A0A087XRE7_POEFO Loading...

Si:dkey-6i22.5

AlphaFold DB , UniProt , Accession A0A087XRE7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 237 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1Q39.2Very low42.6Very low239 Ų239184.6 Ų184.6100%1.11787%0.865SS**  0122.80-151.3169.1-7.500108
2K42.4Very low41.8Very low197 Ų197182.2 Ų182.286%0.85786%0.862SS**  trans65.796.7168.4-68-178.2177.3-179.90120.2
3R38.5Very low41.5Very low232 Ų232182.5 Ų182.588%0.87586%0.862SS**  trans-50.5144.8147.2-68.6172.4168.7170.4-4.4111.1
4K53.8Low40.6Very low212 Ų212174.9 Ų174.992%0.92286%0.857SS**  trans-123.6104.7152.9-91.1-176.2174.5-177.80108.6
5Q43.1Very low39.8Very low165 Ų165168.6 Ų168.677%0.77186%0.855SS**  trans-75.5139.6158-80.4170.2-23.700107.8
6S51.3Low39.2Very low116 Ų116165.6 Ų165.681%0.81185%0.854SS**  trans-126.598.3157.955.60000108
7Q40.3Very low38.6Very low178 Ų178160.4 Ų160.483%0.83285%0.851SS**  trans-68.3134.7156.7-74.9171.9-15.900108
8L41.9Very low38.2Very low178 Ų178161.3 Ų161.393%0.93285%0.85SS**  trans-132.9136.2154.9-96159.5000108.5
9K41.8Very low37.8Very low169 Ų169160.3 Ų160.374%0.73585%0.845SS**  trans-102.9140.5-151.2177.9178.9171.5-159.30108.2E11K9-E11 IonicContact NZ-OE1 3.99Å
10M36Very low37.6Very low185 Ų185161.3 Ų161.391%0.91185%0.845SS**  trans-67.1133.3166.3-72-148-79.600109.6
11E40Very low37.4Very low160 Ų160160.3 Ų160.375%0.74884%0.84SS**  trans-126.1123.9161.5-90176.9-178.400109.9K9K9-E11 IonicContact NZ-OE1 3.99Å
12D33.3Very low37Very low155 Ų155157.1 Ų157.183%0.82983%0.826SS**  trans-82.7135.1174.1179.227.8000108.5
13Q37.8Very low36.5Very low186 Ų186157.3 Ų157.387%0.86983%0.826SS**  trans-137100.9165.9-82.1-170.426.200109.4
14G28.9Very low36.2Very low76 Ų76154.1 Ų154.178%0.78482%0.821SS**  trans-73.5145.2156.300000111.2
15G28.4Very low35.1Very low81 Ų81151.7 Ų151.784%0.83581%0.811SS**  trans-147.8101.8173.700000109.8
16S30.3Very low34.5Very low120 Ų120150.7 Ų150.784%0.83981%0.806SS**  trans-68.9146.7174.8169.70000112.2
17G28.8Very low33.4Very low78 Ų78150.4 Ų150.480%0.80480%0.804SS**  trans-163.6100.4165.400000111.4
18Q32.8Very low32.8Very low176 Ų176148.6 Ų148.682%0.82280%0.8SS**  trans-94.1152.1165.9-69.2176.4-76.500110.1
19N29.9Very low32.3Very low142 Ų142144.4 Ų144.476%0.75979%0.786SS**  trans156.2111142.4-76.7-7000107.5
20E33.4Very low31.8Very low181 Ų181143 Ų14385%0.84679%0.791SS**  60.2139.686.8-72.4-172.5-176.600113
21D33.3Very low31.6Very low140 Ų140143 Ų14375%0.74979%0.789SS**  cis-169.8165.5-24.8-145.7-21000106.1
22E31.6Very low31.2Very low173 Ų173145 Ų14581%0.80880%0.795SS**  trans64.8123156.7-61.8-169.4155.100123.4
23K31.8Very low31.3Very low201 Ų201148.3 Ų148.387%0.87480%0.796SS**  trans-148.8128.2132.6-153.3170.1-176.8178.80112.9
24Q31.1Very low31Very low165 Ų165144.7 Ų144.777%0.77179%0.787SS**  trans-52.3156.6177.1-58.6158.9-56.300115.4
25K31.1Very low31Very low161 Ų161148.2 Ų148.270%0.779%0.788SS**  168.5133.897.2-116.2-179.4173.2-1290115.4
26E30.4Very low31.1Very low143 Ų143148.8 Ų148.867%0.66879%0.785SS**  trans64115.1133.6-94.6171.8158.500121.1
27S29.4Very low31.1Very low111 Ų111148.1 Ų148.178%0.77679%0.787SS**  93.6148.398750000110.4
28D26Very low31.3Very low139 Ų139149.1 Ų149.174%0.74379%0.788SS**  cis-164.3154.319.2-174.823.4000108.1
29S33Very low31.5Very low90 Ų90147.5 Ų147.563%0.62979%0.79SS**  trans24.2136.4151.2-58.30000123.3
30T30.6Very low31.8Very low139 Ų139149.8 Ų149.885%0.85380%0.796SS**  172.3136.7101.1-68.20000111.6
31E32.7Very low32.1Very low185 Ų185148.8 Ų148.886%0.86480%0.797SS**  trans-64.9157.3178.3-59.4172.713000114.8
32K31.8Very low32.3Very low202 Ų202149.1 Ų149.188%0.87879%0.794SS**  153.2100.4115.4-166.1172.2-174.7-179.40115.1
33R35.3Very low32.8Very low225 Ų225146.2 Ų146.285%0.84979%0.789SS**  36.6146.9128.6-126.3179.8-174.4172.91.8124.2
34T30.9Very low33.3Very low110 Ų110138.7 Ų138.768%0.67577%0.769SS**  trans81.2141.1155.663.50000117.5
35D29.7Very low33.9Very low150 Ų150140.6 Ų140.680%0.80277%0.769SS**  cis-169163.8-6.9-107.2-35.7000108.6
36A29.2Very low34.1Very low94 Ų94140.4 Ų140.478%0.77777%0.768SS**  trans75104.7149.100000122.8
37A30.7Very low34.6Very low105 Ų105136.5 Ų136.587%0.86876%0.76SS**  52.6114.1122.700000122
38A32Very low35.3Very low100 Ų100134.1 Ų134.183%0.82675%0.747SS**  trans-152.8112.1133.800000109.8
39T38.7Very low35.9Very low142 Ų142134.1 Ų134.187%0.87174%0.743SS**  trans-66.8119.4164.5180000109.8
40E35.9Very low36.3Very low189 Ų189137.1 Ų137.188%0.88375%0.747SS**  trans-127.9114.8150.9-69.8-152.1169.500108.9E42E40-E42 PolarHBondContact O-N 3.25Å
41D39.2Very low36.9Very low161 Ų161132.8 Ų132.886%0.86172%0.72SS**  trans-69.3102.2173.7-105.1-38.7000109
42E37.6Very low37.5Very low147 Ų147128 Ų12869%0.68771%0.712SS**  trans-97.7111.9169.3-117.3-73.7167.400108.6E40 G44E40-E42 PolarHBondContact O-N 3.25Å; E42-G44 PolarHBondContact O-N 3.14Å; E42-G44 PolarHBondContact OE2-N 3.28Å
43P42Very low38Very low111 Ų111121.7 Ų121.772%0.72170%0.698SS**THydrogen-bonded Turntrans-74-4.9-176.430.7-32.8000112.8
44G42.1Very low38.9Very low43 Ų43118.1 Ų118.144%0.44369%0.685SS.*Hα-helixtrans-76.2-22.3-175.900000115.6E42E42-G44 PolarHBondContact O-N 3.14Å; E42-G44 PolarHBondContact OE2-N 3.28Å
45R42.9Very low40.3Very low206 Ų206120.8 Ų120.878%0.77768%0.684SS**Hα-helixtrans-79.8-32.7-176.9-107.6-178.5179.4-169.9-0.1114A47 A48 E49R45-A47 PolarHBondContact O-N 2.71Å; R45-A48 PolarHBondContact O-N 3.45Å; R45-E49 PolarHBondContact O-N 3.35Å
46K36.1Very low42.9Very low157 Ų157116.1 Ų116.168%0.68366%0.658SS**Hα-helixtrans-68.1-33.7-179.1-77.3-177.5179.4170.10112.8E50K46-E50 WeakPolarHBondContact O-CB 3.33Å; K46-E50 WeakPolarHBondContact O-CG 3.43Å; K46-E50 PolarHBondContact O-N 3.2Å
47A41.4Very low46Very low60 Ų60115.4 Ų115.450%0.49664%0.636SS.*Hα-helixtrans-69.8-34.1175.700000112.4R45 T51R45-A47 PolarHBondContact O-N 2.71Å; A47-T51 WeakPolarHBondContact O-CG2 3.29Å; A47-T51 PolarHBondContact O-N 3.04Å
48A42.9Very low48.9Very low61 Ų61112 Ų11250%0.50460%0.602SS.*Hα-helixtrans-73.6-41.8176.700000111.8R45 T51 A52R45-A48 PolarHBondContact O-N 3.45Å; A48-T51 PolarHBondContact O-N 3.2Å; A48-T51 PolarHBondContact O-OG1 3.46Å; A48-A52 PolarHBondContact O-N 3.3Å
49E39.5Very low51.8Low139 Ų139114.4 Ų114.465%0.6560%0.595SS**Hα-helixtrans-71-35.2174.9-94177.6152.800113.4R45 T51 A52 A53R45-E49 PolarHBondContact O-N 3.35Å; E49-T51 PolarHBondContact O-N 3.1Å; E49-A52 PolarHBondContact O-N 3.38Å; E49-A52 VanDerWaalsContact O-N 3.17Å; E49-A53 PolarHBondContact O-N 3.24Å
50E40.3Very low54.4Low154 Ų154111.9 Ų111.972%0.7258%0.575SS**Hα-helixtrans-62.5-29.2173.1-88.3-176.5143.900112.4K46K46-E50 WeakPolarHBondContact O-CB 3.33Å; K46-E50 WeakPolarHBondContact O-CG 3.43Å; K46-E50 PolarHBondContact O-N 3.2Å
51T45Very low57.2Low47 Ų47105.3 Ų105.329%0.28854%0.544SS..Hα-helixtrans-82.5-24.5174.964.30000113.9A47 A48 E49 A53 R54 K139A47-T51 WeakPolarHBondContact O-CG2 3.29Å; A47-T51 PolarHBondContact O-N 3.04Å; A48-T51 PolarHBondContact O-N 3.2Å; A48-T51 PolarHBondContact O-OG1 3.46Å; E49-T51 PolarHBondContact O-N 3.1Å; T51-A53 VanDerWaalsContact C-N 3.32Å; T51-R54 VanDerWaalsContact O-CB 3.24Å; T51-R54 WeakPolarHBondContact O-CB 3.49Å; T51-R54 VanDerWaalsContact O-CG 3.27Å; T51-R54 WeakPolarHBondContact O-CG 3.28Å; T51-R54 PolarHBondContact O-N 3.39Å; T51-K139 PolarHBondContact OG1-NZ 3.19Å
52A44.5Very low59.8Low84 Ų84101.3 Ų101.369%0.69452%0.522SS*.Hα-helixtrans-74.4-27176.100000111.9A48 E49 R54A48-A52 PolarHBondContact O-N 3.3Å; E49-A52 PolarHBondContact O-N 3.38Å; E49-A52 VanDerWaalsContact O-N 3.17Å; A52-R54 PolarHBondContact O-N 2.79Å
53A42.5Very low62.5Low71 Ų71100.7 Ų100.759%0.58752%0.517SS*.THydrogen-bonded Turntrans-81.619.1167.200000113.3E49 T51 Y55E49-A53 PolarHBondContact O-N 3.24Å; T51-A53 VanDerWaalsContact C-N 3.32Å; A53-Y55 PolarHBondContact O-N 3.16Å
54R53.7Low65.1Low149 Ų14999 Ų9956%0.56251%0.505SS*.  trans-53.9104.4167.1-95.4-177.1177.9172.76.5107.9T51 A52 N56 E135T51-R54 VanDerWaalsContact O-CB 3.24Å; T51-R54 WeakPolarHBondContact O-CB 3.49Å; T51-R54 VanDerWaalsContact O-CG 3.27Å; T51-R54 WeakPolarHBondContact O-CG 3.28Å; T51-R54 PolarHBondContact O-N 3.39Å; A52-R54 PolarHBondContact O-N 2.79Å; R54-N56 PolarHBondContact O-N 3.28Å; R54-E135 IonicContact CZ-OE1 2.67Å; R54-E135 IonicContact NH1-OE1 2.7Å; R54-E135 PolarHBondContact NH1-OE1 2.9Å
55Y59.8Low67.6Low167 Ų16799 Ų9966%0.65549%0.494SS*.  trans-35.2121.5-179.5-69.3-94.3000111.7A53 R57A53-Y55 PolarHBondContact O-N 3.16Å; Y55-R57 PolarHBondContact O-N 3.43Å; Y55-R57 VanDerWaalsContact O-N 3.1Å
56N85Confident70.1Confident51 Ų5192.2 Ų92.227%0.27347%0.471SS..  trans-46122.2166.5171.4-67.1000108.4R54 L58 K59 L60 N129R54-N56 PolarHBondContact O-N 3.28Å; N56-L58 PolarHBondContact O-N 3.12Å; N56-L58 VanDerWaalsContact O-N 3.14Å; N56-L58 WeakPolarHBondContact OD1-CA 3.18Å; N56-L58 WeakPolarHBondContact OD1-CB 3.35Å; N56-L58 PolarHBondContact OD1-N 3.16Å; N56-K59 HydrophobicContact CB-CB 4.43Å; N56-K59 HydrophobicContact CB-CD 4.17Å; N56-K59 HydrophobicContact CB-CG 4.06Å; N56-K59 WeakPolarHBondContact O-CB 3.33Å; N56-K59 PolarHBondContact O-N 3.09Å; N56-K59 PolarHBondContact OD1-N 3.2Å; N56-L60 PolarHBondContact O-N 3.17Å; N56-L60 VanDerWaalsContact O-N 3.13Å; N56-N129 PolarHBondContact ND2-OD1 3.43Å
57R93.3Very high73Confident80 Ų8092.2 Ų92.230%0.30247%0.471SS..Hα-helixtrans-57.1-32.8-171.3-79.7177172.386.72.8112.5Y55 L60 F61 F128 D132 E135Y55-R57 PolarHBondContact O-N 3.43Å; Y55-R57 VanDerWaalsContact O-N 3.1Å; R57-L60 PolarHBondContact O-N 3.3Å; R57-F61 WeakPolarHBondContact O-CB 3.35Å; R57-F61 PolarHBondContact O-N 3.34Å; R57-F128 HydrophobicContact CB-CB 3.99Å; R57-F128 HydrophobicContact CB-CD1 3.74Å; R57-F128 HydrophobicContact CB-CE1 4.42Å; R57-F128 HydrophobicContact CB-CG 3.92Å; R57-D132 WeakPolarHBondContact CD-OD1 3.35Å; R57-D132 VanDerWaalsContact CG-OD1 3.22Å; R57-D132 WeakPolarHBondContact CG-OD1 3.15Å; R57-D132 IonicContact CZ-OD1 3.6Å; R57-D132 PolarHBondContact N-OD2 3.31Å; R57-D132 IonicContact NE-OD1 2.74Å; R57-D132 IonicContact NH1-OD1 3.21Å; R57-D132 PolarHBondContact NH1-OD1 3.34Å; R57-E135 IonicContact CZ-OE2 3.78Å; R57-E135 IonicContact NH1-OE2 2.65Å; R57-E135 PolarHBondContact NH1-OE2 3.29Å; R57-E135 IonicContact NH2-OE1 3.57Å; R57-E135 IonicContact NH2-OE2 3.83Å; R57-E135 PolarHBondContact NH2-OE2 3.42Å
58L92.3Very high75.6Confident32 Ų3292.5 Ų92.517%0.16847%0.47CS..Hα-helixtrans-65.1-42.7175.4-177.369.5000111.8N56 L60 F61 D62 M119 E125 F128N56-L58 PolarHBondContact O-N 3.12Å; N56-L58 VanDerWaalsContact O-N 3.14Å; N56-L58 WeakPolarHBondContact OD1-CA 3.18Å; N56-L58 WeakPolarHBondContact OD1-CB 3.35Å; N56-L58 PolarHBondContact OD1-N 3.16Å; L58-L60 VanDerWaalsContact C-N 3.32Å; L58-L60 PolarHBondContact O-N 3.46Å; L58-F61 WeakPolarHBondContact O-CB 3.39Å; L58-F61 PolarHBondContact O-N 3.26Å; L58-D62 PolarHBondContact O-N 3.17Å; L58-M119 HydrophobicContact CD1-CE 3.65Å; L58-E125 HydrophobicContact CD2-CB 3.95Å; L58-E125 HydrophobicContact CD2-CG 3.86Å; L58-F128 HydrophobicContact CB-CB 4.42Å; L58-F128 HydrophobicContact CB-CD2 4.17Å; L58-F128 HydrophobicContact CD1-CD2 4.02Å
59K92.1Very high78.1Confident152 Ų15290 Ų9066%0.66145%0.448SS*.Hα-helixtrans-64-38.7175.9-63.8-173.6-178-179.10112N56 K63N56-K59 HydrophobicContact CB-CB 4.43Å; N56-K59 HydrophobicContact CB-CD 4.17Å; N56-K59 HydrophobicContact CB-CG 4.06Å; N56-K59 WeakPolarHBondContact O-CB 3.33Å; N56-K59 PolarHBondContact O-N 3.09Å; N56-K59 PolarHBondContact OD1-N 3.2Å; K59-K63 WeakPolarHBondContact O-CB 3.2Å; K59-K63 PolarHBondContact O-N 3.45Å
60L94.2Very high80.7Confident88 Ų8887 Ų8746%0.46144%0.436SS..Hα-helixtrans-65.4-44.7175.3-18061.9000110.9N56 R57 L58 K63 V64N56-L60 PolarHBondContact O-N 3.17Å; N56-L60 VanDerWaalsContact O-N 3.13Å; R57-L60 PolarHBondContact O-N 3.3Å; L58-L60 VanDerWaalsContact C-N 3.32Å; L58-L60 PolarHBondContact O-N 3.46Å; L60-K63 PolarHBondContact O-N 2.84Å; L60-V64 HydrophobicContact CD1-CG2 4.24Å; L60-V64 VanDerWaalsContact O-CG2 3.3Å; L60-V64 WeakPolarHBondContact O-CG2 3.46Å; L60-V64 PolarHBondContact O-N 3.42Å
61F94.3Very high83.4Confident51 Ų5185.6 Ų85.622%0.22443%0.428CS..Hα-helixtrans-57.2-53.4175.8177.7-92.1000111.4R57 L58 K63 V64 I65 M119 F124 F128R57-F61 WeakPolarHBondContact O-CB 3.35Å; R57-F61 PolarHBondContact O-N 3.34Å; L58-F61 WeakPolarHBondContact O-CB 3.39Å; L58-F61 PolarHBondContact O-N 3.26Å; F61-K63 VanDerWaalsContact C-N 3.34Å; F61-K63 PolarHBondContact O-N 3.2Å; F61-V64 PolarHBondContact O-N 3.16Å; F61-V64 VanDerWaalsContact O-N 3.14Å; F61-I65 HydrophobicContact CD1-CG1 4.09Å; F61-I65 HydrophobicContact CD2-CG1 4.32Å; F61-I65 HydrophobicContact CE1-CG1 3.69Å; F61-I65 HydrophobicContact CE2-CD1 4.16Å; F61-I65 HydrophobicContact CE2-CG1 3.96Å; F61-I65 HydrophobicContact CG-CG1 4.38Å; F61-I65 HydrophobicContact CZ-CD1 3.97Å; F61-I65 HydrophobicContact CZ-CG1 3.63Å; F61-I65 WeakPolarHBondContact O-CB 3.46Å; F61-I65 WeakPolarHBondContact O-CG1 3.48Å; F61-I65 PolarHBondContact O-N 3.09Å; F61-M119 HydrophobicContact CD1-CE 4.22Å; F61-M119 HydrophobicContact CD1-SD 4.28Å; F61-M119 HydrophobicContact CE1-CE 4.15Å; F61-M119 HydrophobicContact CE1-CG 3.89Å; F61-M119 HydrophobicContact CE1-SD 3.67Å; F61-F124 HydrophobicContact CE1-CD2 4.2Å; F61-F124 HydrophobicContact CE2-CD2 4.3Å; F61-F124 HydrophobicContact CE2-CE2 4.04Å; F61-F124 AromaticContact CZ-CD2 3.97Å; F61-F124 HydrophobicContact CZ-CD2 3.97Å; F61-F124 AromaticContact CZ-CE2 3.84Å; F61-F124 HydrophobicContact CZ-CE2 3.84Å; F61-F128 HydrophobicContact CB-CE2 4.01Å; F61-F128 HydrophobicContact CB-CZ 4.41Å; F61-F128 HydrophobicContact CD2-CE2 4.23Å; F61-F128 HydrophobicContact CD2-CZ 4.21Å; F61-F128 HydrophobicContact CG-CE2 4.01Å; F61-F128 HydrophobicContact CG-CZ 4.4Å
62D93.7Very high85.7Confident77 Ų7788.4 Ų88.441%0.41244%0.436SS..Hα-helixtrans-56.1-48178.4179.454.3000111.2L58 V64 I65 Q66L58-D62 PolarHBondContact O-N 3.17Å; D62-V64 VanDerWaalsContact C-N 3.35Å; D62-V64 PolarHBondContact O-N 2.93Å; D62-I65 PolarHBondContact O-N 3.09Å; D62-Q66 VanDerWaalsContact O-CG 3.31Å; D62-Q66 WeakPolarHBondContact O-CG 3.41Å; D62-Q66 PolarHBondContact O-N 3.42Å; D62-Q66 PolarHBondContact OD1-NE2 3.11Å
63K95.2Very high88Confident134 Ų13485.6 Ų85.658%0.58341%0.409SS*.Hα-helixtrans-57.5-44.2176.9-175.8176.9-178.4177.40113K59 L60 F61 K67K59-K63 WeakPolarHBondContact O-CB 3.2Å; K59-K63 PolarHBondContact O-N 3.45Å; L60-K63 PolarHBondContact O-N 2.84Å; F61-K63 VanDerWaalsContact C-N 3.34Å; F61-K63 PolarHBondContact O-N 3.2Å; K63-K67 VanDerWaalsContact O-CB 3.26Å; K63-K67 WeakPolarHBondContact O-CB 3.45Å; K63-K67 PolarHBondContact O-N 3.23Å; K63-K67 VanDerWaalsContact O-N 3.09Å
64V96.4Very high90.4Very high76 Ų7688.7 Ų88.746%0.46141%0.411SS..Hα-helixtrans-67.4-42179.9169.90000110.8L60 F61 D62 S68L60-V64 HydrophobicContact CD1-CG2 4.24Å; L60-V64 VanDerWaalsContact O-CG2 3.3Å; L60-V64 WeakPolarHBondContact O-CG2 3.46Å; L60-V64 PolarHBondContact O-N 3.42Å; F61-V64 PolarHBondContact O-N 3.16Å; F61-V64 VanDerWaalsContact O-N 3.14Å; D62-V64 VanDerWaalsContact C-N 3.35Å; D62-V64 PolarHBondContact O-N 2.93Å; V64-S68 WeakPolarHBondContact O-CB 3.47Å; V64-S68 PolarHBondContact O-N 3.3Å; V64-S68 PolarHBondContact O-OG 3.23Å
65I95.4Very high92.1Very high42 Ų4287.8 Ų87.822%0.21541%0.413CS..Hα-helixtrans-66-49.8179.5-70.5-62.9000111.2F61 D62 K67 S68 L69 I115F61-I65 HydrophobicContact CD1-CG1 4.09Å; F61-I65 HydrophobicContact CD2-CG1 4.32Å; F61-I65 HydrophobicContact CE1-CG1 3.69Å; F61-I65 HydrophobicContact CE2-CD1 4.16Å; F61-I65 HydrophobicContact CE2-CG1 3.96Å; F61-I65 HydrophobicContact CG-CG1 4.38Å; F61-I65 HydrophobicContact CZ-CD1 3.97Å; F61-I65 HydrophobicContact CZ-CG1 3.63Å; F61-I65 WeakPolarHBondContact O-CB 3.46Å; F61-I65 WeakPolarHBondContact O-CG1 3.48Å; F61-I65 PolarHBondContact O-N 3.09Å; D62-I65 PolarHBondContact O-N 3.09Å; I65-K67 VanDerWaalsContact C-N 3.31Å; I65-K67 PolarHBondContact O-N 3.25Å; I65-S68 PolarHBondContact O-N 3.4Å; I65-S68 VanDerWaalsContact O-N 3.14Å; I65-L69 WeakPolarHBondContact O-CB 3.46Å; I65-L69 PolarHBondContact O-N 3.37Å; I65-I115 HydrophobicContact CG2-CD1 3.7Å; I65-I115 HydrophobicContact CG2-CG2 3.97Å
66Q95.3Very high93.4Very high64 Ų6481.2 Ų81.230%0.29939%0.394SS..Hα-helixtrans-59.5-43.2177.6-64.8-55.9-26.900111.4D62 S68 L69 N70D62-Q66 VanDerWaalsContact O-CG 3.31Å; D62-Q66 WeakPolarHBondContact O-CG 3.41Å; D62-Q66 PolarHBondContact O-N 3.42Å; D62-Q66 PolarHBondContact OD1-NE2 3.11Å; Q66-S68 VanDerWaalsContact C-N 3.33Å; Q66-S68 PolarHBondContact O-N 2.91Å; Q66-L69 PolarHBondContact O-N 2.73Å; Q66-N70 WeakPolarHBondContact O-CB 3.43Å; Q66-N70 PolarHBondContact O-N 2.99Å; Q66-N70 PolarHBondContact O-ND2 3.39Å
67K96.8Very high93.6Very high157 Ų15780.9 Ų80.968%0.68340%0.396SS*.Hα-helixtrans-63.3-40.1177.1-172.6174.7-177.8179.40112.2K63 I65 K71K63-K67 VanDerWaalsContact O-CB 3.26Å; K63-K67 WeakPolarHBondContact O-CB 3.45Å; K63-K67 PolarHBondContact O-N 3.23Å; K63-K67 VanDerWaalsContact O-N 3.09Å; I65-K67 VanDerWaalsContact C-N 3.31Å; I65-K67 PolarHBondContact O-N 3.25Å; K67-K71 WeakPolarHBondContact O-CB 3.26Å; K67-K71 PolarHBondContact O-N 3.42Å; K67-K71 VanDerWaalsContact O-N 3.09Å
68S96.1Very high93.4Very high67 Ų6779.4 Ų79.447%0.46939%0.391SS..Hα-helixtrans-67.9-42178.9-58.10000111.4V64 I65 Q66 K71 F72V64-S68 WeakPolarHBondContact O-CB 3.47Å; V64-S68 PolarHBondContact O-N 3.3Å; V64-S68 PolarHBondContact O-OG 3.23Å; I65-S68 PolarHBondContact O-N 3.4Å; I65-S68 VanDerWaalsContact O-N 3.14Å; Q66-S68 VanDerWaalsContact C-N 3.33Å; Q66-S68 PolarHBondContact O-N 2.91Å; S68-K71 PolarHBondContact O-N 2.92Å; S68-F72 WeakPolarHBondContact O-CB 3.37Å; S68-F72 PolarHBondContact O-N 3.35Å
69L95.4Very high93.2Very high8 Ų886.2 Ų86.24%0.04242%0.42CS..Hα-helixtrans-62.9-47.7175.6178.959.3000111.6I65 Q66 K71 F72 I73 Q108 I111 Q112I65-L69 WeakPolarHBondContact O-CB 3.46Å; I65-L69 PolarHBondContact O-N 3.37Å; Q66-L69 PolarHBondContact O-N 2.73Å; L69-K71 VanDerWaalsContact C-N 3.29Å; L69-K71 PolarHBondContact O-N 3.32Å; L69-F72 WeakPolarHBondContact O-CB 3.45Å; L69-F72 PolarHBondContact O-N 3.31Å; L69-F72 VanDerWaalsContact O-N 3.09Å; L69-I73 HydrophobicContact CD1-CG1 4.21Å; L69-I73 WeakPolarHBondContact O-CG1 3.39Å; L69-I73 PolarHBondContact O-N 3.23Å; L69-Q108 HydrophobicContact CD2-CG 3.91Å; L69-Q108 HydrophobicContact CG-CG 4.28Å; L69-I111 HydrophobicContact CD1-CB 4.12Å; L69-I111 HydrophobicContact CD1-CD1 4.03Å; L69-I111 HydrophobicContact CD1-CG2 3.81Å; L69-Q112 HydrophobicContact CD2-CG 3.38Å
70N94.2Very high93Very high75 Ų7582.5 Ų82.540%0.40141%0.41SS..Hα-helixtrans-57.3-45.1177.2-71.2-17.2000111.2Q66 F72 I73 E74Q66-N70 WeakPolarHBondContact O-CB 3.43Å; Q66-N70 PolarHBondContact O-N 2.99Å; Q66-N70 PolarHBondContact O-ND2 3.39Å; N70-F72 VanDerWaalsContact C-N 3.33Å; N70-F72 PolarHBondContact O-N 3.46Å; N70-I73 PolarHBondContact O-N 2.98Å; N70-E74 WeakPolarHBondContact O-CG 3.47Å; N70-E74 PolarHBondContact O-N 2.99Å
71K95.8Very high92.8Very high126 Ų12680.2 Ų80.255%0.54840%0.396SS..Hα-helixtrans-62.9-38.9176.6-169.7174.3-177.5-179.10112.4K67 S68 L69 E74 H75K67-K71 WeakPolarHBondContact O-CB 3.26Å; K67-K71 PolarHBondContact O-N 3.42Å; K67-K71 VanDerWaalsContact O-N 3.09Å; S68-K71 PolarHBondContact O-N 2.92Å; L69-K71 VanDerWaalsContact C-N 3.29Å; L69-K71 PolarHBondContact O-N 3.32Å; K71-E74 PolarHBondContact O-N 3.47Å; K71-H75 PolarHBondContact O-CD2 2.93Å; K71-H75 PolarHBondContact O-N 3.2Å
72F94.1Very high92.5Very high105 Ų10578.5 Ų78.546%0.46139%0.391SS..Hα-helixtrans-62.4-43.9175.1176.4-103.4000111.7S68 L69 N70 H75 A76 L107 I111S68-F72 WeakPolarHBondContact O-CB 3.37Å; S68-F72 PolarHBondContact O-N 3.35Å; L69-F72 WeakPolarHBondContact O-CB 3.45Å; L69-F72 PolarHBondContact O-N 3.31Å; L69-F72 VanDerWaalsContact O-N 3.09Å; N70-F72 VanDerWaalsContact C-N 3.33Å; N70-F72 PolarHBondContact O-N 3.46Å; F72-H75 WeakPolarHBondContact O-CB 3.32Å; F72-H75 PolarHBondContact O-N 3.45Å; F72-A76 PolarHBondContact O-N 2.92Å; F72-L107 HydrophobicContact CE1-CD2 3.97Å; F72-L107 HydrophobicContact CE1-CG 4.48Å; F72-I111 HydrophobicContact CD1-CD1 4.2Å; F72-I111 HydrophobicContact CE1-CD1 3.87Å
73I92.8Very high92.3Very high25 Ų2577.7 Ų77.713%0.12839%0.391CS..Hα-helixtrans-65.4-38.4176.6-65.2-58000111.9L69 N70 H75 A76 T104 L107 Q108L69-I73 HydrophobicContact CD1-CG1 4.21Å; L69-I73 WeakPolarHBondContact O-CG1 3.39Å; L69-I73 PolarHBondContact O-N 3.23Å; N70-I73 PolarHBondContact O-N 2.98Å; I73-H75 VanDerWaalsContact C-N 3.25Å; I73-H75 PolarHBondContact O-N 3.03Å; I73-A76 CarbonylContact O-C 3.45Å; I73-A76 WeakPolarHBondContact O-CA 3.39Å; I73-A76 WeakPolarHBondContact O-CB 3.38Å; I73-A76 PolarHBondContact O-N 3.45Å; I73-T104 HydrophobicContact CD1-CG2 4.16Å; I73-T104 HydrophobicContact CG2-CG2 3.31Å; I73-L107 HydrophobicContact CD1-CD2 4.29Å; I73-L107 HydrophobicContact CD1-CG 4.42Å; I73-Q108 HydrophobicContact CD1-CB 4.05Å; I73-Q108 HydrophobicContact CG1-CB 4.27Å; I73-Q108 HydrophobicContact CG1-CG 4.4Å
74E92Very high91.9Very high136 Ų13675.8 Ų75.864%0.63639%0.391SS*.Hα-helixtrans-57.7-37.1173.8-74.6169.4-169.600112.3N70 K71 A76 S77N70-E74 WeakPolarHBondContact O-CG 3.47Å; N70-E74 PolarHBondContact O-N 2.99Å; K71-E74 PolarHBondContact O-N 3.47Å; E74-A76 VanDerWaalsContact C-N 3.29Å; E74-A76 PolarHBondContact O-N 3.37Å; E74-S77 WeakPolarHBondContact O-CB 3.3Å; E74-S77 PolarHBondContact O-N 3.15Å
75H89.5Confident91.4Very high130 Ų13076.4 Ų76.460%0.60239%0.388SS*.Hα-helixtrans-66.8-31.6174.9-73.8-64.6000112.6K71 F72 I73 S77K71-H75 PolarHBondContact O-CD2 2.93Å; K71-H75 PolarHBondContact O-N 3.2Å; F72-H75 WeakPolarHBondContact O-CB 3.32Å; F72-H75 PolarHBondContact O-N 3.45Å; I73-H75 VanDerWaalsContact C-N 3.25Å; I73-H75 PolarHBondContact O-N 3.03Å; H75-S77 PolarHBondContact O-N 3.47Å; H75-S77 VanDerWaalsContact O-N 3.11Å
76A87.9Confident90.9Very high30 Ų3082.4 Ų82.425%0.24841%0.408CS..THydrogen-bonded Turntrans-79.528172.500000112.8F72 I73 E74 H100F72-A76 PolarHBondContact O-N 2.92Å; I73-A76 CarbonylContact O-C 3.45Å; I73-A76 WeakPolarHBondContact O-CA 3.39Å; I73-A76 WeakPolarHBondContact O-CB 3.38Å; I73-A76 PolarHBondContact O-N 3.45Å; E74-A76 VanDerWaalsContact C-N 3.29Å; E74-A76 PolarHBondContact O-N 3.37Å; A76-H100 PolarHBondContact O-CE1 3.14Å; A76-H100 PolarHBondContact O-NE2 3.09Å
77S89.7Confident90.5Very high44 Ų4484 Ų8431%0.30842%0.423SS..  trans-55.9153.4-178.167.70000114.1E74 H75 K79 V80 F81E74-S77 WeakPolarHBondContact O-CB 3.3Å; E74-S77 PolarHBondContact O-N 3.15Å; H75-S77 PolarHBondContact O-N 3.47Å; H75-S77 VanDerWaalsContact O-N 3.11Å; S77-K79 PolarHBondContact O-N 3.39Å; S77-V80 PolarHBondContact O-N 3.37Å; S77-V80 VanDerWaalsContact O-N 3.09Å; S77-V80 WeakPolarHBondContact OG-CG2 3.33Å; S77-F81 PolarHBondContact O-N 3.01Å; S77-F81 VanDerWaalsContact O-N 3.16Å
78F88.6Confident89.7Confident48 Ų4881.1 Ų81.121%0.21142%0.415CS..Hα-helixtrans-57.1-34.4177.5-175.7-121.9000113.2V80 F81 A82 Y89 E97 H100F78-V80 VanDerWaalsContact C-N 3.33Å; F78-V80 PolarHBondContact O-N 3.3Å; F78-F81 HydrophobicContact CD2-CD1 4.28Å; F78-F81 HydrophobicContact CE2-CD1 4.4Å; F78-F81 PolarHBondContact O-N 3.28Å; F78-A82 VanDerWaalsContact O-CB 3.28Å; F78-A82 WeakPolarHBondContact O-CB 3.41Å; F78-A82 PolarHBondContact O-N 3.29Å; F78-Y89 AromaticContact CE1-CE2 3.83Å; F78-Y89 HydrophobicContact CE1-CE2 3.83Å; F78-Y89 HydrophobicContact CE2-CE2 4.4Å; F78-Y89 HydrophobicContact CZ-CD2 4.27Å; F78-Y89 AromaticContact CZ-CE2 3.46Å; F78-Y89 HydrophobicContact CZ-CE2 3.46Å; F78-Y89 VanDerWaalsContact CZ-CE2 3.46Å; F78-E97 HydrophobicContact CE1-CB 4.41Å; F78-E97 HydrophobicContact CE1-CG 4.27Å; F78-E97 VanDerWaalsContact CE2-CA 3.48Å; F78-E97 HydrophobicContact CE2-CB 4.02Å; F78-E97 HydrophobicContact CE2-CG 4.28Å; F78-E97 HydrophobicContact CZ-CB 3.65Å; F78-E97 HydrophobicContact CZ-CG 3.91Å; F78-H100 HydrophobicContact CD2-CB 3.61Å; F78-H100 AromaticContact CD2-CG 3.58Å; F78-H100 AromaticContact CD2-ND1 3.62Å; F78-H100 HydrophobicContact CE2-CB 3.93Å; F78-H100 PolarHBondContact N-CE1 2.89Å; F78-H100 VanDerWaalsContact N-CE1 3.3Å
79K88.1Confident89Confident175 Ų17581.2 Ų81.276%0.76141%0.406SS*.Hα-helixtrans-59.3-44.9177.9-177.8-178.3177.4-177.20111.6S77 S83S77-K79 PolarHBondContact O-N 3.39Å; K79-S83 WeakPolarHBondContact O-CB 3.37Å; K79-S83 PolarHBondContact O-N 3.17Å; K79-S83 VanDerWaalsContact O-N 3.1Å; K79-S83 PolarHBondContact O-OG 2.89Å
80V88.4Confident88.5Confident75 Ų7589.4 Ų89.446%0.45544%0.441SS..Hα-helixtrans-65.3-48.6177.9176.60000109.1S77 F78 A82 S83 T84S77-V80 PolarHBondContact O-N 3.37Å; S77-V80 VanDerWaalsContact O-N 3.09Å; S77-V80 WeakPolarHBondContact OG-CG2 3.33Å; F78-V80 VanDerWaalsContact C-N 3.33Å; F78-V80 PolarHBondContact O-N 3.3Å; V80-A82 PolarHBondContact O-N 3.23Å; V80-S83 PolarHBondContact O-N 2.7Å; V80-S83 PolarHBondContact O-OG 3.42Å; V80-T84 PolarHBondContact O-N 2.78Å; V80-T84 PolarHBondContact O-OG1 3.44Å; V80-T84 VanDerWaalsContact O-OG1 3.14Å
81F88.4Confident88.1Confident40 Ų4093.7 Ų93.718%0.17546%0.456CS..Hα-helixtrans-58.3-49179.4-174-106.6000113.5S77 F78 S83 T84 F85 M96 I99 H100S77-F81 PolarHBondContact O-N 3.01Å; S77-F81 VanDerWaalsContact O-N 3.16Å; F78-F81 HydrophobicContact CD2-CD1 4.28Å; F78-F81 HydrophobicContact CE2-CD1 4.4Å; F78-F81 PolarHBondContact O-N 3.28Å; F81-S83 VanDerWaalsContact C-N 3.3Å; F81-S83 PolarHBondContact O-N 3.34Å; F81-T84 PolarHBondContact O-N 2.92Å; F81-F85 HydrophobicContact CD2-CD2 4.02Å; F81-F85 AromaticContact CD2-CE2 3.96Å; F81-F85 HydrophobicContact CD2-CE2 3.96Å; F81-F85 AromaticContact CE2-CD2 3.9Å; F81-F85 HydrophobicContact CE2-CD2 3.9Å; F81-F85 AromaticContact CE2-CE2 3.73Å; F81-F85 HydrophobicContact CE2-CE2 3.73Å; F81-F85 HydrophobicContact CG-CD2 4.44Å; F81-F85 HydrophobicContact CZ-CD2 4.26Å; F81-F85 HydrophobicContact CZ-CE2 4.41Å; F81-F85 WeakPolarHBondContact O-CD2 3.3Å; F81-F85 PolarHBondContact O-N 3.21Å; F81-F85 VanDerWaalsContact O-N 3.17Å; F81-M96 HydrophobicContact CD1-CE 4.09Å; F81-M96 HydrophobicContact CE1-CE 3.08Å; F81-M96 HydrophobicContact CE1-CG 4.04Å; F81-M96 HydrophobicContact CE1-SD 4.36Å; F81-M96 HydrophobicContact CE2-CE 4.39Å; F81-M96 HydrophobicContact CZ-CE 3.27Å; F81-I99 HydrophobicContact CZ-CG2 4.48Å; F81-H100 HydrophobicContact CD1-CB 3.67Å; F81-H100 AromaticContact CD1-CD2 3.64Å; F81-H100 AromaticContact CD1-CG 3.88Å; F81-H100 AromaticContact CD2-CD2 3.94Å; F81-H100 HydrophobicContact CE1-CB 3.68Å; F81-H100 HydrophobicContact CG-CB 4.39Å; F81-H100 AromaticContact CG-CD2 3.46Å; F81-H100 VanDerWaalsContact CG-CD2 3.46Å; F81-H100 WeakPolarHBondContact CG-CD2 3.23Å; F81-H100 HydrophobicContact CZ-CB 4.46Å
82A88.2Confident87.7Confident14 Ų1492.4 Ų92.412%0.11646%0.455CS..Hα-helixtrans-65.5-32.2178.300000112.6F78 V80 T84 R86 Y89F78-A82 VanDerWaalsContact O-CB 3.28Å; F78-A82 WeakPolarHBondContact O-CB 3.41Å; F78-A82 PolarHBondContact O-N 3.29Å; V80-A82 PolarHBondContact O-N 3.23Å; A82-T84 VanDerWaalsContact C-N 3.35Å; A82-R86 PolarHBondContact O-N 2.88Å; A82-Y89 HydrophobicContact CB-CD2 4.01Å; A82-Y89 HydrophobicContact CB-CE2 4.15Å; A82-Y89 HydrophobicContact CB-CG 4.31Å
83S88.9Confident87.3Confident60 Ų6090.1 Ų90.142%0.4245%0.45SS..Hα-helixtrans-68.3-33.4177.177.40000112.9K79 V80 F81 R86K79-S83 WeakPolarHBondContact O-CB 3.37Å; K79-S83 PolarHBondContact O-N 3.17Å; K79-S83 VanDerWaalsContact O-N 3.1Å; K79-S83 PolarHBondContact O-OG 2.89Å; V80-S83 PolarHBondContact O-N 2.7Å; V80-S83 PolarHBondContact O-OG 3.42Å; F81-S83 VanDerWaalsContact C-N 3.3Å; F81-S83 PolarHBondContact O-N 3.34Å; S83-R86 WeakPolarHBondContact O-CG 3.33Å
84T88.2Confident87.1Confident95 Ų9596.7 Ų96.758%0.58348%0.478SS*.Hα-helixtrans-77.4-36.7178.3-51.70000111.9V80 F81 A82V80-T84 PolarHBondContact O-N 2.78Å; V80-T84 PolarHBondContact O-OG1 3.44Å; V80-T84 VanDerWaalsContact O-OG1 3.14Å; F81-T84 PolarHBondContact O-N 2.92Å; A82-T84 VanDerWaalsContact C-N 3.35Å
85F86.3Confident87Confident88 Ų8898 Ų9839%0.38648%0.477SS..THydrogen-bonded Turntrans-105.736.5-178-61.3-73.8000113.9F81 P87 L88 Y89 M96F81-F85 HydrophobicContact CD2-CD2 4.02Å; F81-F85 AromaticContact CD2-CE2 3.96Å; F81-F85 HydrophobicContact CD2-CE2 3.96Å; F81-F85 AromaticContact CE2-CD2 3.9Å; F81-F85 HydrophobicContact CE2-CD2 3.9Å; F81-F85 AromaticContact CE2-CE2 3.73Å; F81-F85 HydrophobicContact CE2-CE2 3.73Å; F81-F85 HydrophobicContact CG-CD2 4.44Å; F81-F85 HydrophobicContact CZ-CD2 4.26Å; F81-F85 HydrophobicContact CZ-CE2 4.41Å; F81-F85 WeakPolarHBondContact O-CD2 3.3Å; F81-F85 PolarHBondContact O-N 3.21Å; F81-F85 VanDerWaalsContact O-N 3.17Å; F85-P87 VanDerWaalsContact C-CD 3.46Å; F85-L88 HydrophobicContact CD1-CD1 4.45Å; F85-L88 PolarHBondContact O-N 3.47Å; F85-L88 VanDerWaalsContact O-N 3.09Å; F85-Y89 PolarHBondContact O-N 3.37Å; F85-Y89 VanDerWaalsContact O-N 3.16Å; F85-M96 HydrophobicContact CB-CE 4.22Å; F85-M96 HydrophobicContact CD2-CE 4.41Å; F85-M96 HydrophobicContact CG-CE 4.41Å
86R85.1Confident87Confident168 Ų16892.9 Ų92.963%0.63445%0.453SS*.Hα-helixtrans-46.2-46.4-175.9-87.5174.1-177.7165.43115.8A82 S83 L88 Y89 K90A82-R86 PolarHBondContact O-N 2.88Å; S83-R86 WeakPolarHBondContact O-CG 3.33Å; R86-L88 VanDerWaalsContact C-N 3.28Å; R86-L88 PolarHBondContact O-N 3.41Å; R86-Y89 PolarHBondContact O-N 3.02Å; R86-K90 PolarHBondContact O-N 2.94Å
87P85.3Confident87.1Confident97 Ų9796.5 Ų96.563%0.6347%0.465SS*.Hα-helixtrans-64.2-31.7-177-23.334.9000113.7F85F85-P87 VanDerWaalsContact C-CD 3.46Å
88L79.9Confident87.2Confident97 Ų97100.6 Ų100.651%0.50848%0.479SS..Hα-helixtrans-79.8-38.3179.4-63.2174.7000111.1F85 R86 K90 K91 N92 M96F85-L88 HydrophobicContact CD1-CD1 4.45Å; F85-L88 PolarHBondContact O-N 3.47Å; F85-L88 VanDerWaalsContact O-N 3.09Å; R86-L88 VanDerWaalsContact C-N 3.28Å; R86-L88 PolarHBondContact O-N 3.41Å; L88-K90 PolarHBondContact O-N 2.87Å; L88-K91 PolarHBondContact O-N 3.22Å; L88-K91 VanDerWaalsContact O-N 3.16Å; L88-N92 PolarHBondContact O-N 3.47Å; L88-M96 HydrophobicContact CB-SD 4.43Å
89Y82.7Confident87.3Confident69 Ų69102.4 Ų102.427%0.27149%0.49SS..Hα-helixtrans-60.2-43.3178.2-171.8-102.6000112.8F78 A82 F85 R86 K91 N92 V93 M96F78-Y89 AromaticContact CE1-CE2 3.83Å; F78-Y89 HydrophobicContact CE1-CE2 3.83Å; F78-Y89 HydrophobicContact CE2-CE2 4.4Å; F78-Y89 HydrophobicContact CZ-CD2 4.27Å; F78-Y89 AromaticContact CZ-CE2 3.46Å; F78-Y89 HydrophobicContact CZ-CE2 3.46Å; F78-Y89 VanDerWaalsContact CZ-CE2 3.46Å; A82-Y89 HydrophobicContact CB-CD2 4.01Å; A82-Y89 HydrophobicContact CB-CE2 4.15Å; A82-Y89 HydrophobicContact CB-CG 4.31Å; F85-Y89 PolarHBondContact O-N 3.37Å; F85-Y89 VanDerWaalsContact O-N 3.16Å; R86-Y89 PolarHBondContact O-N 3.02Å; Y89-K91 PolarHBondContact O-N 3.37Å; Y89-K91 VanDerWaalsContact O-N 3.12Å; Y89-N92 CarbonylContact O-C 3.59Å; Y89-N92 PolarHBondContact O-N 2.91Å; Y89-V93 HydrophobicContact CD1-CG2 3.97Å; Y89-V93 HydrophobicContact CD2-CG2 4.36Å; Y89-V93 HydrophobicContact CE1-CB 4.48Å; Y89-V93 HydrophobicContact CE1-CG1 4.28Å; Y89-V93 HydrophobicContact CE1-CG2 3.61Å; Y89-V93 HydrophobicContact CE2-CB 4.06Å; Y89-V93 HydrophobicContact CE2-CG1 3.63Å; Y89-V93 HydrophobicContact CE2-CG2 3.99Å; Y89-V93 HydrophobicContact CG-CG2 4.35Å; Y89-V93 VanDerWaalsContact CZ-CG1 3.45Å; Y89-V93 VanDerWaalsContact O-CG2 3.29Å; Y89-V93 WeakPolarHBondContact O-CG2 3.47Å; Y89-V93 PolarHBondContact O-N 3.14Å; Y89-V93 WeakPolarHBondContact OH-CG1 3.49Å; Y89-M96 HydrophobicContact CD2-CB 4Å; Y89-M96 HydrophobicContact CD2-CG 4.14Å
90K84.1Confident87.5Confident180 Ų18095 Ų9578%0.78346%0.458SS*.THydrogen-bonded Turntrans-59.8-23.6178.1-72.2-176.7179.3-174.60113.8R86 L88R86-K90 PolarHBondContact O-N 2.94Å; L88-K90 PolarHBondContact O-N 2.87Å
91K86.3Confident87.8Confident166 Ų16697.5 Ų97.572%0.72246%0.463SS*.THydrogen-bonded Turntrans-85.7-39.9-178.9-68.8-176.5177.7-176.90112.7L88 Y89L88-K91 PolarHBondContact O-N 3.22Å; L88-K91 VanDerWaalsContact O-N 3.16Å; Y89-K91 PolarHBondContact O-N 3.37Å; Y89-K91 VanDerWaalsContact O-N 3.12Å
92N86.2Confident88.1Confident98 Ų98100.9 Ų100.952%0.52448%0.479SS..  trans-154.384.4-177.2-87.9-61000111.5L88 Y89 K94 R95 M96L88-N92 PolarHBondContact O-N 3.47Å; Y89-N92 CarbonylContact O-C 3.59Å; Y89-N92 PolarHBondContact O-N 2.91Å; N92-K94 PolarHBondContact O-N 3.32Å; N92-R95 HydrophobicContact CB-CB 4.16Å; N92-M96 PolarHBondContact O-N 3.4Å
93V87.5Confident88.3Confident57 Ų57105.1 Ų105.135%0.34550%0.495SS..Hα-helixtrans-57.1-49.6179.9170.30000112.3Y89 R95 M96 E97Y89-V93 HydrophobicContact CD1-CG2 3.97Å; Y89-V93 HydrophobicContact CD2-CG2 4.36Å; Y89-V93 HydrophobicContact CE1-CB 4.48Å; Y89-V93 HydrophobicContact CE1-CG1 4.28Å; Y89-V93 HydrophobicContact CE1-CG2 3.61Å; Y89-V93 HydrophobicContact CE2-CB 4.06Å; Y89-V93 HydrophobicContact CE2-CG1 3.63Å; Y89-V93 HydrophobicContact CE2-CG2 3.99Å; Y89-V93 HydrophobicContact CG-CG2 4.35Å; Y89-V93 VanDerWaalsContact CZ-CG1 3.45Å; Y89-V93 VanDerWaalsContact O-CG2 3.29Å; Y89-V93 WeakPolarHBondContact O-CG2 3.47Å; Y89-V93 PolarHBondContact O-N 3.14Å; Y89-V93 WeakPolarHBondContact OH-CG1 3.49Å; V93-R95 PolarHBondContact O-N 2.94Å; V93-M96 PolarHBondContact O-N 2.88Å; V93-M96 VanDerWaalsContact O-N 3.15Å; V93-E97 PolarHBondContact O-N 2.96Å
94K88.3Confident88.6Confident164 Ų164103.2 Ų103.271%0.71348%0.481SS*.Hα-helixtrans-59.4-48.4-175.9-66.3-175.1177.5-177.20112.5N92 M96 E97 E98N92-K94 PolarHBondContact O-N 3.32Å; K94-M96 VanDerWaalsContact C-N 3.29Å; K94-M96 PolarHBondContact O-N 3.36Å; K94-E97 WeakPolarHBondContact O-CB 3.46Å; K94-E97 PolarHBondContact O-N 2.71Å; K94-E98 WeakPolarHBondContact O-CG 3.37Å; K94-E98 PolarHBondContact O-N 2.96Å
95R88.4Confident88.9Confident163 Ų163103.4 Ų103.462%0.61548%0.475SS*.Hα-helixtrans-61.7-38.5177.4-173.9-177.3-69-162.5-1.8111.6N92 V93 E97 E98 I99N92-R95 HydrophobicContact CB-CB 4.16Å; V93-R95 PolarHBondContact O-N 2.94Å; R95-E97 VanDerWaalsContact C-N 3.34Å; R95-E98 PolarHBondContact O-N 3.38Å; R95-I99 HydrophobicContact CG-CD1 4.03Å; R95-I99 WeakPolarHBondContact O-CD1 3.27Å; R95-I99 VanDerWaalsContact O-CG1 3.23Å; R95-I99 WeakPolarHBondContact O-CG1 2.89Å; R95-I99 PolarHBondContact O-N 3.05Å
96M89.6Confident89.4Confident22 Ų22103.9 Ų103.911%0.10848%0.48CS..Hα-helixtrans-68.8-35.7179.4-158.276.3-153.800112.1F81 F85 L88 Y89 N92 V93 K94 I99 H100F81-M96 HydrophobicContact CD1-CE 4.09Å; F81-M96 HydrophobicContact CE1-CE 3.08Å; F81-M96 HydrophobicContact CE1-CG 4.04Å; F81-M96 HydrophobicContact CE1-SD 4.36Å; F81-M96 HydrophobicContact CE2-CE 4.39Å; F81-M96 HydrophobicContact CZ-CE 3.27Å; F85-M96 HydrophobicContact CB-CE 4.22Å; F85-M96 HydrophobicContact CD2-CE 4.41Å; F85-M96 HydrophobicContact CG-CE 4.41Å; L88-M96 HydrophobicContact CB-SD 4.43Å; Y89-M96 HydrophobicContact CD2-CB 4Å; Y89-M96 HydrophobicContact CD2-CG 4.14Å; N92-M96 PolarHBondContact O-N 3.4Å; V93-M96 PolarHBondContact O-N 2.88Å; V93-M96 VanDerWaalsContact O-N 3.15Å; K94-M96 VanDerWaalsContact C-N 3.29Å; K94-M96 PolarHBondContact O-N 3.36Å; M96-I99 PolarHBondContact O-N 3.09Å; M96-H100 PolarHBondContact O-N 3.37Å
97E89.9Confident89.9Confident107 Ų10798.2 Ų98.250%0.546%0.462SS..Hα-helixtrans-65.1-44.7174.2-166.6172.7-178.500111.7F78 V93 K94 R95 I99 H100 K101F78-E97 HydrophobicContact CE1-CB 4.41Å; F78-E97 HydrophobicContact CE1-CG 4.27Å; F78-E97 VanDerWaalsContact CE2-CA 3.48Å; F78-E97 HydrophobicContact CE2-CB 4.02Å; F78-E97 HydrophobicContact CE2-CG 4.28Å; F78-E97 HydrophobicContact CZ-CB 3.65Å; F78-E97 HydrophobicContact CZ-CG 3.91Å; V93-E97 PolarHBondContact O-N 2.96Å; K94-E97 WeakPolarHBondContact O-CB 3.46Å; K94-E97 PolarHBondContact O-N 2.71Å; R95-E97 VanDerWaalsContact C-N 3.34Å; E97-I99 PolarHBondContact O-N 3.1Å; E97-H100 PolarHBondContact O-N 3.4Å; E97-K101 WeakPolarHBondContact O-CB 3.33Å; E97-K101 PolarHBondContact O-N 3.46Å
98E92.3Very high90.4Very high130 Ų13096.2 Ų96.261%0.60744%0.444SS*.Hα-helixtrans-59.2-44.5173.5-70.3165.4-175.300112K94 R95 K101 H102K94-E98 WeakPolarHBondContact O-CG 3.37Å; K94-E98 PolarHBondContact O-N 2.96Å; R95-E98 PolarHBondContact O-N 3.38Å; E98-K101 PolarHBondContact O-N 3.17Å; E98-H102 WeakPolarHBondContact O-CB 3.31Å; E98-H102 PolarHBondContact O-N 3.13Å
99I91.8Very high91.2Very high86 Ų8697 Ų9744%0.44144%0.444SS..Hα-helixtrans-62.5-45.3177.4-70.1164.9000111.1F81 R95 M96 E97 H102 F103F81-I99 HydrophobicContact CZ-CG2 4.48Å; R95-I99 HydrophobicContact CG-CD1 4.03Å; R95-I99 WeakPolarHBondContact O-CD1 3.27Å; R95-I99 VanDerWaalsContact O-CG1 3.23Å; R95-I99 WeakPolarHBondContact O-CG1 2.89Å; R95-I99 PolarHBondContact O-N 3.05Å; M96-I99 PolarHBondContact O-N 3.09Å; E97-I99 PolarHBondContact O-N 3.1Å; I99-H102 PolarHBondContact O-N 3.27Å; I99-F103 WeakPolarHBondContact O-CB 3.46Å; I99-F103 PolarHBondContact O-N 3.17Å
100H92.8Very high91.9Very high19 Ų1996.4 Ų96.49%0.08845%0.449CS..Hα-helixtrans-65-43.5179.9177-100.6000112.1A76 F78 F81 M96 E97 F103 T104A76-H100 PolarHBondContact O-CE1 3.14Å; A76-H100 PolarHBondContact O-NE2 3.09Å; F78-H100 HydrophobicContact CD2-CB 3.61Å; F78-H100 AromaticContact CD2-CG 3.58Å; F78-H100 AromaticContact CD2-ND1 3.62Å; F78-H100 HydrophobicContact CE2-CB 3.93Å; F78-H100 PolarHBondContact N-CE1 2.89Å; F78-H100 VanDerWaalsContact N-CE1 3.3Å; F81-H100 HydrophobicContact CD1-CB 3.67Å; F81-H100 AromaticContact CD1-CD2 3.64Å; F81-H100 AromaticContact CD1-CG 3.88Å; F81-H100 AromaticContact CD2-CD2 3.94Å; F81-H100 HydrophobicContact CE1-CB 3.68Å; F81-H100 HydrophobicContact CG-CB 4.39Å; F81-H100 AromaticContact CG-CD2 3.46Å; F81-H100 VanDerWaalsContact CG-CD2 3.46Å; F81-H100 WeakPolarHBondContact CG-CD2 3.23Å; F81-H100 HydrophobicContact CZ-CB 4.46Å; M96-H100 PolarHBondContact O-N 3.37Å; E97-H100 PolarHBondContact O-N 3.4Å; H100-F103 PolarHBondContact O-N 3.25Å; H100-T104 PolarHBondContact CE1-OG1 3.33Å; H100-T104 PolarHBondContact NE2-OG1 2.82Å; H100-T104 WeakPolarHBondContact O-CB 3.19Å; H100-T104 PolarHBondContact O-N 3.02Å; H100-T104 PolarHBondContact O-OG1 3.46Å
101K93.5Very high92.4Very high127 Ų12790 Ų9055%0.55242%0.423SS*.Hα-helixtrans-58.1-50.4175-179.5178.4173.2-178.20110.5E97 E98 F103 T104 E105E97-K101 WeakPolarHBondContact O-CB 3.33Å; E97-K101 PolarHBondContact O-N 3.46Å; E98-K101 PolarHBondContact O-N 3.17Å; K101-F103 PolarHBondContact O-N 3.43Å; K101-T104 PolarHBondContact O-N 3.41Å; K101-E105 WeakPolarHBondContact CE-OE1 3.26Å; K101-E105 WeakPolarHBondContact CG-OE1 3.24Å; K101-E105 IonicContact NZ-OE1 2.65Å; K101-E105 WeakPolarHBondContact O-CG 3.28Å; K101-E105 PolarHBondContact O-N 2.89Å
102H94.8Very high92.9Very high112 Ų11284.9 Ų84.952%0.51940%0.402SS..Hα-helixtrans-61.6-43.5179.1-173.758.9000112.5E98 I99 T104 E105 M106E98-H102 WeakPolarHBondContact O-CB 3.31Å; E98-H102 PolarHBondContact O-N 3.13Å; I99-H102 PolarHBondContact O-N 3.27Å; H102-T104 VanDerWaalsContact C-N 3.33Å; H102-T104 PolarHBondContact O-N 3.39Å; H102-E105 PolarHBondContact O-N 3.25Å; H102-M106 WeakPolarHBondContact O-CB 3.33Å; H102-M106 VanDerWaalsContact O-CG 3.26Å; H102-M106 WeakPolarHBondContact O-CG 3.47Å; H102-M106 PolarHBondContact O-N 2.91Å
103F93.4Very high93.5Very high102 Ų10285 Ų8545%0.44740%0.399SS..Hα-helixtrans-58.7-44.9175.3170.2-98.3000112I99 H100 K101 M106 L107I99-F103 WeakPolarHBondContact O-CB 3.46Å; I99-F103 PolarHBondContact O-N 3.17Å; H100-F103 PolarHBondContact O-N 3.25Å; K101-F103 PolarHBondContact O-N 3.43Å; F103-M106 PolarHBondContact O-N 3.45Å; F103-L107 HydrophobicContact CE1-CD2 4.04Å; F103-L107 HydrophobicContact CZ-CD2 4.08Å; F103-L107 VanDerWaalsContact O-CB 3.26Å; F103-L107 WeakPolarHBondContact O-CB 3.37Å; F103-L107 PolarHBondContact O-N 3.44Å
104T94Very high93.9Very high20 Ų2087.2 Ų87.212%0.12341%0.409CS..Hα-helixtrans-67-43.7-178.1-55.20000111.5I73 H100 K101 H102 L107 Q108I73-T104 HydrophobicContact CD1-CG2 4.16Å; I73-T104 HydrophobicContact CG2-CG2 3.31Å; H100-T104 PolarHBondContact CE1-OG1 3.33Å; H100-T104 PolarHBondContact NE2-OG1 2.82Å; H100-T104 WeakPolarHBondContact O-CB 3.19Å; H100-T104 PolarHBondContact O-N 3.02Å; H100-T104 PolarHBondContact O-OG1 3.46Å; K101-T104 PolarHBondContact O-N 3.41Å; H102-T104 VanDerWaalsContact C-N 3.33Å; H102-T104 PolarHBondContact O-N 3.39Å; T104-L107 PolarHBondContact O-N 3.44Å; T104-Q108 VanDerWaalsContact O-CB 3.3Å; T104-Q108 WeakPolarHBondContact O-CB 3.28Å; T104-Q108 PolarHBondContact O-N 3.5Å
105E95.1Very high94.3Very high99 Ų9981.2 Ų81.246%0.46338%0.384SS..Hα-helixtrans-62-45.9175.6-72.3171.217800111.4K101 H102 Q108 K109K101-E105 WeakPolarHBondContact CE-OE1 3.26Å; K101-E105 WeakPolarHBondContact CG-OE1 3.24Å; K101-E105 IonicContact NZ-OE1 2.65Å; K101-E105 WeakPolarHBondContact O-CG 3.28Å; K101-E105 PolarHBondContact O-N 2.89Å; H102-E105 PolarHBondContact O-N 3.25Å; E105-Q108 PolarHBondContact O-N 3.46Å; E105-K109 VanDerWaalsContact O-CB 3.23Å; E105-K109 WeakPolarHBondContact O-CB 3.26Å; E105-K109 PolarHBondContact O-N 2.95Å
106M96.3Very high94.7Very high99 Ų9978.6 Ų78.649%0.48838%0.38SS..Hα-helixtrans-62.3-44.3177.2-76.6-60.9-51.900112H102 F103 S110H102-M106 WeakPolarHBondContact O-CB 3.33Å; H102-M106 VanDerWaalsContact O-CG 3.26Å; H102-M106 WeakPolarHBondContact O-CG 3.47Å; H102-M106 PolarHBondContact O-N 2.91Å; F103-M106 PolarHBondContact O-N 3.45Å; M106-S110 VanDerWaalsContact O-CB 3.28Å; M106-S110 WeakPolarHBondContact O-CB 3.35Å; M106-S110 PolarHBondContact O-N 2.94Å
107L95.1Very high95Very high49 Ų4983.1 Ų83.126%0.25740%0.4SS..Hα-helixtrans-63.7-47.9178.1179.761.5000111.4F72 I73 F103 T104 K109 S110 I111F72-L107 HydrophobicContact CE1-CD2 3.97Å; F72-L107 HydrophobicContact CE1-CG 4.48Å; I73-L107 HydrophobicContact CD1-CD2 4.29Å; I73-L107 HydrophobicContact CD1-CG 4.42Å; F103-L107 HydrophobicContact CE1-CD2 4.04Å; F103-L107 HydrophobicContact CZ-CD2 4.08Å; F103-L107 VanDerWaalsContact O-CB 3.26Å; F103-L107 WeakPolarHBondContact O-CB 3.37Å; F103-L107 PolarHBondContact O-N 3.44Å; T104-L107 PolarHBondContact O-N 3.44Å; L107-K109 PolarHBondContact O-N 3.46Å; L107-S110 PolarHBondContact O-N 2.98Å; L107-I111 HydrophobicContact CD1-CD1 3.8Å; L107-I111 HydrophobicContact CD1-CG1 4.3Å; L107-I111 HydrophobicContact CG-CD1 3.94Å; L107-I111 VanDerWaalsContact O-CG1 3.28Å; L107-I111 WeakPolarHBondContact O-CG1 3.23Å; L107-I111 PolarHBondContact O-N 2.92Å
108Q95.9Very high95.4Very high54 Ų5483 Ų8325%0.25240%0.401SS..Hα-helixtrans-60.2-47.8178.5-175.6178.5-9.100111L69 I73 T104 E105 I111 Q112L69-Q108 HydrophobicContact CD2-CG 3.91Å; L69-Q108 HydrophobicContact CG-CG 4.28Å; I73-Q108 HydrophobicContact CD1-CB 4.05Å; I73-Q108 HydrophobicContact CG1-CB 4.27Å; I73-Q108 HydrophobicContact CG1-CG 4.4Å; T104-Q108 VanDerWaalsContact O-CB 3.3Å; T104-Q108 WeakPolarHBondContact O-CB 3.28Å; T104-Q108 PolarHBondContact O-N 3.5Å; E105-Q108 PolarHBondContact O-N 3.46Å; Q108-I111 PolarHBondContact O-N 3.03Å; Q108-Q112 WeakPolarHBondContact O-CG 3.33Å; Q108-Q112 PolarHBondContact O-N 3.47Å
109K96.4Very high95.5Very high115 Ų11578.8 Ų78.850%0.538%0.382SS..Hα-helixtrans-61.6-47.6179-179.3175.3172178.50111.7E105 L107 I111 Q112 E113E105-K109 VanDerWaalsContact O-CB 3.23Å; E105-K109 WeakPolarHBondContact O-CB 3.26Å; E105-K109 PolarHBondContact O-N 2.95Å; L107-K109 PolarHBondContact O-N 3.46Å; K109-I111 VanDerWaalsContact C-N 3.33Å; K109-I111 PolarHBondContact O-N 3.01Å; K109-Q112 PolarHBondContact O-N 3.16Å; K109-E113 WeakPolarHBondContact CE-OE1 3.49Å; K109-E113 HydrophobicContact CG-CG 4.41Å; K109-E113 IonicContact NZ-OE1 2.82Å; K109-E113 WeakPolarHBondContact O-CG 3.39Å; K109-E113 PolarHBondContact O-N 3.13Å
110S97.4Very high95.7Very high55 Ų5581.2 Ų81.239%0.38539%0.392SS..Hα-helixtrans-58.4-45.2178.2-174.30000111.6M106 L107 E113 D114M106-S110 VanDerWaalsContact O-CB 3.28Å; M106-S110 WeakPolarHBondContact O-CB 3.35Å; M106-S110 PolarHBondContact O-N 2.94Å; L107-S110 PolarHBondContact O-N 2.98Å; S110-E113 PolarHBondContact O-N 3.19Å; S110-D114 WeakPolarHBondContact O-CB 3.19Å; S110-D114 PolarHBondContact O-N 3.46Å
111I96.5Very high95.9Very high45 Ų4586.4 Ų86.423%0.23142%0.416CS..Hα-helixtrans-65.5-40.7178.1-66.4166.7000111L69 F72 L107 Q108 K109 D114 I115L69-I111 HydrophobicContact CD1-CB 4.12Å; L69-I111 HydrophobicContact CD1-CD1 4.03Å; L69-I111 HydrophobicContact CD1-CG2 3.81Å; F72-I111 HydrophobicContact CD1-CD1 4.2Å; F72-I111 HydrophobicContact CE1-CD1 3.87Å; L107-I111 HydrophobicContact CD1-CD1 3.8Å; L107-I111 HydrophobicContact CD1-CG1 4.3Å; L107-I111 HydrophobicContact CG-CD1 3.94Å; L107-I111 VanDerWaalsContact O-CG1 3.28Å; L107-I111 WeakPolarHBondContact O-CG1 3.23Å; L107-I111 PolarHBondContact O-N 2.92Å; Q108-I111 PolarHBondContact O-N 3.03Å; K109-I111 VanDerWaalsContact C-N 3.33Å; K109-I111 PolarHBondContact O-N 3.01Å; I111-D114 PolarHBondContact O-N 3.4Å; I111-I115 HydrophobicContact CG2-CD1 3.62Å; I111-I115 HydrophobicContact CG2-CG1 4.31Å; I111-I115 WeakPolarHBondContact O-CB 3.32Å; I111-I115 WeakPolarHBondContact O-CD1 3.44Å; I111-I115 WeakPolarHBondContact O-CG1 3.22Å; I111-I115 PolarHBondContact O-N 2.65Å
112Q96.6Very high96Very high59 Ų5981 Ų8128%0.27640%0.397SS..Hα-helixtrans-63.2-44.2177.2-75.5176.5-30.900112L69 Q108 K109 I115 M116L69-Q112 HydrophobicContact CD2-CG 3.38Å; Q108-Q112 WeakPolarHBondContact O-CG 3.33Å; Q108-Q112 PolarHBondContact O-N 3.47Å; K109-Q112 PolarHBondContact O-N 3.16Å; Q112-I115 PolarHBondContact O-N 3.14Å; Q112-M116 WeakPolarHBondContact O-CB 3.45Å; Q112-M116 WeakPolarHBondContact O-CG 3.49Å; Q112-M116 PolarHBondContact O-N 2.93Å
113E97.2Very high96.1Very high102 Ų10282.9 Ų82.948%0.47740%0.404SS..Hα-helixtrans-61.2-45.2176.5-72.9173.7174.800111.3K109 S110 I115 M116 K117K109-E113 WeakPolarHBondContact CE-OE1 3.49Å; K109-E113 HydrophobicContact CG-CG 4.41Å; K109-E113 IonicContact NZ-OE1 2.82Å; K109-E113 WeakPolarHBondContact O-CG 3.39Å; K109-E113 PolarHBondContact O-N 3.13Å; S110-E113 PolarHBondContact O-N 3.19Å; E113-I115 PolarHBondContact O-N 3.01Å; E113-M116 PolarHBondContact O-N 2.89Å; E113-K117 WeakPolarHBondContact O-CB 3.45Å; E113-K117 PolarHBondContact O-N 3.04Å
114D97.6Very high96.1Very high102 Ų10280.7 Ų80.755%0.54539%0.394SS..Hα-helixtrans-63.4-40.7177.3-74.8-21.2000112.2S110 I111 K117 L118S110-D114 WeakPolarHBondContact O-CB 3.19Å; S110-D114 PolarHBondContact O-N 3.46Å; I111-D114 PolarHBondContact O-N 3.4Å; D114-K117 PolarHBondContact O-N 2.67Å; D114-L118 WeakPolarHBondContact O-CB 3.38Å; D114-L118 PolarHBondContact O-N 2.7Å
115I96.1Very high96Very high39 Ų3985.6 Ų85.620%0.242%0.416CS..Hα-helixtrans-64.4-46.5175.9-72.8168000110.7I65 I111 Q112 E113 K117 L118 M119I65-I115 HydrophobicContact CG2-CD1 3.7Å; I65-I115 HydrophobicContact CG2-CG2 3.97Å; I111-I115 HydrophobicContact CG2-CD1 3.62Å; I111-I115 HydrophobicContact CG2-CG1 4.31Å; I111-I115 WeakPolarHBondContact O-CB 3.32Å; I111-I115 WeakPolarHBondContact O-CD1 3.44Å; I111-I115 WeakPolarHBondContact O-CG1 3.22Å; I111-I115 PolarHBondContact O-N 2.65Å; Q112-I115 PolarHBondContact O-N 3.14Å; E113-I115 PolarHBondContact O-N 3.01Å; I115-K117 VanDerWaalsContact C-N 3.32Å; I115-K117 PolarHBondContact O-N 2.89Å; I115-L118 PolarHBondContact O-N 3.1Å; I115-M119 HydrophobicContact CG2-CG 4.44Å; I115-M119 HydrophobicContact CG2-SD 4.09Å; I115-M119 VanDerWaalsContact O-CG 3.29Å; I115-M119 WeakPolarHBondContact O-CG 3.42Å; I115-M119 PolarHBondContact O-N 3.42Å
116M95.6Very high96Very high108 Ų10884.5 Ų84.553%0.53242%0.419SS..Hα-helixtrans-59.2-45.9177.6-76.4178.553.500110.9Q112 E113 L118 M119 E120Q112-M116 WeakPolarHBondContact O-CB 3.45Å; Q112-M116 WeakPolarHBondContact O-CG 3.49Å; Q112-M116 PolarHBondContact O-N 2.93Å; E113-M116 PolarHBondContact O-N 2.89Å; M116-L118 PolarHBondContact O-N 3.45Å; M116-M119 WeakPolarHBondContact O-CB 3.5Å; M116-M119 PolarHBondContact O-N 3.11Å; M116-M119 VanDerWaalsContact O-N 3.15Å; M116-E120 WeakPolarHBondContact O-CG 3.29Å; M116-E120 PolarHBondContact O-N 3.43Å
117K97.7Very high96Very high117 Ų11785.2 Ų85.251%0.50942%0.419SS..Hα-helixtrans-59.2-45.3175.7-175.3178.7174.6-176.20111.8E113 D114 I115 M119 E120 E121E113-K117 WeakPolarHBondContact O-CB 3.45Å; E113-K117 PolarHBondContact O-N 3.04Å; D114-K117 PolarHBondContact O-N 2.67Å; I115-K117 VanDerWaalsContact C-N 3.32Å; I115-K117 PolarHBondContact O-N 2.89Å; K117-M119 VanDerWaalsContact C-N 3.31Å; K117-M119 PolarHBondContact O-N 3.28Å; K117-E120 PolarHBondContact O-N 3.19Å; K117-E121 WeakPolarHBondContact CE-OE1 3.27Å; K117-E121 HydrophobicContact CG-CG 4.42Å; K117-E121 WeakPolarHBondContact O-CB 3.46Å; K117-E121 VanDerWaalsContact O-CG 3.32Å; K117-E121 WeakPolarHBondContact O-CG 3.29Å; K117-E121 PolarHBondContact O-N 3.42Å
118L96.8Very high96Very high103 Ų10385 Ų8554%0.53942%0.416SS..Hα-helixtrans-62.6-37.6176.5-177.265000112.2D114 I115 M116 G122D114-L118 WeakPolarHBondContact O-CB 3.38Å; D114-L118 PolarHBondContact O-N 2.7Å; I115-L118 PolarHBondContact O-N 3.1Å; M116-L118 PolarHBondContact O-N 3.45Å; L118-G122 WeakPolarHBondContact O-CA 3.47Å; L118-G122 PolarHBondContact O-N 3.33Å
119M95.1Very high95.8Very high42 Ų4284.7 Ų84.721%0.20742%0.416CS..Hα-helixtrans-65.8-41.8176.3-72.9176.665.200111.9L58 F61 I115 M116 K117 K123 F124L58-M119 HydrophobicContact CD1-CE 3.65Å; F61-M119 HydrophobicContact CD1-CE 4.22Å; F61-M119 HydrophobicContact CD1-SD 4.28Å; F61-M119 HydrophobicContact CE1-CE 4.15Å; F61-M119 HydrophobicContact CE1-CG 3.89Å; F61-M119 HydrophobicContact CE1-SD 3.67Å; I115-M119 HydrophobicContact CG2-CG 4.44Å; I115-M119 HydrophobicContact CG2-SD 4.09Å; I115-M119 VanDerWaalsContact O-CG 3.29Å; I115-M119 WeakPolarHBondContact O-CG 3.42Å; I115-M119 PolarHBondContact O-N 3.42Å; M116-M119 WeakPolarHBondContact O-CB 3.5Å; M116-M119 PolarHBondContact O-N 3.11Å; M116-M119 VanDerWaalsContact O-N 3.15Å; K117-M119 VanDerWaalsContact C-N 3.31Å; K117-M119 PolarHBondContact O-N 3.28Å; M119-K123 PolarHBondContact O-N 3.33Å; M119-F124 HydrophobicContact CB-CB 4.48Å; M119-F124 HydrophobicContact CG-CD2 4.15Å; M119-F124 PolarHBondContact O-N 3.47Å
120E96Very high95.8Very high137 Ų13784.5 Ų84.564%0.6442%0.417SS*.Hα-helixtrans-66-51.8176.8-71.9173.8-169.900111.2M116 K117 G122 K123M116-E120 WeakPolarHBondContact O-CG 3.29Å; M116-E120 PolarHBondContact O-N 3.43Å; K117-E120 PolarHBondContact O-N 3.19Å; E120-G122 VanDerWaalsContact C-N 3.32Å; E120-G122 PolarHBondContact O-N 2.63Å; E120-K123 PolarHBondContact O-N 3.24Å
121E97.1Very high95.6Very high128 Ų12886 Ų8660%0.59842%0.421SS*.Hα-helixtrans-58.8-44.3176.6-72.9177.8-178.100111.5K117 K123K117-E121 WeakPolarHBondContact CE-OE1 3.27Å; K117-E121 HydrophobicContact CG-CG 4.42Å; K117-E121 WeakPolarHBondContact O-CB 3.46Å; K117-E121 VanDerWaalsContact O-CG 3.32Å; K117-E121 WeakPolarHBondContact O-CG 3.29Å; K117-E121 PolarHBondContact O-N 3.42Å; E121-K123 PolarHBondContact O-N 3.13Å
122G94.9Very high95.4Very high15 Ų1585.1 Ų85.116%0.15542%0.416CS..Hα-helixtrans-71.6-13178.200000114L118 E120 F124 K127L118-G122 WeakPolarHBondContact O-CA 3.47Å; L118-G122 PolarHBondContact O-N 3.33Å; E120-G122 VanDerWaalsContact C-N 3.32Å; E120-G122 PolarHBondContact O-N 2.63Å; G122-F124 VanDerWaalsContact C-N 3.29Å; G122-F124 PolarHBondContact O-N 3.35Å; G122-K127 WeakPolarHBondContact O-CD 3.43Å; G122-K127 VanDerWaalsContact O-CE 3.24Å; G122-K127 WeakPolarHBondContact O-CE 3.34Å; G122-K127 PolarHBondContact O-NZ 3.36Å
123K96.4Very high95.2Very high150 Ų15088.9 Ų88.965%0.65243%0.432SS*.THydrogen-bonded Turntrans5244.9-173.6-58.3-179.7-179.4179.10112.5M119 E120 E121 E125 S126 K127M119-K123 PolarHBondContact O-N 3.33Å; E120-K123 PolarHBondContact O-N 3.24Å; E121-K123 PolarHBondContact O-N 3.13Å; K123-E125 VanDerWaalsContact C-N 3.34Å; K123-E125 PolarHBondContact O-N 2.93Å; K123-S126 PolarHBondContact O-N 3.27Å; K123-K127 PolarHBondContact O-N 2.95Å; K123-K127 VanDerWaalsContact O-N 3.11Å
124F94.8Very high95Very high56 Ų5688.4 Ų88.425%0.24643%0.432CS..Hα-helixtrans-63.5-38.2-169.6-8322.5000112.8F61 M119 G122 S126 K127 F128F61-F124 HydrophobicContact CE1-CD2 4.2Å; F61-F124 HydrophobicContact CE2-CD2 4.3Å; F61-F124 HydrophobicContact CE2-CE2 4.04Å; F61-F124 AromaticContact CZ-CD2 3.97Å; F61-F124 HydrophobicContact CZ-CD2 3.97Å; F61-F124 AromaticContact CZ-CE2 3.84Å; F61-F124 HydrophobicContact CZ-CE2 3.84Å; M119-F124 HydrophobicContact CB-CB 4.48Å; M119-F124 HydrophobicContact CG-CD2 4.15Å; M119-F124 PolarHBondContact O-N 3.47Å; G122-F124 VanDerWaalsContact C-N 3.29Å; G122-F124 PolarHBondContact O-N 3.35Å; F124-S126 PolarHBondContact O-N 3.46Å; F124-K127 PolarHBondContact O-N 2.91Å; F124-F128 HydrophobicContact CB-CD2 4.16Å; F124-F128 HydrophobicContact CB-CE2 4.07Å; F124-F128 AromaticContact CD2-CE2 3.96Å; F124-F128 HydrophobicContact CD2-CE2 3.96Å; F124-F128 HydrophobicContact CD2-CZ 4.44Å; F124-F128 HydrophobicContact CG-CE2 4.28Å; F124-F128 WeakPolarHBondContact O-CB 3.36Å; F124-F128 VanDerWaalsContact O-CD2 3.27Å; F124-F128 WeakPolarHBondContact O-CD2 2.79Å; F124-F128 WeakPolarHBondContact O-CG 3.49Å; F124-F128 PolarHBondContact O-N 3.43Å
125E92.2Very high94.6Very high124 Ų12486.2 Ų86.258%0.57942%0.419SS*.Hα-helixtrans-57.7-50176.7177170.5-162.400111.7L58 K123 K127 N129L58-E125 HydrophobicContact CD2-CB 3.95Å; L58-E125 HydrophobicContact CD2-CG 3.86Å; K123-E125 VanDerWaalsContact C-N 3.34Å; K123-E125 PolarHBondContact O-N 2.93Å; E125-K127 PolarHBondContact O-N 3Å; E125-N129 VanDerWaalsContact O-CB 3.24Å; E125-N129 WeakPolarHBondContact O-CB 3.29Å; E125-N129 PolarHBondContact O-N 3.47Å; E125-N129 PolarHBondContact O-ND2 3.43Å; E125-N129 VanDerWaalsContact O-ND2 3.1Å
126S93.8Very high94.4Very high76 Ų7689.5 Ų89.553%0.53144%0.436SS..Hα-helixtrans-61.2-47.8178.1-174.30000111.6K123 F124 N129 E130K123-S126 PolarHBondContact O-N 3.27Å; F124-S126 PolarHBondContact O-N 3.46Å; S126-N129 PolarHBondContact O-N 2.84Å; S126-E130 WeakPolarHBondContact O-CB 3.35Å; S126-E130 PolarHBondContact O-N 2.88Å
127K96Very high94.1Very high114 Ų11492.5 Ų92.550%0.49645%0.447SS..Hα-helixtrans-64.4-43.8-178.6-70.7177.1179167.70112.7G122 K123 F124 E125 E130 L131G122-K127 WeakPolarHBondContact O-CD 3.43Å; G122-K127 VanDerWaalsContact O-CE 3.24Å; G122-K127 WeakPolarHBondContact O-CE 3.34Å; G122-K127 PolarHBondContact O-NZ 3.36Å; K123-K127 PolarHBondContact O-N 2.95Å; K123-K127 VanDerWaalsContact O-N 3.11Å; F124-K127 PolarHBondContact O-N 2.91Å; E125-K127 PolarHBondContact O-N 3Å; K127-E130 PolarHBondContact O-N 2.91Å; K127-L131 WeakPolarHBondContact O-CB 3.43Å; K127-L131 VanDerWaalsContact O-CG 3.29Å; K127-L131 WeakPolarHBondContact O-CG 3.26Å; K127-L131 PolarHBondContact O-N 3.38Å
128F95.3Very high93.8Very high44 Ų4489.7 Ų89.719%0.19345%0.445CS..Hα-helixtrans-66.9-41.9177-75-43000111.7R57 L58 F61 F124 E130 L131 D132R57-F128 HydrophobicContact CB-CB 3.99Å; R57-F128 HydrophobicContact CB-CD1 3.74Å; R57-F128 HydrophobicContact CB-CE1 4.42Å; R57-F128 HydrophobicContact CB-CG 3.92Å; L58-F128 HydrophobicContact CB-CB 4.42Å; L58-F128 HydrophobicContact CB-CD2 4.17Å; L58-F128 HydrophobicContact CD1-CD2 4.02Å; F61-F128 HydrophobicContact CB-CE2 4.01Å; F61-F128 HydrophobicContact CB-CZ 4.41Å; F61-F128 HydrophobicContact CD2-CE2 4.23Å; F61-F128 HydrophobicContact CD2-CZ 4.21Å; F61-F128 HydrophobicContact CG-CE2 4.01Å; F61-F128 HydrophobicContact CG-CZ 4.4Å; F124-F128 HydrophobicContact CB-CD2 4.16Å; F124-F128 HydrophobicContact CB-CE2 4.07Å; F124-F128 AromaticContact CD2-CE2 3.96Å; F124-F128 HydrophobicContact CD2-CE2 3.96Å; F124-F128 HydrophobicContact CD2-CZ 4.44Å; F124-F128 HydrophobicContact CG-CE2 4.28Å; F124-F128 WeakPolarHBondContact O-CB 3.36Å; F124-F128 VanDerWaalsContact O-CD2 3.27Å; F124-F128 WeakPolarHBondContact O-CD2 2.79Å; F124-F128 WeakPolarHBondContact O-CG 3.49Å; F124-F128 PolarHBondContact O-N 3.43Å; F128-E130 VanDerWaalsContact C-N 3.3Å; F128-E130 PolarHBondContact O-N 3.46Å; F128-L131 HydrophobicContact CD1-CD1 4.35Å; F128-L131 PolarHBondContact O-N 3.33Å; F128-D132 WeakPolarHBondContact O-CB 3.24Å; F128-D132 VanDerWaalsContact O-CG 3.23Å; F128-D132 PolarHBondContact O-N 2.92Å
129N92.9Very high93.4Very high47 Ų4790.2 Ų90.225%0.25144%0.443SS..Hα-helixtrans-63.8-36.7175.5-70.8-24.2000112N56 E125 S126 K133N56-N129 PolarHBondContact ND2-OD1 3.43Å; E125-N129 VanDerWaalsContact O-CB 3.24Å; E125-N129 WeakPolarHBondContact O-CB 3.29Å; E125-N129 PolarHBondContact O-N 3.47Å; E125-N129 PolarHBondContact O-ND2 3.43Å; E125-N129 VanDerWaalsContact O-ND2 3.1Å; S126-N129 PolarHBondContact O-N 2.84Å; N129-K133 VanDerWaalsContact O-CG 3.26Å; N129-K133 WeakPolarHBondContact O-CG 3.35Å; N129-K133 PolarHBondContact O-N 2.9Å; N129-K133 VanDerWaalsContact O-N 3.11Å
130E95.3Very high93.1Very high111 Ų11195.3 Ų95.352%0.51947%0.471SS..Hα-helixtrans-67.7-43.9174.2-174.2174.6-168.800111.9S126 K127 F128 D132 K133 L134S126-E130 WeakPolarHBondContact O-CB 3.35Å; S126-E130 PolarHBondContact O-N 2.88Å; K127-E130 PolarHBondContact O-N 2.91Å; F128-E130 VanDerWaalsContact C-N 3.3Å; F128-E130 PolarHBondContact O-N 3.46Å; E130-D132 PolarHBondContact O-N 2.9Å; E130-K133 WeakPolarHBondContact O-CB 3.5Å; E130-K133 PolarHBondContact O-N 3.24Å; E130-L134 HydrophobicContact CG-CD1 4.17Å; E130-L134 HydrophobicContact CG-CG 4.44Å; E130-L134 WeakPolarHBondContact O-CG 3.5Å; E130-L134 PolarHBondContact O-N 2.86Å
131L93.8Very high92.8Very high87 Ų8793.3 Ų93.346%0.45546%0.464SS..Hα-helixtrans-60.6-43174.8-74.3173.4000112.1K127 F128 K133 L134 E135K127-L131 WeakPolarHBondContact O-CB 3.43Å; K127-L131 VanDerWaalsContact O-CG 3.29Å; K127-L131 WeakPolarHBondContact O-CG 3.26Å; K127-L131 PolarHBondContact O-N 3.38Å; F128-L131 HydrophobicContact CD1-CD1 4.35Å; F128-L131 PolarHBondContact O-N 3.33Å; L131-K133 VanDerWaalsContact C-N 3.3Å; L131-K133 PolarHBondContact O-N 2.91Å; L131-L134 PolarHBondContact O-N 3.43Å; L131-E135 WeakPolarHBondContact O-CB 3.44Å; L131-E135 PolarHBondContact O-N 3.11Å
132D92.8Very high92.3Very high27 Ų2793 Ų9314%0.14447%0.473CS..Hα-helixtrans-59.5-42.4175-69.5-8.4000110.6R57 F128 E130 N136R57-D132 WeakPolarHBondContact CD-OD1 3.35Å; R57-D132 VanDerWaalsContact CG-OD1 3.22Å; R57-D132 WeakPolarHBondContact CG-OD1 3.15Å; R57-D132 IonicContact CZ-OD1 3.6Å; R57-D132 PolarHBondContact N-OD2 3.31Å; R57-D132 IonicContact NE-OD1 2.74Å; R57-D132 IonicContact NH1-OD1 3.21Å; R57-D132 PolarHBondContact NH1-OD1 3.34Å; F128-D132 WeakPolarHBondContact O-CB 3.24Å; F128-D132 VanDerWaalsContact O-CG 3.23Å; F128-D132 PolarHBondContact O-N 2.92Å; E130-D132 PolarHBondContact O-N 2.9Å; D132-N136 WeakPolarHBondContact O-CB 3.24Å; D132-N136 PolarHBondContact O-N 2.85Å; D132-N136 VanDerWaalsContact O-N 3.11Å; D132-N136 PolarHBondContact O-ND2 3.37Å; D132-N136 VanDerWaalsContact O-ND2 3.1Å
133K92.6Very high92Very high138 Ų13897.8 Ų97.860%0.650%0.496SS*.Hα-helixtrans-64.8-43175-71.4168.5-174.1177.10112.5N129 E130 L131 N136 K137N129-K133 VanDerWaalsContact O-CG 3.26Å; N129-K133 WeakPolarHBondContact O-CG 3.35Å; N129-K133 PolarHBondContact O-N 2.9Å; N129-K133 VanDerWaalsContact O-N 3.11Å; E130-K133 WeakPolarHBondContact O-CB 3.5Å; E130-K133 PolarHBondContact O-N 3.24Å; L131-K133 VanDerWaalsContact C-N 3.3Å; L131-K133 PolarHBondContact O-N 2.91Å; K133-N136 PolarHBondContact O-N 2.97Å; K133-K137 WeakPolarHBondContact O-CG 3.44Å; K133-K137 PolarHBondContact O-N 3.5Å
134L92.1Very high91.6Very high91 Ų9196.5 Ų96.548%0.47650%0.503SS..Hα-helixtrans-66.7-42.4-179.6-72.2172.6000111.6E130 L131 K137 A138E130-L134 HydrophobicContact CG-CD1 4.17Å; E130-L134 HydrophobicContact CG-CG 4.44Å; E130-L134 WeakPolarHBondContact O-CG 3.5Å; E130-L134 PolarHBondContact O-N 2.86Å; L131-L134 PolarHBondContact O-N 3.43Å; L134-K137 PolarHBondContact O-N 3.17Å; L134-A138 WeakPolarHBondContact O-CB 3.41Å; L134-A138 PolarHBondContact O-N 3.1Å
135E90.5Very high91.3Very high57 Ų5797 Ų9727%0.26652%0.517SS..Hα-helixtrans-60.4-46.1174.5-178.2-175.8-173.500111.1R54 R57 L131 K137 A138 K139R54-E135 IonicContact CZ-OE1 2.67Å; R54-E135 IonicContact NH1-OE1 2.7Å; R54-E135 PolarHBondContact NH1-OE1 2.9Å; R57-E135 IonicContact CZ-OE2 3.78Å; R57-E135 IonicContact NH1-OE2 2.65Å; R57-E135 PolarHBondContact NH1-OE2 3.29Å; R57-E135 IonicContact NH2-OE1 3.57Å; R57-E135 IonicContact NH2-OE2 3.83Å; R57-E135 PolarHBondContact NH2-OE2 3.42Å; L131-E135 WeakPolarHBondContact O-CB 3.44Å; L131-E135 PolarHBondContact O-N 3.11Å; E135-K137 VanDerWaalsContact C-N 3.32Å; E135-K137 PolarHBondContact O-N 3.47Å; E135-A138 CarbonylContact O-C 3.58Å; E135-A138 PolarHBondContact O-N 3.05Å; E135-A138 VanDerWaalsContact O-N 3.13Å; E135-K139 PolarHBondContact O-N 3.11Å
136N90.3Very high91.2Very high107 Ų10798.5 Ų98.557%0.57252%0.518SS*.Hα-helixtrans-61.9-40179.1-72.9-26.7000112.2D132 K133 A138 K139D132-N136 WeakPolarHBondContact O-CB 3.24Å; D132-N136 PolarHBondContact O-N 2.85Å; D132-N136 VanDerWaalsContact O-N 3.11Å; D132-N136 PolarHBondContact O-ND2 3.37Å; D132-N136 VanDerWaalsContact O-ND2 3.1Å; K133-N136 PolarHBondContact O-N 2.97Å; N136-A138 VanDerWaalsContact C-N 3.3Å; N136-A138 PolarHBondContact O-N 3.44Å; N136-K139 WeakPolarHBondContact O-CB 3.32Å; N136-K139 PolarHBondContact O-N 3.36Å
137K90.9Very high91Very high172 Ų172103.2 Ų103.275%0.74852%0.524SS*.Hα-helixtrans-67.2-29.3175.4-72.6178.9-174.1-175.50113.3K133 L134 E135K133-K137 WeakPolarHBondContact O-CG 3.44Å; K133-K137 PolarHBondContact O-N 3.5Å; L134-K137 PolarHBondContact O-N 3.17Å; E135-K137 VanDerWaalsContact C-N 3.32Å; E135-K137 PolarHBondContact O-N 3.47Å
138A89.8Confident90.9Very high57 Ų57101.9 Ų101.947%0.47153%0.527SS..Hα-helixtrans-91.8-5.8-178.300000113.5L134 E135 N136 D140 N141L134-A138 WeakPolarHBondContact O-CB 3.41Å; L134-A138 PolarHBondContact O-N 3.1Å; E135-A138 CarbonylContact O-C 3.58Å; E135-A138 PolarHBondContact O-N 3.05Å; E135-A138 VanDerWaalsContact O-N 3.13Å; N136-A138 VanDerWaalsContact C-N 3.3Å; N136-A138 PolarHBondContact O-N 3.44Å; A138-D140 PolarHBondContact O-N 3.07Å; A138-D140 VanDerWaalsContact O-N 3.16Å; A138-N141 PolarHBondContact O-N 2.89Å
139K88.1Confident90.7Very high114 Ų114102.7 Ų102.750%0.49654%0.538SS..THydrogen-bonded Turntrans-57.1-34.5-171.6-168.2176-179-179.20113.4T51 E135 N136T51-K139 PolarHBondContact OG1-NZ 3.19Å; E135-K139 PolarHBondContact O-N 3.11Å; N136-K139 WeakPolarHBondContact O-CB 3.32Å; N136-K139 PolarHBondContact O-N 3.36Å
140D89.3Confident90.8Very high149 Ų149103.6 Ų103.680%0.79756%0.558SS**THydrogen-bonded Turntrans-96.62.9-177.3-55-40.7000113.2A138 P142A138-D140 PolarHBondContact O-N 3.07Å; A138-D140 VanDerWaalsContact O-N 3.16Å; D140-P142 WeakPolarHBondContact O-CD 3.38Å
141N89.4Confident90.9Very high95 Ų95101.5 Ų101.551%0.50855%0.553SS.*  trans-90.4112178.4-166.9-25.7000109.9A138 D143A138-N141 PolarHBondContact O-N 2.89Å; N141-D143 VanDerWaalsContact C-N 3.26Å; N141-D143 PolarHBondContact O-N 3.39Å; N141-D143 WeakPolarHBondContact OD1-CB 3.41Å; N141-D143 PolarHBondContact OD1-N 3.49Å
142P86.5Confident90.9Very high121 Ų121101.1 Ų101.179%0.78656%0.556SS**  trans-76.6-14.9-179.433.1-36.3000112.9D140D140-P142 WeakPolarHBondContact O-CD 3.38Å
143D89.6Confident91Very high116 Ų116106.1 Ų106.162%0.6258%0.578SS**SBendtrans-74.1141.4-175.2-65.6-35.7000111.1N141 A145N141-D143 VanDerWaalsContact C-N 3.26Å; N141-D143 PolarHBondContact O-N 3.39Å; N141-D143 WeakPolarHBondContact OD1-CB 3.41Å; N141-D143 PolarHBondContact OD1-N 3.49Å; D143-A145 PolarHBondContact O-N 3.21Å
144P87.9Confident91.1Very high123 Ų123105.3 Ų105.380%0.79958%0.577SS**PPolyproline II helixtrans-60.5128.7174.325.5-32.8000109.9W146P144-W146 PolarHBondContact O-N 3.35Å
145A88.6Confident91.3Very high67 Ų67102.3 Ų102.355%0.55456%0.561SS**PPolyproline II helixtrans-59.5137.3177.600000110.8D143 R147D143-A145 PolarHBondContact O-N 3.21Å; A145-R147 PolarHBondContact O-NH1 2.86Å; A145-R147 VanDerWaalsContact O-NH1 3.17Å
146W89.1Confident91.4Very high155 Ų155104.3 Ų104.359%0.58757%0.573SS**PPolyproline II helixtrans-54.3142.2178.5-178.287.5000111.6P144 P148 D155P144-W146 PolarHBondContact O-N 3.35Å; W146-P148 HydrophobicContact CH2-CB 4.03Å; W146-P148 HydrophobicContact CH2-CG 3.76Å; W146-P148 HydrophobicContact CZ3-CB 4.48Å; W146-P148 HydrophobicContact CZ3-CG 3.75Å; W146-D155 HydrophobicContact CH2-CB 4.35Å; W146-D155 HydrophobicContact CZ2-CB 3.91Å
147R90.8Very high91.6Very high175 Ų175102.6 Ų102.666%0.6657%0.568SS**  trans-132.4141.9173.6-63.9-66.8-178.6-86-2.9107.7A145 S149A145-R147 PolarHBondContact O-NH1 2.86Å; A145-R147 VanDerWaalsContact O-NH1 3.17Å; R147-S149 PolarHBondContact O-N 3.41Å
148P92.6Very high91.6Very high87 Ų8797.6 Ų97.657%0.56556%0.555SS**  trans-53.1129.7171.9-23.632.5000110.1W146 G150 D155W146-P148 HydrophobicContact CH2-CB 4.03Å; W146-P148 HydrophobicContact CH2-CG 3.76Å; W146-P148 HydrophobicContact CZ3-CB 4.48Å; W146-P148 HydrophobicContact CZ3-CG 3.75Å; P148-G150 PolarHBondContact O-N 3.28Å; P148-D155 WeakPolarHBondContact CA-OD2 3.36Å
149S92.5Very high91.7Very high60 Ų60101.5 Ų101.542%0.4256%0.561SS.*  trans-69.1-19.9179.161.40000112.3R147 V151 D155R147-S149 PolarHBondContact O-N 3.41Å; S149-V151 VanDerWaalsContact C-N 3.29Å; S149-V151 PolarHBondContact OG-N 3.41Å; S149-V151 VanDerWaalsContact OG-N 3.13Å; S149-V151 PolarHBondContact OG-O 3.23Å; S149-D155 VanDerWaalsContact CB-OD1 3.29Å; S149-D155 WeakPolarHBondContact CB-OD1 3.4Å; S149-D155 PolarHBondContact N-OD1 2.85Å; S149-D155 PolarHBondContact N-OD2 3.43Å; S149-D155 VanDerWaalsContact OG-CG 3.3Å; S149-D155 PolarHBondContact OG-OD1 2.88Å
150G94.8Very high92.1Very high66 Ų6698.8 Ų98.868%0.6855%0.552SS**SBendtrans87.5-1-169.100000112.9P148P148-G150 PolarHBondContact O-N 3.28Å
151V96.6Very high92.4Very high68 Ų6896 Ų9641%0.41254%0.535SS..  trans-111.7101.8174.4-176.70000108.3S149 E153 Q154 D155S149-V151 VanDerWaalsContact C-N 3.29Å; S149-V151 PolarHBondContact OG-N 3.41Å; S149-V151 VanDerWaalsContact OG-N 3.13Å; S149-V151 PolarHBondContact OG-O 3.23Å; V151-E153 VanDerWaalsContact C-N 3.26Å; V151-E153 PolarHBondContact O-N 3.11Å; V151-Q154 HydrophobicContact CB-CB 4.16Å; V151-Q154 HydrophobicContact CG1-CB 4.18Å; V151-Q154 PolarHBondContact O-N 3.38Å; V151-Q154 VanDerWaalsContact O-N 3.07Å; V151-D155 PolarHBondContact O-N 3.05Å; V151-D155 VanDerWaalsContact O-N 3.11Å
152P94.9Very high92.7Very high79 Ų7995 Ų9551%0.51353%0.534SS..Hα-helixtrans-55.7-38.4-173.4-27.635.7000113.8Q154 D155 I156P152-Q154 VanDerWaalsContact C-N 3.32Å; P152-Q154 PolarHBondContact O-N 3.43Å; P152-D155 PolarHBondContact O-N 3.01Å; P152-I156 WeakPolarHBondContact O-CB 3.27Å; P152-I156 VanDerWaalsContact O-CG1 3.25Å; P152-I156 WeakPolarHBondContact O-CG1 3.41Å; P152-I156 PolarHBondContact O-N 3.15Å
153E95.2Very high93.2Very high131 Ų13196.4 Ų96.461%0.61253%0.525SS*.Hα-helixtrans-61.1-43.1179.5-63.976.8-170.700111.1V151 C157V151-E153 VanDerWaalsContact C-N 3.26Å; V151-E153 PolarHBondContact O-N 3.11Å; E153-C157 VanDerWaalsContact O-CB 3.27Å; E153-C157 WeakPolarHBondContact O-CB 3.37Å; E153-C157 PolarHBondContact O-N 3.29Å; E153-C157 PolarHBondContact O-SG 2.95Å
154Q94.3Very high93.6Very high122 Ų12297.4 Ų97.457%0.5752%0.521SS*.Hα-helixtrans-69-42.8179.2-175.5171.28.700111.6V151 P152 C157 S158V151-Q154 HydrophobicContact CB-CB 4.16Å; V151-Q154 HydrophobicContact CG1-CB 4.18Å; V151-Q154 PolarHBondContact O-N 3.38Å; V151-Q154 VanDerWaalsContact O-N 3.07Å; P152-Q154 VanDerWaalsContact C-N 3.32Å; P152-Q154 PolarHBondContact O-N 3.43Å; Q154-C157 PolarHBondContact O-N 3Å; Q154-S158 WeakPolarHBondContact O-CB 3.31Å; Q154-S158 PolarHBondContact O-N 2.95Å
155D95.1Very high94.1Very high28 Ų2896.9 Ų96.915%0.1551%0.508CS..Hα-helixtrans-64.3-42.6-179.3-67-17.5000111.1W146 P148 S149 V151 P152 S158 F159W146-D155 HydrophobicContact CH2-CB 4.35Å; W146-D155 HydrophobicContact CZ2-CB 3.91Å; P148-D155 WeakPolarHBondContact CA-OD2 3.36Å; S149-D155 VanDerWaalsContact CB-OD1 3.29Å; S149-D155 WeakPolarHBondContact CB-OD1 3.4Å; S149-D155 PolarHBondContact N-OD1 2.85Å; S149-D155 PolarHBondContact N-OD2 3.43Å; S149-D155 VanDerWaalsContact OG-CG 3.3Å; S149-D155 PolarHBondContact OG-OD1 2.88Å; V151-D155 PolarHBondContact O-N 3.05Å; V151-D155 VanDerWaalsContact O-N 3.11Å; P152-D155 PolarHBondContact O-N 3.01Å; D155-S158 PolarHBondContact O-N 3.28Å; D155-F159 PolarHBondContact O-N 2.95Å
156I93.9Very high94.5Very high99 Ų99101.5 Ų101.551%0.50852%0.516SS..Hα-helixtrans-66.7-45.8175.4-67.8168000110.8P152 S158 F159 L160P152-I156 WeakPolarHBondContact O-CB 3.27Å; P152-I156 VanDerWaalsContact O-CG1 3.25Å; P152-I156 WeakPolarHBondContact O-CG1 3.41Å; P152-I156 PolarHBondContact O-N 3.15Å; I156-S158 VanDerWaalsContact C-N 3.31Å; I156-S158 PolarHBondContact O-N 2.95Å; I156-F159 PolarHBondContact O-N 3.39Å; I156-F159 VanDerWaalsContact O-N 3.16Å; I156-L160 HydrophobicContact CG2-CD1 3.65Å; I156-L160 HydrophobicContact CG2-CG 4.18Å; I156-L160 WeakPolarHBondContact O-CG 3.25Å; I156-L160 PolarHBondContact O-N 2.91Å
157C93.1Very high94.9Very high71 Ų7199.3 Ų99.348%0.4851%0.512SS..Hα-helixtrans-59.1-42.8177.8-78.90000111.7E153 Q154 F159 L160 M161E153-C157 VanDerWaalsContact O-CB 3.27Å; E153-C157 WeakPolarHBondContact O-CB 3.37Å; E153-C157 PolarHBondContact O-N 3.29Å; E153-C157 PolarHBondContact O-SG 2.95Å; Q154-C157 PolarHBondContact O-N 3Å; C157-F159 VanDerWaalsContact C-N 3.29Å; C157-F159 PolarHBondContact O-N 3.16Å; C157-L160 PolarHBondContact O-N 2.94Å; C157-M161 WeakPolarHBondContact O-CB 3.41Å; C157-M161 PolarHBondContact O-N 3.22Å
158S91.6Very high95.3Very high67 Ų6795.8 Ų95.847%0.46950%0.503SS..Hα-helixtrans-59.1-40.7176.4-175.70000112.1Q154 D155 I156Q154-S158 WeakPolarHBondContact O-CB 3.31Å; Q154-S158 PolarHBondContact O-N 2.95Å; D155-S158 PolarHBondContact O-N 3.28Å; I156-S158 VanDerWaalsContact C-N 3.31Å; I156-S158 PolarHBondContact O-N 2.95Å
159F92Very high95.6Very high138 Ų13894.6 Ų94.661%0.60550%0.5SS*.Hα-helixtrans-70-39.7177.9176.2-101.9000112.7D155 I156 C157 P162 Y163D155-F159 PolarHBondContact O-N 2.95Å; I156-F159 PolarHBondContact O-N 3.39Å; I156-F159 VanDerWaalsContact O-N 3.16Å; C157-F159 VanDerWaalsContact C-N 3.29Å; C157-F159 PolarHBondContact O-N 3.16Å; F159-P162 WeakPolarHBondContact O-CD 3.41Å; F159-Y163 HydrophobicContact CE1-CE2 4.44Å; F159-Y163 HydrophobicContact CZ-CE2 4.35Å
160L95.8Very high95.8Very high57 Ų5799 Ų9930%0.29851%0.509SS..Hα-helixtrans-81.6-24.7-176.2-66.8178.3000113.9I156 C157 P162 Y163 Y164I156-L160 HydrophobicContact CG2-CD1 3.65Å; I156-L160 HydrophobicContact CG2-CG 4.18Å; I156-L160 WeakPolarHBondContact O-CG 3.25Å; I156-L160 PolarHBondContact O-N 2.91Å; C157-L160 PolarHBondContact O-N 2.94Å; L160-P162 VanDerWaalsContact C-CD 3.45Å; L160-Y163 WeakPolarHBondContact O-CB 2.98Å; L160-Y163 PolarHBondContact O-N 2.65Å; L160-Y164 HydrophobicContact CB-CD2 4.12Å; L160-Y164 HydrophobicContact CB-CE2 3.81Å; L160-Y164 HydrophobicContact CD1-CE2 4.27Å; L160-Y164 PolarHBondContact O-N 3.26Å
161M96Very high96Very high90 Ų90101.4 Ų101.444%0.44350%0.503SS..Hα-helixtrans-51.8-45.1-174-162.561.860.700114.2C157 Y163 Y164 Q165C157-M161 WeakPolarHBondContact O-CB 3.41Å; C157-M161 PolarHBondContact O-N 3.22Å; M161-Y163 VanDerWaalsContact C-N 3.26Å; M161-Y163 PolarHBondContact O-N 3.25Å; M161-Y164 PolarHBondContact O-N 3.27Å; M161-Q165 HydrophobicContact CG-CG 4.33Å; M161-Q165 VanDerWaalsContact O-CG 3.31Å; M161-Q165 WeakPolarHBondContact O-CG 3.12Å; M161-Q165 PolarHBondContact O-N 3.32Å
162P96.3Very high96.1Very high76 Ų76103.2 Ų103.249%0.49451%0.506SS..Hα-helixtrans-61.4-33.4179.9-23.335.5000113.3F159 L160 K166F159-P162 WeakPolarHBondContact O-CD 3.41Å; L160-P162 VanDerWaalsContact C-CD 3.45Å; P162-K166 PolarHBondContact O-N 3.09Å; P162-K166 VanDerWaalsContact O-N 3.09Å
163Y96.9Very high96.3Very high149 Ų149105.3 Ų105.358%0.58451%0.512SS*.Hα-helixtrans-69.4-45.2177.9-65.9-87.1000111.4F159 L160 M161 K166 Q167F159-Y163 HydrophobicContact CE1-CE2 4.44Å; F159-Y163 HydrophobicContact CZ-CE2 4.35Å; L160-Y163 WeakPolarHBondContact O-CB 2.98Å; L160-Y163 PolarHBondContact O-N 2.65Å; M161-Y163 VanDerWaalsContact C-N 3.26Å; M161-Y163 PolarHBondContact O-N 3.25Å; Y163-K166 PolarHBondContact O-N 3.42Å; Y163-Q167 PolarHBondContact O-N 2.83Å
164Y97.1Very high96.5Very high138 Ų138102 Ų10254%0.54150%0.497SS..Hα-helixtrans-66.5-38.2177.7-69.6-51000112.3L160 M161 K166 Q167 E168L160-Y164 HydrophobicContact CB-CD2 4.12Å; L160-Y164 HydrophobicContact CB-CE2 3.81Å; L160-Y164 HydrophobicContact CD1-CE2 4.27Å; L160-Y164 PolarHBondContact O-N 3.26Å; M161-Y164 PolarHBondContact O-N 3.27Å; Y164-K166 VanDerWaalsContact C-N 3.33Å; Y164-K166 PolarHBondContact O-N 3.46Å; Y164-Q167 PolarHBondContact O-N 3.28Å; Y164-E168 WeakPolarHBondContact O-CB 3.34Å; Y164-E168 PolarHBondContact O-N 3.28Å
165Q98.1Very high96.7Very high111 Ų111100.9 Ų100.952%0.51949%0.494SS..Hα-helixtrans-60.7-42.7173.6-73.5174.1-12.100111.7M161 E168 A169M161-Q165 HydrophobicContact CG-CG 4.33Å; M161-Q165 VanDerWaalsContact O-CG 3.31Å; M161-Q165 WeakPolarHBondContact O-CG 3.12Å; M161-Q165 PolarHBondContact O-N 3.32Å; Q165-E168 PolarHBondContact O-N 3.04Å; Q165-A169 WeakPolarHBondContact O-CB 3.36Å; Q165-A169 PolarHBondContact O-N 2.96Å
166K97.8Very high96.8Very high165 Ų165106.4 Ų106.472%0.71752%0.517SS*.Hα-helixtrans-63-43.1175.4-174.3177.2-179.8178.80111.9P162 Y163 Y164 A169 Y170P162-K166 PolarHBondContact O-N 3.09Å; P162-K166 VanDerWaalsContact O-N 3.09Å; Y163-K166 PolarHBondContact O-N 3.42Å; Y164-K166 VanDerWaalsContact C-N 3.33Å; Y164-K166 PolarHBondContact O-N 3.46Å; K166-A169 PolarHBondContact O-N 3.47Å; K166-Y170 PolarHBondContact O-N 2.99Å; K166-Y170 VanDerWaalsContact O-N 3.08Å
167Q98.1Very high97.1Very high108 Ų108107.4 Ų107.451%0.50551%0.514SS..Hα-helixtrans-64.1-44.8177.3-176.7178-7.500111.6Y163 Y164 A169 Y170 M171Y163-Q167 PolarHBondContact O-N 2.83Å; Y164-Q167 PolarHBondContact O-N 3.28Å; Q167-A169 VanDerWaalsContact C-N 3.35Å; Q167-A169 PolarHBondContact O-N 3.3Å; Q167-Y170 PolarHBondContact O-N 3.08Å; Q167-M171 HydrophobicContact CG-SD 4.46Å; Q167-M171 WeakPolarHBondContact O-CG 3.47Å; Q167-M171 PolarHBondContact O-N 3.44Å
168E98.3Very high97.3Very high102 Ų102107.1 Ų107.148%0.47751%0.507SS..Hα-helixtrans-60.5-45.3177.7-170.1-165.9-173.800111.2Y164 Q165 Y170 M171 K172Y164-E168 WeakPolarHBondContact O-CB 3.34Å; Y164-E168 PolarHBondContact O-N 3.28Å; Q165-E168 PolarHBondContact O-N 3.04Å; E168-Y170 VanDerWaalsContact C-N 3.33Å; E168-Y170 PolarHBondContact O-N 3.17Å; E168-M171 PolarHBondContact O-N 3.47Å; E168-K172 HydrophobicContact CG-CD 4.28Å; E168-K172 WeakPolarHBondContact O-CB 3.4Å; E168-K172 WeakPolarHBondContact O-CG 3.39Å; E168-K172 PolarHBondContact O-N 3.47Å; E168-K172 WeakPolarHBondContact OE1-CE 3.34Å; E168-K172 IonicContact OE1-NZ 3.69Å; E168-K172 PolarHBondContact OE1-NZ 3.39Å; E168-K172 IonicContact OE2-NZ 2.71Å
169A98.4Very high97.7Very high61 Ų61109.3 Ų109.350%0.50451%0.51SS..Hα-helixtrans-59.3-43.8177.200000112Q165 K166 Q167 K172 L173Q165-A169 WeakPolarHBondContact O-CB 3.36Å; Q165-A169 PolarHBondContact O-N 2.96Å; K166-A169 PolarHBondContact O-N 3.47Å; Q167-A169 VanDerWaalsContact C-N 3.35Å; Q167-A169 PolarHBondContact O-N 3.3Å; A169-K172 PolarHBondContact O-N 3.43Å; A169-L173 PolarHBondContact O-N 2.93Å; A169-L173 VanDerWaalsContact O-N 3.17Å
170Y98.5Very high98Very high153 Ų153105.8 Ų105.860%0.651%0.506SS*.Hα-helixtrans-62-48.8175.6172-100.6000112.1K166 Q167 E168 K172 L173 E174K166-Y170 PolarHBondContact O-N 2.99Å; K166-Y170 VanDerWaalsContact O-N 3.08Å; Q167-Y170 PolarHBondContact O-N 3.08Å; E168-Y170 VanDerWaalsContact C-N 3.33Å; E168-Y170 PolarHBondContact O-N 3.17Å; Y170-K172 VanDerWaalsContact C-N 3.3Å; Y170-K172 PolarHBondContact O-N 3.19Å; Y170-L173 WeakPolarHBondContact O-CB 3.44Å; Y170-L173 PolarHBondContact O-N 3.03Å; Y170-L173 VanDerWaalsContact O-N 3.1Å; Y170-E174 PolarHBondContact O-N 3.36Å
171M98.8Very high98.1Very high116 Ų116107.7 Ų107.757%0.57151%0.514SS*.Hα-helixtrans-62.8-37.6-180-69.9-167.876.100112.3Q167 E168 L173 E174 L175Q167-M171 HydrophobicContact CG-SD 4.46Å; Q167-M171 WeakPolarHBondContact O-CG 3.47Å; Q167-M171 PolarHBondContact O-N 3.44Å; E168-M171 PolarHBondContact O-N 3.47Å; M171-L173 VanDerWaalsContact C-N 3.3Å; M171-L173 PolarHBondContact O-N 3.45Å; M171-E174 PolarHBondContact O-N 2.9Å; M171-L175 VanDerWaalsContact O-CB 3.28Å; M171-L175 WeakPolarHBondContact O-CB 3.42Å; M171-L175 PolarHBondContact O-N 3.3Å
172K98.6Very high98.2Very high107 Ų107107.8 Ų107.847%0.46552%0.516SS..Hα-helixtrans-61.5-39.3174.4-77.1174.4-1801670111.9E168 A169 Y170 K176E168-K172 HydrophobicContact CG-CD 4.28Å; E168-K172 WeakPolarHBondContact O-CB 3.4Å; E168-K172 WeakPolarHBondContact O-CG 3.39Å; E168-K172 PolarHBondContact O-N 3.47Å; E168-K172 WeakPolarHBondContact OE1-CE 3.34Å; E168-K172 IonicContact OE1-NZ 3.69Å; E168-K172 PolarHBondContact OE1-NZ 3.39Å; E168-K172 IonicContact OE2-NZ 2.71Å; A169-K172 PolarHBondContact O-N 3.43Å; Y170-K172 VanDerWaalsContact C-N 3.3Å; Y170-K172 PolarHBondContact O-N 3.19Å; K172-K176 WeakPolarHBondContact O-CG 3.27Å; K172-K176 PolarHBondContact O-N 3.01Å
173L98.6Very high98.4Very high123 Ų123106.7 Ų106.764%0.64451%0.513SS*.Hα-helixtrans-66.6-47.3177.4-17565.7000111.2A169 Y170 M171 L175 K176 R177A169-L173 PolarHBondContact O-N 2.93Å; A169-L173 VanDerWaalsContact O-N 3.17Å; Y170-L173 WeakPolarHBondContact O-CB 3.44Å; Y170-L173 PolarHBondContact O-N 3.03Å; Y170-L173 VanDerWaalsContact O-N 3.1Å; M171-L173 VanDerWaalsContact C-N 3.3Å; M171-L173 PolarHBondContact O-N 3.45Å; L173-L175 PolarHBondContact O-N 3.49Å; L173-K176 PolarHBondContact O-N 2.96Å; L173-R177 PolarHBondContact O-N 3.1Å
174E98.7Very high98.4Very high61 Ų61101.8 Ų101.829%0.28550%0.503SS..Hα-helixtrans-65.4-39.9-179.1-171.455.5-15000111.9Y170 M171 K176 R177 I178Y170-E174 PolarHBondContact O-N 3.36Å; M171-E174 PolarHBondContact O-N 2.9Å; E174-K176 VanDerWaalsContact C-N 3.35Å; E174-K176 PolarHBondContact O-N 3.48Å; E174-R177 WeakPolarHBondContact O-CB 3.28Å; E174-R177 PolarHBondContact O-N 2.94Å; E174-R177 IonicContact OE1-CZ 3.42Å; E174-R177 IonicContact OE1-NE 3.8Å; E174-R177 PolarHBondContact OE1-NE 3.28Å; E174-R177 IonicContact OE1-NH2 2.76Å; E174-R177 PolarHBondContact OE1-NH2 3.07Å; E174-R177 IonicContact OE2-NE 3.97Å; E174-R177 PolarHBondContact OE2-NE 3.47Å; E174-I178 HydrophobicContact CG-CD1 4.17Å; E174-I178 WeakPolarHBondContact O-CG1 3.43Å; E174-I178 PolarHBondContact O-N 3.42Å
175L98.8Very high98.5Very high98 Ų9898.3 Ų98.351%0.51349%0.494SS..Hα-helixtrans-61-44.4176.1-177.163.2000111.7M171 L173 R177 I178 Q179M171-L175 VanDerWaalsContact O-CB 3.28Å; M171-L175 WeakPolarHBondContact O-CB 3.42Å; M171-L175 PolarHBondContact O-N 3.3Å; L173-L175 PolarHBondContact O-N 3.49Å; L175-R177 VanDerWaalsContact C-N 3.3Å; L175-R177 PolarHBondContact O-N 3.34Å; L175-I178 PolarHBondContact O-N 3.36Å; L175-Q179 HydrophobicContact CD1-CG 4.41Å; L175-Q179 HydrophobicContact CG-CG 4.49Å; L175-Q179 WeakPolarHBondContact O-CB 3.42Å; L175-Q179 VanDerWaalsContact O-CG 3.27Å; L175-Q179 WeakPolarHBondContact O-CG 3.46Å; L175-Q179 PolarHBondContact O-N 3.43Å
176K98.6Very high98.5Very high144 Ų14495.9 Ų95.963%0.62649%0.493SS*.Hα-helixtrans-60.4-41.3175.8-76.3177.9179.6-176.70111.7K172 L173 E174 Q179 A180K172-K176 WeakPolarHBondContact O-CG 3.27Å; K172-K176 PolarHBondContact O-N 3.01Å; L173-K176 PolarHBondContact O-N 2.96Å; E174-K176 VanDerWaalsContact C-N 3.35Å; E174-K176 PolarHBondContact O-N 3.48Å; K176-Q179 PolarHBondContact O-N 3.47Å; K176-A180 WeakPolarHBondContact O-CB 3.38Å; K176-A180 PolarHBondContact O-N 3.06Å
177R98.6Very high98.6Very high120 Ų12094.8 Ų94.845%0.45349%0.49SS..Hα-helixtrans-59.5-50.9177.4-168.2-163.669.769.42.6111L173 E174 L175 Q179 A180 E181L173-R177 PolarHBondContact O-N 3.1Å; E174-R177 WeakPolarHBondContact O-CB 3.28Å; E174-R177 PolarHBondContact O-N 2.94Å; E174-R177 IonicContact OE1-CZ 3.42Å; E174-R177 IonicContact OE1-NE 3.8Å; E174-R177 PolarHBondContact OE1-NE 3.28Å; E174-R177 IonicContact OE1-NH2 2.76Å; E174-R177 PolarHBondContact OE1-NH2 3.07Å; E174-R177 IonicContact OE2-NE 3.97Å; E174-R177 PolarHBondContact OE2-NE 3.47Å; L175-R177 VanDerWaalsContact C-N 3.3Å; L175-R177 PolarHBondContact O-N 3.34Å; R177-Q179 PolarHBondContact O-N 2.74Å; R177-A180 PolarHBondContact O-N 3.04Å; R177-E181 IonicContact CZ-OE2 3.2Å; R177-E181 IonicContact NH1-OE2 3.79Å; R177-E181 PolarHBondContact NH1-OE2 3.14Å; R177-E181 PolarHBondContact O-N 2.92Å
178I98.6Very high98.6Very high66 Ų6697.8 Ų97.834%0.33850%0.497SS..Hα-helixtrans-63.9-41-180-67.1169.7000111.1E174 L175 A180 E181 N182E174-I178 HydrophobicContact CG-CD1 4.17Å; E174-I178 WeakPolarHBondContact O-CG1 3.43Å; E174-I178 PolarHBondContact O-N 3.42Å; L175-I178 PolarHBondContact O-N 3.36Å; I178-A180 PolarHBondContact O-N 3.42Å; I178-E181 PolarHBondContact O-N 3Å; I178-N182 VanDerWaalsContact O-CB 3.32Å; I178-N182 WeakPolarHBondContact O-CB 3.32Å; I178-N182 VanDerWaalsContact O-CG 3.29Å; I178-N182 PolarHBondContact O-N 3.38Å
179Q98.7Very high98.6Very high113 Ų11396.6 Ų96.653%0.52850%0.496SS..Hα-helixtrans-62.2-42.9177.7-76.1174.5-15.100112.1L175 K176 R177 N182 A183L175-Q179 HydrophobicContact CD1-CG 4.41Å; L175-Q179 HydrophobicContact CG-CG 4.49Å; L175-Q179 WeakPolarHBondContact O-CB 3.42Å; L175-Q179 VanDerWaalsContact O-CG 3.27Å; L175-Q179 WeakPolarHBondContact O-CG 3.46Å; L175-Q179 PolarHBondContact O-N 3.43Å; K176-Q179 PolarHBondContact O-N 3.47Å; R177-Q179 PolarHBondContact O-N 2.74Å; Q179-N182 PolarHBondContact O-N 2.82Å; Q179-A183 WeakPolarHBondContact O-CB 3.49Å; Q179-A183 PolarHBondContact O-N 3.19Å
180A98.6Very high98.6Very high64 Ų6498.4 Ų98.453%0.52950%0.495SS..Hα-helixtrans-64.4-43.8176.800000111.9K176 R177 I178 A183 A184K176-A180 WeakPolarHBondContact O-CB 3.38Å; K176-A180 PolarHBondContact O-N 3.06Å; R177-A180 PolarHBondContact O-N 3.04Å; I178-A180 PolarHBondContact O-N 3.42Å; A180-A183 PolarHBondContact O-N 3.36Å; A180-A184 PolarHBondContact O-N 2.86Å
181E98.6Very high98.6Very high97 Ų9793.8 Ų93.845%0.45349%0.488SS..Hα-helixtrans-63.2-44.4177.2-173.2177.2177.700111.8R177 I178 A183 A184 L185R177-E181 IonicContact CZ-OE2 3.2Å; R177-E181 IonicContact NH1-OE2 3.79Å; R177-E181 PolarHBondContact NH1-OE2 3.14Å; R177-E181 PolarHBondContact O-N 2.92Å; I178-E181 PolarHBondContact O-N 3Å; E181-A183 VanDerWaalsContact C-N 3.35Å; E181-A183 PolarHBondContact O-N 2.88Å; E181-A184 PolarHBondContact O-N 3.37Å; E181-L185 HydrophobicContact CG-CD1 4.1Å; E181-L185 WeakPolarHBondContact O-CB 3.49Å; E181-L185 WeakPolarHBondContact O-CG 3.35Å; E181-L185 PolarHBondContact O-N 2.97Å
182N98.7Very high98.6Very high92 Ų9289.8 Ų89.849%0.49248%0.476SS..Hα-helixtrans-64-38.6177-76.7-14.7000112.3I178 Q179 L185 A186I178-N182 VanDerWaalsContact O-CB 3.32Å; I178-N182 WeakPolarHBondContact O-CB 3.32Å; I178-N182 VanDerWaalsContact O-CG 3.29Å; I178-N182 PolarHBondContact O-N 3.38Å; Q179-N182 PolarHBondContact O-N 2.82Å; N182-L185 PolarHBondContact O-N 3.47Å; N182-A186 WeakPolarHBondContact O-CB 3.36Å; N182-A186 PolarHBondContact O-N 2.89Å
183A98.6Very high98.6Very high52 Ų5292.6 Ų92.643%0.4348%0.484SS..Hα-helixtrans-62.4-48.9175.100000111Q179 A180 E181 L185 A186 E187Q179-A183 WeakPolarHBondContact O-CB 3.49Å; Q179-A183 PolarHBondContact O-N 3.19Å; A180-A183 PolarHBondContact O-N 3.36Å; E181-A183 VanDerWaalsContact C-N 3.35Å; E181-A183 PolarHBondContact O-N 2.88Å; A183-L185 VanDerWaalsContact C-N 3.29Å; A183-L185 PolarHBondContact O-N 3.34Å; A183-A186 PolarHBondContact O-N 3.2Å; A183-A186 VanDerWaalsContact O-N 3.14Å; A183-E187 WeakPolarHBondContact O-CG 3.42Å; A183-E187 PolarHBondContact O-N 2.89Å
184A98.4Very high98.6Very high46 Ų4691.3 Ų91.338%0.3848%0.475SS..Hα-helixtrans-62.5-35.117700000112.7A180 E181 R188A180-A184 PolarHBondContact O-N 2.86Å; E181-A184 PolarHBondContact O-N 3.37Å; A184-R188 WeakPolarHBondContact O-CG 3.4Å; A184-R188 PolarHBondContact O-N 3.49Å
185L98.7Very high98.6Very high65 Ų6591.5 Ų91.534%0.3448%0.483SS..Hα-helixtrans-67.1-44.1173-79.3165.1000111.9E181 N182 A183 E187 R188 V189E181-L185 HydrophobicContact CG-CD1 4.1Å; E181-L185 WeakPolarHBondContact O-CB 3.49Å; E181-L185 WeakPolarHBondContact O-CG 3.35Å; E181-L185 PolarHBondContact O-N 2.97Å; N182-L185 PolarHBondContact O-N 3.47Å; A183-L185 VanDerWaalsContact C-N 3.29Å; A183-L185 PolarHBondContact O-N 3.34Å; L185-E187 PolarHBondContact O-N 2.99Å; L185-R188 PolarHBondContact O-N 3.1Å; L185-V189 WeakPolarHBondContact O-CG2 3.46Å; L185-V189 PolarHBondContact O-N 2.92Å
186A98.6Very high98.6Very high60 Ų6091.5 Ų91.550%0.49648%0.482SS..Hα-helixtrans-61.8-43178.700000111.6N182 A183 R188 V189 Q190N182-A186 WeakPolarHBondContact O-CB 3.36Å; N182-A186 PolarHBondContact O-N 2.89Å; A183-A186 PolarHBondContact O-N 3.2Å; A183-A186 VanDerWaalsContact O-N 3.14Å; A186-R188 PolarHBondContact O-N 3.35Å; A186-V189 PolarHBondContact O-N 2.76Å; A186-Q190 WeakPolarHBondContact O-CB 3.48Å; A186-Q190 PolarHBondContact O-N 3.49Å
187E98.6Very high98.6Very high143 Ų14387.1 Ų87.167%0.66847%0.473SS*.Hα-helixtrans-59.6-45.7174.4-72.8-178.8166.100111.8A183 L185 V189 Q190 A191A183-E187 WeakPolarHBondContact O-CG 3.42Å; A183-E187 PolarHBondContact O-N 2.89Å; L185-E187 PolarHBondContact O-N 2.99Å; E187-V189 PolarHBondContact O-N 3.25Å; E187-Q190 PolarHBondContact O-N 2.94Å; E187-A191 WeakPolarHBondContact O-CB 3.45Å; E187-A191 PolarHBondContact O-N 3.26Å
188R98.5Very high98.6Very high170 Ų17087.5 Ų87.564%0.64248%0.48SS*.Hα-helixtrans-62.6-40.6176.8-75.5-169.7-69.1163.5-9112.8A184 L185 A186 Q190 G192A184-R188 WeakPolarHBondContact O-CG 3.4Å; A184-R188 PolarHBondContact O-N 3.49Å; L185-R188 PolarHBondContact O-N 3.1Å; A186-R188 PolarHBondContact O-N 3.35Å; R188-Q190 VanDerWaalsContact C-N 3.34Å; R188-G192 PolarHBondContact O-N 3.31Å
189V98.8Very high98.5Very high77 Ų7787.2 Ų87.247%0.46748%0.482SS..Hα-helixtrans-63.7-43.3176.2167.60000110.5L185 A186 E187 G192 R193L185-V189 WeakPolarHBondContact O-CG2 3.46Å; L185-V189 PolarHBondContact O-N 2.92Å; A186-V189 PolarHBondContact O-N 2.76Å; E187-V189 PolarHBondContact O-N 3.25Å; V189-G192 PolarHBondContact O-N 3.29Å; V189-R193 WeakPolarHBondContact O-CG 3.49Å; V189-R193 PolarHBondContact O-N 3.43Å
190Q98.6Very high98.5Very high100 Ų10087.8 Ų87.847%0.46748%0.484SS..Hα-helixtrans-63.7-48.9179.5-176.656.929.600111.6A186 E187 R188 G192 R193 E194A186-Q190 WeakPolarHBondContact O-CB 3.48Å; A186-Q190 PolarHBondContact O-N 3.49Å; E187-Q190 PolarHBondContact O-N 2.94Å; R188-Q190 VanDerWaalsContact C-N 3.34Å; Q190-G192 VanDerWaalsContact C-N 3.26Å; Q190-G192 PolarHBondContact O-N 3.45Å; Q190-R193 WeakPolarHBondContact O-CB 3.47Å; Q190-R193 PolarHBondContact O-N 2.94Å; Q190-R193 VanDerWaalsContact O-N 3.1Å; Q190-E194 WeakPolarHBondContact CG-OE1 3.35Å; Q190-E194 PolarHBondContact NE2-OE1 3.33Å; Q190-E194 WeakPolarHBondContact O-CG 3.46Å; Q190-E194 PolarHBondContact O-N 2.96Å
191A98.4Very high98.5Very high55 Ų5591 Ų9146%0.45549%0.488SS..Hα-helixtrans-58.3-39.2174.600000112.1E187 E194 S195E187-A191 WeakPolarHBondContact O-CB 3.45Å; E187-A191 PolarHBondContact O-N 3.26Å; A191-E194 PolarHBondContact O-N 2.92Å; A191-S195 PolarHBondContact O-N 3.49Å
192G98.6Very high98.5Very high32 Ų3295 Ų9533%0.3350%0.499SS..Hα-helixtrans-62-44.6174.100000112.9R188 V189 Q190 E194 S195 I196R188-G192 PolarHBondContact O-N 3.31Å; V189-G192 PolarHBondContact O-N 3.29Å; Q190-G192 VanDerWaalsContact C-N 3.26Å; Q190-G192 PolarHBondContact O-N 3.45Å; G192-E194 PolarHBondContact O-N 3.3Å; G192-S195 PolarHBondContact O-N 3.48Å; G192-I196 WeakPolarHBondContact O-CG1 3.39Å; G192-I196 PolarHBondContact O-N 3.49Å
193R98.6Very high98.5Very high166 Ų16695.4 Ų95.463%0.62650%0.5SS*.Hα-helixtrans-62.3-41.5176.7-72.5173.4-176.6-85.20112V189 Q190 I196 A197V189-R193 WeakPolarHBondContact O-CG 3.49Å; V189-R193 PolarHBondContact O-N 3.43Å; Q190-R193 WeakPolarHBondContact O-CB 3.47Å; Q190-R193 PolarHBondContact O-N 2.94Å; Q190-R193 VanDerWaalsContact O-N 3.1Å; R193-I196 PolarHBondContact O-N 3.36Å; R193-A197 WeakPolarHBondContact O-CB 3.28Å; R193-A197 PolarHBondContact O-N 2.94Å
194E98.6Very high98.4Very high96 Ų9695.9 Ų95.945%0.44950%0.5SS..Hα-helixtrans-63.7-43.1177.5-72.4167.2-165.500111.9Q190 A191 G192 I196 A197 Q198Q190-E194 WeakPolarHBondContact CG-OE1 3.35Å; Q190-E194 PolarHBondContact NE2-OE1 3.33Å; Q190-E194 WeakPolarHBondContact O-CG 3.46Å; Q190-E194 PolarHBondContact O-N 2.96Å; A191-E194 PolarHBondContact O-N 2.92Å; G192-E194 PolarHBondContact O-N 3.3Å; E194-I196 PolarHBondContact O-N 2.94Å; E194-A197 PolarHBondContact O-N 3.37Å; E194-Q198 VanDerWaalsContact O-CG 3.28Å; E194-Q198 WeakPolarHBondContact O-CG 3.36Å; E194-Q198 PolarHBondContact O-N 3.06Å
195S98.5Very high98.4Very high66 Ų6696.2 Ų96.246%0.46250%0.497SS..Hα-helixtrans-62-41.5175.5-177.80000112.6A191 G192 Q198 T199A191-S195 PolarHBondContact O-N 3.49Å; G192-S195 PolarHBondContact O-N 3.48Å; S195-Q198 PolarHBondContact O-N 3.04Å; S195-T199 WeakPolarHBondContact O-CB 3.41Å; S195-T199 PolarHBondContact O-N 3.44Å; S195-T199 PolarHBondContact O-OG1 3.34Å
196I98.6Very high98.3Very high97 Ų9796.5 Ų96.550%0.49751%0.505SS..Hα-helixtrans-62.6-50.4174.8-68.8167.3000110.1G192 R193 E194 Q198 T199 E200G192-I196 WeakPolarHBondContact O-CG1 3.39Å; G192-I196 PolarHBondContact O-N 3.49Å; R193-I196 PolarHBondContact O-N 3.36Å; E194-I196 PolarHBondContact O-N 2.94Å; I196-Q198 VanDerWaalsContact C-N 3.3Å; I196-Q198 PolarHBondContact O-N 3.44Å; I196-T199 WeakPolarHBondContact O-CB 3.43Å; I196-T199 PolarHBondContact O-N 2.97Å; I196-E200 HydrophobicContact CG2-CG 4.18Å; I196-E200 WeakPolarHBondContact O-CG 3.34Å; I196-E200 PolarHBondContact O-N 3.11Å
197A98.4Very high98.3Very high53 Ų5396.5 Ų96.544%0.43850%0.499SS..Hα-helixtrans-59.3-40.4-179.800000112.4R193 E194 H201R193-A197 WeakPolarHBondContact O-CB 3.28Å; R193-A197 PolarHBondContact O-N 2.94Å; E194-A197 PolarHBondContact O-N 3.37Å; A197-H201 WeakPolarHBondContact O-CB 3.49Å; A197-H201 PolarHBondContact O-N 3.05Å
198Q98.3Very high98.2Very high127 Ų12793.5 Ų93.559%0.59349%0.487SS*.Hα-helixtrans-63.3-41.9174.1-72.5173.32200111.9E194 S195 I196 H201 R202E194-Q198 VanDerWaalsContact O-CG 3.28Å; E194-Q198 WeakPolarHBondContact O-CG 3.36Å; E194-Q198 PolarHBondContact O-N 3.06Å; S195-Q198 PolarHBondContact O-N 3.04Å; I196-Q198 VanDerWaalsContact C-N 3.3Å; I196-Q198 PolarHBondContact O-N 3.44Å; Q198-H201 PolarHBondContact O-N 3.39Å; Q198-R202 WeakPolarHBondContact O-CG 3.45Å; Q198-R202 PolarHBondContact O-N 3.04Å
199T98.3Very high98.1Very high61 Ų6191 Ų9137%0.37448%0.483SS..Hα-helixtrans-67.1-44.6178.9-57.30000111.2S195 I196 H201 R202 I203S195-T199 WeakPolarHBondContact O-CB 3.41Å; S195-T199 PolarHBondContact O-N 3.44Å; S195-T199 PolarHBondContact O-OG1 3.34Å; I196-T199 WeakPolarHBondContact O-CB 3.43Å; I196-T199 PolarHBondContact O-N 2.97Å; T199-H201 VanDerWaalsContact C-N 3.32Å; T199-H201 PolarHBondContact O-N 2.94Å; T199-R202 PolarHBondContact O-N 3Å; T199-I203 HydrophobicContact CG2-CD1 4.01Å; T199-I203 WeakPolarHBondContact O-CG1 3.25Å; T199-I203 PolarHBondContact O-N 3.24Å
200E98.3Very high98Very high125 Ų12595.9 Ų95.958%0.58449%0.493SS*.Hα-helixtrans-58.1-44.3174.6-73.9178.2168.900111.4I196 I203 S204I196-E200 HydrophobicContact CG2-CG 4.18Å; I196-E200 WeakPolarHBondContact O-CG 3.34Å; I196-E200 PolarHBondContact O-N 3.11Å; E200-I203 PolarHBondContact O-N 3.29Å; E200-S204 PolarHBondContact O-N 3.17Å
201H98.3Very high97.8Very high130 Ų13096 Ų9660%0.60249%0.492SS*.Hα-helixtrans-60.2-48.8176.7-175.558.3000111.9A197 Q198 T199 I203 S204 T205A197-H201 WeakPolarHBondContact O-CB 3.49Å; A197-H201 PolarHBondContact O-N 3.05Å; Q198-H201 PolarHBondContact O-N 3.39Å; T199-H201 VanDerWaalsContact C-N 3.32Å; T199-H201 PolarHBondContact O-N 2.94Å; H201-I203 VanDerWaalsContact C-N 3.33Å; H201-I203 PolarHBondContact O-N 2.82Å; H201-S204 PolarHBondContact O-N 3.33Å; H201-S204 VanDerWaalsContact O-N 3.17Å; H201-T205 PolarHBondContact O-N 2.84Å; H201-T205 PolarHBondContact O-OG1 2.92Å; H201-T205 VanDerWaalsContact O-OG1 3.11Å
202R98.2Very high97.6Very high182 Ų18298.8 Ų98.869%0.68750%0.499SS*.Hα-helixtrans-58.7-43.4177.2-71.7173.365.6-155.7-0.3112.1Q198 T199 T205 S206Q198-R202 WeakPolarHBondContact O-CG 3.45Å; Q198-R202 PolarHBondContact O-N 3.04Å; T199-R202 PolarHBondContact O-N 3Å; R202-T205 PolarHBondContact O-N 2.88Å; R202-S206 PolarHBondContact O-N 2.96Å; R202-S206 PolarHBondContact O-OG 2.92Å; R202-S206 VanDerWaalsContact O-OG 3.1Å
203I98.1Very high97.4Very high101 Ų101101 Ų10152%0.51851%0.508SS..Hα-helixtrans-61.5-46.6176.8-69.2167.6000110.1T199 E200 H201 T205 S206 V207T199-I203 HydrophobicContact CG2-CD1 4.01Å; T199-I203 WeakPolarHBondContact O-CG1 3.25Å; T199-I203 PolarHBondContact O-N 3.24Å; E200-I203 PolarHBondContact O-N 3.29Å; H201-I203 VanDerWaalsContact C-N 3.33Å; H201-I203 PolarHBondContact O-N 2.82Å; I203-T205 PolarHBondContact O-N 3.33Å; I203-S206 PolarHBondContact O-N 3.1Å; I203-V207 HydrophobicContact CG2-CG2 4.28Å; I203-V207 WeakPolarHBondContact O-CB 3.32Å; I203-V207 VanDerWaalsContact O-CG2 3.25Å; I203-V207 WeakPolarHBondContact O-CG2 3.38Å; I203-V207 PolarHBondContact O-N 2.92Å
204S97.9Very high97.1Very high61 Ų6198 Ų9843%0.42750%0.501SS..Hα-helixtrans-59.9-46.2179.2-161.90000111.7E200 H201 V207 D208E200-S204 PolarHBondContact O-N 3.17Å; H201-S204 PolarHBondContact O-N 3.33Å; H201-S204 VanDerWaalsContact O-N 3.17Å; S204-V207 PolarHBondContact O-N 3.35Å; S204-D208 VanDerWaalsContact O-CG 3.31Å; S204-D208 PolarHBondContact O-N 3Å
205T97.6Very high96.9Very high53 Ų5398.6 Ų98.633%0.32551%0.507SS..Hα-helixtrans-59.7-48.9177.1-54.80000111.6H201 R202 I203 V207 D208 E209H201-T205 PolarHBondContact O-N 2.84Å; H201-T205 PolarHBondContact O-OG1 2.92Å; H201-T205 VanDerWaalsContact O-OG1 3.11Å; R202-T205 PolarHBondContact O-N 2.88Å; I203-T205 PolarHBondContact O-N 3.33Å; T205-V207 VanDerWaalsContact C-N 3.28Å; T205-V207 PolarHBondContact O-N 3.46Å; T205-D208 PolarHBondContact O-N 3.21Å; T205-D208 VanDerWaalsContact O-N 3.17Å; T205-E209 HydrophobicContact CG2-CG 4.47Å; T205-E209 WeakPolarHBondContact O-CG 3.32Å; T205-E209 PolarHBondContact O-N 3.45Å
206S97.4Very high96.5Very high71 Ų71101.3 Ų101.350%0.49751%0.512SS..Hα-helixtrans-60.7-37.7177.6-62.40000112.6R202 I203 W210R202-S206 PolarHBondContact O-N 2.96Å; R202-S206 PolarHBondContact O-OG 2.92Å; R202-S206 VanDerWaalsContact O-OG 3.1Å; I203-S206 PolarHBondContact O-N 3.1Å; S206-W210 WeakPolarHBondContact O-CB 3.42Å; S206-W210 PolarHBondContact O-N 3.01Å
207V97.6Very high96Very high61 Ų6199 Ų9937%0.3751%0.508SS..Hα-helixtrans-66.1-42.4176.5165.90000110.9I203 S204 T205 W210 K211I203-V207 HydrophobicContact CG2-CG2 4.28Å; I203-V207 WeakPolarHBondContact O-CB 3.32Å; I203-V207 VanDerWaalsContact O-CG2 3.25Å; I203-V207 WeakPolarHBondContact O-CG2 3.38Å; I203-V207 PolarHBondContact O-N 2.92Å; S204-V207 PolarHBondContact O-N 3.35Å; T205-V207 VanDerWaalsContact C-N 3.28Å; T205-V207 PolarHBondContact O-N 3.46Å; V207-W210 PolarHBondContact O-N 2.99Å; V207-K211 HydrophobicContact CG1-CD 4.36Å; V207-K211 WeakPolarHBondContact O-CG 3.47Å; V207-K211 PolarHBondContact O-N 3.45Å
208D96.7Very high95.7Very high80 Ų8099 Ų9943%0.42850%0.502SS..Hα-helixtrans-70.4-39.5179.6-67.6-26.4000111.9S204 T205 K211 L212S204-D208 VanDerWaalsContact O-CG 3.31Å; S204-D208 PolarHBondContact O-N 3Å; T205-D208 PolarHBondContact O-N 3.21Å; T205-D208 VanDerWaalsContact O-N 3.17Å; D208-K211 PolarHBondContact O-N 3.36Å; D208-K211 IonicContact OD1-NZ 3.14Å; D208-K211 PolarHBondContact OD1-NZ 3.41Å; D208-L212 WeakPolarHBondContact O-CB 3.35Å; D208-L212 PolarHBondContact O-N 2.93Å
209E96.3Very high95.2Very high118 Ų11896.5 Ų96.555%0.55150%0.495SS*.Hα-helixtrans-58.4-46.8170.4-74.1176.4-174.900111.5T205 K211 L212 C213T205-E209 HydrophobicContact CG2-CG 4.47Å; T205-E209 WeakPolarHBondContact O-CG 3.32Å; T205-E209 PolarHBondContact O-N 3.45Å; E209-K211 PolarHBondContact O-N 3.2Å; E209-L212 PolarHBondContact O-N 3.46Å; E209-C213 PolarHBondContact O-N 3.17Å; E209-C213 PolarHBondContact O-SG 3.44Å; E209-C213 VanDerWaalsContact O-SG 3.41Å
210W95.8Very high94.8Very high179 Ų17996 Ų9668%0.67850%0.495SS*.Hα-helixtrans-61.3-43.6178.2179.577.1000112.3S206 V207 L212 C213 H214S206-W210 WeakPolarHBondContact O-CB 3.42Å; S206-W210 PolarHBondContact O-N 3.01Å; V207-W210 PolarHBondContact O-N 2.99Å; W210-L212 VanDerWaalsContact C-N 3.32Å; W210-L212 PolarHBondContact O-N 2.98Å; W210-C213 PolarHBondContact O-N 2.9Å; W210-H214 WeakPolarHBondContact O-CB 3.41Å; W210-H214 PolarHBondContact O-N 2.91Å
211K95.6Very high94.3Very high103 Ų10395.9 Ų95.945%0.44849%0.494SS..Hα-helixtrans-60.4-41.9174.9-72.2170.1-170159.40111.8V207 D208 E209 H214 L215V207-K211 HydrophobicContact CG1-CD 4.36Å; V207-K211 WeakPolarHBondContact O-CG 3.47Å; V207-K211 PolarHBondContact O-N 3.45Å; D208-K211 PolarHBondContact O-N 3.36Å; D208-K211 IonicContact OD1-NZ 3.14Å; D208-K211 PolarHBondContact OD1-NZ 3.41Å; E209-K211 PolarHBondContact O-N 3.2Å; K211-H214 PolarHBondContact O-N 3.42Å; K211-L215 WeakPolarHBondContact O-CG 3.37Å; K211-L215 PolarHBondContact O-N 3.31Å
212L95.1Very high93.8Very high112 Ų11296.7 Ų96.759%0.58650%0.496SS*.Hα-helixtrans-67.5-45.4-179.2-165145.1000111.5D208 E209 W210 H214 L215 Q216D208-L212 WeakPolarHBondContact O-CB 3.35Å; D208-L212 PolarHBondContact O-N 2.93Å; E209-L212 PolarHBondContact O-N 3.46Å; W210-L212 VanDerWaalsContact C-N 3.32Å; W210-L212 PolarHBondContact O-N 2.98Å; L212-H214 VanDerWaalsContact C-N 3.3Å; L212-H214 PolarHBondContact O-N 2.92Å; L212-L215 PolarHBondContact O-N 3.36Å; L212-Q216 WeakPolarHBondContact O-CB 3.35Å; L212-Q216 PolarHBondContact O-N 2.92Å
213C92.4Very high93.2Very high79 Ų7993.6 Ų93.653%0.53449%0.489SS..Hα-helixtrans-58.4-41.6172.3-72.40000112E209 W210 Q216 A217E209-C213 PolarHBondContact O-N 3.17Å; E209-C213 PolarHBondContact O-SG 3.44Å; E209-C213 VanDerWaalsContact O-SG 3.41Å; W210-C213 PolarHBondContact O-N 2.9Å; C213-Q216 PolarHBondContact O-N 3.5Å; C213-A217 WeakPolarHBondContact O-CB 3.23Å; C213-A217 PolarHBondContact O-N 2.93Å
214H93.9Very high92.7Very high103 Ų10398.1 Ų98.148%0.47750%0.5SS..Hα-helixtrans-65.6-44.3177.4-178.366.4000112.4W210 K211 L212 Q216 A217 T218W210-H214 WeakPolarHBondContact O-CB 3.41Å; W210-H214 PolarHBondContact O-N 2.91Å; K211-H214 PolarHBondContact O-N 3.42Å; L212-H214 VanDerWaalsContact C-N 3.3Å; L212-H214 PolarHBondContact O-N 2.92Å; H214-Q216 VanDerWaalsContact C-N 3.35Å; H214-Q216 PolarHBondContact O-N 3.41Å; H214-A217 PolarHBondContact O-N 3.47Å; H214-T218 WeakPolarHBondContact O-CG2 3.46Å; H214-T218 PolarHBondContact O-N 2.86Å; H214-T218 PolarHBondContact O-OG1 2.94Å
215L93.8Very high92Very high109 Ų109100.4 Ų100.457%0.57151%0.507SS*.Hα-helixtrans-61.4-42.8174.6-75.9167.3000111.5K211 L212 T218 V219K211-L215 WeakPolarHBondContact O-CG 3.37Å; K211-L215 PolarHBondContact O-N 3.31Å; L212-L215 PolarHBondContact O-N 3.36Å; L215-T218 WeakPolarHBondContact CA-OG1 3.35Å; L215-T218 PolarHBondContact O-N 2.92Å; L215-T218 PolarHBondContact O-OG1 3.34Å; L215-V219 WeakPolarHBondContact O-CB 3.39Å; L215-V219 VanDerWaalsContact O-CG2 3.23Å; L215-V219 WeakPolarHBondContact O-CG2 3.47Å; L215-V219 PolarHBondContact O-N 3.43Å
216Q90.6Very high91.3Very high122 Ų12299.9 Ų99.957%0.5751%0.508SS*.Hα-helixtrans-64.9-40.8176.9-173.31750.700112.2L212 C213 H214 S220L212-Q216 WeakPolarHBondContact O-CB 3.35Å; L212-Q216 PolarHBondContact O-N 2.92Å; C213-Q216 PolarHBondContact O-N 3.5Å; H214-Q216 VanDerWaalsContact C-N 3.35Å; H214-Q216 PolarHBondContact O-N 3.41Å; Q216-S220 WeakPolarHBondContact O-CB 3.46Å; Q216-S220 PolarHBondContact O-N 2.71Å; Q216-S220 PolarHBondContact O-OG 2.91Å
217A88Confident90.4Very high49 Ų49100.7 Ų100.741%0.40551%0.513SS..Hα-helixtrans-63.4-46.7176.200000111.6C213 H214 S220 E221C213-A217 WeakPolarHBondContact O-CB 3.23Å; C213-A217 PolarHBondContact O-N 2.93Å; H214-A217 PolarHBondContact O-N 3.47Å; A217-S220 PolarHBondContact O-N 3.03Å; A217-E221 WeakPolarHBondContact O-CG 3.42Å; A217-E221 PolarHBondContact O-N 2.93Å
218T90.8Very high89.5Confident53 Ų53102.2 Ų102.233%0.32553%0.527SS..Hα-helixtrans-65.1-40178.250.30000112.6H214 L215 E221 F222H214-T218 WeakPolarHBondContact O-CG2 3.46Å; H214-T218 PolarHBondContact O-N 2.86Å; H214-T218 PolarHBondContact O-OG1 2.94Å; L215-T218 WeakPolarHBondContact CA-OG1 3.35Å; L215-T218 PolarHBondContact O-N 2.92Å; L215-T218 PolarHBondContact O-OG1 3.34Å; T218-E221 PolarHBondContact O-N 3.19Å; T218-F222 WeakPolarHBondContact O-CB 3.5Å; T218-F222 PolarHBondContact O-N 3.42Å
219V89.3Confident88.5Confident74 Ų74105 Ų10545%0.44854%0.541SS..Hα-helixtrans-62.2-44.7171.9170.30000110.9L215 E221 F222 E223L215-V219 WeakPolarHBondContact O-CB 3.39Å; L215-V219 VanDerWaalsContact O-CG2 3.23Å; L215-V219 WeakPolarHBondContact O-CG2 3.47Å; L215-V219 PolarHBondContact O-N 3.43Å; V219-E221 VanDerWaalsContact C-N 3.33Å; V219-E221 PolarHBondContact O-N 2.94Å; V219-F222 WeakPolarHBondContact O-CB 3.37Å; V219-F222 PolarHBondContact O-N 3.4Å; V219-E223 HydrophobicContact CG1-CG 4.42Å; V219-E223 WeakPolarHBondContact O-CG 3.4Å; V219-E223 PolarHBondContact O-N 2.88Å
220S88.6Confident86.7Confident51 Ų51103.9 Ų103.936%0.35755%0.545SS..Hα-helixtrans-63.4-38.1178.2-57.50000112.3Q216 A217 R224Q216-S220 WeakPolarHBondContact O-CB 3.46Å; Q216-S220 PolarHBondContact O-N 2.71Å; Q216-S220 PolarHBondContact O-OG 2.91Å; A217-S220 PolarHBondContact O-N 3.03Å; S220-R224 WeakPolarHBondContact O-CB 3.37Å; S220-R224 WeakPolarHBondContact O-CG 3.33Å; S220-R224 PolarHBondContact O-N 3.24Å
221E89Confident84.8Confident123 Ų123100.4 Ų100.458%0.57555%0.545SS*.Hα-helixtrans-65.8-42.9173.4-75.5-17617300111.7A217 T218 V219 R224 L225A217-E221 WeakPolarHBondContact O-CG 3.42Å; A217-E221 PolarHBondContact O-N 2.93Å; T218-E221 PolarHBondContact O-N 3.19Å; V219-E221 VanDerWaalsContact C-N 3.33Å; V219-E221 PolarHBondContact O-N 2.94Å; E221-R224 WeakPolarHBondContact O-CB 3.3Å; E221-R224 PolarHBondContact O-N 3.21Å; E221-L225 WeakPolarHBondContact O-CG 3.42Å; E221-L225 PolarHBondContact O-N 2.75Å
222F88.3Confident83Confident146 Ų146100.4 Ų100.464%0.6457%0.565SS**Hα-helixtrans-62.3-45.1175.5-175.4-94.7000112.1T218 V219 R224 L225 A226T218-F222 WeakPolarHBondContact O-CB 3.5Å; T218-F222 PolarHBondContact O-N 3.42Å; V219-F222 WeakPolarHBondContact O-CB 3.37Å; V219-F222 PolarHBondContact O-N 3.4Å; F222-R224 VanDerWaalsContact C-N 3.33Å; F222-R224 PolarHBondContact O-N 3.48Å; F222-L225 PolarHBondContact O-N 2.83Å; F222-A226 WeakPolarHBondContact O-CB 3.5Å; F222-A226 PolarHBondContact O-N 2.97Å
223E85.5Confident81.1Confident117 Ų117102.2 Ų102.255%0.54757%0.57SS.*Hα-helixtrans-61.5-39.6175.9-74.9178.1173.300112.3V219 A226 S227V219-E223 HydrophobicContact CG1-CG 4.42Å; V219-E223 WeakPolarHBondContact O-CG 3.4Å; V219-E223 PolarHBondContact O-N 2.88Å; E223-A226 PolarHBondContact O-N 2.9Å; E223-S227 VanDerWaalsContact O-CB 3.3Å; E223-S227 WeakPolarHBondContact O-CB 3.36Å; E223-S227 PolarHBondContact O-N 3.44Å; E223-S227 PolarHBondContact O-OG 3.07Å
224R86.1Confident79.2Confident197 Ų197103.8 Ų103.874%0.74358%0.577SS**Hα-helixtrans-62.1-44.1173.1-82.6177.7167.3179.7-2.3112.2S220 E221 F222 S227 S228S220-R224 WeakPolarHBondContact O-CB 3.37Å; S220-R224 WeakPolarHBondContact O-CG 3.33Å; S220-R224 PolarHBondContact O-N 3.24Å; E221-R224 WeakPolarHBondContact O-CB 3.3Å; E221-R224 PolarHBondContact O-N 3.21Å; F222-R224 VanDerWaalsContact C-N 3.33Å; F222-R224 PolarHBondContact O-N 3.48Å; R224-S227 PolarHBondContact O-N 3.25Å; R224-S228 PolarHBondContact O-N 3.44Å; R224-S228 VanDerWaalsContact O-N 3.13Å
225L84.8Confident77.2Confident109 Ų109107.9 Ų107.957%0.57159%0.593SS**Hα-helixtrans-66.7-43.3177.5-71.9170.9000111.7E221 F222 S227 S228 L229E221-L225 WeakPolarHBondContact O-CG 3.42Å; E221-L225 PolarHBondContact O-N 2.75Å; F222-L225 PolarHBondContact O-N 2.83Å; L225-S227 VanDerWaalsContact C-N 3.31Å; L225-S227 PolarHBondContact O-N 3.46Å; L225-S228 PolarHBondContact O-N 2.91Å; L225-S228 PolarHBondContact O-OG 3.13Å; L225-S228 VanDerWaalsContact O-OG 3.07Å; L225-L229 WeakPolarHBondContact O-CD1 3.41Å; L225-L229 WeakPolarHBondContact O-CG 3.47Å; L225-L229 PolarHBondContact O-N 3.34Å
226A81.3Confident75Confident41 Ų41109.6 Ų109.634%0.33960%0.603SS.*Hα-helixtrans-62.3-39.7175.900000111.8F222 E223 S228 L229 C230F222-A226 WeakPolarHBondContact O-CB 3.5Å; F222-A226 PolarHBondContact O-N 2.97Å; E223-A226 PolarHBondContact O-N 2.9Å; A226-S228 VanDerWaalsContact C-N 3.31Å; A226-S228 PolarHBondContact O-N 3.29Å; A226-L229 PolarHBondContact O-N 3.25Å; A226-C230 PolarHBondContact O-N 3.23Å
227S80.1Confident72.7Confident88 Ų88116.7 Ų116.762%0.61564%0.636SS**Hα-helixtrans-68.3-27.4177.1-58.70000113.2E223 R224 L225E223-S227 VanDerWaalsContact O-CB 3.3Å; E223-S227 WeakPolarHBondContact O-CB 3.36Å; E223-S227 PolarHBondContact O-N 3.44Å; E223-S227 PolarHBondContact O-OG 3.07Å; R224-S227 PolarHBondContact O-N 3.25Å; L225-S227 VanDerWaalsContact C-N 3.31Å; L225-S227 PolarHBondContact O-N 3.46Å
228S78.1Confident71.9Confident93 Ų93120.1 Ų120.165%0.6565%0.648SS**Hα-helixtrans-79.7-20.617584.30000113.3R224 L225 A226R224-S228 PolarHBondContact O-N 3.44Å; R224-S228 VanDerWaalsContact O-N 3.13Å; L225-S228 PolarHBondContact O-N 2.91Å; L225-S228 PolarHBondContact O-OG 3.13Å; L225-S228 VanDerWaalsContact O-OG 3.07Å; A226-S228 VanDerWaalsContact C-N 3.31Å; A226-S228 PolarHBondContact O-N 3.29Å
229L74.9Confident70.9Confident140 Ų140123.6 Ų123.673%0.73367%0.665SS**Hα-helixtrans-89.4-13.2178.7-71.4162.9000113.6L225 A226 P231L225-L229 WeakPolarHBondContact O-CD1 3.41Å; L225-L229 WeakPolarHBondContact O-CG 3.47Å; L225-L229 PolarHBondContact O-N 3.34Å; A226-L229 PolarHBondContact O-N 3.25Å; L229-P231 WeakPolarHBondContact O-CD 3.41Å
230C59.3Low69.9Low94 Ų94126.3 Ų126.364%0.63568%0.677SS**SBendtrans-93.7108.1171.1-760000109.9A226 A232A226-C230 PolarHBondContact O-N 3.23Å; C230-A232 PolarHBondContact O-N 3.26Å
231P56.5Low68.8Low105 Ų105130.8 Ų130.868%0.68270%0.696SS**  trans-70.9119.9174.9-6.622.8000109L229 H233L229-P231 WeakPolarHBondContact O-CD 3.41Å; P231-H233 PolarHBondContact O-N 3.44Å
232A56.8Low67.6Low103 Ų103131.3 Ų131.385%0.85170%0.703SS**SBendtrans-73.958.416000000109.8C230C230-A232 PolarHBondContact O-N 3.26Å
233H54.5Low66.2Low150 Ų150130.3 Ų130.369%0.69471%0.707SS**  trans179.693.2162.6-108.2-9.1000110.6P231P231-H233 PolarHBondContact O-N 3.44Å
234V52.6Low64.8Low112 Ų112131.2 Ų131.268%0.67972%0.719SS**SBendtrans-139.5132.6141.4-177.10000104.9
235F51.9Low63.2Low189 Ų189126.2 Ų126.283%0.82972%0.717SS**  trans89.973.2-170.4-51.4-69.8000115.5
236D48.3Very low61.4Low145 Ų145127.6 Ų127.678%0.77573%0.729SS**  -135.7122.4128.6-100.6-28.1000107.9
237E42.4Very low59.6Low271 Ų271135.5 Ų135.5100%1.26677%0.765SS**  trans47.40173.9-65.6-170.8148.700121.6

Retrieved 237 of 237 residues in 640.3 ms (Link to these results)