWaalsContact O-N 3.09Å; F158-K160 PolarHBondContact O-N 2.87Å; K160-I162 HydrophobicContact CB-CG1 4.47Å
161D91.2Very high91.7Very high86 Ų8650 Ų5046%0.4626%0.264SS..EExtended strand (participates in β ladder)trans-92.4110.1169.5178.77.3000108.5H154 K163H154-D161 IonicContact CD2-OD1 3.19Å; H154-D161 PolarHBondContact CD2-OD1 2.9Å; H154-D161 IonicContact NE2-OD1 3.81Å; D161-K163 WeakPolarHBondContact OD1-CE 3.34Å; D161-K163 IonicContact OD1-NZ 2.79Å; D161-K163 PolarHBondContact OD1-NZ 3.09Å; D161-K163 IonicContact OD2-NZ 2.88Å; D161-K163 PolarHBondContact OD2-NZ 3.33Å
162I92Very high91.7Very high24 Ų2456.5 Ų56.512%0.12329%0.293CS..EExtended strand (participates in β ladder)trans-111.7118.5-178.9-64.3174.8000108.1L134 Y140 H154 S155 K160L134-I162 HydrophobicContact CD2-CG2 4.46Å; Y140-I162 HydrophobicContact CD1-CD1 3.47Å; Y140-I162 VanDerWaalsContact CD1-CD1 3.47Å; Y140-I162 HydrophobicContact CD2-CD1 3.74Å; Y140-I162 HydrophobicContact CE1-CD1 3.59Å; Y140-I162 HydrophobicContact CE2-CD1 3.82Å; Y140-I162 HydrophobicContact CG-CD1 3.55Å; H154-I162 WeakPolarHBondContact CA-O 3.18Å; S155-I162 PolarHBondContact N-O 3.29Å; S155-I162 PolarHBondContact O-N 3.29Å; K160-I162 HydrophobicContact CB-CG1 4.47Å
163K94Very high91.5Very high91 Ų9160.8 Ų60.840%0.39632%0.315SS..EExtended strand (participates in β ladder)trans-121.6137.9175.5-74.7158.7-179.9149.40110F117 F153 H154 D161F117-K163 HydrophobicContact CE1-CB 4.12Å; F117-K163 HydrophobicContact CE1-CG 4.08Å; F153-K163 CarbonylContact O-C 3.42Å; F153-K163 WeakPolarHBondContact O-CA 3.43Å; H154-K163 HydrophobicContact CB-CG 4.36Å; D161-K163 WeakPolarHBondContact OD1-CE 3.34Å; D161-K163 IonicContact OD1-NZ 2.79Å; D161-K163 PolarHBondContact OD1-NZ 3.09Å; D161-K163 IonicContact OD2-NZ 2.88Å; D161-K163 PolarHBondContact OD2-NZ 3.33Å
164I92.9Very high91.5Very high15 Ų1561.3 Ų61.38%0.07732%0.317CS..EExtended strand (participates in β ladder)trans-132.2138.1174.9-63.8175.4000106.9L134 R136 C152 F153 I166L134-I164 HydrophobicContact CD1-CD1 4.12Å; L134-I164 HydrophobicContact CD2-CD1 3.47Å; L134-I164 VanDerWaalsContact CD2-CD1 3.47Å; L134-I164 HydrophobicContact CG-CD1 4.43Å; R136-I164 VanDerWaalsContact NH2-CD1 3.34Å; C152-I164 CarbonylContact C-O 3.42Å; C152-I164 WeakPolarHBondContact CA-O 3.46Å; C152-I164 WeakPolarHBondContact CB-O 3.49Å; F153-I164 HydrophobicContact CB-CB 4.33Å; F153-I164 PolarHBondContact N-O 3.34Å; F153-I164 PolarHBondContact O-N 3.27Å; I164-I166 HydrophobicContact CG2-CD1 3.74Å; I164-I166 HydrophobicContact CG2-CG1 3.69Å
165S94Very high91.3Very high41 Ų4165.4 Ų65.429%0.28734%0.335SS..EExtended strand (participates in β ladder)trans-134.3106.4172.9-62.90000108.1F117F117-S165 WeakPolarHBondContact CD1-OG 3.34Å
166I93.9Very high91.2Very high5 Ų569.4 Ų69.43%0.02635%0.352CS..EExtended strand (participates in β ladder)trans-102.3117.6-179.4-59.1143.3000107.8W150 I151 I164 V168 V171 T191 F198W150-I166 WeakPolarHBondContact CA-O 3.4Å; I151-I166 HydrophobicContact CB-CB 4.45Å; I151-I166 HydrophobicContact CG2-CD1 4.5Å; I151-I166 PolarHBondContact N-O 2.86Å; I151-I166 WeakPolarHBondContact O-CB 3.49Å; I151-I166 PolarHBondContact O-N 3.23Å; I164-I166 HydrophobicContact CG2-CD1 3.74Å; I164-I166 HydrophobicContact CG2-CG1 3.69Å; I166-V168 PolarHBondContact O-N 3.26Å; I166-V171 HydrophobicContact CG2-CG2 3.85Å; I166-T191 HydrophobicContact CG2-CG2 4Å; I166-F198 HydrophobicContact CD1-CZ 4.47Å
167P93.4Very high90.9Very high47 Ų4763.8 Ų63.831%0.30533%0.331SS..EExtended strand (participates in β ladder)trans-58.4133.5166.8-2130.8000110.3W150 M169 S170W150-P167 HydrophobicContact CE3-CG 4.08Å; W150-P167 HydrophobicContact CH2-CG 3.88Å; W150-P167 HydrophobicContact CZ2-CG 4.49Å; W150-P167 HydrophobicContact CZ3-CG 3.64Å; P167-M169 PolarHBondContact O-N 2.9Å; P167-S170 WeakPolarHBondContact CD-OG 3.27Å; P167-S170 PolarHBondContact O-N 3.04Å; P167-S170 PolarHBondContact O-OG 3.15Å
168V93.1Very high90.5Very high2 Ų269.6 Ų69.61%0.01235%0.353CS..G310 helixtrans-55.3-39.5176.7161.60000110.9N149 I151 I166 S170 V171 I214 C215 H217N149-V168 WeakPolarHBondContact O-CB 3.45Å; N149-V168 WeakPolarHBondContact O-CG2 3.48Å; N149-V168 PolarHBondContact O-N 3.41Å; I151-V168 HydrophobicContact CD1-CG2 4.32Å; I151-V168 HydrophobicContact CG1-CG2 4.18Å; I166-V168 PolarHBondContact O-N 3.26Å; V168-S170 PolarHBondContact O-N 3.31Å; V168-V171 WeakPolarHBondContact O-CB 3.43Å; V168-V171 PolarHBondContact O-N 3.43Å; V168-V171 VanDerWaalsContact O-N 3.15Å; V168-I214 HydrophobicContact CG1-CG2 4.32Å; V168-I214 VanDerWaalsContact CG1-O 3.26Å; V168-I214 WeakPolarHBondContact CG1-O 3.36Å; V168-I214 HydrophobicContact CG2-CG2 3.77Å; V168-C215 HydrophobicContact CG1-CB 4.3Å; V168-H217 PolarHBondContact O-CE1 3.46Å; V168-H217 PolarHBondContact O-NE2 3.23Å
169M91.7Very high89.9Confident134 Ų13464.8 Ų64.866%0.6634%0.336SS*.G310 helixtrans-64.1-19.9177.2-57.6-70.189.700114.3P167P167-M169 PolarHBondContact O-N 2.9Å
170S93.4Very high88.4Confident19 Ų1966.1 Ų66.113%0.13334%0.34CS..G310 helixtrans-91.4-5.4176.469.90000113.6P167 V168 K172 T191 T192P167-S170 WeakPolarHBondContact CD-OG 3.27Å; P167-S170 PolarHBondContact O-N 3.04Å; P167-S170 PolarHBondContact O-OG 3.15Å; V168-S170 PolarHBondContact O-N 3.31Å; S170-K172 PolarHBondContact O-N 3.07Å; S170-T191 CarbonylContact O-C 3.6Å; S170-T191 VanDerWaalsContact O-C 3.28Å; S170-T191 VanDerWaalsContact O-CA 3.3Å; S170-T191 WeakPolarHBondContact O-CA 3.43Å; S170-T191 WeakPolarHBondContact OG-CG2 3.47Å; S170-T192 PolarHBondContact O-N 2.72Å
171V94.8Very high87Confident2 Ų268 Ų681%0.01236%0.355CS..EExtended strand (participates in β ladder)trans-71.9121.5173.3-175.60000109.3I151 I166 V168 I174 I189 G190 H217 L218I151-V171 HydrophobicContact CD1-CG2 4.05Å; I166-V171 HydrophobicContact CG2-CG2 3.85Å; V168-V171 WeakPolarHBondContact O-CB 3.43Å; V168-V171 PolarHBondContact O-N 3.43Å; V168-V171 VanDerWaalsContact O-N 3.15Å; V171-I174 HydrophobicContact CG1-CD1 4.24Å; V171-I174 HydrophobicContact CG1-CG1 3.79Å; V171-I189 HydrophobicContact CB-CG2 4.47Å; V171-I189 HydrophobicContact CG1-CG2 3.78Å; V171-I189 HydrophobicContact CG2-CG2 3.87Å; V171-G190 CarbonylContact C-O 3.28Å; V171-G190 WeakPolarHBondContact CA-O 3.32Å; V171-H217 PolarHBondContact O-CD2 3.25Å; V171-H217 PolarHBondContact O-NE2 2.99Å; V171-L218 HydrophobicContact CG1-CD1 3.87Å; V171-L218 HydrophobicContact CG1-CD2 4.36Å; V171-L218 WeakPolarHBondContact O-CD2 3.45Å
172K93.5Very high85.3Confident137 Ų13771.5 Ų71.560%0.59637%0.373SS*.EExtended strand (participates in β ladder)trans-95-27.3173.6-72.1177.2173.6161.20113.2S170 G190 T192 L218S170-K172 PolarHBondContact O-N 3.07Å; K172-G190 PolarHBondContact N-O 3.45Å; K172-T192 PolarHBondContact NZ-O 2.91Å; K172-L218 VanDerWaalsContact O-CD2 3.28Å; K172-L218 WeakPolarHBondContact O-CD2 3.29Å
173L91.9Very high83.7Confident91 Ų9172.1 Ų72.148%0.47638%0.378SS..EExtended strand (participates in β ladder)trans-152.4143.5-175.4-178.161.8000112K175 I189 G190L173-K175 HydrophobicContact CD2-CB 4.41Å; L173-K175 HydrophobicContact CG-CB 4.4Å; L173-I189 CarbonylContact O-C 3.55Å; L173-G190 PolarHBondContact N-O 3.39Å; L173-G190 PolarHBondContact O-N 2.94Å
174I94.1Very high82.4Confident10 Ų1071 Ų715%0.05138%0.38CS..EExtended strand (participates in β ladder)trans-126.1118.3164.6-60.9175.5000108.3V171 L187 V188 F208 L211 C215 L218V171-I174 HydrophobicContact CG1-CD1 4.24Å; V171-I174 HydrophobicContact CG1-CG1 3.79Å; I174-L187 HydrophobicContact CG2-CD1 4.36Å; I174-L187 HydrophobicContact CG2-CD2 4.09Å; I174-L187 HydrophobicContact CG2-CG 4.29Å; I174-V188 WeakPolarHBondContact CA-O 3.49Å; I174-F208 HydrophobicContact CG2-CD2 3.73Å; I174-F208 HydrophobicContact CG2-CE2 3.81Å; I174-F208 WeakPolarHBondContact O-CE2 3.38Å; I174-L211 HydrophobicContact CD1-CB 3.84Å; I174-C215 HydrophobicContact CD1-CB 4.42Å; I174-L218 HydrophobicContact CB-CD1 4.29Å; I174-L218 HydrophobicContact CD1-CD1 3.54Å; I174-L218 HydrophobicContact CG1-CD1 3.59Å
175K91.8Very high82Confident122 Ų12273.3 Ų73.353%0.5339%0.392SS..EExtended strand (participates in β ladder)trans-125136.9-174.6-174.2174.3179.6178.40111.2L173 L187 V188L173-K175 HydrophobicContact CD2-CB 4.41Å; L173-K175 HydrophobicContact CG-CB 4.4Å; K175-L187 WeakPolarHBondContact O-CA 3.21Å; K175-V188 HydrophobicContact CB-CB 4.44Å; K175-V188 PolarHBondContact N-O 3.35Å; K175-V188 PolarHBondContact O-N 2.8Å
176K91.7Very high81.7Confident85 Ų8571.3 Ų71.337%0.3738%0.379SS..EExtended strand (participates in β ladder)trans-81.9131.6167.2-60.5177.7-170.1168.80108.5F208K176-F208 HydrophobicContact CD-CD1 4.43Å; K176-F208 HydrophobicContact CD-CD2 4.24Å; K176-F208 HydrophobicContact CD-CE2 4.46Å; K176-F208 HydrophobicContact CD-CG 4.21Å; K176-F208 HydrophobicContact CG-CB 4.42Å; K176-F208 HydrophobicContact CG-CD1 4.5Å; K176-F208 HydrophobicContact CG-CD2 3.46Å; K176-F208 VanDerWaalsContact CG-CD2 3.46Å; K176-F208 HydrophobicContact CG-CE2 3.7Å; K176-F208 HydrophobicContact CG-CG 3.89Å; K176-F208 HydrophobicContact CG-CZ 4.3Å
177T85.4Confident81.7Confident41 Ų4171.1 Ų71.125%0.25238%0.377SS..EExtended strand (participates in β ladder)trans-126.9151.8178.7-620000109.4A186 V188T177-A186 PolarHBondContact N-O 3.48Å; T177-A186 VanDerWaalsContact N-O 3.07Å; T177-A186 WeakPolarHBondContact O-CB 3.27Å; T177-A186 PolarHBondContact O-N 2.86Å; T177-V188 WeakPolarHBondContact OG1-CG2 3.4Å
178K79.4Confident81.7Confident160 Ų16069.5 Ų69.570%0.69637%0.367SS*.EExtended strand (participates in β ladder)trans-112.6116.1162.3-64.9179.4179.2-1800105.9A180 P184K178-A180 PolarHBondContact O-N 3.18Å; K178-P184 HydrophobicContact CG-CB 4.37Å
179T67.4Low81.8Confident47 Ų4769.4 Ų69.429%0.28837%0.366SS..EExtended strand (participates in β ladder)trans-79.9121.9179-54.40000108.3L181 L182 V183T179-L181 PolarHBondContact O-N 3.07Å; T179-L182 PolarHBondContact O-N 3.03Å; T179-V183 PolarHBondContact N-O 2.65Å; T179-V183 PolarHBondContact O-N 3.28Å
180A51.8Low81.9Confident100 Ų10063.1 Ų63.183%0.82634%0.336SS*.THydrogen-bonded Turntrans-63.5-9.7-146.700000118.1K178K178-A180 PolarHBondContact O-N 3.18Å
181L55.1Low82Confident168 Ų16862.8 Ų62.888%0.8833%0.333SS*.THydrogen-bonded Turntrans-113.2-20.5-174.7-117.171000116.1T179T179-L181 PolarHBondContact O-N 3.07Å
182L55.6Low81.8Confident160 Ų16065.6 Ų65.684%0.83835%0.35SS*.THydrogen-bonded Turntrans-161.1-24.3-176-147.968.4000116.8T179 P184T179-L182 PolarHBondContact O-N 3.03Å; L182-P184 VanDerWaalsContact O-CD 3.31Å; L182-P184 WeakPolarHBondContact O-CD 3.28Å
183V59.2Low81.6Confident37 Ų3765.5 Ų65.522%0.22436%0.356CS..EExtended strand (participates in β ladder)trans-117.895.2-168.9-167.90000112.3T179 N185 V199T179-V183 PolarHBondContact N-O 2.65Å; T179-V183 PolarHBondContact O-N 3.28Å; V183-N185 PolarHBondContact O-N 2.87Å; V183-V199 HydrophobicContact CG1-CB 4.1Å
184P66.3Low81.6Confident67 Ų6765.7 Ų65.744%0.43536%0.357SS..EExtended strand (participates in β ladder)trans-73.1-16.3174.530.1-35.3000112.9K178 L182 A186 R204K178-P184 HydrophobicContact CG-CB 4.37Å; L182-P184 VanDerWaalsContact O-CD 3.31Å; L182-P184 WeakPolarHBondContact O-CD 3.28Å; P184-A186 VanDerWaalsContact C-N 3.31Å; P184-A186 PolarHBondContact O-N 3.35Å; P184-R204 PolarHBondContact O-NH1 3.01Å
185N83.9Confident81.5Confident64 Ų6470.2 Ų70.234%0.34238%0.381SS..EExtended strand (participates in β ladder)trans-92.644.4-174.5-72.2-18.1000113.4V183 V199 S200 F201V183-N185 PolarHBondContact O-N 2.87Å; N185-V199 CarbonylContact O-C 3.55Å; N185-S200 PolarHBondContact O-N 3.36Å; N185-F201 WeakPolarHBondContact CB-O 3.38Å; N185-F201 PolarHBondContact ND2-O 2.91Å; N185-F201 PolarHBondContact O-N 3.48Å
186A89.4Confident81.6Confident0 Ų065.1 Ų65.10%036%0.359CS..EExtended strand (participates in β ladder)trans-99146.517700000113T177 P184 F198 V199 R204T177-A186 PolarHBondContact N-O 3.48Å; T177-A186 VanDerWaalsContact N-O 3.07Å; T177-A186 WeakPolarHBondContact O-CB 3.27Å; T177-A186 PolarHBondContact O-N 2.86Å; P184-A186 VanDerWaalsContact C-N 3.31Å; P184-A186 PolarHBondContact O-N 3.35Å; A186-F198 CarbonylContact C-O 3.52Å; A186-F198 WeakPolarHBondContact CA-O 3.4Å; A186-V199 HydrophobicContact CB-CG1 3.91Å; A186-R204 WeakPolarHBondContact O-CD 3.49Å
187L93.6Very high81.7Confident0 Ų062.9 Ų62.90%035%0.352CS..EExtended strand (participates in β ladder)trans-141.8129.2177.5-178.5153.3000108.1I174 K175 I189 F198 F201 R204 F208 L211I174-L187 HydrophobicContact CG2-CD1 4.36Å; I174-L187 HydrophobicContact CG2-CD2 4.09Å; I174-L187 HydrophobicContact CG2-CG 4.29Å; K175-L187 WeakPolarHBondContact O-CA 3.21Å; L187-I189 HydrophobicContact CD2-CD1 4.09Å; L187-I189 HydrophobicContact CD2-CG1 3.52Å; L187-F198 PolarHBondContact N-O 2.85Å; L187-F198 PolarHBondContact O-N 2.87Å; L187-F198 VanDerWaalsContact O-O 3.06Å; L187-F201 HydrophobicContact CB-CD2 4.18Å; L187-F201 HydrophobicContact CB-CE2 3.76Å; L187-R204 HydrophobicContact CB-CG 4.44Å; L187-F208 HydrophobicContact CD1-CB 3.85Å; L187-F208 HydrophobicContact CD1-CD2 4.03Å; L187-F208 HydrophobicContact CD1-CG 4.46Å; L187-L211 HydrophobicContact CD1-CD1 4.07Å; L187-L211 HydrophobicContact CD2-CD1 3.94Å
188V93.7Very high82.1Confident14 Ų1460.9 Ų60.99%0.08534%0.34CS..EExtended strand (participates in β ladder)trans-104.1130.8178.7-172.50000108.8I174 K175 T177 D195 H196 V197I174-V188 WeakPolarHBondContact CA-O 3.49Å; K175-V188 HydrophobicContact CB-CB 4.44Å; K175-V188 PolarHBondContact N-O 3.35Å; K175-V188 PolarHBondContact O-N 2.8Å; T177-V188 WeakPolarHBondContact OG1-CG2 3.4Å; V188-D195 HydrophobicContact CG1-CB 4.16Å; V188-H196 WeakPolarHBondContact CA-O 3.36Å; V188-V197 HydrophobicContact CG1-CG2 4.36Å; V188-V197 HydrophobicContact CG2-CG1 4.41Å; V188-V197 HydrophobicContact CG2-CG2 4.12Å
189I95.1Very high82.7Confident0 Ų053.3 Ų53.30%031%0.308CS..EExtended strand (participates in β ladder)trans-110.3103.6170.6-56.5-177.9000106.4M144 I151 V171 L173 L187 H196 F198 L211M144-I189 HydrophobicContact SD-CD1 4.43Å; I151-I189 HydrophobicContact CD1-CD1 4.41Å; I151-I189 HydrophobicContact CG2-CD1 4.03Å; V171-I189 HydrophobicContact CB-CG2 4.47Å; V171-I189 HydrophobicContact CG1-CG2 3.78Å; V171-I189 HydrophobicContact CG2-CG2 3.87Å; L173-I189 CarbonylContact O-C 3.55Å; L187-I189 HydrophobicContact CD2-CD1 4.09Å; L187-I189 HydrophobicContact CD2-CG1 3.52Å; I189-H196 PolarHBondContact N-O 2.91Å; I189-H196 PolarHBondContact O-N 3.23Å; I189-F198 HydrophobicContact CB-CE2 4.41Å; I189-F198 HydrophobicContact CD1-CD2 4.01Å; I189-F198 HydrophobicContact CD1-CE2 3.87Å; I189-F198 HydrophobicContact CG1-CD2 4.18Å; I189-F198 HydrophobicContact CG1-CE2 4.25Å; I189-L211 HydrophobicContact CD1-CD1 4.11Å
190G93.6Very high83.8Confident2 Ų254 Ų542%0.02131%0.314CS..EExtended strand (participates in β ladder)trans-81.5122174.200000110V171 K172 L173 D195V171-G190 CarbonylContact C-O 3.28Å; V171-G190 WeakPolarHBondContact CA-O 3.32Å; K172-G190 PolarHBondContact N-O 3.45Å; L173-G190 PolarHBondContact N-O 3.39Å; L173-G190 PolarHBondContact O-N 2.94Å; G190-D195 WeakPolarHBondContact CA-OD1 3.41Å
191T93.9Very high85.6Confident12 Ų1249.3 Ų49.37%0.07428%0.275CS..EExtended strand (participates in β ladder)trans-98.7-179.1-179.2-45.30000109.5I166 S170 D193 I194I166-T191 HydrophobicContact CG2-CG2 4Å; S170-T191 CarbonylContact O-C 3.6Å; S170-T191 VanDerWaalsContact O-C 3.28Å; S170-T191 VanDerWaalsContact O-CA 3.3Å; S170-T191 WeakPolarHBondContact O-CA 3.43Å; S170-T191 WeakPolarHBondContact OG-CG2 3.47Å; T191-D193 PolarHBondContact O-N 3.37Å; T191-I194 WeakPolarHBondContact CB-O 3.49Å; T191-I194 PolarHBondContact N-O 3.06Å; T191-I194 PolarHBondContact OG1-O 3.44Å
192T90.9Very high87.3Confident61 Ų6148 Ų4837%0.37427%0.268SS..SBendtrans-54.7-39.2172.141.10000112.6S170 K172S170-T192 PolarHBondContact O-N 2.72Å; K172-T192 PolarHBondContact NZ-O 2.91Å
193D89Confident88.9Confident134 Ų13443.6 Ų43.672%0.71725%0.251SS*.SBendtrans-110.4-39-164-28.8-43.1000112.7T191T191-D193 PolarHBondContact O-N 3.37Å
194I92.1Very high90.4Very high96 Ų9643.8 Ų43.849%0.49225%0.248SC..  trans-149.2150.1-174.252.4-178.3000112.9T191 H196T191-I194 WeakPolarHBondContact CB-O 3.49Å; T191-I194 PolarHBondContact N-O 3.06Å; T191-I194 PolarHBondContact OG1-O 3.44Å; I194-H196 WeakPolarHBondContact CD1-CE1 3.26Å
195D92.1Very high91.6Very high105 Ų10544.7 Ų44.756%0.56125%0.249SC*.EExtended strand (participates in β ladder)trans-85.1132.1173.1-89.122.6000111.4V188 G190V188-D195 HydrophobicContact CG1-CB 4.16Å; G190-D195 WeakPolarHBondContact CA-OD1 3.41Å
196H94.3Very high92Very high14 Ų1446.4 Ų46.47%0.06526%0.258CS..EExtended strand (participates in β ladder)trans-110.6109.6176.9-69.9-36.4000111.1V188 I189 I194 F198V188-H196 WeakPolarHBondContact CA-O 3.36Å; I189-H196 PolarHBondContact N-O 2.91Å; I189-H196 PolarHBondContact O-N 3.23Å; I194-H196 WeakPolarHBondContact CD1-CE1 3.26Å; H196-F198 HydrophobicContact CB-CD2 4.24Å; H196-F198 HydrophobicContact CB-CE2 3.55Å; H196-F198 HydrophobicContact CB-CZ 4.13Å
197V93.3Very high92.2Very high38 Ų3846.5 Ų46.523%0.2326%0.258CS..EExtended strand (participates in β ladder)trans-88.7113177.2-174.20000109.4Q135 V188 V199Q135-V197 HydrophobicContact CB-CB 4.16Å; Q135-V197 HydrophobicContact CB-CG1 4.15Å; Q135-V197 PolarHBondContact N-O 2.77Å; V188-V197 HydrophobicContact CG1-CG2 4.36Å; V188-V197 HydrophobicContact CG2-CG1 4.41Å; V188-V197 HydrophobicContact CG2-CG2 4.12Å; V197-V199 HydrophobicContact CG1-CG1 4.06Å
198F94.4Very high92.2Very high0 Ų048 Ų480%027%0.265CS..EExtended strand (participates in β ladder)trans-107.2140.1173.1-63.5-85.4000110.1A133 L134 F153 I166 A186 L187 I189 H196 F201A133-F198 CarbonylContact O-C 3.58Å; A133-F198 WeakPolarHBondContact O-CA 3.46Å; L134-F198 HydrophobicContact CB-CD1 4.26Å; L134-F198 HydrophobicContact CB-CE1 4.24Å; L134-F198 HydrophobicContact CD1-CD1 3.97Å; L134-F198 HydrophobicContact CD1-CE1 3.62Å; L134-F198 HydrophobicContact CD1-CZ 3.94Å; F153-F198 HydrophobicContact CB-CE1 3.83Å; F153-F198 HydrophobicContact CB-CZ 4.28Å; F153-F198 HydrophobicContact CD1-CE1 4.31Å; F153-F198 HydrophobicContact CD2-CD1 4.19Å; F153-F198 AromaticContact CD2-CE1 3.79Å; F153-F198 HydrophobicContact CD2-CE1 3.79Å; F153-F198 HydrophobicContact CE2-CE1 4.45Å; F153-F198 AromaticContact CG-CE1 3.71Å; F153-F198 HydrophobicContact CG-CE1 3.71Å; I166-F198 HydrophobicContact CD1-CZ 4.47Å; A186-F198 CarbonylContact C-O 3.52Å; A186-F198 WeakPolarHBondContact CA-O 3.4Å; L187-F198 PolarHBondContact N-O 2.85Å; L187-F198 PolarHBondContact O-N 2.87Å; L187-F198 VanDerWaalsContact O-O 3.06Å; I189-F198 HydrophobicContact CB-CE2 4.41Å; I189-F198 HydrophobicContact CD1-CD2 4.01Å; I189-F198 HydrophobicContact CD1-CE2 3.87Å; I189-F198 HydrophobicContact CG1-CD2 4.18Å; I189-F198 HydrophobicContact CG1-CE2 4.25Å; H196-F198 HydrophobicContact CB-CD2 4.24Å; H196-F198 HydrophobicContact CB-CE2 3.55Å; H196-F198 HydrophobicContact CB-CZ 4.13Å; F198-F201 HydrophobicContact CB-CE2 3.42Å; F198-F201 VanDerWaalsContact CB-CE2 3.42Å; F198-F201 HydrophobicContact CB-CZ 3.5Å; F198-F201 HydrophobicContact CG-CZ 4.33Å
199V92.4Very high92.2Very high1 Ų154.9 Ų54.91%0.00629%0.294CS..EExtended strand (participates in β ladder)trans-134174-172.6-51.50000111.9C132 A133 Q135 L139 V183 N185 A186 V197 F201C132-V199 WeakPolarHBondContact CA-O 3.37Å; C132-V199 WeakPolarHBondContact CB-O 3.4Å; A133-V199 HydrophobicContact CB-CG2 3.92Å; A133-V199 PolarHBondContact N-O 2.9Å; A133-V199 PolarHBondContact O-N 2.86Å; Q135-V199 HydrophobicContact CB-CG1 4.3Å; L139-V199 HydrophobicContact CD2-CG2 3.66Å; V183-V199 HydrophobicContact CG1-CB 4.1Å; N185-V199 CarbonylContact O-C 3.55Å; A186-V199 HydrophobicContact CB-CG1 3.91Å; V197-V199 HydrophobicContact CG1-CG1 4.06Å; V199-F201 VanDerWaalsContact C-N 3.27Å; V199-F201 PolarHBondContact O-N 2.88Å
200S89.6Confident92.1Very high61 Ų6157.3 Ų57.343%0.42731%0.305SS..  trans59.730.3176.5-54.20000115N185 L202N185-S200 PolarHBondContact O-N 3.36Å; S200-L202 PolarHBondContact O-N 2.86Å
201F90.9Very high92.2Very high1 Ų157.2 Ų57.20%0.00430%0.304CS..  trans-68.5126.1170.5-69.2-78.9000111.4C132 M144 N185 L187 F198 V199 S203 R204 T207C132-F201 HydrophobicContact CB-CD1 3.76Å; C132-F201 HydrophobicContact CB-CE1 3.53Å; C132-F201 HydrophobicContact CB-CE2 4.31Å; C132-F201 HydrophobicContact CB-CG 4.25Å; C132-F201 HydrophobicContact CB-CZ 3.84Å; M144-F201 HydrophobicContact CE-CE1 3.76Å; M144-F201 HydrophobicContact CE-CZ 4.15Å; M144-F201 HydrophobicContact SD-CE1 4.44Å; M144-F201 HydrophobicContact SD-CZ 4.38Å; N185-F201 WeakPolarHBondContact CB-O 3.38Å; N185-F201 PolarHBondContact ND2-O 2.91Å; N185-F201 PolarHBondContact O-N 3.48Å; L187-F201 HydrophobicContact CB-CD2 4.18Å; L187-F201 HydrophobicContact CB-CE2 3.76Å; F198-F201 HydrophobicContact CB-CE2 3.42Å; F198-F201 VanDerWaalsContact CB-CE2 3.42Å; F198-F201 HydrophobicContact CB-CZ 3.5Å; F198-F201 HydrophobicContact CG-CZ 4.33Å; V199-F201 VanDerWaalsContact C-N 3.27Å; V199-F201 PolarHBondContact O-N 2.88Å; F201-S203 PolarHBondContact O-N 2.89Å; F201-R204 HydrophobicContact CB-CB 4.06Å; F201-T207 HydrophobicContact CD1-CG2 4.01Å; F201-T207 HydrophobicContact CE1-CG2 3.84Å; F201-T207 HydrophobicContact CZ-CG2 4.46Å
202L88.9Confident92.1Very high141 Ų14158.7 Ų58.774%0.73831%0.309SS*.THydrogen-bonded Turntrans-57.4-36.6172.7-7869.2000112.1S200S200-L202 PolarHBondContact O-N 2.86Å
203S89.3Confident92.1Very high68 Ų6859.9 Ų59.948%0.47632%0.32SS..THydrogen-bonded Turntrans-135.150.1-173.4-50.40000112.3F201 N205 N206 T207F201-S203 PolarHBondContact O-N 2.89Å; S203-N205 PolarHBondContact O-N 3.02Å; S203-N206 WeakPolarHBondContact O-CA 3.48Å; S203-N206 WeakPolarHBondContact O-CB 3.22Å; S203-N206 PolarHBondContact O-N 2.85Å; S203-T207 PolarHBondContact O-N 2.9Å; S203-T207 VanDerWaalsContact O-N 3.09Å; S203-T207 PolarHBondContact O-OG1 3.04Å
204R91.5Very high92.3Very high41 Ų4154.1 Ų54.116%0.15529%0.289CS..Hα-helixtrans-39.1-44.9-177.8-174.3-154.861.4-167.4-1.1113.9P184 A186 L187 F201 N206 F208P184-R204 PolarHBondContact O-NH1 3.01Å; A186-R204 WeakPolarHBondContact O-CD 3.49Å; L187-R204 HydrophobicContact CB-CG 4.44Å; F201-R204 HydrophobicContact CB-CB 4.06Å; R204-N206 PolarHBondContact O-N 2.94Å; R204-F208 VanDerWaalsContact O-CB 3.27Å; R204-F208 WeakPolarHBondContact O-CB 3.5Å; R204-F208 PolarHBondContact O-N 3.25Å
205N91.6Very high92.2Very high86 Ų8649.5 Ų49.546%0.4627%0.265SS..Hα-helixtrans-66.8-33.5-178.3-79.65.4000113.6S203 K209S203-N205 PolarHBondContact O-N 3.02Å; N205-K209 PolarHBondContact O-N 3.22Å
206N92.5Very high91.8Very high100 Ų10048.5 Ų48.554%0.53526%0.264SS..Hα-helixtrans-75.6-48.9175.3-16920.4000110.5S203 R204 F208 K209 F210S203-N206 WeakPolarHBondContact O-CA 3.48Å; S203-N206 WeakPolarHBondContact O-CB 3.22Å; S203-N206 PolarHBondContact O-N 2.85Å; R204-N206 PolarHBondContact O-N 2.94Å; N206-F208 PolarHBondContact O-N 3.09Å; N206-K209 PolarHBondContact O-N 2.91Å; N206-F210 WeakPolarHBondContact O-CB 3.35Å; N206-F210 PolarHBondContact O-N 2.78Å
207T93.5Very high91.4Very high1 Ų150.3 Ų50.31%0.00627%0.273CS..Hα-helixtrans-53.2-41.5174.5-52.50000112Y130 M144 F201 S203 F210 L211Y130-T207 HydrophobicContact CD1-CG2 4.24Å; Y130-T207 VanDerWaalsContact CD1-OG1 3.27Å; Y130-T207 WeakPolarHBondContact CD1-OG1 3.19Å; Y130-T207 HydrophobicContact CD2-CG2 3.89Å; Y130-T207 HydrophobicContact CE1-CG2 4.15Å; Y130-T207 WeakPolarHBondContact CE1-OG1 3.48Å; Y130-T207 HydrophobicContact CE2-CG2 3.76Å; Y130-T207 HydrophobicContact CG-CG2 4.1Å; M144-T207 HydrophobicContact CE-CG2 3.63Å; F201-T207 HydrophobicContact CD1-CG2 4.01Å; F201-T207 HydrophobicContact CE1-CG2 3.84Å; F201-T207 HydrophobicContact CZ-CG2 4.46Å; S203-T207 PolarHBondContact O-N 2.9Å; S203-T207 VanDerWaalsContact O-N 3.09Å; S203-T207 PolarHBondContact O-OG1 3.04Å; T207-F210 PolarHBondContact O-N 3.34Å; T207-L211 HydrophobicContact CG2-CD1 3.93Å; T207-L211 HydrophobicContact CG2-CG 4.3Å; T207-L211 WeakPolarHBondContact O-CB 3.31Å; T207-L211 VanDerWaalsContact O-CG 3.27Å; T207-L211 WeakPolarHBondContact O-CG 3.37Å; T207-L211 PolarHBondContact O-N 3.02Å
208F93.8Very high90.9Very high33 Ų3349.5 Ų49.515%0.14527%0.267CS..Hα-helixtrans-62.6-46.1175.3179.1-89.2000113.5I174 K176 L187 R204 N206 F210 K212I174-F208 HydrophobicContact CG2-CD2 3.73Å; I174-F208 HydrophobicContact CG2-CE2 3.81Å; I174-F208 WeakPolarHBondContact O-CE2 3.38Å; K176-F208 HydrophobicContact CD-CD1 4.43Å; K176-F208 HydrophobicContact CD-CD2 4.24Å; K176-F208 HydrophobicContact CD-CE2 4.46Å; K176-F208 HydrophobicContact CD-CG 4.21Å; K176-F208 HydrophobicContact CG-CB 4.42Å; K176-F208 HydrophobicContact CG-CD1 4.5Å; K176-F208 HydrophobicContact CG-CD2 3.46Å; K176-F208 VanDerWaalsContact CG-CD2 3.46Å; K176-F208 HydrophobicContact CG-CE2 3.7Å; K176-F208 HydrophobicContact CG-CG 3.89Å; K176-F208 HydrophobicContact CG-CZ 4.3Å; L187-F208 HydrophobicContact CD1-CB 3.85Å; L187-F208 HydrophobicContact CD1-CD2 4.03Å; L187-F208 HydrophobicContact CD1-CG 4.46Å; R204-F208 VanDerWaalsContact O-CB 3.27Å; R204-F208 WeakPolarHBondContact O-CB 3.5Å; R204-F208 PolarHBondContact O-N 3.25Å; N206-F208 PolarHBondContact O-N 3.09Å; F208-F210 VanDerWaalsContact C-N 3.33Å; F208-K212 HydrophobicContact CE1-CD 3.78Å; F208-K212 HydrophobicContact CZ-CD 3.98Å; F208-K212 PolarHBondContact O-N 2.95Å; F208-K212 VanDerWaalsContact O-N 3.1Å
209K93.6Very high89.6Confident158 Ų15854.5 Ų54.569%0.68729%0.29SS*.Hα-helixtrans-60.9-46.2176.8-75.9-174.4175.5-168.70110.4N205 N206 K212 S213N205-K209 PolarHBondContact O-N 3.22Å; N206-K209 PolarHBondContact O-N 2.91Å; K209-K212 PolarHBondContact O-N 3.22Å; K209-S213 PolarHBondContact O-N 2.89Å; K209-S213 PolarHBondContact O-OG 3.29Å
210F93.7Very high88Confident51 Ų5158.7 Ų58.722%0.22432%0.316CS..Hα-helixtrans-63.6-48.5-178.7-175.9-101.1000112.9K127 Q128 Y130 V146 N206 T207 F208 K212 S213 I214K127-F210 HydrophobicContact CB-CZ 3.84Å; Q128-F210 HydrophobicContact CB-CD1 4.31Å; Q128-F210 HydrophobicContact CB-CE1 3.5Å; Q128-F210 VanDerWaalsContact CB-CE1 3.5Å; Q128-F210 HydrophobicContact CB-CE2 4.44Å; Q128-F210 HydrophobicContact CB-CZ 3.57Å; Q128-F210 HydrophobicContact CG-CE1 4.24Å; Q128-F210 HydrophobicContact CG-CZ 4.45Å; Y130-F210 HydrophobicContact CE2-CD1 4.02Å; Y130-F210 HydrophobicContact CE2-CE1 4.43Å; Y130-F210 WeakPolarHBondContact OH-CB 3.48Å; Y130-F210 VanDerWaalsContact OH-CD1 3.28Å; Y130-F210 WeakPolarHBondContact OH-CD1 3.43Å; Y130-F210 WeakPolarHBondContact OH-CG 3.3Å; V146-F210 HydrophobicContact CB-CE1 4.03Å; V146-F210 HydrophobicContact CG1-CD1 4.47Å; V146-F210 HydrophobicContact CG1-CE1 3.87Å; N206-F210 WeakPolarHBondContact O-CB 3.35Å; N206-F210 PolarHBondContact O-N 2.78Å; T207-F210 PolarHBondContact O-N 3.34Å; F208-F210 VanDerWaalsContact C-N 3.33Å; F210-K212 VanDerWaalsContact C-N 3.31Å; F210-K212 PolarHBondContact O-N 2.93Å; F210-S213 WeakPolarHBondContact CA-OG 3.43Å; F210-S213 PolarHBondContact O-N 3.48Å; F210-S213 PolarHBondContact O-OG 3.45Å; F210-I214 HydrophobicContact CD1-CD1 4.02Å; F210-I214 HydrophobicContact CE1-CD1 3.4Å; F210-I214 HydrophobicContact CE2-CD1 4.19Å; F210-I214 HydrophobicContact CZ-CD1 3.51Å; F210-I214 PolarHBondContact O-N 3.42Å
211L93.8Very high86.3Confident0 Ų061 Ų610%032%0.323CS..Hα-helixtrans-60.2-41175.9-71.2170.4000111.6M144 V146 I151 I174 L187 I189 T207 I214 C215M144-L211 HydrophobicContact CE-CD1 4.05Å; M144-L211 HydrophobicContact CE-CD2 4.18Å; M144-L211 HydrophobicContact CE-CG 4.43Å; V146-L211 HydrophobicContact CG1-CD2 4.06Å; V146-L211 HydrophobicContact CG2-CD2 3.83Å; I151-L211 HydrophobicContact CD1-CD2 3.86Å; I151-L211 HydrophobicContact CG1-CD2 3.95Å; I151-L211 HydrophobicContact CG2-CD2 4.45Å; I174-L211 HydrophobicContact CD1-CB 3.84Å; L187-L211 HydrophobicContact CD1-CD1 4.07Å; L187-L211 HydrophobicContact CD2-CD1 3.94Å; I189-L211 HydrophobicContact CD1-CD1 4.11Å; T207-L211 HydrophobicContact CG2-CD1 3.93Å; T207-L211 HydrophobicContact CG2-CG 4.3Å; T207-L211 WeakPolarHBondContact O-CB 3.31Å; T207-L211 VanDerWaalsContact O-CG 3.27Å; T207-L211 WeakPolarHBondContact O-CG 3.37Å; T207-L211 PolarHBondContact O-N 3.02Å; L211-I214 PolarHBondContact O-N 3.41Å; L211-C215 PolarHBondContact O-N 2.98Å; L211-C215 VanDerWaalsContact O-N 3.15Å; L211-C215 PolarHBondContact O-SG 3.21Å
212K92.2Very high84.5Confident43 Ų4369.6 Ų69.619%0.18736%0.361CS..Hα-helixtrans-59.5-46.4173.1-98.5-171.6149.4-74.50112.5F208 K209 F210 I214 C215 E219F208-K212 HydrophobicContact CE1-CD 3.78Å; F208-K212 HydrophobicContact CZ-CD 3.98Å; F208-K212 PolarHBondContact O-N 2.95Å; F208-K212 VanDerWaalsContact O-N 3.1Å; K209-K212 PolarHBondContact O-N 3.22Å; F210-K212 VanDerWaalsContact C-N 3.31Å; F210-K212 PolarHBondContact O-N 2.93Å; K212-I214 PolarHBondContact O-N 3.25Å; K212-I214 VanDerWaalsContact O-N 3.11Å; K212-C215 CarbonylContact O-C 3.59Å; K212-C215 PolarHBondContact O-N 3.49Å; K212-E219 IonicContact NZ-OE1 2.57Å; K212-E219 PolarHBondContact NZ-OE1 2.83Å
213S92.1Very high82.6Confident86 Ų8669.7 Ų69.760%0.60136%0.361SS*.Hα-helixtrans-64.4-14.5178.559.20000114.7K209 F210K209-S213 PolarHBondContact O-N 2.89Å; K209-S213 PolarHBondContact O-OG 3.29Å; F210-S213 WeakPolarHBondContact CA-OG 3.43Å; F210-S213 PolarHBondContact O-N 3.48Å; F210-S213 PolarHBondContact O-OG 3.45Å
214I91.9Very high80.3Confident12 Ų1269.9 Ų69.96%0.06236%0.362CS..Hα-helixtrans-94.9-18.7173.6-72.4175.5000111.9V146 V168 F210 L211 K212 P216V146-I214 HydrophobicContact CG1-CD1 3.59Å; V168-I214 HydrophobicContact CG1-CG2 4.32Å; V168-I214 VanDerWaalsContact CG1-O 3.26Å; V168-I214 WeakPolarHBondContact CG1-O 3.36Å; V168-I214 HydrophobicContact CG2-CG2 3.77Å; F210-I214 HydrophobicContact CD1-CD1 4.02Å; F210-I214 HydrophobicContact CE1-CD1 3.4Å; F210-I214 HydrophobicContact CE2-CD1 4.19Å; F210-I214 HydrophobicContact CZ-CD1 3.51Å; F210-I214 PolarHBondContact O-N 3.42Å; L211-I214 PolarHBondContact O-N 3.41Å; K212-I214 PolarHBondContact O-N 3.25Å; K212-I214 VanDerWaalsContact O-N 3.11Å; I214-P216 WeakPolarHBondContact O-CD 3.27Å
215C90Very high77.9Confident0 Ų072.9 Ų72.90%039%0.389CS..  trans-111.867-178.3-540000111.2V168 I174 L211 K212 H217 L218V168-C215 HydrophobicContact CG1-CB 4.3Å; I174-C215 HydrophobicContact CD1-CB 4.42Å; L211-C215 PolarHBondContact O-N 2.98Å; L211-C215 VanDerWaalsContact O-N 3.15Å; L211-C215 PolarHBondContact O-SG 3.21Å; K212-C215 CarbonylContact O-C 3.59Å; K212-C215 PolarHBondContact O-N 3.49Å; C215-H217 VanDerWaalsContact C-N 3.26Å; C215-H217 PolarHBondContact O-N 2.75Å; C215-L218 HydrophobicContact CB-CB 4.47Å; C215-L218 HydrophobicContact CB-CD1 3.45Å; C215-L218 VanDerWaalsContact CB-CD1 3.45Å; C215-L218 HydrophobicContact CB-CG 3.77Å; C215-L218 WeakPolarHBondContact O-CB 3.1Å; C215-L218 PolarHBondContact O-N 2.97Å; C215-L218 VanDerWaalsContact O-N 3.09Å
216P84.8Confident75.4Confident83 Ų8373.6 Ų73.654%0.53940%0.401SS..THydrogen-bonded Turntrans-63.4-28.9-169.726.7-36.3000113.6I214 L218 E219I214-P216 WeakPolarHBondContact O-CD 3.27Å; P216-L218 PolarHBondContact O-N 3.48Å; P216-E219 PolarHBondContact O-N 3.42Å; P216-E219 VanDerWaalsContact O-N 3.1Å
217H86.3Confident73.2Confident53 Ų5374.7 Ų74.725%0.24541%0.413CS..Hα-helixtrans-59.4-29.317659.5-64.9000112.9V168 V171 C215 E219 V220V168-H217 PolarHBondContact O-CE1 3.46Å; V168-H217 PolarHBondContact O-NE2 3.23Å; V171-H217 PolarHBondContact O-CD2 3.25Å; V171-H217 PolarHBondContact O-NE2 2.99Å; C215-H217 VanDerWaalsContact C-N 3.26Å; C215-H217 PolarHBondContact O-N 2.75Å; H217-E219 PolarHBondContact O-N 3.09Å; H217-E219 VanDerWaalsContact O-N 3.12Å; H217-V220 PolarHBondContact O-N 3.41Å
218L82.7Confident70.7Confident20 Ų2080.5 Ų80.511%0.10545%0.448CS..Hα-helixtrans-69.3-4.3176.4-60.3-177.7000114.7V171 K172 I174 C215 P216V171-L218 HydrophobicContact CG1-CD1 3.87Å; V171-L218 HydrophobicContact CG1-CD2 4.36Å; V171-L218 WeakPolarHBondContact O-CD2 3.45Å; K172-L218 VanDerWaalsContact O-CD2 3.28Å; K172-L218 WeakPolarHBondContact O-CD2 3.29Å; I174-L218 HydrophobicContact CB-CD1 4.29Å; I174-L218 HydrophobicContact CD1-CD1 3.54Å; I174-L218 HydrophobicContact CG1-CD1 3.59Å; C215-L218 HydrophobicContact CB-CB 4.47Å; C215-L218 HydrophobicContact CB-CD1 3.45Å; C215-L218 VanDerWaalsContact CB-CD1 3.45Å; C215-L218 HydrophobicContact CB-CG 3.77Å; C215-L218 WeakPolarHBondContact O-CB 3.1Å; C215-L218 PolarHBondContact O-N 2.97Å; C215-L218 VanDerWaalsContact O-N 3.09Å; P216-L218 PolarHBondContact O-N 3.48Å
219E65.6Low67.9Low105 Ų10584 Ų8449%0.49148%0.484SS..Hα-helixtrans-105-22176.2-46.5-139120.400111.5K212 P216 H217K212-E219 IonicContact NZ-OE1 2.57Å; K212-E219 PolarHBondContact NZ-OE1 2.83Å; P216-E219 PolarHBondContact O-N 3.42Å; P216-E219 VanDerWaalsContact O-N 3.1Å; H217-E219 PolarHBondContact O-N 3.09Å; H217-E219 VanDerWaalsContact O-N 3.12Å
220V59.3Low65.7Low90 Ų9081.4 Ų81.455%0.54549%0.486SS..Hα-helixtrans-70.6-39.9175.7-175.50000111.6H217 K222 I223 S224H217-V220 PolarHBondContact O-N 3.41Å; V220-K222 PolarHBondContact O-N 2.87Å; V220-I223 PolarHBondContact O-N 3.49Å; V220-S224 PolarHBondContact O-N 3.2Å
221D54.4Low63.1Low110 Ų11084.2 Ų84.259%0.58851%0.511SS*.THydrogen-bonded Turntrans-67.3-2.9-179-87.6-19000115.1S224D221-S224 WeakPolarHBondContact CA-OG 3.23Å; D221-S224 PolarHBondContact OD1-OG 2.9Å
222K52.1Low60.3Low180 Ų18089.6 Ų89.678%0.78355%0.548SS*.THydrogen-bonded Turntrans-88.8-4.4167.9-84.6-172160.1-107.60114.2V220V220-K222 PolarHBondContact O-N 2.87Å
223I51.1Low57.6Low144 Ų14496.2 Ų96.274%0.73858%0.579SS**THydrogen-bonded Turntrans-118.3-23.9-174.8-53172.6000110.4V220V220-I223 PolarHBondContact O-N 3.49Å
224S40.3Very low55Low72 Ų7299.4 Ų99.450%0.50359%0.59SS.*SBendtrans-81.6-14.5-178.159.10000115.4V220 D221 S226V220-S224 PolarHBondContact O-N 3.2Å; D221-S224 WeakPolarHBondContact CA-OG 3.23Å; D221-S224 PolarHBondContact OD1-OG 2.9Å; S224-S226 PolarHBondContact O-N 2.96Å
225S39.9Very low52.4Low103 Ų103103.5 Ų103.572%0.7262%0.619SS**  trans-81.753.5-173.469.80000114
226S39Very low49.7Very low102 Ų102113.1 Ų113.171%0.71366%0.661SS**SBendtrans-152.6109.3167.8-172.40000110.7S224 V228S224-S226 PolarHBondContact O-N 2.96Å; S226-V228 PolarHBondContact O-N 3.32Å
227P47.7Very low48Very low122 Ų122120.4 Ų120.479%0.79268%0.678SS**  trans-85.5111.1-178.331.7-31.9000112.6
228V40.6Very low45.4Very low123 Ų123122.8 Ų122.875%0.74571%0.707SS**  trans51.8112.4144.9-171.50000118.6S226S226-V228 PolarHBondContact O-N 3.32Å
229A34.8Very low43.1Very low108 Ų108127.1 Ų127.189%0.89374%0.739SS**  trans-125.6129.1132.700000107.8
230S48.3Very low41.8Very low103 Ų103127.8 Ų127.872%0.7275%0.754SS**  trans-128.7125.9-169.457.20000112.5
231S37.5Very low40.8Very low110 Ų110129.3 Ų129.377%0.76977%0.766SS**  trans-160.9126.6164.258.40000113.3
232C35.7Very low40.1Very low113 Ų113130.7 Ų130.776%0.76478%0.778SS**  trans36.993.3153.560.30000120.2
233E35.9Very low39.3Very low182 Ų182127.5 Ų127.585%0.8578%0.779SS**  1116.1112.2-176.7172112.200116.9
234N37Very low38.8Very low153 Ų153128.6 Ų128.682%0.81879%0.785SS**  -171.5167.5115.5-132.9-33.1000114.7
235S37.7Very low38.9Very low97 Ų97130.5 Ų130.568%0.67880%0.796SS**  trans83.5117.2152.8-152.20000121.9
236F33.3Very low38.7Very low202 Ų202133.1 Ų133.189%0.88680%0.801SS**  trans79.9135.4145.6-104.1-101.2000123.6
237R48.1Very low38.3Very low237 Ų237133.7 Ų133.789%0.89480%0.796SS**  trans-78140.3170.7-64.3-101.1-155.7178.55.4110.3
238A32.9Very low37.7Very low103 Ų103138.1 Ų138.185%0.85180%0.803SS**  trans-142.4137.8146.600000108.9
239S34.4Very low37.8Very low111 Ų111137.4 Ų137.478%0.77680%0.804SS**  trans-87.9146.3178.747.90000111.6
240C38.3Very low37.9Very low119 Ų119135.7 Ų135.780%0.80480%0.797SS**  trans-63.2150.3163.855.30000111.8
241P37.4Very low37.6Very low122 Ų122137.4 Ų137.479%0.79280%0.798SS**  trans-128153.3137.935.8-26.7000112.3
242T40.4Very low37.7Very low138 Ų138141.7 Ų141.785%0.84780%0.803SS**  trans-104124.6177.446.80000111.8
243S34.2Very low38.5Very low114 Ų114142 Ų14280%0.79781%0.806SS**  trans-162.9136.1153.346.10000111.9
244L42.4Very low39.2Very low167 Ų167140.2 Ų140.287%0.87480%0.802SS**  trans-92.2153.9155.1-63.8169.8000106.9
245P41.1Very low39.9Very low112 Ų112141.1 Ų141.173%0.72781%0.806SS**  -152161.893.139-21.5000117.3
246L37Very low40.5Very low158 Ų158141.6 Ų141.683%0.82780%0.801SS**  trans63.8111.3146.3-70.7165.3000122
247D30.6Very low41.4Very low114 Ų114135.3 Ų135.361%0.6179%0.793SS**  59.8110.1116.3-163.615000120.3S249D247-S249 PolarHBondContact OD1-N 3.39Å
248F33.9Very low41.6Very low215 Ų215130.1 Ų130.194%0.94379%0.788SS**  trans-131.5124.4133.6-87.7-80.7000109.4
249S43.2Very low42.4Very low108 Ų108129 Ų12976%0.75577%0.77SS**  trans-92.6136.6165.932.90000109.9D247D247-S249 PolarHBondContact OD1-N 3.39Å
250G37.5Very low43Very low72 Ų72129.1 Ų129.174%0.74276%0.758SS**  trans163126-17800000110.7
251D40.8Very low43.6Very low139 Ų139129.2 Ų129.274%0.74375%0.747SS**  trans-64.3150.7-172.1-54.7-79.8000113.9
252F39.6Very low44Very low200 Ų200134.1 Ų134.188%0.87775%0.75SS**  -161.7100.2124.2-94.9-62.4000110D254F252-D254 PolarHBondContact O-N 3.39Å
253S52Low44.4Very low120 Ų120135.9 Ų135.984%0.83974%0.741SS**  trans-90.690.1-178.2-64.80000111
254D52.2Low44.8Very low143 Ų143136.7 Ų136.777%0.76573%0.732SS**  trans-143.349.4-166.5-138.5-9.2000115.1F252F252-D254 PolarHBondContact O-N 3.39Å
255L50.5Low44.8Very low172 Ų172135 Ų13590%0.90172%0.724SS**SBendtrans-148.59.5173.2-142.881.4000117.5
256D50.7Low44.8Very low107 Ų107137.4 Ų137.457%0.57273%0.727SS**  trans-950.1-177.8-154.716.9000114.4V258 V259D256-V258 PolarHBondContact O-N 2.89Å; D256-V259 PolarHBondContact O-N 2.89Å
257G52.5Low45Very low70 Ų70137.7 Ų137.772%0.72273%0.726SS**Hα-helixtrans-63.8-9.5-172.600000116.6
258V52.2Low45.5Very low128 Ų128140.9 Ų140.978%0.77674%0.738SS**Hα-helixtrans-96.5-18.8-173.4-172.80000113.1D256D256-V258 PolarHBondContact O-N 2.89Å
259V48.8Very low45.4Very low80 Ų80136.7 Ų136.749%0.48574%0.735SS.*Hα-helixtrans-91.8-22.4-173.4-179.20000113.1D256D256-V259 PolarHBondContact O-N 2.89Å
260H48Very low45.3Very low113 Ų113137.2 Ų137.252%0.52374%0.738SS.*Hα-helixtrans-84.5-41.6-175.7-83-90.4000114.3R262 R263H260-R262 VanDerWaalsContact C-N 3.32Å; H260-R262 PolarHBondContact O-N 3.25Å; H260-R263 PolarHBondContact O-N 2.74Å
261Q50.8Low45.6Very low122 Ų122139.2 Ų139.257%0.5774%0.741SS**Hα-helixtrans-53.9-44.6-174.4-169.563.64600113.2R263 Q264Q261-R263 PolarHBondContact O-N 3.26Å; Q261-R263 VanDerWaalsContact O-N 3.09Å; Q261-Q264 PolarHBondContact O-N 2.88Å
262R46.4Very low45.3Very low224 Ų224138.5 Ų138.585%0.84575%0.747SS**Hα-helixtrans-67.6-9.5-178.8-172.9171.6-69.8140.21.2114.3H260H260-R262 VanDerWaalsContact C-N 3.32Å; H260-R262 PolarHBondContact O-N 3.25Å
263R48.5Very low45Very low176 Ų176132.7 Ų132.766%0.66474%0.743SS**Hα-helixtrans-95-11.6176.4-80.2-169.3173.187.2-4114.2H260 Q261H260-R263 PolarHBondContact O-N 2.74Å; Q261-R263 PolarHBondContact O-N 3.26Å; Q261-R263 VanDerWaalsContact O-N 3.09Å
264Q42.7Very low44.3Very low131 Ų131132.2 Ų132.261%0.61274%0.74SS**Hα-helixtrans-95.7-33-170.3-147.8149.1-13.600112.7Q261 M266 M267Q261-Q264 PolarHBondContact O-N 2.88Å; Q264-M266 PolarHBondContact O-N 2.93Å; Q264-M267 PolarHBondContact O-N 3.28Å
265D42.1Very low43.3Very low131 Ų131134.4 Ų134.470%0.70175%0.746SS**THydrogen-bonded Turntrans-66.916.7178.6-50-23.8000115
266M42Very low42.9Very low163 Ų163132.3 Ų132.380%0.80374%0.74SS**THydrogen-bonded Turntrans-138.519.8-179.9-152.1-172.378.900113.4Q264Q264-M266 PolarHBondContact O-N 2.93Å
267M41.1Very low42.4Very low164 Ų164132.9 Ų132.981%0.80875%0.75SS**  trans-138.627.3179-71.3-162.7171.500115.7Q264Q264-M267 PolarHBondContact O-N 3.28Å
268E40Very low41.5Very low181 Ų181136.7 Ų136.785%0.84675%0.754SS**  trans-123.180.4174.8-69.7-158.9139.300114.3
269S32.7Very low40.5Very low126 Ų126140.9 Ų140.988%0.88176%0.757SS**  trans179.4124.2143.2-83.20000109.3
270S41.3Very low39.8Very low119 Ų119143.3 Ų143.383%0.83277%0.767SS**  trans-142.7131.1-171.9-153.60000113.3
271S43.3Very low38.9Very low115 Ų115145.9 Ų145.980%0.80478%0.777SS**  trans62.4122.8160.2-160.20000119.6
272S34.3Very low38.3Very low124 Ų124146.8 Ų146.887%0.86778%0.784SS**  167.1161.994.7-166.70000112
273G32.4Very low37.5Very low77 Ų77140.3 Ų140.379%0.79477%0.773SS**  trans118.4115.3166.800000114.7
274S37.8Very low36.5Very low111 Ų111138 Ų13878%0.77677%0.774SS**  trans-127146.9178.655.10000111.7
275Q31.8Very low35.9Very low189 Ų189140.4 Ų140.488%0.88378%0.783SS**  trans175.5154.2130.9-98.4174.48.800112.4
276T41.5Very low35.2Very low128 Ų128139 Ų13979%0.78578%0.783SS**  trans-95.5154.1164.847.40000110.3
277P41.1Very low34.5Very low119 Ų119136.7 Ų136.777%0.77378%0.783SS**  -138.4-176.3124.236-22.1000113.7
278D31.8Very low34Very low149 Ų149136.8 Ų136.880%0.79779%0.786SS**  trans-89.8-177.6-157.4-54.6-96000117.2
279Y32.1Very low34.2Very low217 Ų217132.6 Ų132.685%0.85178%0.775SS**  trans-0.2142.6154.7-85.8-101.3000118
280D33.9Very low34.1Very low131 Ų131133.5 Ų133.570%0.70177%0.77SS**  cis-171.7178.246.8-161-0.2000112.8
281K30.1Very low33.4Very low167 Ų167134 Ų13473%0.72677%0.767SS**  trans93.3104.8137.3-152.5153.4-175.3171.60122.7
282I36.8Very low32.6Very low141 Ų141137 Ų13772%0.72377%0.767SS**  trans55.9113.815435.3164.7000125.1
283S29.6Very low32.5Very low87 Ų87139.7 Ų139.761%0.60877%0.77SS**  62.8152.2112.378.40000126.1
284D27.8Very low32.1Very low127 Ų127140.4 Ų140.468%0.67976%0.763SS**  trans98.2103.4147-57.6-44.7000123.4
285F30.3Very low31.4Very low183 Ų183140 Ų14080%0.80377%0.767SS**  trans56104136-71.3-84.3000124.1
286S27.7Very low31.2Very low102 Ų102135.6 Ų135.671%0.71376%0.763SS**  89.1169.6113.682.40000122.6
287S27.7Very low30.6Very low114 Ų114138.4 Ų138.480%0.79776%0.764SS**  trans87.6103.616770.30000120.5
288L30.8Very low29.9Very low165 Ų165138.9 Ų138.986%0.86477%0.765SS**  trans-72173.6139.3-128.170000108.4
289P43.6Very low29.5Very low94 Ų94143.2 Ų143.261%0.6177%0.77SS**  cis-140.8-176.71.941.3-21.2000117
290D29.3Very low29.4Very low145 Ų145141.1 Ų141.178%0.77577%0.768SS**  trans38.1133.6146.2-61.6-36.4000122.9
291T28.2Very low29.2Very low128 Ų128140.5 Ų140.579%0.78577%0.768SS**  -175125.4114-79.20000113.3
292F25.3Very low29Very low180 Ų180138 Ų13879%0.78977%0.772SS**  trans25.1132.2152.7-75.9-112.4000122
293L31.9Very low28.4Very low179 Ų179137.6 Ų137.694%0.93778%0.776SS**  -144.3140.5118-113.9179.2000111.2
294S23.9Very low28.4Very low92 Ų92141.4 Ų141.464%0.64378%0.784SS**  trans-137.3131.9-175.255.30000112.2
295A24.6Very low28.5Very low104 Ų104139.8 Ų139.886%0.8679%0.788SS**  trans-155.2147.8168.400000111.5
296A28Very low28.5Very low96 Ų96137.6 Ų137.679%0.79379%0.785SS**  trans-69.9174.9-174.300000113
297K29.1Very low28.7Very low186 Ų186140.6 Ų140.681%0.80979%0.791SS**  cis-174.4147.541.9-157.8-176.9-170.9178.30114.1
298T25.6Very low28.9Very low130 Ų130143.7 Ų143.780%0.79879%0.793SS**  trans65.9134.91659.50000115.8
299R24.3Very low29.1Very low239 Ų239143.1 Ų143.190%0.90279%0.79SS**  cis-155.4147.331.5-177178.2-176160.51.8112
300E28.5Very low28.3Very low174 Ų174147.8 Ų147.881%0.81380%0.803SS**  trans-87.9169.2-179-131.2166.7-166.800110.9
301V29.5Very low28.2Very low117 Ų117147.8 Ų147.871%0.70980%0.804SS**  cis-147155.226.9179.10000111.4V303V301-V303 HydrophobicContact CG1-CG2 4.1Å
302S25.9Very low29.3Very low115 Ų115146.4 Ų146.480%0.80480%0.796SS**  trans-124.7151.9159.8-178.30000109.9
303V24.8Very low29.3Very low133 Ų133143.4 Ų143.481%0.80680%0.798SS**  trans-128.3134176.7-178.30000110.3V301V301-V303 HydrophobicContact CG1-CG2 4.1Å
304H29.9Very low29.2Very low166 Ų166142.7 Ų142.777%0.76979%0.79SS**  trans-101.4162.7-172.7-174.352.5000111.3
305A29.1Very low29.5Very low94 Ų94145.7 Ų145.778%0.77779%0.791SS**  trans-142.5126.7175.400000110.1
306D29.9Very low29.7Very low137 Ų137149 Ų14973%0.73379%0.789SS**  trans-152.8132.1-176.5-168.915.2000108.9
307I33.8Very low29.6Very low165 Ų165147.9 Ų147.985%0.84679%0.786SS**  trans-146.4131.5-179.8-63.7-174.3000110.3
308H30.6Very low29.7Very low179 Ų179144 Ų14483%0.82979%0.789SS**  trans-110.7168.5-178.6-159.483.7000113.1
309L35.3Very low29.9Very low152 Ų152142 Ų14280%0.79679%0.786SS**  trans-81.7137.7-179.1-107.3125.6000113.7
310Q27.5Very low30.2Very low192 Ų192137.3 Ų137.390%0.89778%0.778SS**  trans-170.5175.4137.6-110.4176.730.700113.9
311N26.5Very low30.4Very low146 Ų146137.4 Ų137.478%0.78178%0.776SS**  trans-164.9173-165.5-157.335.2000108.6
312P50.8Low30.4Very low98 Ų98139.5 Ų139.564%0.63678%0.783SS**  cis-120.9171.4-48.835.4-22000113.6
313S26.7Very low30.6Very low118 Ų118137.9 Ų137.983%0.82578%0.784SS**  trans-168.4131.2144.8-93.20000118.1
314Q29.8Very low30.9Very low163 Ų163140.9 Ų140.976%0.76279%0.789SS**  trans32.9136.4145.3-65.7-159.216.200125.6
315K28.5Very low31Very low155 Ų155138.9 Ų138.967%0.67479%0.794SS**  103.6119.9126.5-96.6-178.8174.8-177.20121.8
316H28.7Very low31.3Very low174 Ų174142.8 Ų142.881%0.80680%0.798SS**  trans57.6141.1158.4-49.8-68000118.4
317G27.6Very low32.5Very low72 Ų72141.8 Ų141.874%0.74280%0.799SS**  cis179.3155.7-7.300000112.5
318A30.2Very low33.2Very low106 Ų106138.7 Ų138.788%0.87679%0.79SS**  trans24.5127.4164.800000122.1
319A30.7Very low33.3Very low87 Ų87139 Ų13972%0.71979%0.791SS**  174.211910900000116.3
320L30.2Very low33Very low141 Ų141135.4 Ų135.474%0.73879%0.791SS**  trans54.4136.4143.4-75.893.8000124.6
321K32.9Very low33.5Very low176 Ų176134.5 Ų134.577%0.76579%0.791SS**  trans70.9151.1146.1-71.7166.9176.2175.70118.7
322N28.4Very low33.7Very low161 Ų161137.8 Ų137.886%0.86179%0.793SS**  cis-175.6137.2-35.4-11520.8000106.8
323G31.2Very low33.2Very low80 Ų80138 Ų13883%0.82579%0.794SS**  trans167.3131.3172.200000113.7
324Q30.7Very low33.4Very low196 Ų196141.9 Ų141.992%0.91680%0.796SS**  trans-117.9139.8-178.4-59.4166.8-59.600110.7
325S31.5Very low33.6Very low124 Ų124140.6 Ų140.687%0.86779%0.794SS**  trans179.8154.5130.954.80000112.7
326M35Very low34Very low177 Ų177138 Ų13887%0.87280%0.796SS**  trans-120.8176.7174.6-77.3-87.4-160.900108
327P56.9Low34.8Very low115 Ų115135.6 Ų135.675%0.74780%0.799SS**  cis-114.9-131.7-15.528.6-4.2000107.2
328P46.8Very low35.8Very low101 Ų101136.4 Ų136.466%0.65679%0.793SS**  cis-134.1-170.6-21.442.7-24.4000115.4
329H32.8Very low36.7Very low185 Ų185137.5 Ų137.586%0.85678%0.78SS**  trans43.3106.4157.4-68.8-60.7000121.2
330G30.5Very low37.8Very low76 Ų76137.6 Ų137.678%0.78477%0.773SS**  trans-155.8111.3155.400000111.2
331L36.5Very low39.2Very low174 Ų174138.2 Ų138.291%0.91177%0.77SS**  trans-78130176.3-117.670.4000110.4
332R30.5Very low41Very low215 Ų215132.9 Ų132.981%0.81176%0.755SS**  trans-138.2112.5168.3-119.9-72.1-180165.1-0109K334R332-K334 PolarHBondContact O-N 3.07Å
333P40.8Very low43.5Very low101 Ų101131.2 Ų131.266%0.65675%0.745SS**  trans-57.2134.3169.5-24.235000110
334K30.4Very low46.1Very low200 Ų200132.6 Ų132.687%0.8773%0.73SS**  trans-97.993.2176.8-176.1178.2-176.41770108R332 S336R332-K334 PolarHBondContact O-N 3.07Å; K334-S336 PolarHBondContact O-N 3.42Å
335D34.9Very low48.9Very low137 Ų137127.2 Ų127.273%0.73371%0.71SS**  trans-60.8101.7178.2-68.6-54.4000110.6S337D335-S337 VanDerWaalsContact C-N 3.34Å; D335-S337 PolarHBondContact O-N 3.29Å
336S36Very low51.6Low101 Ų101126.1 Ų126.171%0.70669%0.693SS**  trans-77.485.2174.656.50000109.4K334 S338K334-S336 PolarHBondContact O-N 3.42Å; S336-S338 PolarHBondContact O-N 3.5Å
337S46.8Very low54.2Low123 Ų123122.7 Ų122.786%0.8668%0.678SS**  trans-70.966.2178.563.80000112.3D335D335-S337 VanDerWaalsContact C-N 3.34Å; D335-S337 PolarHBondContact O-N 3.29Å
338S47.3Very low55.9Low89 Ų89124 Ų12462%0.62267%0.672SS**  trans-113108.618059.10000111.1S336S336-S338 PolarHBondContact O-N 3.5Å
339Q49.9Very low58.2Low128 Ų128123.7 Ų123.760%0.59866%0.664SS**  trans167.566.5144.2-90.5-74.76.900112.4K341Q339-K341 PolarHBondContact O-N 3.36Å
340P54.1Low61.1Low89 Ų89122.2 Ų122.258%0.57865%0.652SS**SBendtrans-66.7-19.4166.529-34.6000112.6S342 L343 H344P340-S342 PolarHBondContact O-N 2.99Å; P340-L343 PolarHBondContact O-N 3.37Å; P340-H344 PolarHBondContact O-CD2 3.44Å
341K59.2Low64.1Low155 Ų155123.7 Ų123.767%0.67464%0.642SS**Hα-helixtrans-67.2-33.9-172.3-55.2-177.8177.8-177.40113.3Q339 L343 H344 V345Q339-K341 PolarHBondContact O-N 3.36Å; K341-L343 PolarHBondContact O-N 3.21Å; K341-H344 PolarHBondContact O-N 2.97Å; K341-V345 WeakPolarHBondContact O-CG2 3.3Å; K341-V345 PolarHBondContact O-N 3.43Å; K341-V345 VanDerWaalsContact O-N 3.17Å
342S69.8Low67Low64 Ų64121.8 Ų121.845%0.44863%0.626SS.*Hα-helixtrans-61.3-42.9179.6-172.30000112.4P340 H344 V345 I346P340-S342 PolarHBondContact O-N 2.99Å; S342-H344 PolarHBondContact O-N 3.27Å; S342-V345 PolarHBondContact O-N 2.7Å; S342-I346 WeakPolarHBondContact O-CG1 3.4Å; S342-I346 PolarHBondContact O-N 2.98Å
343L82.3Confident70.1Confident126 Ų126116.4 Ų116.466%0.6661%0.613SS**Hα-helixtrans-65.3-39.4179.8-65.6177.9000112.3P340 K341 I346 L347P340-L343 PolarHBondContact O-N 3.37Å; K341-L343 PolarHBondContact O-N 3.21Å; L343-I346 PolarHBondContact O-N 3.41Å; L343-L347 WeakPolarHBondContact O-CB 3.46Å; L343-L347 PolarHBondContact O-N 3.43Å
344H86.4Confident72.7Confident108 Ų108114.1 Ų114.150%0.560%0.597SS.*Hα-helixtrans-63.2-40.8173.8-72.7-71.5000112.2P340 K341 S342 L347 F348P340-H344 PolarHBondContact O-CD2 3.44Å; K341-H344 PolarHBondContact O-N 2.97Å; S342-H344 PolarHBondContact O-N 3.27Å; H344-L347 PolarHBondContact O-N 2.85Å; H344-F348 HydrophobicContact CB-CE2 4.39Å; H344-F348 WeakPolarHBondContact O-CD2 3.45Å; H344-F348 PolarHBondContact O-N 3.39Å
345V87.9Confident75.9Confident84 Ų84107.3 Ų107.351%0.50958%0.575SS.*Hα-helixtrans-62.6-44175.8173.20000111.3K341 S342 L347 F348 I349K341-V345 WeakPolarHBondContact O-CG2 3.3Å; K341-V345 PolarHBondContact O-N 3.43Å; K341-V345 VanDerWaalsContact O-N 3.17Å; S342-V345 PolarHBondContact O-N 2.7Å; V345-L347 VanDerWaalsContact C-N 3.34Å; V345-L347 PolarHBondContact O-N 3.45Å; V345-F348 PolarHBondContact O-N 3.19Å; V345-I349 HydrophobicContact CG1-CD1 3.92Å; V345-I349 VanDerWaalsContact O-CG1 3.3Å; V345-I349 WeakPolarHBondContact O-CG1 3.36Å; V345-I349 PolarHBondContact O-N 2.93Å
346I88.4Confident78.8Confident100 Ų100104.6 Ų104.651%0.51356%0.559SS.*Hα-helixtrans-62.8-41.1175.9-66.1164.9000111S342 L343 I349 Y350S342-I346 WeakPolarHBondContact O-CG1 3.4Å; S342-I346 PolarHBondContact O-N 2.98Å; L343-I346 PolarHBondContact O-N 3.41Å; I346-I349 PolarHBondContact O-N 3.44Å; I346-Y350 WeakPolarHBondContact O-CB 3.39Å; I346-Y350 PolarHBondContact O-N 2.9Å
347L89.6Confident81.6Confident105 Ų105105.4 Ų105.455%0.5556%0.555SS.*Hα-helixtrans-64.2-41.5176.6-176.963.9000112.2L343 H344 V345 Y350 L351L343-L347 WeakPolarHBondContact O-CB 3.46Å; L343-L347 PolarHBondContact O-N 3.43Å; H344-L347 PolarHBondContact O-N 2.85Å; V345-L347 VanDerWaalsContact C-N 3.34Å; V345-L347 PolarHBondContact O-N 3.45Å; L347-Y350 PolarHBondContact O-N 3.28Å; L347-L351 WeakPolarHBondContact O-CB 3.31Å; L347-L351 PolarHBondContact O-N 3.26Å
348F92.9Very high84Confident142 Ų142103.4 Ų103.462%0.62354%0.538SS*.Hα-helixtrans-65.5-39.9174.5-75.8-58.5000112.4H344 V345 L351 F352H344-F348 HydrophobicContact CB-CE2 4.39Å; H344-F348 WeakPolarHBondContact O-CD2 3.45Å; H344-F348 PolarHBondContact O-N 3.39Å; V345-F348 PolarHBondContact O-N 3.19Å; F348-L351 PolarHBondContact O-N 2.97Å; F348-F352 VanDerWaalsContact O-CB 3.29Å; F348-F352 WeakPolarHBondContact O-CB 3.4Å; F348-F352 PolarHBondContact O-N 3.15Å
349I94.3Very high86.3Confident95 Ų95104.6 Ų104.649%0.48754%0.536SS..Hα-helixtrans-62.2-44.5173.8-68.6164.3000110.5V345 I346 F352 L353V345-I349 HydrophobicContact CG1-CD1 3.92Å; V345-I349 VanDerWaalsContact O-CG1 3.3Å; V345-I349 WeakPolarHBondContact O-CG1 3.36Å; V345-I349 PolarHBondContact O-N 2.93Å; I346-I349 PolarHBondContact O-N 3.44Å; I349-F352 PolarHBondContact O-N 3.14Å; I349-L353 HydrophobicContact CG2-CD1 4.04Å; I349-L353 VanDerWaalsContact O-CG 3.31Å; I349-L353 WeakPolarHBondContact O-CG 3.31Å; I349-L353 PolarHBondContact O-N 3.2Å
350Y93.9Very high88.5Confident154 Ų154100.9 Ų100.960%0.60453%0.525SS*.Hα-helixtrans-62.5-47.2176.6-179.9-101.2000112.1I346 L347 F352 L353 V354I346-Y350 WeakPolarHBondContact O-CB 3.39Å; I346-Y350 PolarHBondContact O-N 2.9Å; L347-Y350 PolarHBondContact O-N 3.28Å; Y350-F352 VanDerWaalsContact C-N 3.31Å; Y350-F352 PolarHBondContact O-N 2.78Å; Y350-L353 PolarHBondContact O-N 3.09Å; Y350-V354 HydrophobicContact CD1-CG2 4.23Å; Y350-V354 HydrophobicContact CE1-CG2 3.79Å; Y350-V354 HydrophobicContact CE2-CG2 4.11Å; Y350-V354 WeakPolarHBondContact O-CG2 3.44Å; Y350-V354 PolarHBondContact O-N 3.43Å
351L95Very high90.5Very high108 Ų108100.3 Ų100.357%0.56552%0.523SS*.Hα-helixtrans-60.8-39.2177.3-176.663.3000112L347 F348 V354 S355L347-L351 WeakPolarHBondContact O-CB 3.31Å; L347-L351 PolarHBondContact O-N 3.26Å; F348-L351 PolarHBondContact O-N 2.97Å; L351-V354 PolarHBondContact O-N 3.27Å; L351-S355 VanDerWaalsContact O-CB 3.3Å; L351-S355 WeakPolarHBondContact O-CB 3.34Å; L351-S355 PolarHBondContact O-N 3.16Å
352F96.3Very high92.2Very high133 Ų13396.5 Ų96.558%0.58352%0.515SS*.Hα-helixtrans-65.7-42.3175-178.4-110.3000112.3F348 I349 Y350 S355 I356F348-F352 VanDerWaalsContact O-CB 3.29Å; F348-F352 WeakPolarHBondContact O-CB 3.4Å; F348-F352 PolarHBondContact O-N 3.15Å; I349-F352 PolarHBondContact O-N 3.14Å; Y350-F352 VanDerWaalsContact C-N 3.31Å; Y350-F352 PolarHBondContact O-N 2.78Å; F352-S355 PolarHBondContact O-N 3.05Å; F352-I356 HydrophobicContact CD1-CD1 3.89Å; F352-I356 HydrophobicContact CE1-CD1 3.44Å; F352-I356 VanDerWaalsContact CE1-CD1 3.44Å; F352-I356 HydrophobicContact CE2-CD1 4.27Å; F352-I356 HydrophobicContact CG-CD1 4.49Å; F352-I356 HydrophobicContact CZ-CD1 3.66Å; F352-I356 HydrophobicContact CZ-CG1 4.44Å; F352-I356 WeakPolarHBondContact O-CG1 3.25Å; F352-I356 PolarHBondContact O-N 3.19Å
353L95.4Very high93.4Very high103 Ų103100.5 Ų100.554%0.53952%0.521SS..Hα-helixtrans-65.7-40.2175.4-71.1170.8000112.4I349 Y350 I356 L357I349-L353 HydrophobicContact CG2-CD1 4.04Å; I349-L353 VanDerWaalsContact O-CG 3.31Å; I349-L353 WeakPolarHBondContact O-CG 3.31Å; I349-L353 PolarHBondContact O-N 3.2Å; Y350-L353 PolarHBondContact O-N 3.09Å; L353-I356 PolarHBondContact O-N 2.91Å; L353-L357 WeakPolarHBondContact O-CB 3.4Å; L353-L357 PolarHBondContact O-N 3.43Å
354V96.5Very high94Very high52 Ų5299.3 Ų99.332%0.31551%0.513SS..Hα-helixtrans-64.9-41.4173.2172.20000110.8Y350 L351 L357 V358Y350-V354 HydrophobicContact CD1-CG2 4.23Å; Y350-V354 HydrophobicContact CE1-CG2 3.79Å; Y350-V354 HydrophobicContact CE2-CG2 4.11Å; Y350-V354 WeakPolarHBondContact O-CG2 3.44Å; Y350-V354 PolarHBondContact O-N 3.43Å; L351-V354 PolarHBondContact O-N 3.27Å; V354-L357 PolarHBondContact O-N 2.83Å; V354-V358 HydrophobicContact CG1-CG2 4.46Å; V354-V358 WeakPolarHBondContact O-CG2 3.45Å; V354-V358 PolarHBondContact O-N 2.96Å
355S96.2Very high94.4Very high57 Ų5796.5 Ų96.540%0.39951%0.509SS..Hα-helixtrans-61.1-45.3175.1-1750000111.9L351 F352 L357 V358 L359L351-S355 VanDerWaalsContact O-CB 3.3Å; L351-S355 WeakPolarHBondContact O-CB 3.34Å; L351-S355 PolarHBondContact O-N 3.16Å; F352-S355 PolarHBondContact O-N 3.05Å; S355-L357 VanDerWaalsContact C-N 3.33Å; S355-L357 PolarHBondContact O-N 3.2Å; S355-V358 PolarHBondContact O-N 3.32Å; S355-L359 VanDerWaalsContact O-CB 3.31Å; S355-L359 WeakPolarHBondContact O-CB 3.21Å; S355-L359 VanDerWaalsContact O-CG 3.25Å; S355-L359 WeakPolarHBondContact O-CG 3.44Å; S355-L359 PolarHBondContact O-N 3.1Å
356I96.7Very high94.7Very high81 Ų8199.5 Ų99.542%0.41552%0.515SS..Hα-helixtrans-59.7-43172.5-72.8171.6000111.2F352 L353 L359 S360F352-I356 HydrophobicContact CD1-CD1 3.89Å; F352-I356 HydrophobicContact CE1-CD1 3.44Å; F352-I356 VanDerWaalsContact CE1-CD1 3.44Å; F352-I356 HydrophobicContact CE2-CD1 4.27Å; F352-I356 HydrophobicContact CG-CD1 4.49Å; F352-I356 HydrophobicContact CZ-CD1 3.66Å; F352-I356 HydrophobicContact CZ-CG1 4.44Å; F352-I356 WeakPolarHBondContact O-CG1 3.25Å; F352-I356 PolarHBondContact O-N 3.19Å; L353-I356 PolarHBondContact O-N 2.91Å; I356-L359 PolarHBondContact O-N 2.84Å; I356-S360 VanDerWaalsContact O-CB 3.28Å; I356-S360 WeakPolarHBondContact O-CB 3.28Å; I356-S360 PolarHBondContact O-N 3.5Å; I356-S360 PolarHBondContact O-OG 2.81Å
357L95.3Very high94.9Very high117 Ų117100 Ų10061%0.61351%0.514SS*.Hα-helixtrans-62.6-47.4179.6-174.463.4000111.2L353 V354 S355 S360 S361L353-L357 WeakPolarHBondContact O-CB 3.4Å; L353-L357 PolarHBondContact O-N 3.43Å; V354-L357 PolarHBondContact O-N 2.83Å; S355-L357 VanDerWaalsContact C-N 3.33Å; S355-L357 PolarHBondContact O-N 3.2Å; L357-S360 PolarHBondContact O-N 3.33Å; L357-S360 PolarHBondContact O-OG 2.77Å; L357-S361 WeakPolarHBondContact O-CB 3.41Å; L357-S361 PolarHBondContact O-N 3.3Å
358V96.9Very high95Very high82 Ų8299.1 Ų99.150%0.49751%0.509SS..Hα-helixtrans-62.1-48.5175.7173.70000110.9V354 S355 S360 S361 C362V354-V358 HydrophobicContact CG1-CG2 4.46Å; V354-V358 WeakPolarHBondContact O-CG2 3.45Å; V354-V358 PolarHBondContact O-N 2.96Å; S355-V358 PolarHBondContact O-N 3.32Å; V358-S360 VanDerWaalsContact C-N 3.29Å; V358-S360 PolarHBondContact O-N 3.32Å; V358-S361 WeakPolarHBondContact O-CB 3.45Å; V358-S361 PolarHBondContact O-N 2.86Å; V358-S361 VanDerWaalsContact O-N 3.1Å; V358-C362 PolarHBondContact O-N 2.82Å; V358-C362 PolarHBondContact O-SG 3.41Å
359L95.8Very high95Very high113 Ų11396.7 Ų96.759%0.59251%0.505SS*.Hα-helixtrans-58.6-39.6176.6-74.4167.6000112.2S355 I356 Y363S355-L359 VanDerWaalsContact O-CB 3.31Å; S355-L359 WeakPolarHBondContact O-CB 3.21Å; S355-L359 VanDerWaalsContact O-CG 3.25Å; S355-L359 WeakPolarHBondContact O-CG 3.44Å; S355-L359 PolarHBondContact O-N 3.1Å; I356-L359 PolarHBondContact O-N 2.84Å; L359-Y363 VanDerWaalsContact O-CB 3.23Å; L359-Y363 WeakPolarHBondContact O-CB 3.23Å; L359-Y363 PolarHBondContact O-N 3.31Å
360S95.3Very high94.7Very high51 Ų5194.1 Ų94.136%0.35750%0.499SS..Hα-helixtrans-68.8-36.1175.976.60000112.5I356 L357 V358 Y363 M364I356-S360 VanDerWaalsContact O-CB 3.28Å; I356-S360 WeakPolarHBondContact O-CB 3.28Å; I356-S360 PolarHBondContact O-N 3.5Å; I356-S360 PolarHBondContact O-OG 2.81Å; L357-S360 PolarHBondContact O-N 3.33Å; L357-S360 PolarHBondContact O-OG 2.77Å; V358-S360 VanDerWaalsContact C-N 3.29Å; V358-S360 PolarHBondContact O-N 3.32Å; S360-Y363 PolarHBondContact O-N 2.85Å; S360-M364 WeakPolarHBondContact O-CB 3.17Å; S360-M364 VanDerWaalsContact O-CG 3.25Å; S360-M364 WeakPolarHBondContact O-CG 3.25Å; S360-M364 PolarHBondContact O-N 2.85Å
361S96.1Very high94.5Very high77 Ų7791.8 Ų91.854%0.53850%0.496SS..Hα-helixtrans-67.4-47.3174.6-177.30000111.1L357 V358 Y363 M364 A365L357-S361 WeakPolarHBondContact O-CB 3.41Å; L357-S361 PolarHBondContact O-N 3.3Å; V358-S361 WeakPolarHBondContact O-CB 3.45Å; V358-S361 PolarHBondContact O-N 2.86Å; V358-S361 VanDerWaalsContact O-N 3.1Å; S361-Y363 PolarHBondContact O-N 3.26Å; S361-M364 PolarHBondContact O-N 3.46Å; S361-A365 WeakPolarHBondContact O-CB 3.44Å; S361-A365 PolarHBondContact O-N 2.9Å
362C95.7Very high94.3Very high74 Ų7491.3 Ų91.350%0.549%0.491SS..Hα-helixtrans-61.1-41173.6-65.60000112.2V358 A365 F366V358-C362 PolarHBondContact O-N 2.82Å; V358-C362 PolarHBondContact O-SG 3.41Å; C362-A365 PolarHBondContact O-N 2.83Å; C362-F366 WeakPolarHBondContact O-CB 3.41Å; C362-F366 PolarHBondContact O-N 3.49Å
363Y95.4Very high93.9Very high148 Ų14891.8 Ų91.858%0.5849%0.494SS*.Hα-helixtrans-64.2-42.2175.1175.6-104.2000112L359 S360 S361 K367L359-Y363 VanDerWaalsContact O-CB 3.23Å; L359-Y363 WeakPolarHBondContact O-CB 3.23Å; L359-Y363 PolarHBondContact O-N 3.31Å; S360-Y363 PolarHBondContact O-N 2.85Å; S361-Y363 PolarHBondContact O-N 3.26Å; Y363-K367 HydrophobicContact CE1-CD 4.46Å; Y363-K367 WeakPolarHBondContact O-CB 3.33Å; Y363-K367 PolarHBondContact O-N 3.11Å
364M94.5Very high93.4Very high101 Ų10195.6 Ų95.650%0.49850%0.502SS..Hα-helixtrans-66.6-40.3175.5-72.8-65.7-69.500111.8S360 S361 K367 I368S360-M364 WeakPolarHBondContact O-CB 3.17Å; S360-M364 VanDerWaalsContact O-CG 3.25Å; S360-M364 WeakPolarHBondContact O-CG 3.25Å; S360-M364 PolarHBondContact O-N 2.85Å; S361-M364 PolarHBondContact O-N 3.46Å; M364-K367 PolarHBondContact O-N 3.42Å; M364-I368 WeakPolarHBondContact O-CD1 3.39Å; M364-I368 VanDerWaalsContact O-CG1 3.24Å; M364-I368 WeakPolarHBondContact O-CG1 3.4Å; M364-I368 PolarHBondContact O-N 2.93Å
365A93.7Very high92.6Very high50 Ų5097.8 Ų97.841%0.41351%0.511SS..Hα-helixtrans-63.7-47174.400000112S361 C362 K367 I368 V369S361-A365 WeakPolarHBondContact O-CB 3.44Å; S361-A365 PolarHBondContact O-N 2.9Å; C362-A365 PolarHBondContact O-N 2.83Å; A365-K367 VanDerWaalsContact C-N 3.31Å; A365-K367 PolarHBondContact O-N 3.34Å; A365-I368 WeakPolarHBondContact O-CB 3.24Å; A365-I368 PolarHBondContact O-N 3.23Å; A365-V369 PolarHBondContact O-N 3.38Å
366F94.4Very high91.9Very high146 Ų14699.8 Ų99.864%0.6452%0.517SS*.Hα-helixtrans-60.2-41.2173.6176.7-97000111.8C362 I368 V369 A370C362-F366 WeakPolarHBondContact O-CB 3.41Å; C362-F366 PolarHBondContact O-N 3.49Å; F366-I368 VanDerWaalsContact C-N 3.33Å; F366-I368 PolarHBondContact O-N 3.49Å; F366-V369 PolarHBondContact O-N 3.17Å; F366-A370 VanDerWaalsContact O-CB 3.27Å; F366-A370 WeakPolarHBondContact O-CB 3.49Å; F366-A370 PolarHBondContact O-N 2.85Å
367K92.8Very high91Very high112 Ų11299.5 Ų99.549%0.48752%0.523SS..Hα-helixtrans-65.8-34.7176.1-172-176177.9-168.60112.1Y363 M364 A365 L371Y363-K367 HydrophobicContact CE1-CD 4.46Å; Y363-K367 WeakPolarHBondContact O-CB 3.33Å; Y363-K367 PolarHBondContact O-N 3.11Å; M364-K367 PolarHBondContact O-N 3.42Å; A365-K367 VanDerWaalsContact C-N 3.31Å; A365-K367 PolarHBondContact O-N 3.34Å; K367-L371 WeakPolarHBondContact O-CB 3.27Å; K367-L371 PolarHBondContact O-N 2.96Å
368I91.9Very high90.1Very high85 Ų8599 Ų9944%0.43652%0.52SS..Hα-helixtrans-64.3-54.2172.2-72.7161.2000109.4M364 A365 F366 A370 L371 E372M364-I368 WeakPolarHBondContact O-CD1 3.39Å; M364-I368 VanDerWaalsContact O-CG1 3.24Å; M364-I368 WeakPolarHBondContact O-CG1 3.4Å; M364-I368 PolarHBondContact O-N 2.93Å; A365-I368 WeakPolarHBondContact O-CB 3.24Å; A365-I368 PolarHBondContact O-N 3.23Å; F366-I368 VanDerWaalsContact C-N 3.33Å; F366-I368 PolarHBondContact O-N 3.49Å; I368-A370 VanDerWaalsContact C-N 3.29Å; I368-A370 PolarHBondContact O-N 3.18Å; I368-L371 CarbonylContact O-C 3.51Å; I368-L371 WeakPolarHBondContact O-CA 3.48Å; I368-L371 WeakPolarHBondContact O-CB 3.21Å; I368-L371 PolarHBondContact O-N 3.08Å; I368-E372 HydrophobicContact CG2-CG 4.2Å; I368-E372 WeakPolarHBondContact CG2-OE1 3.36Å; I368-E372 WeakPolarHBondContact O-CB 3.49Å; I368-E372 WeakPolarHBondContact O-CG 3.41Å; I368-E372 PolarHBondContact O-N 3.24Å
369V92.9Very high88.8Confident91 Ų91100.3 Ų100.355%0.55252%0.523SS*.Hα-helixtrans-59.5-38.6178.8176.70000112.2A365 F366 E372 H373A365-V369 PolarHBondContact O-N 3.38Å; F366-V369 PolarHBondContact O-N 3.17Å; V369-E372 PolarHBondContact O-N 2.94Å; V369-H373 WeakPolarHBondContact O-CB 3.5Å; V369-H373 PolarHBondContact O-N 3.48Å
370A88.9Confident87.5Confident42 Ų4298.4 Ų98.435%0.34752%0.52SS..Hα-helixtrans-68.2-32.7174.500000112.8F366 I368 R374F366-A370 VanDerWaalsContact O-CB 3.27Å; F366-A370 WeakPolarHBondContact O-CB 3.49Å; F366-A370 PolarHBondContact O-N 2.85Å; I368-A370 VanDerWaalsContact C-N 3.29Å; I368-A370 PolarHBondContact O-N 3.18Å; A370-R374 WeakPolarHBondContact O-CG 3.33Å; A370-R374 PolarHBondContact O-N 3.06Å
371L89.1Confident85.9Confident104 Ų104101.2 Ų101.255%0.54553%0.528SS..Hα-helixtrans-75.2-39.4174.7-170.869.1000111.4K367 I368 R374 L375K367-L371 WeakPolarHBondContact O-CB 3.27Å; K367-L371 PolarHBondContact O-N 2.96Å; I368-L371 CarbonylContact O-C 3.51Å; I368-L371 WeakPolarHBondContact O-CA 3.48Å; I368-L371 WeakPolarHBondContact O-CB 3.21Å; I368-L371 PolarHBondContact O-N 3.08Å; L371-R374 CarbonylContact O-C 3.53Å; L371-R374 PolarHBondContact O-N 2.76Å; L371-L375 HydrophobicContact CG-CD1 4.34Å; L371-L375 WeakPolarHBondContact O-CB 3.43Å; L371-L375 PolarHBondContact O-N 2.95Å
372E90Very high84.1Confident99 Ų9999.1 Ų99.146%0.46352%0.519SS..Hα-helixtrans-61.3-43.6172.4-73170.3167.700111.1I368 V369 R374 L375 N376I368-E372 HydrophobicContact CG2-CG 4.2Å; I368-E372 WeakPolarHBondContact CG2-OE1 3.36Å; I368-E372 WeakPolarHBondContact O-CB 3.49Å; I368-E372 WeakPolarHBondContact O-CG 3.41Å; I368-E372 PolarHBondContact O-N 3.24Å; V369-E372 PolarHBondContact O-N 2.94Å; E372-R374 VanDerWaalsContact C-N 3.33Å; E372-R374 PolarHBondContact O-N 3.11Å; E372-L375 PolarHBondContact O-N 3.41Å; E372-N376 WeakPolarHBondContact O-CB 3.36Å; E372-N376 PolarHBondContact O-N 2.88Å; E372-N376 PolarHBondContact O-OD1 3.23Å
373H87.4Confident82.2Confident142 Ų142102.2 Ų102.266%0.65753%0.526SS*.Hα-helixtrans-63.7-38.3175.4-170.564.4000112.1V369 S377V369-H373 WeakPolarHBondContact O-CB 3.5Å; V369-H373 PolarHBondContact O-N 3.48Å; H373-S377 WeakPolarHBondContact O-CB 3.39Å; H373-S377 PolarHBondContact O-N 2.92Å
374R84.9Confident80.3Confident184 Ų18499.5 Ų99.569%0.69452%0.521SS*.Hα-helixtrans-69.9-36.8172.6-69.6-175.776.7173.85.4112.5A370 L371 E372 S377 L378A370-R374 WeakPolarHBondContact O-CG 3.33Å; A370-R374 PolarHBondContact O-N 3.06Å; L371-R374 CarbonylContact O-C 3.53Å; L371-R374 PolarHBondContact O-N 2.76Å; E372-R374 VanDerWaalsContact C-N 3.33Å; E372-R374 PolarHBondContact O-N 3.11Å; R374-S377 PolarHBondContact O-N 3.36Å; R374-L378 VanDerWaalsContact O-CG 3.28Å; R374-L378 WeakPolarHBondContact O-CG 3.44Å; R374-L378 PolarHBondContact O-N 3.28Å
375L79.8Confident78.4Confident98 Ų9898.4 Ų98.451%0.51352%0.52SS..Hα-helixtrans-65.3-43.1174-93.6161.9000111.4L371 E372 S377 L378 L379L371-L375 HydrophobicContact CG-CD1 4.34Å; L371-L375 WeakPolarHBondContact O-CB 3.43Å; L371-L375 PolarHBondContact O-N 2.95Å; E372-L375 PolarHBondContact O-N 3.41Å; L375-S377 VanDerWaalsContact C-N 3.34Å; L375-S377 PolarHBondContact O-N 3.2Å; L375-L378 CarbonylContact O-C 3.51Å; L375-L378 PolarHBondContact O-N 2.89Å; L375-L378 VanDerWaalsContact O-N 3.16Å; L375-L379 VanDerWaalsContact O-CB 3.3Å; L375-L379 WeakPolarHBondContact O-CB 3.5Å; L375-L379 PolarHBondContact O-N 3.19Å
376N81.9Confident76.3Confident98 Ų98103 Ų10352%0.52454%0.538SS..Hα-helixtrans-68.6-33.5177.1-67.3-8.7000111.5E372 L379 S380E372-N376 WeakPolarHBondContact O-CB 3.36Å; E372-N376 PolarHBondContact O-N 2.88Å; E372-N376 PolarHBondContact O-OD1 3.23Å; N376-L379 PolarHBondContact O-N 2.98Å; N376-S380 VanDerWaalsContact O-CB 3.29Å; N376-S380 WeakPolarHBondContact O-CB 3.49Å; N376-S380 PolarHBondContact O-N 3.48Å
377S78.8Confident74.1Confident76 Ų76102.7 Ų102.753%0.53154%0.543SS..Hα-helixtrans-65.2-39169.1174.80000112.6H373 R374 L375 M381H373-S377 WeakPolarHBondContact O-CB 3.39Å; H373-S377 PolarHBondContact O-N 2.92Å; R374-S377 PolarHBondContact O-N 3.36Å; L375-S377 VanDerWaalsContact C-N 3.34Å; L375-S377 PolarHBondContact O-N 3.2Å; S377-M381 WeakPolarHBondContact O-CB 3.43Å; S377-M381 PolarHBondContact O-N 3.45Å; S377-M381 VanDerWaalsContact O-N 3.14Å
378L75.3Confident72.1Confident105 Ų105103.8 Ų103.855%0.5555%0.55SS..Hα-helixtrans-72.4-33.3174-69.7170.6000112.5R374 L375 M381 G382R374-L378 VanDerWaalsContact O-CG 3.28Å; R374-L378 WeakPolarHBondContact O-CG 3.44Å; R374-L378 PolarHBondContact O-N 3.28Å; L375-L378 CarbonylContact O-C 3.51Å; L375-L378 PolarHBondContact O-N 2.89Å; L375-L378 VanDerWaalsContact O-N 3.16Å; L378-M381 HydrophobicContact CD2-CE 3.81Å; L378-M381 PolarHBondContact O-N 3.39Å; L378-G382 PolarHBondContact O-N 3.44Å
379L70.9Confident70.2Confident110 Ų110105.8 Ų105.858%0.57656%0.562SS**Hα-helixtrans-68.4-46.9176.5-173.173000110.7L375 N376 M381 G382 E383L375-L379 VanDerWaalsContact O-CB 3.3Å; L375-L379 WeakPolarHBondContact O-CB 3.5Å; L375-L379 PolarHBondContact O-N 3.19Å; N376-L379 PolarHBondContact O-N 2.98Å; L379-M381 VanDerWaalsContact C-N 3.27Å; L379-M381 PolarHBondContact O-N 2.95Å; L379-G382 CarbonylContact O-C 3.58Å; L379-G382 VanDerWaalsContact O-CA 3.29Å; L379-G382 WeakPolarHBondContact O-CA 3.18Å; L379-G382 PolarHBondContact O-N 3.5Å; L379-E383 PolarHBondContact O-N 3.21Å
380S67.4Low68.1Low73 Ų73106.5 Ų106.551%0.5158%0.577SS.*Hα-helixtrans-62.1-34.2174178.50000112.1N376 G382 L384N376-S380 VanDerWaalsContact O-CB 3.29Å; N376-S380 WeakPolarHBondContact O-CB 3.49Å; N376-S380 PolarHBondContact O-N 3.48Å; S380-G382 VanDerWaalsContact C-N 3.35Å; S380-L384 PolarHBondContact O-N 2.76Å; S380-L384 VanDerWaalsContact O-N 3.11Å
381M61.7Low66.4Low110 Ų110107.9 Ų107.954%0.54260%0.595SS.*Hα-helixtrans-71.9-28170.1-169.2162.560.600112.5S377 L378 L379 L384 V385S377-M381 WeakPolarHBondContact O-CB 3.43Å; S377-M381 PolarHBondContact O-N 3.45Å; S377-M381 VanDerWaalsContact O-N 3.14Å; L378-M381 HydrophobicContact CD2-CE 3.81Å; L378-M381 PolarHBondContact O-N 3.39Å; L379-M381 VanDerWaalsContact C-N 3.27Å; L379-M381 PolarHBondContact O-N 2.95Å; M381-L384 PolarHBondContact O-N 3.5Å; M381-V385 VanDerWaalsContact O-CG2 3.31Å; M381-V385 WeakPolarHBondContact O-CG2 3.37Å; M381-V385 PolarHBondContact O-N 3.33Å
382G59.6Low64.6Low34 Ų34107.6 Ų107.635%0.35160%0.602SS.*Hα-helixtrans-67.3-45.7170.100000113L378 L379 S380 L384 V385 D386L378-G382 PolarHBondContact O-N 3.44Å; L379-G382 CarbonylContact O-C 3.58Å; L379-G382 VanDerWaalsContact O-CA 3.29Å; L379-G382 WeakPolarHBondContact O-CA 3.18Å; L379-G382 PolarHBondContact O-N 3.5Å; S380-G382 VanDerWaalsContact C-N 3.35Å; G382-L384 PolarHBondContact O-N 3.05Å; G382-V385 WeakPolarHBondContact O-CB 3.34Å; G382-V385 PolarHBondContact O-N 3.2Å; G382-D386 PolarHBondContact O-N 3.46Å; G382-D386 VanDerWaalsContact O-N 3.17Å
383E55.3Low62.9Low138 Ų138109.9 Ų109.965%0.64561%0.613SS**Hα-helixtrans-63-29.6173.6-69.2-179.2115.900112.2L379L379-E383 PolarHBondContact O-N 3.21Å
384L55Low61.2Low91 Ų91113.7 Ų113.748%0.47662%0.621SS.*Hα-helixtrans-71.4-35.5170.5-16174000112.2S380 M381 G382 D386 N387 E388S380-L384 PolarHBondContact O-N 2.76Å; S380-L384 VanDerWaalsContact O-N 3.11Å; M381-L384 PolarHBondContact O-N 3.5Å; G382-L384 PolarHBondContact O-N 3.05Å; L384-D386 PolarHBondContact O-N 3.39Å; L384-N387 CarbonylContact O-C 3.56Å; L384-N387 PolarHBondContact O-N 3.13Å; L384-N387 VanDerWaalsContact O-N 3.08Å; L384-E388 PolarHBondContact O-N 2.77Å
385V53.8Low59.6Low78 Ų78108.7 Ų108.747%0.47362%0.615SS.*Hα-helixtrans-67-32.7178.4163.20000112.7M381 G382 N387 N389M381-V385 VanDerWaalsContact O-CG2 3.31Å; M381-V385 WeakPolarHBondContact O-CG2 3.37Å; M381-V385 PolarHBondContact O-N 3.33Å; G382-V385 WeakPolarHBondContact O-CB 3.34Å; G382-V385 PolarHBondContact O-N 3.2Å; V385-N387 PolarHBondContact O-N 3.47Å; V385-N389 PolarHBondContact O-N 3.06Å
386D50.2Low58.1Low146 Ų146110.3 Ų110.378%0.78162%0.619SS**THydrogen-bonded Turntrans-66.6-20.5171.5-87-31.4000113G382 L384G382-D386 PolarHBondContact O-N 3.46Å; G382-D386 VanDerWaalsContact O-N 3.17Å; L384-D386 PolarHBondContact O-N 3.39Å
387N49Very low56.9Low141 Ų141110.1 Ų110.175%0.75462%0.622SS**THydrogen-bonded Turntrans-102.3-25.4179.7-15422.1000113.5L384 V385L384-N387 CarbonylContact O-C 3.56Å; L384-N387 PolarHBondContact O-N 3.13Å; L384-N387 VanDerWaalsContact O-N 3.08Å; V385-N387 PolarHBondContact O-N 3.47Å
388E49.6Very low55.9Low134 Ų134113.3 Ų113.363%0.62663%0.628SS**  trans-106.436.9175.2-71.6-158.183.800113.4L384 A390L384-E388 PolarHBondContact O-N 2.77Å; E388-A390 PolarHBondContact O-N 3.21Å
389N51.9Low55.1Low128 Ų128112.1 Ų112.168%0.68463%0.625SS**THydrogen-bonded Turntrans-70.768.7175.9-174.423.7000113.1V385V385-N389 PolarHBondContact O-N 3.06Å
390A50.7Low54.5Low106 Ų106110.5 Ų110.588%0.87662%0.617SS**THydrogen-bonded Turntrans-152.4-30.5171.100000113.7E388E388-A390 PolarHBondContact O-N 3.21Å
391G51.7Low54.5Low70 Ų70110 Ų11072%0.72262%0.617SS**THydrogen-bonded Turntrans-98.4-51.3-165.300000117.2
392S51.3Low54.8Low99 Ų99111.7 Ų111.769%0.69262%0.624SS**  trans-103.215.6-153-149.60000116.5R394S392-R394 PolarHBondContact O-N 3.43Å; S392-R394 VanDerWaalsContact O-N 3.1Å
393Q54.1Low55.4Low147 Ų147114.9 Ų114.969%0.68763%0.631SS**Hα-helixtrans-68-15.4-169.9-159.7171.681.700114.7V397Q393-V397 WeakPolarHBondContact O-CG2 3.41Å
394R51.8Low56.1Low221 Ų221116.3 Ų116.383%0.83463%0.632SS**Hα-helixtrans-78.9-39.8-170.2-164.8170.2-174.7143.91.8114.9S392S392-R394 PolarHBondContact O-N 3.43Å; S392-R394 VanDerWaalsContact O-N 3.1Å
395S52.2Low57.3Low80 Ų80113.4 Ų113.456%0.55963%0.625SS**Hα-helixtrans-77.6-36.7-173.3178.50000113V397 E398S395-V397 VanDerWaalsContact C-N 3.33Å; S395-V397 PolarHBondContact O-N 3.44Å; S395-E398 PolarHBondContact O-N 2.99Å
396Q48.8Very low58.5Low131 Ų131116 Ų11661%0.61263%0.632SS**Hα-helixtrans-72.1-26.1-175.6-160.817613.800113.1N400Q396-N400 WeakPolarHBondContact O-CB 3.37Å; Q396-N400 PolarHBondContact O-N 2.95Å; Q396-N400 PolarHBondContact O-ND2 3.25Å
397V56.9Low59.9Low94 Ų94114 Ų11457%0.5762%0.621SS**Hα-helixtrans-70.1-38.4175.4173.30000111.4Q393 S395 A401Q393-V397 WeakPolarHBondContact O-CG2 3.41Å; S395-V397 VanDerWaalsContact C-N 3.33Å; S395-V397 PolarHBondContact O-N 3.44Å; V397-A401 WeakPolarHBondContact O-CB 3.28Å; V397-A401 PolarHBondContact O-N 3.5Å
398E57.4Low61.3Low143 Ų143110.8 Ų110.867%0.66861%0.609SS**Hα-helixtrans-69.5-48-174.6-163.3156.7-148.500111.7S395 N400 A401 E402S395-E398 PolarHBondContact O-N 2.99Å; E398-N400 VanDerWaalsContact C-N 3.35Å; E398-N400 PolarHBondContact O-N 3.43Å; E398-A401 PolarHBondContact O-N 2.76Å; E398-E402 PolarHBondContact O-N 2.96Å; E398-E402 VanDerWaalsContact O-N 3.13Å
399V58.6Low63Low81 Ų81107.4 Ų107.449%0.49160%0.597SS.*Hα-helixtrans-62.2-40.6175.8-179.90000111.9E402 I403V399-E402 PolarHBondContact O-N 3.28Å; V399-I403 HydrophobicContact CG1-CD1 4.17Å; V399-I403 WeakPolarHBondContact O-CG1 3.44Å; V399-I403 PolarHBondContact O-N 2.57Å
400N57.5Low64.5Low76 Ų76105.1 Ų105.141%0.40659%0.585SS.*Hα-helixtrans-65.5-41.1177-78.7-32.3000111.9Q396 E398 E402 I403 Y404Q396-N400 WeakPolarHBondContact O-CB 3.37Å; Q396-N400 PolarHBondContact O-N 2.95Å; Q396-N400 PolarHBondContact O-ND2 3.25Å; E398-N400 VanDerWaalsContact C-N 3.35Å; E398-N400 PolarHBondContact O-N 3.43Å; N400-E402 VanDerWaalsContact C-N 3.31Å; N400-E402 PolarHBondContact O-N 2.98Å; N400-I403 PolarHBondContact O-N 3.17Å; N400-Y404 WeakPolarHBondContact O-CD2 3.3Å; N400-Y404 PolarHBondContact O-N 3.37Å; N400-Y404 VanDerWaalsContact O-N 3.09Å
401A67.5Low66.3Low61 Ų61105.6 Ų105.650%0.50457%0.572SS.*Hα-helixtrans-61.6-38.6177.200000112.2V397 E398 Y404 G405V397-A401 WeakPolarHBondContact O-CB 3.28Å; V397-A401 PolarHBondContact O-N 3.5Å; E398-A401 PolarHBondContact O-N 2.76Å; A401-Y404 PolarHBondContact O-N 3.03Å; A401-G405 PolarHBondContact O-N 3.48Å
402E68.6Low68.1Low147 Ų147108.1 Ų108.169%0.68756%0.564SS**Hα-helixtrans-65.8-42177.6-163.9164.4-129.600112.1E398 V399 N400 G405 E406E398-E402 PolarHBondContact O-N 2.96Å; E398-E402 VanDerWaalsContact O-N 3.13Å; V399-E402 PolarHBondContact O-N 3.28Å; N400-E402 VanDerWaalsContact C-N 3.31Å; N400-E402 PolarHBondContact O-N 2.98Å; E402-G405 WeakPolarHBondContact O-CA 3.48Å; E402-G405 PolarHBondContact O-N 3.49Å; E402-G405 VanDerWaalsContact O-N 3.15Å; E402-E406 PolarHBondContact O-N 3.47Å
403I71.4Confident70Confident100 Ų100108.5 Ų108.551%0.51355%0.553SS.*Hα-helixtrans-62.1-45.4175.3-66.7166000111.6V399 N400 G405 E406 L407V399-I403 HydrophobicContact CG1-CD1 4.17Å; V399-I403 WeakPolarHBondContact O-CG1 3.44Å; V399-I403 PolarHBondContact O-N 2.57Å; N400-I403 PolarHBondContact O-N 3.17Å; I403-G405 VanDerWaalsContact C-N 3.28Å; I403-G405 PolarHBondContact O-N 3.04Å; I403-E406 PolarHBondContact O-N 3.42Å; I403-L407 VanDerWaalsContact O-CB 3.32Å; I403-L407 WeakPolarHBondContact O-CB 3.46Å; I403-L407 PolarHBondContact O-N 3.05Å
404Y70.4Confident71.4Confident168 Ų168107.2 Ų107.266%0.65955%0.55SS*.Hα-helixtrans-64.8-34.7174.2-74.6-64.1000112N400 A401 S408N400-Y404 WeakPolarHBondContact O-CD2 3.3Å; N400-Y404 PolarHBondContact O-N 3.37Å; N400-Y404 VanDerWaalsContact O-N 3.09Å; A401-Y404 PolarHBondContact O-N 3.03Å; Y404-S408 WeakPolarHBondContact O-CB 3.29Å; Y404-S408 PolarHBondContact O-N 3.36Å
405G79.8Confident73.3Confident31 Ų31100.4 Ų100.432%0.3253%0.528SS..Hα-helixtrans-55.7-60.4170.800000112A401 E402 I403 L407 S408 T409A401-G405 PolarHBondContact O-N 3.48Å; E402-G405 WeakPolarHBondContact O-CA 3.48Å; E402-G405 PolarHBondContact O-N 3.49Å; E402-G405 VanDerWaalsContact O-N 3.15Å; I403-G405 VanDerWaalsContact C-N 3.28Å; I403-G405 PolarHBondContact O-N 3.04Å; G405-L407 VanDerWaalsContact C-N 3.34Å; G405-L407 PolarHBondContact O-N 3.03Å; G405-S408 PolarHBondContact O-N 2.89Å; G405-S408 PolarHBondContact O-OG 3.13Å; G405-T409 PolarHBondContact O-N 2.69Å
406E78.5Confident75.1Confident133 Ų133102.2 Ų102.262%0.62153%0.526SS*.Hα-helixtrans-56.1-46.9179-72.3-144.9127.700112.5E402 I403 S408 T409 N410E402-E406 PolarHBondContact O-N 3.47Å; I403-E406 PolarHBondContact O-N 3.42Å; E406-S408 VanDerWaalsContact C-N 3.3Å; E406-S408 PolarHBondContact O-N 3.41Å; E406-T409 PolarHBondContact O-N 2.96Å; E406-T409 VanDerWaalsContact O-N 3.13Å; E406-T409 PolarHBondContact O-OG1 2.97Å; E406-N410 PolarHBondContact O-N 3.21Å; E406-N410 PolarHBondContact O-ND2 2.89Å
407L79.4Confident77.1Confident104 Ų104100.6 Ų100.655%0.54552%0.52SS..Hα-helixtrans-56.9-43.6179.5-175.463.3000111.4I403 G405 T409 N410 L411I403-L407 VanDerWaalsContact O-CB 3.32Å; I403-L407 WeakPolarHBondContact O-CB 3.46Å; I403-L407 PolarHBondContact O-N 3.05Å; G405-L407 VanDerWaalsContact C-N 3.34Å; G405-L407 PolarHBondContact O-N 3.03Å; L407-T409 PolarHBondContact O-N 2.79Å; L407-N410 PolarHBondContact O-N 2.88Å; L407-L411 WeakPolarHBondContact O-CB 3.39Å; L407-L411 PolarHBondContact O-N 3.42Å
408S79.5Confident78.5Confident72 Ų72102 Ų10250%0.50352%0.52SS..Hα-helixtrans-62.1-41.5176.978.60000112.5Y404 G405 E406 N410 L411 F412Y404-S408 WeakPolarHBondContact O-CB 3.29Å; Y404-S408 PolarHBondContact O-N 3.36Å; G405-S408 PolarHBondContact O-N 2.89Å; G405-S408 PolarHBondContact O-OG 3.13Å; E406-S408 VanDerWaalsContact C-N 3.3Å; E406-S408 PolarHBondContact O-N 3.41Å; S408-N410 VanDerWaalsContact C-N 3.31Å; S408-N410 PolarHBondContact O-N 2.74Å; S408-L411 PolarHBondContact O-N 3.44Å; S408-F412 PolarHBondContact O-N 3.24Å
409T84.7Confident80Confident64 Ų64100.6 Ų100.639%0.39351%0.509SS..Hα-helixtrans-65.9-36.1177.378.10000111.8G405 E406 L407 K413G405-T409 PolarHBondContact O-N 2.69Å; E406-T409 PolarHBondContact O-N 2.96Å; E406-T409 VanDerWaalsContact O-N 3.13Å; E406-T409 PolarHBondContact O-OG1 2.97Å; L407-T409 PolarHBondContact O-N 2.79Å; T409-K413 WeakPolarHBondContact O-CD 3.29Å; T409-K413 WeakPolarHBondContact O-CG 3.44Å; T409-K413 PolarHBondContact O-N 2.89Å; T409-K413 PolarHBondContact OG1-NZ 3.44Å
410N83.4Confident81.3Confident79 Ų79101.3 Ų101.342%0.42251%0.51SS..Hα-helixtrans-73.1-37.6-179.2-70.7-35.3000111.7E406 L407 S408 K413 L414E406-N410 PolarHBondContact O-N 3.21Å; E406-N410 PolarHBondContact O-ND2 2.89Å; L407-N410 PolarHBondContact O-N 2.88Å; S408-N410 VanDerWaalsContact C-N 3.31Å; S408-N410 PolarHBondContact O-N 2.74Å; N410-K413 PolarHBondContact O-N 3.44Å; N410-K413 PolarHBondContact OD1-NZ 3.16Å; N410-L414 WeakPolarHBondContact O-CB 3.31Å; N410-L414 PolarHBondContact O-N 3.35Å
411L89.6Confident82.6Confident117 Ų117102.8 Ų102.861%0.61352%0.517SS*.Hα-helixtrans-62.2-46.3171.7-156.1163.3000111.1L407 S408 K413 L414 E415L407-L411 WeakPolarHBondContact O-CB 3.39Å; L407-L411 PolarHBondContact O-N 3.42Å; S408-L411 PolarHBondContact O-N 3.44Å; L411-K413 PolarHBondContact O-N 3.21Å; L411-L414 WeakPolarHBondContact O-CB 3.46Å; L411-L414 PolarHBondContact O-N 3.4Å; L411-L414 VanDerWaalsContact O-N 3.17Å; L411-E415 PolarHBondContact O-N 2.9Å
412F89.1Confident83.4Confident123 Ų123108.1 Ų108.154%0.53952%0.524SS..Hα-helixtrans-64.6-37.8176.9-174.6-102.4000113.6S408 L414 E415 K416S408-F412 PolarHBondContact O-N 3.24Å; F412-L414 VanDerWaalsContact C-N 3.33Å; F412-L414 PolarHBondContact O-N 2.9Å; F412-E415 PolarHBondContact O-N 3.46Å; F412-K416 WeakPolarHBondContact O-CB 3.32Å; F412-K416 PolarHBondContact O-N 3.13Å
413K89.7Confident84.1Confident107 Ų107107.5 Ų107.547%0.46552%0.519SS..Hα-helixtrans-59.1-44.7171.4-72.1161.1-164.2146.70110.8T409 N410 L411 K416 I417T409-K413 WeakPolarHBondContact O-CD 3.29Å; T409-K413 WeakPolarHBondContact O-CG 3.44Å; T409-K413 PolarHBondContact O-N 2.89Å; T409-K413 PolarHBondContact OG1-NZ 3.44Å; N410-K413 PolarHBondContact O-N 3.44Å; N410-K413 PolarHBondContact OD1-NZ 3.16Å; L411-K413 PolarHBondContact O-N 3.21Å; K413-K416 PolarHBondContact O-N 3.47Å; K413-I417 WeakPolarHBondContact O-CG1 3.4Å; K413-I417 PolarHBondContact O-N 3.09Å
414L85Confident84.4Confident119 Ų119108 Ų10862%0.62352%0.522SS*.Hα-helixtrans-63.9-45.2-179.3-152.972.5000111.7N410 L411 F412 K416 I417 Q418N410-L414 WeakPolarHBondContact O-CB 3.31Å; N410-L414 PolarHBondContact O-N 3.35Å; L411-L414 WeakPolarHBondContact O-CB 3.46Å; L411-L414 PolarHBondContact O-N 3.4Å; L411-L414 VanDerWaalsContact O-N 3.17Å; F412-L414 VanDerWaalsContact C-N 3.33Å; F412-L414 PolarHBondContact O-N 2.9Å; L414-K416 VanDerWaalsContact C-N 3.34Å; L414-K416 PolarHBondContact O-N 3.15Å; L414-I417 WeakPolarHBondContact O-CB 3.12Å; L414-I417 PolarHBondContact O-N 3.43Å; L414-Q418 PolarHBondContact O-N 3.11Å
415E90.1Very high84.7Confident78 Ų78106.7 Ų106.736%0.36453%0.526SS..Hα-helixtrans-63.6-38.2178.1-156.7-126.9135.300112L411 F412 Q418 R419L411-E415 PolarHBondContact O-N 2.9Å; F412-E415 PolarHBondContact O-N 3.46Å; E415-Q418 PolarHBondContact O-N 3.34Å; E415-R419 PolarHBondContact O-N 3.48Å; E415-R419 IonicContact OE1-CZ 3.26Å; E415-R419 IonicContact OE1-NE 3.05Å; E415-R419 PolarHBondContact OE1-NE 2.86Å; E415-R419 IonicContact OE1-NH2 2.78Å; E415-R419 PolarHBondContact OE1-NH2 3.38Å; E415-R419 IonicContact OE2-CZ 3.41Å; E415-R419 IonicContact OE2-NH2 2.65Å; E415-R419 PolarHBondContact OE2-NH2 3.14Å
416K90.1Very high84.7Confident119 Ų119112.5 Ų112.552%0.51755%0.545SS..Hα-helixtrans-65.6-38.3173.6-170.6177-177.7178.70112.6F412 K413 L414 N420F412-K416 WeakPolarHBondContact O-CB 3.32Å; F412-K416 PolarHBondContact O-N 3.13Å; K413-K416 PolarHBondContact O-N 3.47Å; L414-K416 VanDerWaalsContact C-N 3.34Å; L414-K416 PolarHBondContact O-N 3.15Å; K416-N420 PolarHBondContact O-N 2.71Å; K416-N420 VanDerWaalsContact O-N 3.13Å
417I91.1Very high84.1Confident97 Ų97113.8 Ų113.850%0.49755%0.551SS.*Hα-helixtrans-64.9-46.1173.5-68.7163.1000110.1K413 L414 R419 N420 L421K413-I417 WeakPolarHBondContact O-CG1 3.4Å; K413-I417 PolarHBondContact O-N 3.09Å; L414-I417 WeakPolarHBondContact O-CB 3.12Å; L414-I417 PolarHBondContact O-N 3.43Å; I417-R419 VanDerWaalsContact C-N 3.33Å; I417-R419 PolarHBondContact O-N 3.2Å; I417-N420 PolarHBondContact O-N 3.46Å; I417-L421 HydrophobicContact CG2-CD1 3.87Å; I417-L421 HydrophobicContact CG2-CG 4.32Å; I417-L421 WeakPolarHBondContact O-CG 3.42Å; I417-L421 PolarHBondContact O-N 3.01Å
418Q86.9Confident82.5Confident122 Ų122117.2 Ų117.257%0.5758%0.576SS**Hα-helixtrans-59-41.4177.3-175.2178.9-8.200112.3L414 E415 L421 R422L414-Q418 PolarHBondContact O-N 3.11Å; E415-Q418 PolarHBondContact O-N 3.34Å; Q418-L421 PolarHBondContact O-N 2.92Å; Q418-R422 PolarHBondContact O-N 2.98Å
419R89.1Confident82.6Confident114 Ų114119.5 Ų119.543%0.4358%0.58SS.*Hα-helixtrans-65.3-40174.9-78.5-171.7-98.5119.6-8.6113.2E415 I417 R422 K423E415-R419 PolarHBondContact O-N 3.48Å; E415-R419 IonicContact OE1-CZ 3.26Å; E415-R419 IonicContact OE1-NE 3.05Å; E415-R419 PolarHBondContact OE1-NE 2.86Å; E415-R419 IonicContact OE1-NH2 2.78Å; E415-R419 PolarHBondContact OE1-NH2 3.38Å; E415-R419 IonicContact OE2-CZ 3.41Å; E415-R419 IonicContact OE2-NH2 2.65Å; E415-R419 PolarHBondContact OE2-NH2 3.14Å; I417-R419 VanDerWaalsContact C-N 3.33Å; I417-R419 PolarHBondContact O-N 3.2Å; R419-R422 PolarHBondContact O-N 3.36Å; R419-K423 PolarHBondContact O-N 3.17Å
420N86.3Confident82.5Confident97 Ų97122.4 Ų122.452%0.51959%0.59SS.*Hα-helixtrans-67.5-40.7174.6-79.9-7.9000112.3K416 I417 R422 K423 L424K416-N420 PolarHBondContact O-N 2.71Å; K416-N420 VanDerWaalsContact O-N 3.13Å; I417-N420 PolarHBondContact O-N 3.46Å; N420-R422 VanDerWaalsContact C-N 3.34Å; N420-R422 PolarHBondContact O-N 3.42Å; N420-K423 PolarHBondContact O-N 3.01Å; N420-L424 PolarHBondContact O-N 2.85Å; N420-L424 VanDerWaalsContact O-N 3.11Å
421L85.1Confident82.5Confident106 Ų106124.8 Ų124.856%0.55560%0.599SS**Hα-helixtrans-63.5-38.5175.7-72.8172.2000112I417 Q418 L425I417-L421 HydrophobicContact CG2-CD1 3.87Å; I417-L421 HydrophobicContact CG2-CG 4.32Å; I417-L421 WeakPolarHBondContact O-CG 3.42Å; I417-L421 PolarHBondContact O-N 3.01Å; Q418-L421 PolarHBondContact O-N 2.92Å; L421-L425 PolarHBondContact O-N 3.06Å
422R83.2Confident82Confident173 Ų173125.2 Ų125.265%0.65360%0.598SS**Hα-helixtrans-62.2-46.2174.1-175.6179.1-76.6-177.4-4.5111.6Q418 R419 N420 L424 L425 E426Q418-R422 PolarHBondContact O-N 2.98Å; R419-R422 PolarHBondContact O-N 3.36Å; N420-R422 VanDerWaalsContact C-N 3.34Å; N420-R422 PolarHBondContact O-N 3.42Å; R422-L424 PolarHBondContact O-N 3Å; R422-L425 WeakPolarHBondContact O-CA 3.44Å; R422-L425 WeakPolarHBondContact O-CB 3.37Å; R422-L425 PolarHBondContact O-N 3.08Å; R422-L425 VanDerWaalsContact O-N 3.08Å; R422-E426 PolarHBondContact O-N 3.49Å
423K84.1Confident81.6Confident135 Ų135125.4 Ų125.459%0.58760%0.602SS**Hα-helixtrans-58.1-46.7177.1-77.2-165168-157.40112.9R419 N420 L425 E426 E427R419-K423 PolarHBondContact O-N 3.17Å; N420-K423 PolarHBondContact O-N 3.01Å; K423-L425 PolarHBondContact O-N 3.33Å; K423-E426 PolarHBondContact O-N 3.37Å; K423-E427 PolarHBondContact O-N 2.76Å
424L77.9Confident81.1Confident110 Ų110126.6 Ų126.658%0.57661%0.611SS**Hα-helixtrans-61-25.4176.9-77.3163000113.4N420 R422 T428N420-L424 PolarHBondContact O-N 2.85Å; N420-L424 VanDerWaalsContact O-N 3.11Å; R422-L424 PolarHBondContact O-N 3Å; L424-T428 PolarHBondContact O-OG1 3.1Å; L424-T428 VanDerWaalsContact O-OG1 3.11Å
425L75.8Confident80.8Confident140 Ų140127.1 Ų127.173%0.73361%0.61SS**THydrogen-bonded Turntrans-84.9-7.8175.4-118.5165000113.7L421 R422 K423L421-L425 PolarHBondContact O-N 3.06Å; R422-L425 WeakPolarHBondContact O-CA 3.44Å; R422-L425 WeakPolarHBondContact O-CB 3.37Å; R422-L425 PolarHBondContact O-N 3.08Å; R422-L425 VanDerWaalsContact O-N 3.08Å; K423-L425 PolarHBondContact O-N 3.33Å
426E80.4Confident80.1Confident153 Ų153130.9 Ų130.972%0.71563%0.629SS**THydrogen-bonded Turntrans-113.4-10.8-176.6-159.4158.9-151.800111.4R422 K423R422-E426 PolarHBondContact O-N 3.49Å; K423-E426 PolarHBondContact O-N 3.37Å
427E66.1Low79.2Confident160 Ų160131.9 Ų131.975%0.74864%0.639SS**  trans-97.914.8170-66.6179.8149.300113.3K423K423-E427 PolarHBondContact O-N 2.76Å
428T44.6Very low78.1Confident176 Ų176135.1 Ų135.1100%1.0865%0.651SS**  trans-126.90-177.9-56.50000113.1L424L424-T428 PolarHBondContact O-OG1 3.1Å; L424-T428 VanDerWaalsContact O-OG1 3.11Å

Retrieved 428 of 428 residues in 365.1 ms (Link to these results)