A0A096NWE3_PAPAN Loading...

Vestigial like family member 3

May act as a specific coactivator for the mammalian TEFs.

AlphaFold DB , UniProt , Accession A0A096NWE3, Species PAPAN (Papio anubis, Olive baboon), Gene VGLL3, Length 327 aa.

Structure Viewer
Loading PAE data...
(Predicted Aligned Error values between residue pairs)
Error loading PAE data: please refresh the page.

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
1M46.5Very low52Low236 Ų236145.4 Ų145.4100%1.16377%0.771SS**  0119.10-63.9176.473.300106.5
2S50.3Low52.3Low83 Ų83141.8 Ų141.858%0.5876%0.763SS**  trans-93.9145.1-169.7179.10000111A4 E5S2-A4 PolarHBondContact O-N 3.24Å; S2-E5 PolarHBondContact O-N 3.09Å; S2-E5 VanDerWaalsContact O-N 3.1Å
3C51.7Low51.2Low116 Ų116149.3 Ų149.378%0.78478%0.776SS**G310 helixtrans-57.4-17.5-175.4-55.30000114.6E5C3-E5 VanDerWaalsContact C-N 3.31Å; C3-E5 PolarHBondContact O-N 3.46Å
4A53.7Low50.1Low72 Ų72143.4 Ų143.460%0.59577%0.77SS**G310 helixtrans-70.8-23.6177.700000113.6S2S2-A4 PolarHBondContact O-N 3.24Å
5E50.4Low49.2Very low155 Ų155141.2 Ų141.272%0.72478%0.779SS**G310 helixtrans-84.5-15.2-170.1-150.9162.8157.400113.4S2 C3S2-E5 PolarHBondContact O-N 3.09Å; S2-E5 VanDerWaalsContact O-N 3.1Å; C3-E5 VanDerWaalsContact C-N 3.31Å; C3-E5 PolarHBondContact O-N 3.46Å
6V61.1Low48.3Very low130 Ų130138.2 Ų138.279%0.78877%0.771SS**SBendtrans-86.8-23.6178.5173.90000112.5
7M63.3Low47.6Very low156 Ų156138.8 Ų138.877%0.76877%0.767SS**SBendtrans-89.2-8.7-172.5-75.2-68.7-7000114.5
8Y45.8Very low46.9Very low204 Ų204142.9 Ų142.980%0.877%0.771SS**  trans-121.596-178.8-87.3-87.9000111.3
9H52.8Low46.2Very low173 Ų173143.6 Ų143.680%0.80177%0.773SS**  trans-108.9103.4167.6-143.8-60000108.6
10P54.4Low46Very low111 Ų111142.1 Ų142.172%0.72177%0.771SS**PPolyproline II helixtrans-81120.7171.31.815.5000109.1
11Q41.4Very low45.4Very low163 Ų163142.3 Ų142.376%0.76277%0.772SS**PPolyproline II helixtrans-76136.1166.1-93.9-76.4-21.500110
12P56.4Low45.7Very low103 Ų103136.3 Ų136.367%0.66975%0.751SS**PPolyproline II helixtrans-100.2126.3-176.935.8-27.6000112.3
13Y37.8Very low44.9Very low239 Ų239140.8 Ų140.894%0.93776%0.764SS**  trans-154.5121.9157.9-100.3-91.3000104.1
14G36.2Very low44Very low67 Ų67139.4 Ų139.469%0.69176%0.761SS**  cis147.8108.312.100000105.6
15A35.6Very low43.1Very low110 Ų110140 Ų14091%0.90977%0.767SS**  trans58.9148.416200000119
16S35.9Very low42.3Very low93 Ų93138.7 Ų138.765%0.6577%0.769SS**  cis-176.7164.7-12.8-172.80000106.6
17Q36.2Very low40.9Very low149 Ų149139 Ų13970%0.69677%0.771SS**  trans98.7104.8153.6-49.3-69.9-47.200120
18Y33.7Very low39.3Very low212 Ų212136.9 Ų136.983%0.83177%0.771SS**  trans58.5119.9130.8-78.9-94.9000122.3
19L33.8Very low39.5Very low157 Ų157132.6 Ų132.682%0.82277%0.768SS**  trans-45.8167.4150.1-112.398000112.6
20P43.4Very low38.6Very low112 Ų112129.5 Ų129.573%0.72776%0.761SS**  cis-139.5164.32436-14.4000116.7
21N33.8Very low37.5Very low147 Ų147128.5 Ų128.579%0.78676%0.762SS**  trans-73.9151.3159.1-132.8-10.3000108.3
22P52.6Low37.2Very low111 Ų111130 Ų13072%0.72176%0.763SS**  -156.4-178.757.338.9-15.6000117.6
23M32.6Very low36.1Very low176 Ų176136 Ų13687%0.86777%0.773SS**  trans91.9120.1147.3-95-170.5168.500122.3
24A33.3Very low35.9Very low87 Ų87132.4 Ų132.472%0.71977%0.765SS**  trans71.2108.9130.200000121.4
25A34.1Very low36.2Very low86 Ų86135.1 Ų135.171%0.71177%0.771SS**  69.3125.5119.100000121.7
26T34.3Very low36.2Very low126 Ų126133.4 Ų133.477%0.77376%0.757SS**  trans80.7125.3145.3-38.10000116.8
27T31Very low36.5Very low136 Ų136135 Ų13583%0.83477%0.765SS**  174.2125.7114.9-48.20000110.2
28C30.8Very low36.4Very low112 Ų112135.7 Ų135.776%0.75777%0.768SS**  trans-75.3-175.9171.7-43.20000111.3
29P48.9Very low36.9Very low114 Ų114131.8 Ų131.874%0.7477%0.769SS**  -154.9159.65838.2-13.8000119.7
30T35Very low36.9Very low108 Ų108127 Ų12766%0.66376%0.757SS**  56.4126.2127.8-54.30000121Y32T30-Y32 HydrophobicContact CG2-CD2 3.33Å; T30-Y32 HydrophobicContact CG2-CE2 3.29Å; T30-Y32 HydrophobicContact CG2-CG 4.5Å
31A31.5Very low36.5Very low90 Ų90129.6 Ų129.674%0.74476%0.759SS**  -156.8118.778.600000114
32Y34.7Very low36.8Very low196 Ų196129.1 Ų129.177%0.76975%0.752SS**  66.7101.8105.8-77.3-74.5000117.8T30T30-Y32 HydrophobicContact CG2-CD2 3.33Å; T30-Y32 HydrophobicContact CG2-CE2 3.29Å; T30-Y32 HydrophobicContact CG2-CG 4.5Å
33Y33.2Very low36.1Very low227 Ų227132.4 Ų132.489%0.8976%0.755SS**  179.6133.599.6-113.5-90.5000111.1
34Q33.3Very low36.7Very low164 Ų164132.7 Ų132.777%0.76675%0.751SS**  trans-108.9163.6168.5-137176.6-62.800107.9
35P43.1Very low37.5Very low124 Ų124135 Ų13581%0.80575%0.751SS**  -144164.968.129-5.5000115.9
36A35.4Very low37.7Very low75 Ų75135.9 Ų135.962%0.6276%0.758SS**  trans-81.1169.6172.600000111.7
37P40.9Very low38.1Very low126 Ų126135.6 Ų135.682%0.81876%0.756SS**  -146.5156.372.235.8-15000117.4
38Q36Very low38.6Very low164 Ų164137.2 Ų137.277%0.76675%0.752SS**  trans-62.6165.2158-84.3-90.9-7.500111.3
39P43.7Very low39Very low130 Ų130137.5 Ų137.584%0.84476%0.755SS**  cis-151.4164.949.339.2-16.7000120.1
40G32.5Very low38.5Very low55 Ų55139.5 Ų139.557%0.56775%0.752SS**  trans133.792.4150.500000114.6
41Q35.3Very low38.9Very low167 Ų167142.9 Ų142.978%0.7876%0.763SS**  53.5115.191.3-64.7-80.4-32.900111.1
42Q39.8Very low39.5Very low137 Ų137145.4 Ų145.464%0.6476%0.759SS**  cis-172.7179.226.6-62.1-161.7-33.300111.3
43K38Very low39.5Very low180 Ų180142.9 Ų142.978%0.78376%0.759SS**  trans77133.3149.7-17.8-176.6-168.2-178.60116.5
44K46Very low40Very low182 Ų182137 Ų13779%0.79175%0.751SS**  cis-174.3133.8-1.3-178.9175.1178.1-179.80108.1
45L49.3Very low40.5Very low137 Ų137136.9 Ų136.972%0.71776%0.755SS**  trans60.2113155.5-86.282.4000122.1V47L45-V47 HydrophobicContact CD2-CG2 3.87Å
46A39.5Very low40.3Very low103 Ų103140.3 Ų140.385%0.85176%0.76SS**  trans-94.4143143.900000109.6
47V42.6Very low40.5Very low121 Ų121143 Ų14373%0.73377%0.768SS**  trans-149.7131.7174.3176.10000103.8L45L45-V47 HydrophobicContact CD2-CG2 3.87Å
48F40.2Very low40Very low169 Ų169143.4 Ų143.474%0.74177%0.769SS**  cis-165.4129-7-171.2-99.6000102.4M51F48-M51 HydrophobicContact CZ-CE 4.38Å
49S40.5Very low40.2Very low118 Ų118143 Ų14383%0.82577%0.771SS**  trans-123.9131.3174.1-173.90000108
50K37.4Very low40.1Very low157 Ų157142.6 Ų142.668%0.68377%0.769SS**  trans85106.8163.6-154.9172.4-178.1175.70116.3
51M44Very low40.1Very low179 Ų179144.9 Ų144.988%0.88278%0.776SS**  -131.9120.9128.9-68.3-151.5-16500108.6F48F48-M51 HydrophobicContact CZ-CE 4.38Å
52Q43.9Very low40.5Very low142 Ų142146.2 Ų146.266%0.66478%0.779SS**  trans-126.5150.9171.1-177.3-1807.700103.7
53D35.7Very low40.5Very low143 Ų143148.8 Ų148.877%0.76579%0.791SS**  trans79.9136.5176.3-61.4-61000114.9
54S42.2Very low40.8Very low105 Ų105148.7 Ų148.773%0.73479%0.793SS**  cis-164.5156.56.7-177.20000110
55L45.4Very low40.9Very low160 Ų160149 Ų14984%0.83880%0.798SS**  trans-29.8132.2153.4-167.493.8000116.4
56E37.1Very low40.6Very low196 Ų196151.4 Ų151.492%0.91681%0.805SS**  trans-166.8141.7134-131.6176.1136.600113.1
57V41.6Very low40.8Very low131 Ų131152.4 Ų152.479%0.79480%0.796SS**  trans-74147.3-174.9138.60000113.1
58T30Very low40.9Very low135 Ų135154.6 Ų154.683%0.82880%0.798SS**  trans176.4116.5137.2-69.70000111.7
59L38.8Very low41.1Very low157 Ų157155.5 Ų155.582%0.82281%0.805SS**  trans-67.4162.2167.6-70.7172.2000111.2
60P43.2Very low41.3Very low121 Ų121157.7 Ų157.779%0.78680%0.802SS**  cis-155.1172.243.540.9-18000120
61S32.1Very low41.6Very low103 Ų103157.6 Ų157.672%0.7280%0.804SS**  trans110.4115133.3-142.60000119.2
62K43.1Very low41.4Very low194 Ų194157.7 Ų157.784%0.84380%0.803SS**  trans73.282.9152.5-76.3-175.7167.2-169.90117.7
63Q39.8Very low41.5Very low191 Ų191159 Ų15989%0.89381%0.809SS**  trans-161.863130.7-153.3167.2-25.600109.1
64E45.1Very low41.9Very low178 Ų178159.8 Ų159.883%0.83281%0.808SS**  trans-117.4113.2171.5-68.8166.3-167.500103.8
65E47.6Very low41.9Very low190 Ų190163.2 Ų163.289%0.88881%0.812SS**SBendtrans171.20.9157.9-95-163.3-16400112
66E43Very low42.1Very low187 Ų187163.1 Ų163.187%0.87481%0.807SS**SBendtrans-114.5-4.2173.8-151.5171.5-167.300114
67D43.3Very low42.3Very low124 Ų124162.7 Ų162.766%0.66380%0.803SS**SBendtrans-105.85.7-175.1-108.7-17.5000114.1
68E45.9Very low42.7Very low166 Ų166163.5 Ų163.578%0.77680%0.802SS**SBendtrans-90-8.1-178.3-72.2-170174.300114.2
69E43.1Very low43.7Very low189 Ų189163.1 Ų163.188%0.88379%0.791SS**SBendtrans-97.3-10.6179.7-69.2-168.5-177.900114.3
70E45.8Very low44.5Very low163 Ų163160.4 Ų160.476%0.76278%0.783SS**SBendtrans-101-9.7178.3-70.8-166.8176.500114.3
71E43Very low45.9Very low155 Ų155156.6 Ų156.672%0.72476%0.761SS**THydrogen-bonded Turntrans-82.3-17.7179.8-77.3-165.1164.100114.5E73E71-E73 VanDerWaalsContact C-N 3.31Å; E71-E73 PolarHBondContact O-N 3.01Å
72E40.6Very low48.4Very low182 Ų182157 Ų15785%0.8575%0.752SS**THydrogen-bonded Turntrans-76.8-13.8179-70.6-162.4170.400113.8
73E44.2Very low50.6Low169 Ų169153.6 Ų153.679%0.7974%0.741SS**THydrogen-bonded Turntrans-95.7-12.9-178.1-133.9-175.6-168.400113.7E71E71-E73 VanDerWaalsContact C-N 3.31Å; E71-E73 PolarHBondContact O-N 3.01Å
74E44.8Very low53.1Low159 Ų159149.1 Ų149.174%0.74372%0.72SS**THydrogen-bonded Turntrans-92.1-18.5-177.2-147177.5-168.200113.5E76E74-E76 VanDerWaalsContact C-N 3.31Å; E74-E76 PolarHBondContact O-N 3.15Å
75E43.5Very low55.5Low178 Ų178147.8 Ų147.883%0.83271%0.708SS**G310 helixtrans-75.6-13.1-179.9-158.5177.4178.800113.6K77E75-K77 VanDerWaalsContact C-N 3.31Å; E75-K77 PolarHBondContact O-N 3.06Å
76E48.1Very low57.8Low157 Ų157143.6 Ų143.673%0.73469%0.691SS**G310 helixtrans-79.5-11.2178.3-154.5-171.115500113.3E74E74-E76 VanDerWaalsContact C-N 3.31Å; E74-E76 PolarHBondContact O-N 3.15Å
77K41.3Very low60.3Low188 Ų188139.3 Ų139.382%0.81767%0.674SS**G310 helixtrans-92.7-1.5-172.1-62.7-154.981.3178.60115.5E75E75-K77 VanDerWaalsContact C-N 3.31Å; E75-K77 PolarHBondContact O-N 3.06Å
78D50.7Low62.7Low147 Ų147137.4 Ų137.479%0.78667%0.671SS**  trans-102.136.2175.9-140.5-9.2000111.3P80D78-P80 WeakPolarHBondContact O-CD 3.45Å
79Q51.3Low65.1Low127 Ų127140.7 Ų140.759%0.59368%0.676SS**  trans-56.7104.6172.8-91.4-91.2-3.600108.8
80P55.4Low67.6Low101 Ų101134.4 Ų134.466%0.65665%0.652SS**  trans-68.8144.1175.631.3-29.7000107.5D78 E82D78-P80 WeakPolarHBondContact O-CD 3.45Å; P80-E82 PolarHBondContact O-N 3.42Å; P80-E82 VanDerWaalsContact O-N 3.13Å
81A73Confident70Confident40 Ų40129.5 Ų129.533%0.33163%0.633SS.*  trans-28.1117.3179.400000112.6M83 T94 Y95A81-M83 PolarHBondContact O-N 2.96Å; A81-M83 VanDerWaalsContact O-N 3.15Å; A81-T94 CarbonylContact C-O 3.39Å; A81-T94 VanDerWaalsContact CA-O 3.25Å; A81-T94 WeakPolarHBondContact CA-O 3.48Å; A81-T94 WeakPolarHBondContact CB-O 3.45Å; A81-Y95 HydrophobicContact CB-CD1 3.59Å; A81-Y95 HydrophobicContact CB-CE1 3.81Å; A81-Y95 HydrophobicContact CB-CG 4.3Å
82E84.3Confident72.5Confident111 Ų111125.8 Ų125.852%0.51962%0.618SS.*EExtended strand (participates in β ladder)trans-54.9122.7-173.6174.4-172.5-171.700109P80 F93 T94P80-E82 PolarHBondContact O-N 3.42Å; P80-E82 VanDerWaalsContact O-N 3.13Å; E82-F93 CarbonylContact O-C 3.56Å; E82-F93 WeakPolarHBondContact O-CA 3.39Å; E82-T94 PolarHBondContact N-O 3.22Å; E82-T94 PolarHBondContact O-N 3Å
83M90Very high75Confident124 Ų124121.7 Ų121.761%0.61160%0.598SS**EExtended strand (participates in β ladder)trans-111.3115.9-178.3-178.8-179.860.500109.7A81 V91 L92 F93A81-M83 PolarHBondContact O-N 2.96Å; A81-M83 VanDerWaalsContact O-N 3.15Å; M83-V91 HydrophobicContact CG-CG1 3.45Å; M83-V91 VanDerWaalsContact CG-CG1 3.45Å; M83-V91 HydrophobicContact SD-CG1 3.78Å; M83-L92 CarbonylContact C-O 3.54Å; M83-L92 VanDerWaalsContact CA-O 3.29Å; M83-L92 WeakPolarHBondContact CA-O 3.39Å; M83-F93 HydrophobicContact CB-CD1 4.02Å; M83-F93 HydrophobicContact CB-CE1 4.03Å; M83-F93 HydrophobicContact CG-CD1 3.92Å; M83-F93 HydrophobicContact CG-CE1 3.57Å; M83-F93 HydrophobicContact CG-CZ 4.04Å; M83-F93 HydrophobicContact SD-CD1 4.29Å; M83-F93 HydrophobicContact SD-CE1 3.35Å; M83-F93 WeakPolarHBondContact SD-CE1 3.31Å; M83-F93 HydrophobicContact SD-CZ 3.62Å
84E91.7Very high77.4Confident96 Ų96114.8 Ų114.845%0.44957%0.567SS.*EExtended strand (participates in β ladder)trans-113.4133.5178.2-169.7-173.5171.300110.7L86 V91 L92E84-L86 HydrophobicContact CG-CD2 4.24Å; E84-V91 CarbonylContact O-C 3.56Å; E84-V91 WeakPolarHBondContact O-CA 3.47Å; E84-L92 HydrophobicContact CB-CB 4.35Å; E84-L92 PolarHBondContact N-O 3.24Å; E84-L92 PolarHBondContact O-N 2.84Å
85Y95Very high79.7Confident150 Ų150116 Ų11659%0.58857%0.566SS**EExtended strand (participates in β ladder)trans-98.3112.2177.7-164.8-93000111.2N87 S88 V91Y85-N87 WeakPolarHBondContact CE1-O 3.17Å; Y85-N87 VanDerWaalsContact CZ-C 3.47Å; Y85-N87 PolarHBondContact OH-O 3.2Å; Y85-S88 WeakPolarHBondContact OH-CA 3.46Å; Y85-S88 PolarHBondContact OH-N 3.48Å; Y85-V91 HydrophobicContact CD2-CG2 3.54Å; Y85-V91 HydrophobicContact CE2-CG2 3.67Å
86L95.8Very high82Confident103 Ų103111.2 Ų111.254%0.53954%0.542SS..EExtended strand (participates in β ladder)trans-90.3-40.7-178.6-59.1-179.5000112.5E84 C90E84-L86 HydrophobicContact CG-CD2 4.24Å; L86-C90 HydrophobicContact CB-CB 4.22Å; L86-C90 PolarHBondContact N-O 2.75Å
87N95.3Very high83.9Confident97 Ų97110.8 Ų110.852%0.51954%0.541SS..EExtended strand (participates in β ladder)trans-160.5168.5178.9-171.7-5.7000110.5Y85 R89 C90Y85-N87 WeakPolarHBondContact CE1-O 3.17Å; Y85-N87 VanDerWaalsContact CZ-C 3.47Å; Y85-N87 PolarHBondContact OH-O 3.2Å; N87-R89 PolarHBondContact O-N 3Å; N87-C90 PolarHBondContact N-O 3.02Å; N87-C90 PolarHBondContact O-N 2.95Å; N87-C90 VanDerWaalsContact O-O 3.06Å
88S94Very high86.2Confident83 Ų83104.4 Ų104.458%0.5853%0.528SS*.THydrogen-bonded Turntrans-33.9-29.3167.858.70000116.2Y85Y85-S88 WeakPolarHBondContact OH-CA 3.46Å; Y85-S88 PolarHBondContact OH-N 3.48Å
89R95.9Very high88.2Confident236 Ų236102.5 Ų102.589%0.89152%0.518SS*.THydrogen-bonded Turntrans-120.54.5-175.7-61.2-178.8178.7171.6-0.7114.3N87N87-R89 PolarHBondContact O-N 3Å
90C95.5Very high90.3Very high57 Ų57101.3 Ų101.339%0.38552%0.515SS..EExtended strand (participates in β ladder)trans-141.4120.1-173.4-1690000111.5L86 N87L86-C90 HydrophobicContact CB-CB 4.22Å; L86-C90 PolarHBondContact N-O 2.75Å; N87-C90 PolarHBondContact N-O 3.02Å; N87-C90 PolarHBondContact O-N 2.95Å; N87-C90 VanDerWaalsContact O-O 3.06Å
91V95.9Very high92.2Very high60 Ų6097.2 Ų97.236%0.36449%0.49SS..EExtended strand (participates in β ladder)trans-125.6131.2172.6-169.70000106.7M83 E84 Y85 F93M83-V91 HydrophobicContact CG-CG1 3.45Å; M83-V91 VanDerWaalsContact CG-CG1 3.45Å; M83-V91 HydrophobicContact SD-CG1 3.78Å; E84-V91 CarbonylContact O-C 3.56Å; E84-V91 WeakPolarHBondContact O-CA 3.47Å; Y85-V91 HydrophobicContact CD2-CG2 3.54Å; Y85-V91 HydrophobicContact CE2-CG2 3.67Å; V91-F93 HydrophobicContact CB-CE2 4.09Å; V91-F93 HydrophobicContact CG1-CD2 4.42Å; V91-F93 HydrophobicContact CG1-CE2 3.78Å; V91-F93 HydrophobicContact CG1-CZ 3.86Å
92L95.5Very high93.2Very high76 Ų7698.3 Ų98.340%0.39850%0.496SS..EExtended strand (participates in β ladder)trans-101.6131.5177.217861.2000108.7M83 E84M83-L92 CarbonylContact C-O 3.54Å; M83-L92 VanDerWaalsContact CA-O 3.29Å; M83-L92 WeakPolarHBondContact CA-O 3.39Å; E84-L92 HydrophobicContact CB-CB 4.35Å; E84-L92 PolarHBondContact N-O 3.24Å; E84-L92 PolarHBondContact O-N 2.84Å
93F94.2Very high93.7Very high97 Ų9795.1 Ų95.143%0.42548%0.484SS..EExtended strand (participates in β ladder)trans-116.1119.4172.3-63.8-89.8000108.4E82 M83 V91 Y95E82-F93 CarbonylContact O-C 3.56Å; E82-F93 WeakPolarHBondContact O-CA 3.39Å; M83-F93 HydrophobicContact CB-CD1 4.02Å; M83-F93 HydrophobicContact CB-CE1 4.03Å; M83-F93 HydrophobicContact CG-CD1 3.92Å; M83-F93 HydrophobicContact CG-CE1 3.57Å; M83-F93 HydrophobicContact CG-CZ 4.04Å; M83-F93 HydrophobicContact SD-CD1 4.29Å; M83-F93 HydrophobicContact SD-CE1 3.35Å; M83-F93 WeakPolarHBondContact SD-CE1 3.31Å; M83-F93 HydrophobicContact SD-CZ 3.62Å; V91-F93 HydrophobicContact CB-CE2 4.09Å; V91-F93 HydrophobicContact CG1-CD2 4.42Å; V91-F93 HydrophobicContact CG1-CE2 3.78Å; V91-F93 HydrophobicContact CG1-CZ 3.86Å; F93-Y95 HydrophobicContact CB-CE2 3.74Å
94T94.1Very high94Very high23 Ų2392.4 Ų92.414%0.14147%0.474CS..EExtended strand (participates in β ladder)trans-103.1113.9178.2-58.50000108.8A81 E82 F96A81-T94 CarbonylContact C-O 3.39Å; A81-T94 VanDerWaalsContact CA-O 3.25Å; A81-T94 WeakPolarHBondContact CA-O 3.48Å; A81-T94 WeakPolarHBondContact CB-O 3.45Å; E82-T94 PolarHBondContact N-O 3.22Å; E82-T94 PolarHBondContact O-N 3Å; T94-F96 HydrophobicContact CG2-CD1 3.81Å; T94-F96 HydrophobicContact CG2-CD2 4.15Å; T94-F96 HydrophobicContact CG2-CE1 3.57Å; T94-F96 HydrophobicContact CG2-CE2 3.93Å; T94-F96 HydrophobicContact CG2-CG 4.09Å; T94-F96 HydrophobicContact CG2-CZ 3.62Å
95Y93.3Very high94.1Very high185 Ų18592.7 Ų92.773%0.72548%0.479SS*.  trans-96.5-2.7-176-64.4-81.4000113.8A81 F93A81-Y95 HydrophobicContact CB-CD1 3.59Å; A81-Y95 HydrophobicContact CB-CE1 3.81Å; A81-Y95 HydrophobicContact CB-CG 4.3Å; F93-Y95 HydrophobicContact CB-CE2 3.74Å
96F90.9Very high94.1Very high77 Ų7790 Ų9034%0.33847%0.472SS..  trans-106.1147.6176.764.4-96.8000109.2T94 I100 V103T94-F96 HydrophobicContact CG2-CD1 3.81Å; T94-F96 HydrophobicContact CG2-CD2 4.15Å; T94-F96 HydrophobicContact CG2-CE1 3.57Å; T94-F96 HydrophobicContact CG2-CE2 3.93Å; T94-F96 HydrophobicContact CG2-CG 4.09Å; T94-F96 HydrophobicContact CG2-CZ 3.62Å; F96-I100 HydrophobicContact CE2-CB 4.46Å; F96-I100 HydrophobicContact CE2-CG1 3.88Å; F96-I100 HydrophobicContact CZ-CB 4.45Å; F96-I100 HydrophobicContact CZ-CG1 3.83Å; F96-I100 HydrophobicContact CZ-CG2 4.43Å; F96-V103 HydrophobicContact CB-CG1 4.1Å; F96-V103 HydrophobicContact CB-CG2 4.06Å; F96-V103 HydrophobicContact CD1-CG1 4.43Å; F96-V103 HydrophobicContact CD2-CB 4.32Å; F96-V103 HydrophobicContact CD2-CG1 4.43Å; F96-V103 HydrophobicContact CD2-CG2 3.72Å; F96-V103 HydrophobicContact CE2-CG2 4.49Å; F96-V103 HydrophobicContact CG-CB 4.46Å; F96-V103 HydrophobicContact CG-CG1 4.08Å; F96-V103 HydrophobicContact CG-CG2 4.06Å
97Q89.8Confident94Very high149 Ų14991.1 Ų91.170%0.69647%0.474SS*.  trans-104.3142.2174.5-163.86335.500109.4
98G88.1Confident94Very high54 Ų5492 Ų9256%0.55747%0.473SS*.SBendtrans98.9-164.2175.500000114.5
99D94Very high94Very high107 Ų10789.4 Ų89.457%0.57246%0.455SS*.  trans-71.6132.1-175.7177.151.6000112.4G101 S102 V103D99-G101 PolarHBondContact O-N 3.07Å; D99-G101 WeakPolarHBondContact OD2-CA 3.46Å; D99-G101 PolarHBondContact OD2-N 3.48Å; D99-G101 VanDerWaalsContact OD2-N 3.13Å; D99-S102 PolarHBondContact O-N 3.1Å; D99-S102 VanDerWaalsContact O-N 3.14Å; D99-S102 PolarHBondContact O-OG 2.87Å; D99-S102 PolarHBondContact OD2-N 2.75Å; D99-V103 PolarHBondContact O-N 3.07Å
100I94.6Very high93.8Very high102 Ų10285.6 Ų85.652%0.52344%0.44SS..Hα-helixtrans-56.2-41.2179.1-52.5179.2000110.5F96 S102 V103 V104F96-I100 HydrophobicContact CE2-CB 4.46Å; F96-I100 HydrophobicContact CE2-CG1 3.88Å; F96-I100 HydrophobicContact CZ-CB 4.45Å; F96-I100 HydrophobicContact CZ-CG1 3.83Å; F96-I100 HydrophobicContact CZ-CG2 4.43Å; I100-S102 VanDerWaalsContact C-N 3.32Å; I100-S102 PolarHBondContact O-N 3.07Å; I100-V103 PolarHBondContact O-N 3.35Å; I100-V104 HydrophobicContact CG2-CG2 4.07Å; I100-V104 WeakPolarHBondContact O-CB 3.33Å; I100-V104 WeakPolarHBondContact O-CG2 3.43Å; I100-V104 PolarHBondContact O-N 3.02Å
101G96.2Very high93.7Very high14 Ų1486.5 Ų86.514%0.14445%0.451CS..Hα-helixtrans-58.2-44.1-179.700000112.3D99 D105D99-G101 PolarHBondContact O-N 3.07Å; D99-G101 WeakPolarHBondContact OD2-CA 3.46Å; D99-G101 PolarHBondContact OD2-N 3.48Å; D99-G101 VanDerWaalsContact OD2-N 3.13Å; G101-D105 VanDerWaalsContact O-CB 3.3Å; G101-D105 WeakPolarHBondContact O-CB 3.02Å; G101-D105 PolarHBondContact O-N 3.41Å
102S94.1Very high93.5Very high64 Ų6489.2 Ų89.245%0.44846%0.463SS..Hα-helixtrans-67.2-42.4178.669.60000113.8D99 I100 V104 D105 E106D99-S102 PolarHBondContact O-N 3.1Å; D99-S102 VanDerWaalsContact O-N 3.14Å; D99-S102 PolarHBondContact O-OG 2.87Å; D99-S102 PolarHBondContact OD2-N 2.75Å; I100-S102 VanDerWaalsContact C-N 3.32Å; I100-S102 PolarHBondContact O-N 3.07Å; S102-V104 VanDerWaalsContact C-N 3.32Å; S102-D105 PolarHBondContact O-N 2.65Å; S102-E106 WeakPolarHBondContact O-CB 3.21Å; S102-E106 PolarHBondContact O-N 2.92Å
103V94.9Very high92.8Very high43 Ų4386.4 Ų86.426%0.26145%0.453SS..Hα-helixtrans-65.6-40.7177.8173.80000110.5F96 D99 I100 H107F96-V103 HydrophobicContact CB-CG1 4.1Å; F96-V103 HydrophobicContact CB-CG2 4.06Å; F96-V103 HydrophobicContact CD1-CG1 4.43Å; F96-V103 HydrophobicContact CD2-CB 4.32Å; F96-V103 HydrophobicContact CD2-CG1 4.43Å; F96-V103 HydrophobicContact CD2-CG2 3.72Å; F96-V103 HydrophobicContact CE2-CG2 4.49Å; F96-V103 HydrophobicContact CG-CB 4.46Å; F96-V103 HydrophobicContact CG-CG1 4.08Å; F96-V103 HydrophobicContact CG-CG2 4.06Å; D99-V103 PolarHBondContact O-N 3.07Å; I100-V103 PolarHBondContact O-N 3.35Å; V103-H107 PolarHBondContact O-N 2.78Å
104V95.6Very high91.3Very high67 Ų6787.3 Ų87.341%0.40646%0.459SS..Hα-helixtrans-63.9-50.7174.4171.40000110.1I100 S102 E106 H107 F108I100-V104 HydrophobicContact CG2-CG2 4.07Å; I100-V104 WeakPolarHBondContact O-CB 3.33Å; I100-V104 WeakPolarHBondContact O-CG2 3.43Å; I100-V104 PolarHBondContact O-N 3.02Å; S102-V104 VanDerWaalsContact C-N 3.32Å; V104-E106 VanDerWaalsContact C-N 3.3Å; V104-E106 PolarHBondContact O-N 3.14Å; V104-H107 WeakPolarHBondContact O-CA 3.44Å; V104-H107 WeakPolarHBondContact O-CB 3.37Å; V104-H107 PolarHBondContact O-N 3.03Å; V104-F108 HydrophobicContact CG1-CD2 3.59Å; V104-F108 HydrophobicContact CG1-CE2 3.52Å; V104-F108 VanDerWaalsContact O-CD2 3.25Å; V104-F108 WeakPolarHBondContact O-CD2 3.35Å; V104-F108 PolarHBondContact O-N 3.34Å
105D94.2Very high89.5Confident103 Ų10390 Ų9055%0.55148%0.483SS*.Hα-helixtrans-60.7-38.2-179.7-171.650.2000112.4G101 S102 F108 S109G101-D105 VanDerWaalsContact O-CB 3.3Å; G101-D105 WeakPolarHBondContact O-CB 3.02Å; G101-D105 PolarHBondContact O-N 3.41Å; S102-D105 PolarHBondContact O-N 2.65Å; D105-F108 PolarHBondContact O-N 2.99Å; D105-S109 VanDerWaalsContact O-CB 3.26Å; D105-S109 WeakPolarHBondContact O-CB 3.41Å; D105-S109 PolarHBondContact O-N 3.08Å; D105-S109 PolarHBondContact O-OG 3.3Å
106E94.3Very high87.8Confident94 Ų9485.5 Ų85.544%0.43947%0.471SS..Hα-helixtrans-61.5-44.9172.3-179.5175.1-155.800111.7S102 V104 F108 S109 R110S102-E106 WeakPolarHBondContact O-CB 3.21Å; S102-E106 PolarHBondContact O-N 2.92Å; V104-E106 VanDerWaalsContact C-N 3.3Å; V104-E106 PolarHBondContact O-N 3.14Å; E106-F108 PolarHBondContact O-N 3.5Å; E106-S109 PolarHBondContact O-N 3.22Å; E106-R110 VanDerWaalsContact CD-NH2 3.32Å; E106-R110 HydrophobicContact CG-CG 4.4Å; E106-R110 WeakPolarHBondContact O-CB 3.29Å; E106-R110 VanDerWaalsContact O-CG 3.24Å; E106-R110 WeakPolarHBondContact O-CG 3.34Å; E106-R110 PolarHBondContact O-N 2.7Å; E106-R110 IonicContact OE1-CZ 3.15Å; E106-R110 IonicContact OE1-NE 2.59Å; E106-R110 PolarHBondContact OE1-NE 3Å; E106-R110 VanDerWaalsContact OE1-NE 3.15Å; E106-R110 IonicContact OE1-NH2 3.89Å; E106-R110 PolarHBondContact OE1-NH2 3.24Å; E106-R110 IonicContact OE2-NH2 3.15Å
107H94.8Very high85.9Confident126 Ų12687.5 Ų87.558%0.58349%0.489SS*.Hα-helixtrans-58.3-46.9175.1176.389.7000111.5V103 V104 R110 A111V103-H107 PolarHBondContact O-N 2.78Å; V104-H107 WeakPolarHBondContact O-CA 3.44Å; V104-H107 WeakPolarHBondContact O-CB 3.37Å; V104-H107 PolarHBondContact O-N 3.03Å; H107-R110 PolarHBondContact O-N 2.86Å; H107-A111 WeakPolarHBondContact O-CB 2.99Å; H107-A111 PolarHBondContact O-N 3.25Å
108F94.8Very high84Confident116 Ų11687.6 Ų87.651%0.50949%0.494SS..Hα-helixtrans-64.2-43.5177.5-84.5-84.5000112V104 D105 E106 R110 A111 L112V104-F108 HydrophobicContact CG1-CD2 3.59Å; V104-F108 HydrophobicContact CG1-CE2 3.52Å; V104-F108 VanDerWaalsContact O-CD2 3.25Å; V104-F108 WeakPolarHBondContact O-CD2 3.35Å; V104-F108 PolarHBondContact O-N 3.34Å; D105-F108 PolarHBondContact O-N 2.99Å; E106-F108 PolarHBondContact O-N 3.5Å; F108-R110 VanDerWaalsContact C-N 3.32Å; F108-R110 PolarHBondContact O-N 2.78Å; F108-A111 PolarHBondContact O-N 2.97Å; F108-L112 WeakPolarHBondContact O-CB 3.25Å; F108-L112 VanDerWaalsContact O-CG 3.28Å; F108-L112 WeakPolarHBondContact O-CG 3.24Å; F108-L112 PolarHBondContact O-N 2.82Å
109S93.3Very high81.8Confident27 Ų2790.7 Ų90.719%0.18949%0.493CS..Hα-helixtrans-60.7-40.7176.9-69.20000112.2D105 E106 G113 Q114D105-S109 VanDerWaalsContact O-CB 3.26Å; D105-S109 WeakPolarHBondContact O-CB 3.41Å; D105-S109 PolarHBondContact O-N 3.08Å; D105-S109 PolarHBondContact O-OG 3.3Å; E106-S109 PolarHBondContact O-N 3.22Å; S109-G113 PolarHBondContact O-N 3.01Å; S109-Q114 PolarHBondContact O-N 2.92Å
110R91.1Very high79.5Confident157 Ų15791.8 Ų91.859%0.59251%0.507SS*.Hα-helixtrans-67.6-44.4174.3-71.3170.6179.7-1651111.7E106 H107 F108 L112 G113E106-R110 VanDerWaalsContact CD-NH2 3.32Å; E106-R110 HydrophobicContact CG-CG 4.4Å; E106-R110 WeakPolarHBondContact O-CB 3.29Å; E106-R110 VanDerWaalsContact O-CG 3.24Å; E106-R110 WeakPolarHBondContact O-CG 3.34Å; E106-R110 PolarHBondContact O-N 2.7Å; E106-R110 IonicContact OE1-CZ 3.15Å; E106-R110 IonicContact OE1-NE 2.59Å; E106-R110 PolarHBondContact OE1-NE 3Å; E106-R110 VanDerWaalsContact OE1-NE 3.15Å; E106-R110 IonicContact OE1-NH2 3.89Å; E106-R110 PolarHBondContact OE1-NH2 3.24Å; E106-R110 IonicContact OE2-NH2 3.15Å; H107-R110 PolarHBondContact O-N 2.86Å; F108-R110 VanDerWaalsContact C-N 3.32Å; F108-R110 PolarHBondContact O-N 2.78Å; R110-L112 VanDerWaalsContact C-N 3.35Å; R110-L112 PolarHBondContact O-N 3.04Å; R110-G113 PolarHBondContact O-N 3.25Å
111A94.3Very high76.9Confident75 Ų7592.7 Ų92.762%0.6251%0.508SS*.Hα-helixtrans-65.4-37179.400000112.7H107 F108 G113H107-A111 WeakPolarHBondContact O-CB 2.99Å; H107-A111 PolarHBondContact O-N 3.25Å; F108-A111 PolarHBondContact O-N 2.97Å; A111-G113 VanDerWaalsContact C-N 3.34Å
112L91.6Very high74.7Confident117 Ų11797.1 Ų97.161%0.61354%0.537SS*.THydrogen-bonded Turntrans-84.8-7.5177-63.7175.9000113.1F108 R110 Q114F108-L112 WeakPolarHBondContact O-CB 3.25Å; F108-L112 VanDerWaalsContact O-CG 3.28Å; F108-L112 WeakPolarHBondContact O-CG 3.24Å; F108-L112 PolarHBondContact O-N 2.82Å; R110-L112 VanDerWaalsContact C-N 3.35Å; R110-L112 PolarHBondContact O-N 3.04Å; L112-Q114 HydrophobicContact CB-CG 3.95Å; L112-Q114 PolarHBondContact O-N 3.41Å
113G81.3Confident72.1Confident18 Ų1897.9 Ų97.919%0.18655%0.548CS..THydrogen-bonded Turntrans67.119.4-179.900000114.5S109 R110 A111 A115 I116S109-G113 PolarHBondContact O-N 3.01Å; R110-G113 PolarHBondContact O-N 3.25Å; A111-G113 VanDerWaalsContact C-N 3.34Å; G113-A115 PolarHBondContact O-N 3.38Å; G113-I116 WeakPolarHBondContact O-CB 3.41Å; G113-I116 PolarHBondContact O-N 2.84Å
114Q62.6Low70.1Confident116 Ų116103 Ų10354%0.54257%0.572SS.*Hα-helixtrans-66.4-24-176.4-66.1-172.3-3.500112.8S109 L112 I116S109-Q114 PolarHBondContact O-N 2.92Å; L112-Q114 HydrophobicContact CB-CG 3.95Å; L112-Q114 PolarHBondContact O-N 3.41Å; Q114-I116 PolarHBondContact O-N 2.94Å
115A56.6Low67.7Low78 Ų78104.6 Ų104.665%0.64559%0.586SS**Hα-helixtrans-75.8-6172.600000114G113G113-A115 PolarHBondContact O-N 3.38Å
116I55.9Low65.5Low92 Ų92109.6 Ų109.647%0.47260%0.603SS.*Hα-helixtrans-99.3-21.5-175-51175000111.7G113 Q114 W135G113-I116 WeakPolarHBondContact O-CB 3.41Å; G113-I116 PolarHBondContact O-N 2.84Å; Q114-I116 PolarHBondContact O-N 2.94Å; I116-W135 HydrophobicContact CD1-CH2 3.73Å; I116-W135 HydrophobicContact CD1-CZ3 4.36Å; I116-W135 HydrophobicContact CG1-CH2 4.22Å
117T51.6Low62.9Low119 Ų119110.4 Ų110.473%0.7362%0.619SS**Hα-helixtrans-93.1-13.3-176.445.30000114.5H119T117-H119 PolarHBondContact O-N 3.47Å
118L50Low60.8Low150 Ų150114.3 Ų114.379%0.78563%0.634SS**SBendtrans-9474.8168-60.9179.3000110
119H41.8Very low58.4Low119 Ų119116.3 Ų116.355%0.55165%0.647SS**  trans57.399138.5-156.7-108.7000118T117 E121T117-H119 PolarHBondContact O-N 3.47Å; H119-E121 VanDerWaalsContact CE1-C 3.5Å; H119-E121 WeakPolarHBondContact CE1-CB 3.28Å; H119-E121 WeakPolarHBondContact CE1-CG 3.25Å; H119-E121 PolarHBondContact CE1-O 3.46Å; H119-E121 VanDerWaalsContact ND1-C 3.35Å; H119-E121 WeakPolarHBondContact ND1-CA 3.48Å; H119-E121 WeakPolarHBondContact ND1-CB 3.33Å; H119-E121 PolarHBondContact ND1-N 2.89Å; H119-E121 PolarHBondContact ND1-O 3.27Å; H119-E121 VanDerWaalsContact ND1-O 3.13Å; H119-E121 WeakPolarHBondContact NE2-CB 3.33Å; H119-E121 PolarHBondContact O-N 2.93Å; H119-E121 VanDerWaalsContact O-N 3.15Å
120P45.1Very low56.2Low131 Ų131118.7 Ų118.785%0.85168%0.675SS**SBendtrans-76.618.7161.635.1-35.2000112.9S122P120-S122 VanDerWaalsContact C-N 3.3Å; P120-S122 PolarHBondContact O-N 3.25Å
121E41.9Very low54.1Low120 Ų120118.4 Ų118.456%0.56169%0.685SS**  trans-100.752.9-177174.677.7-130.600109.6H119H119-E121 VanDerWaalsContact CE1-C 3.5Å; H119-E121 WeakPolarHBondContact CE1-CB 3.28Å; H119-E121 WeakPolarHBondContact CE1-CG 3.25Å; H119-E121 PolarHBondContact CE1-O 3.46Å; H119-E121 VanDerWaalsContact ND1-C 3.35Å; H119-E121 WeakPolarHBondContact ND1-CA 3.48Å; H119-E121 WeakPolarHBondContact ND1-CB 3.33Å; H119-E121 PolarHBondContact ND1-N 2.89Å; H119-E121 PolarHBondContact ND1-O 3.27Å; H119-E121 VanDerWaalsContact ND1-O 3.13Å; H119-E121 WeakPolarHBondContact NE2-CB 3.33Å; H119-E121 PolarHBondContact O-N 2.93Å; H119-E121 VanDerWaalsContact O-N 3.15Å
122S48.3Very low52.1Low108 Ų108120.1 Ų120.176%0.75569%0.688SS**SBendtrans-151.440.8164.843.60000111.1P120P120-S122 VanDerWaalsContact C-N 3.3Å; P120-S122 PolarHBondContact O-N 3.25Å
123A41Very low50Low80 Ų80118.4 Ų118.466%0.66168%0.683SS**  trans-16063.7158.400000111.3S125A123-S125 PolarHBondContact O-N 3.35Å
124I51.2Low48.4Very low150 Ų150123.8 Ų123.877%0.76971%0.708SS**  trans-74.271.5148.9-57.4172.5000106.3
125S45.4Very low47.7Very low100 Ų100125 Ų12570%0.69971%0.707SS**  trans-113.9121.7157.9-168.50000106.6A123 S127A123-S125 PolarHBondContact O-N 3.35Å; S125-S127 PolarHBondContact O-N 2.91Å
126K48.8Very low47.4Very low209 Ų209130.2 Ų130.291%0.90971%0.71SS**  trans-58.194.5-173.8-64.6167.1178158.40110.1
127S40Very low47.1Very low110 Ų110132.2 Ų132.277%0.76972%0.722SS**  trans-119.9112.1158.972.40000109.4S125 M129S125-S127 PolarHBondContact O-N 2.91Å; S127-M129 PolarHBondContact O-N 3.15Å; S127-M129 VanDerWaalsContact O-N 3.13Å
128K49.4Very low46.9Very low208 Ų208131.1 Ų131.190%0.90472%0.719SS**  trans-74.590.1172.5166.9154.4170.1163.30107.9
129M44.8Very low47Very low159 Ų159128.4 Ų128.478%0.78371%0.713SS**  trans-168.6108.2144.8-156.966.4151.800107.1S127 L131S127-M129 PolarHBondContact O-N 3.15Å; S127-M129 VanDerWaalsContact O-N 3.13Å; M129-L131 PolarHBondContact O-N 2.79Å
130G47.8Very low47.5Very low76 Ų76125.2 Ų125.278%0.78471%0.707SS**  trans-65.3100.3176.700000110.1
131L47.5Very low48.1Very low152 Ų152125.1 Ų125.180%0.79670%0.698SS**  trans-121.876.7156.5-65.7177.1000106.2M129M129-L131 PolarHBondContact O-N 2.79Å
132T51.4Low48.8Very low111 Ų111122.4 Ų122.468%0.68169%0.693SS**  trans-51.7128.6154.445.30000106.7L134T132-L134 PolarHBondContact O-N 2.85Å
133P47.3Very low49Very low80 Ų80121.6 Ų121.652%0.51969%0.687SS.*  trans-67.1110.5-175.333.2-38.6000107W135 R136P133-W135 VanDerWaalsContact C-CD1 3.48Å; P133-W135 VanDerWaalsContact CB-CD1 3.41Å; P133-W135 VanDerWaalsContact CB-NE1 3.31Å; P133-W135 PolarHBondContact O-N 2.78Å; P133-R136 PolarHBondContact O-N 3.08Å
134L48.1Very low49.7Very low132 Ų132124.2 Ų124.269%0.69169%0.686SS**G310 helixtrans-61.6-1.7-168-178.861.7000114.3T132 R136T132-L134 PolarHBondContact O-N 2.85Å; L134-R136 PolarHBondContact O-N 3.02Å
135W48.8Very low50.1Low141 Ų141124.1 Ų124.153%0.53468%0.676SS.*G310 helixtrans-69.9-19.1177.263.2-76.4000113I116 P133 D137I116-W135 HydrophobicContact CD1-CH2 3.73Å; I116-W135 HydrophobicContact CD1-CZ3 4.36Å; I116-W135 HydrophobicContact CG1-CH2 4.22Å; P133-W135 VanDerWaalsContact C-CD1 3.48Å; P133-W135 VanDerWaalsContact CB-CD1 3.41Å; P133-W135 VanDerWaalsContact CB-NE1 3.31Å; P133-W135 PolarHBondContact O-N 2.78Å; W135-D137 PolarHBondContact O-N 2.96Å
136R50.1Low50.8Low187 Ų187126.9 Ų126.971%0.70668%0.683SS**G310 helixtrans-67.6-18.8-179.5-107.3-150.6-75.9-170.3-4.8114.8P133 L134P133-R136 PolarHBondContact O-N 3.08Å; L134-R136 PolarHBondContact O-N 3.02Å
137D48.3Very low51.8Low135 Ų135120.9 Ų120.972%0.72267%0.667SS**G310 helixtrans-101.7-1.4-174.7-61.1-33.4000113.8W135W135-D137 PolarHBondContact O-N 2.96Å
138S48.3Very low53.7Low96 Ų96119 Ų11967%0.67165%0.645SS**THydrogen-bonded Turntrans-115.6-2.2-173.1-64.20000115.7A140S138-A140 PolarHBondContact O-N 3.15Å
139S52.1Low55.2Low93 Ų93112.7 Ų112.765%0.6563%0.625SS**  trans-82.362.8168.8-56.30000110.3L141S139-L141 PolarHBondContact O-N 2.59Å
140A51.7Low56.6Low52 Ų52110.3 Ų110.343%0.4362%0.62SS.*  trans-57.998.8151.400000105.1S138 S142S138-A140 PolarHBondContact O-N 3.15Å; A140-S142 PolarHBondContact O-N 3.13Å
141L57.4Low58.1Low128 Ų128108.7 Ų108.767%0.6760%0.596SS**  trans-36.5133.6174.2-64158.2000107.1S139 S143 Q144S139-L141 PolarHBondContact O-N 2.59Å; L141-S143 CarbonylContact O-C 3.59Å; L141-S143 PolarHBondContact O-N 3.23Å; L141-Q144 WeakPolarHBondContact O-CB 3.19Å; L141-Q144 PolarHBondContact O-N 3.04Å
142S57.4Low59.8Low64 Ų64106.6 Ų106.645%0.44858%0.581SS.*G310 helixtrans-51.8-23.3-178.954.50000113A140 W153A140-S142 PolarHBondContact O-N 3.13Å; S142-W153 WeakPolarHBondContact OG-CH2 3.3Å
143S53Low61.3Low91 Ų91108.2 Ų108.264%0.63658%0.575SS**G310 helixtrans-64.5-28168.8-85.20000116.1L141L141-S143 CarbonylContact O-C 3.59Å; L141-S143 PolarHBondContact O-N 3.23Å
144Q55.6Low63Low134 Ų134107.3 Ų107.363%0.62657%0.568SS**G310 helixtrans-84.9-11.6-179-157.6-179.212.800112.8L141 N146L141-Q144 WeakPolarHBondContact O-CB 3.19Å; L141-Q144 PolarHBondContact O-N 3.04Å; Q144-N146 PolarHBondContact O-N 3.26Å; Q144-N146 VanDerWaalsContact O-N 3.08Å
145R59.8Low64.3Low148 Ų148107.3 Ų107.356%0.55858%0.579SS**  trans-78.591.5167.2-71.1-173.767.9-172.21.8108.1S147 F148R145-S147 PolarHBondContact O-N 2.9Å; R145-F148 HydrophobicContact CB-CD2 3.97Å; R145-F148 HydrophobicContact CB-CE2 3.73Å
146N59.8Low65.7Low159 Ų159105.1 Ų105.185%0.8559%0.585SS**THydrogen-bonded Turntrans-59.415.8174.1-66.5-37.1000114.8Q144Q144-N146 PolarHBondContact O-N 3.26Å; Q144-N146 VanDerWaalsContact O-N 3.08Å
147S70.2Confident66.8Low82 Ų82102.6 Ų102.657%0.57358%0.577SS**THydrogen-bonded Turntrans-107.47.2-177.375.50000114R145R145-S147 PolarHBondContact O-N 2.9Å
148F78.1Confident68.2Low71 Ų71104.3 Ų104.331%0.31158%0.58SS.*SBendtrans-100131.9176.1-67.2-71.7000110.7R145 F152R145-F148 HydrophobicContact CB-CD2 3.97Å; R145-F148 HydrophobicContact CB-CE2 3.73Å; F148-F152 HydrophobicContact CB-CB 4.19Å; F148-F152 HydrophobicContact CB-CD1 4.47Å; F148-F152 HydrophobicContact CB-CG 4.29Å; F148-F152 HydrophobicContact CD1-CD2 4.13Å; F148-F152 HydrophobicContact CD1-CE2 4.35Å; F148-F152 HydrophobicContact CD1-CG 4.26Å; F148-F152 HydrophobicContact CE1-CE2 4.48Å; F148-F152 HydrophobicContact CG-CG 4.46Å
149P81.6Confident69.3Low76 Ų76103.8 Ų103.849%0.49457%0.574SS.*  trans-63.9151.8174.229.6-34.8000109.7S151 F152P149-S151 WeakPolarHBondContact CB-OG 3.32Å; P149-S151 WeakPolarHBondContact CG-OG 3.39Å; P149-S151 PolarHBondContact O-N 3.49Å; P149-F152 WeakPolarHBondContact O-CB 3.42Å; P149-F152 PolarHBondContact O-N 3.42Å
150T75Confident70.3Confident108 Ų108103.6 Ų103.666%0.66357%0.571SS**G310 helixtrans-54.7-29.6176.8-49.90000112.5F152 W153 T154T150-F152 PolarHBondContact O-N 3.39Å; T150-F152 VanDerWaalsContact O-N 3.14Å; T150-W153 PolarHBondContact O-N 2.91Å; T150-T154 HydrophobicContact CG2-CG2 4.05Å; T150-T154 PolarHBondContact O-N 3.02Å; T150-T154 PolarHBondContact O-OG1 3.05Å
151S79.2Confident71.1Confident42 Ų42106.7 Ų106.729%0.29459%0.587SS.*G310 helixtrans-61.2-15.4173.856.90000114.9P149 W153 T154P149-S151 WeakPolarHBondContact CB-OG 3.32Å; P149-S151 WeakPolarHBondContact CG-OG 3.39Å; P149-S151 PolarHBondContact O-N 3.49Å; S151-W153 VanDerWaalsContact C-N 3.29Å; S151-T154 CarbonylContact C-O 3.58Å; S151-T154 WeakPolarHBondContact CA-OG1 3.26Å
152F82.6Confident71.8Confident109 Ų109104.5 Ų104.548%0.47859%0.587SS.*G310 helixtrans-69.6-29.6172.4-172.7-95000112F148 P149 T150F148-F152 HydrophobicContact CB-CB 4.19Å; F148-F152 HydrophobicContact CB-CD1 4.47Å; F148-F152 HydrophobicContact CB-CG 4.29Å; F148-F152 HydrophobicContact CD1-CD2 4.13Å; F148-F152 HydrophobicContact CD1-CE2 4.35Å; F148-F152 HydrophobicContact CD1-CG 4.26Å; F148-F152 HydrophobicContact CE1-CE2 4.48Å; F148-F152 HydrophobicContact CG-CG 4.46Å; P149-F152 WeakPolarHBondContact O-CB 3.42Å; P149-F152 PolarHBondContact O-N 3.42Å; T150-F152 PolarHBondContact O-N 3.39Å; T150-F152 VanDerWaalsContact O-N 3.14Å
153W83.6Confident72.3Confident144 Ų144107 Ų10755%0.54560%0.602SS.*THydrogen-bonded Turntrans-103.9-29.4-177.7-59.2110000113.1S142 T150 S151S142-W153 WeakPolarHBondContact OG-CH2 3.3Å; T150-W153 PolarHBondContact O-N 2.91Å; S151-W153 VanDerWaalsContact C-N 3.29Å
154T82.3Confident72.4Confident62 Ų62108.4 Ų108.438%0.3861%0.61SS.*SBendtrans-86.7123.2171.465.60000107.4T150 S151 S156T150-T154 HydrophobicContact CG2-CG2 4.05Å; T150-T154 PolarHBondContact O-N 3.02Å; T150-T154 PolarHBondContact O-OG1 3.05Å; S151-T154 CarbonylContact C-O 3.58Å; S151-T154 WeakPolarHBondContact CA-OG1 3.26Å; T154-S156 PolarHBondContact O-N 3.06Å
155S75.9Confident72.3Confident131 Ų131110.2 Ų110.292%0.91662%0.623SS**SBendtrans-5915.9-179.4-168.50000115.7Y157S155-Y157 PolarHBondContact O-N 3.48Å
156S77.3Confident71.7Confident95 Ų95106.3 Ų106.366%0.66463%0.63SS**  trans-84.823.4171.4-480000112.7T154 Q158T154-S156 PolarHBondContact O-N 3.06Å; S156-Q158 PolarHBondContact O-N 3.35Å
157Y74.7Confident71.5Confident135 Ų135102.3 Ų102.353%0.52963%0.625SS.*  trans-64.7106.6174.7-173.9-100.7000109.2S155 P159 P160S155-Y157 PolarHBondContact O-N 3.48Å; Y157-P159 HydrophobicContact CD1-CB 4.38Å; Y157-P159 VanDerWaalsContact CE1-CA 3.49Å; Y157-P159 HydrophobicContact CE1-CB 3.9Å; Y157-P159 VanDerWaalsContact O-CD 3.31Å; Y157-P159 WeakPolarHBondContact O-CD 3.36Å; Y157-P160 WeakPolarHBondContact OH-CD 3.48Å
158Q75.9Confident70.5Confident170 Ų170104.5 Ų104.579%0.79464%0.635SS**  trans-84.9110.9164.9-172.2173.8-26.200106.7S156S156-Q158 PolarHBondContact O-N 3.35Å
159P71.3Confident68.9Low85 Ų85106.5 Ų106.555%0.55265%0.645SS**PPolyproline II helixtrans-57.8134.4175.921.4-29.2000108.7Y157Y157-P159 HydrophobicContact CD1-CB 4.38Å; Y157-P159 VanDerWaalsContact CE1-CA 3.49Å; Y157-P159 HydrophobicContact CE1-CB 3.9Å; Y157-P159 VanDerWaalsContact O-CD 3.31Å; Y157-P159 WeakPolarHBondContact O-CD 3.36Å
160P73.8Confident67.5Low90 Ų90108.1 Ų108.158%0.58466%0.656SS**PPolyproline II helixtrans-55.8137.7171.322.7-30.1000108Y157 A162Y157-P160 WeakPolarHBondContact OH-CD 3.48Å; P160-A162 PolarHBondContact O-N 3.03Å
161P69.5Low66Low117 Ų117108.9 Ų108.976%0.7666%0.656SS**PPolyproline II helixtrans-54.4132.5176.922.8-31.7000108.2
162A71.9Confident64.3Low82 Ų82114.9 Ų114.968%0.67868%0.677SS**PPolyproline II helixtrans-52.8135177.400000108.5P160 C164P160-A162 PolarHBondContact O-N 3.03Å; A162-C164 VanDerWaalsContact C-N 3.34Å; A162-C164 PolarHBondContact O-N 2.86Å
163P68.1Low62.4Low116 Ų116118 Ų11875%0.75369%0.693SS**  trans-59.3107.4167.725-30.1000106L165P163-L165 PolarHBondContact O-N 2.94Å
164C53.5Low60.5Low120 Ų120117.5 Ų117.581%0.81171%0.705SS**  trans-57.8111.9170.117.90000105.8A162 G166A162-C164 VanDerWaalsContact C-N 3.34Å; A162-C164 PolarHBondContact O-N 2.86Å; C164-G166 PolarHBondContact O-N 2.8Å
165L53.9Low58.7Low172 Ų172121 Ų12190%0.90173%0.727SS**  trans-68.864.7162.9-66174.4000107.4P163 G167P163-L165 PolarHBondContact O-N 2.94Å; L165-G167 PolarHBondContact O-N 3.32Å
166G47.1Very low56.9Low67 Ų67117.8 Ų117.869%0.69171%0.714SS**  trans-69.991.5161.500000106C164 V168C164-G166 PolarHBondContact O-N 2.8Å; G166-V168 PolarHBondContact O-N 3.34Å
167G55.4Low55.5Low74 Ų74119.4 Ų119.476%0.76372%0.723SS**  trans-60.7104.2177.100000110.8L165L165-G167 PolarHBondContact O-N 3.32Å
168V49.3Very low54.3Low128 Ų128119 Ų11978%0.77674%0.737SS**  trans-144.9108.4141.3178.20000106.4G166G166-V168 PolarHBondContact O-N 3.34Å
169H44.5Very low52.4Low113 Ų113113.7 Ų113.752%0.52373%0.727SS.*  trans-64.6133.8168.1-175.1-98.7000108.9D171H169-D171 IonicContact CE1-OD2 3.77Å; H169-D171 PolarHBondContact CE1-OD2 3.1Å; H169-D171 WeakPolarHBondContact ND1-CB 3.37Å; H169-D171 PolarHBondContact ND1-N 2.85Å; H169-D171 IonicContact ND1-OD2 3.15Å; H169-D171 PolarHBondContact O-N 2.93Å
170P51.9Low50.9Low111 Ų111115.9 Ų115.972%0.72174%0.739SS**THydrogen-bonded Turntrans-68.1-6.6-172.525.5-32.4000115
171D44.3Very low49.1Very low124 Ų124120.8 Ų120.866%0.66375%0.751SS**THydrogen-bonded Turntrans-91.42-178.1-74-40.8000116.6H169H169-D171 IonicContact CE1-OD2 3.77Å; H169-D171 PolarHBondContact CE1-OD2 3.1Å; H169-D171 WeakPolarHBondContact ND1-CB 3.37Å; H169-D171 PolarHBondContact ND1-N 2.85Å; H169-D171 IonicContact ND1-OD2 3.15Å; H169-D171 PolarHBondContact O-N 2.93Å
172F43.5Very low47.8Very low167 Ų167121.4 Ų121.473%0.73276%0.759SS**  trans-109.671.9173-68.3-77.2000111.6V174F172-V174 VanDerWaalsContact C-N 3.33Å; F172-V174 PolarHBondContact O-N 3.08Å; F172-V174 VanDerWaalsContact O-N 3.09Å
173Q43.7Very low45.9Very low176 Ų176122.1 Ų122.182%0.82276%0.764SS**  trans-72.988159.9-66.2-122.1-48.800109.1T175Q173-T175 PolarHBondContact O-N 3.26Å
174V42.2Very low44.3Very low132 Ų132121.1 Ų121.180%0.877%0.766SS**  trans-75.2109.6165.5171.80000108.2F172F172-V174 VanDerWaalsContact C-N 3.33Å; F172-V174 PolarHBondContact O-N 3.08Å; F172-V174 VanDerWaalsContact O-N 3.09Å
175T44.8Very low43.6Very low137 Ų137121.1 Ų121.184%0.8476%0.758SS**  trans-79.3114171.3-55.70000108.7Q173Q173-T175 PolarHBondContact O-N 3.26Å
176G39.5Very low42.9Very low62 Ų62118.7 Ų118.764%0.63975%0.753SS**  trans174.1123.817100000113.9
177P47.4Very low43.1Very low130 Ų130119.3 Ų119.384%0.84475%0.746SS**  trans-97.7176.2-171.343.4-37.8000112.8
178P49Very low42.6Very low127 Ų127120.9 Ų120.983%0.82574%0.743SS**  -84.4134.6-126.636.9-24.2000114.3
179G36.4Very low42.1Very low57 Ų57126.5 Ų126.559%0.58875%0.751SS**  trans-109.8104.9173.700000111.2
180T40.3Very low42.3Very low131 Ų131127 Ų12780%0.80476%0.764SS**  trans-60121.5170.744.70000112.2
181F35.5Very low41.3Very low193 Ų193124.2 Ų124.285%0.84676%0.755SS**  trans-134.5115.2150.9-29.3-76.9000107.6A183F181-A183 PolarHBondContact O-N 3.12Å
182S41.4Very low40.8Very low130 Ų130127.4 Ų127.491%0.90977%0.766SS**  trans-61.5127.1173.3-71.40000110.9
183A32Very low40.5Very low97 Ų97124.7 Ų124.780%0.80277%0.768SS**  trans-135.7100.5151.700000107.5F181 D185F181-A183 PolarHBondContact O-N 3.12Å; A183-D185 PolarHBondContact O-N 3.13Å
184A34.6Very low40.4Very low96 Ų96123.6 Ų123.679%0.79377%0.767SS**  trans9.9100.6166.400000117.7
185D38.2Very low40Very low119 Ų119124.1 Ų124.164%0.63676%0.76SS**  trans-70.7142.6141.6175.740.3000109A183 S187A183-D185 PolarHBondContact O-N 3.13Å; D185-S187 WeakPolarHBondContact OD1-CB 3.12Å; D185-S187 PolarHBondContact OD1-N 3.44Å; D185-S187 PolarHBondContact OD1-OG 3.39Å; D185-S187 WeakPolarHBondContact OD2-CB 3.4Å; D185-S187 PolarHBondContact OD2-N 2.98Å; D185-S187 VanDerWaalsContact OD2-O 3.08Å
186P39.5Very low39.6Very low122 Ų122124.6 Ų124.679%0.79275%0.753SS**  trans-113.887.914534.8-25.6000109.7
187S52.1Low39.8Very low79 Ų79128 Ų12855%0.55276%0.761SS**  trans-138.2116.2155.7-62.70000106.4D185D185-S187 WeakPolarHBondContact OD1-CB 3.12Å; D185-S187 PolarHBondContact OD1-N 3.44Å; D185-S187 PolarHBondContact OD1-OG 3.39Å; D185-S187 WeakPolarHBondContact OD2-CB 3.4Å; D185-S187 PolarHBondContact OD2-N 2.98Å; D185-S187 VanDerWaalsContact OD2-O 3.08Å
188P44.5Very low39.5Very low108 Ų108124.9 Ų124.970%0.70175%0.753SS**  -164.3122.898.733.2-9000118.2
189W39.8Very low39.1Very low246 Ų246125.2 Ų125.293%0.93276%0.755SS**  trans63162.2142.1-55.6103.4000118.7
190P47.7Very low39.4Very low122 Ų122126.9 Ų126.979%0.79276%0.763SS**  cis-149.8160.936.241.6-19.3000120.4
191G30.2Very low40Very low53 Ų53126.1 Ų126.155%0.54676%0.76SS.*  trans88.7130.6151.100000114.6
192H33.7Very low40.7Very low191 Ų191122.4 Ų122.488%0.88476%0.756SS**  cis-146.8137.237.6-55.5-84.1000112.2
193S37.7Very low41.1Very low111 Ų111121.6 Ų121.678%0.77675%0.748SS**  trans-58.3158.2165.2-720000113.4
194L41.8Very low41.8Very low153 Ų153121.9 Ų121.980%0.80175%0.75SS**  trans90.6137150.6-116.581.9000118.1
195H33.8Very low42Very low143 Ų143123.8 Ų123.866%0.66275%0.751SS**  trans83.3111.7174.3-82.2-117.9000116.4
196Q36.5Very low42Very low146 Ų146123.6 Ų123.668%0.68276%0.76SS**  71.4115.673.2-158.6-170.4123.500110.7
197T44.2Very low41.8Very low134 Ų134127.1 Ų127.182%0.82277%0.765SS**  trans47.696159.957.80000117.5
198G39.9Very low41Very low65 Ų65128.6 Ų128.667%0.6778%0.776SS**  trans-166.4141.6163.500000110.5
199P41.2Very low40.9Very low134 Ų134134.2 Ų134.287%0.8778%0.783SS**PPolyproline II helixtrans-67.5143.2-172.727.8-31.8000111.4
200A43.2Very low40.9Very low91 Ų91128.1 Ų128.175%0.75278%0.775SS**PPolyproline II helixtrans-58.4147.4-179.800000112.4
201P52.2Low40.5Very low115 Ų115132.7 Ų132.775%0.74778%0.778SS**PPolyproline II helixtrans-67.4144.8169.629.9-32.1000109.6
202P50.2Low41.4Very low116 Ų116136 Ų13675%0.75379%0.791SS**PPolyproline II helixtrans-66.5144.2177.928.4-33.2000110.2
203P49.9Very low42.2Very low113 Ų113135.1 Ų135.173%0.73479%0.791SS**PPolyproline II helixtrans-64.3144.7174.127.4-32.8000110.3V205P203-V205 PolarHBondContact O-N 3.32Å
204A46.1Very low42.2Very low103 Ų103135.9 Ų135.985%0.85179%0.791SS**  trans-56.6113.817000000108.7S206A204-S206 PolarHBondContact O-N 3.26Å
205V40.3Very low42.3Very low135 Ų135133.6 Ų133.682%0.81879%0.788SS**  trans-65.6115.8177.5-68.60000108.7P203 E207P203-V205 PolarHBondContact O-N 3.32Å; V205-E207 PolarHBondContact O-N 2.88Å
206S37.5Very low42.8Very low116 Ų116135 Ų13581%0.81180%0.795SS**  trans-58.1132.9156.7-81.50000108.2A204 S208A204-S206 PolarHBondContact O-N 3.26Å; S206-S208 PolarHBondContact O-N 2.94Å
207E36Very low42.8Very low196 Ų196134.3 Ų134.392%0.91680%0.801SS**  trans-5399-175.1-66172.2135.700111.9V205V205-E207 PolarHBondContact O-N 2.88Å
208S35.7Very low42.7Very low110 Ų110133.3 Ų133.377%0.76980%0.799SS**  trans-86.5120.8160.6179.50000107.2S206S206-S208 PolarHBondContact O-N 2.94Å
209W41.6Very low42.8Very low225 Ų225136.1 Ų136.185%0.85281%0.805SS**  trans-41.9125.6176.4-65.594.5000112.7Y211W209-Y211 PolarHBondContact O-N 3.35Å
210P40.7Very low43Very low119 Ų119134.8 Ų134.877%0.77380%0.799SS**  trans-83.698.2173.831.6-29.6000109.2P212P210-P212 WeakPolarHBondContact O-CD 3.46Å
211Y37.8Very low42.6Very low217 Ų217141.6 Ų141.685%0.85181%0.807SS**  trans-85.1118155.8-86.7-82.6000108.5W209 L213W209-Y211 PolarHBondContact O-N 3.35Å; Y211-L213 PolarHBondContact O-N 2.85Å
212P48.9Very low42.3Very low124 Ų124140.5 Ų140.581%0.80580%0.802SS**  trans-80.6102.216830.5-29.2000109.1P210P210-P212 WeakPolarHBondContact O-CD 3.46Å
213L50.6Low42.3Very low172 Ų172143 Ų14390%0.90180%0.804SS**  trans-98.891.6161-172.377.7000108.5Y211Y211-L213 PolarHBondContact O-N 2.85Å
214T37.9Very low42.2Very low126 Ų126144 Ų14477%0.77380%0.8SS**  trans-170117.8154.7161.20000111.4
215S44.9Very low42.1Very low105 Ų105148 Ų14873%0.73480%0.801SS**  trans-67136.6157.4-179.70000109.7
216Q44.1Very low42.1Very low172 Ų172149.3 Ų149.380%0.80480%0.803SS**  trans136.5137.8152.5-74.2-73.84.800112.7
217V35.4Very low42.7Very low133 Ų133150.7 Ų150.781%0.80681%0.806SS**  trans79.6100.4173.292.90000118
218S43.4Very low43.4Very low113 Ų113150.9 Ų150.979%0.7980%0.8SS**  trans-49.1150.3164.1-45.50000112.4
219P42Very low43.9Very low123 Ų123152.9 Ų152.980%0.79980%0.799SS**  -144.9135.1113.929-10000115.8
220S45.3Very low43.8Very low106 Ų106153.8 Ų153.874%0.74180%0.802SS**  trans47.193137.5-158.80000119.4
221Y34.5Very low44.1Very low235 Ų235156.4 Ų156.492%0.92280%0.804SS**  trans-131.6107.4142.2-122.9-96000109.9
222S45.4Very low44.5Very low92 Ų92154.8 Ų154.864%0.64380%0.804SS**  trans-72.4166.6170.448.60000111.7
223H51.1Low44.6Very low169 Ų169157.8 Ų157.878%0.78281%0.807SS**  trans90.1105.2161.7-127.6-121.7000113.2
224M46.8Very low44.9Very low134 Ų134154.5 Ų154.566%0.6680%0.795SS**SBend-179.83771.9-95-69.7-84.500114.9
225H44.1Very low45Very low186 Ų186157 Ų15786%0.86180%0.798SS**  trans-141.172.7179.2-79.3-70.3000114.6
226D40.8Very low45Very low163 Ų163156.3 Ų156.387%0.87280%0.798SS**  trans-15077.4161.6-96.7-45000110.2
227V50.1Low45.1Very low144 Ų144156.7 Ų156.787%0.87380%0.8SS**SBendtrans-128.4-3.4168.4177.80000113
228Y49.9Very low45.6Very low200 Ų200157.5 Ų157.578%0.78480%0.796SS**SBendtrans-136.9120.5176.8-134-112.4000112.1
229M45.9Very low45.8Very low153 Ų153161.7 Ų161.775%0.75480%0.795SS**SBendtrans92.261.6164.9-52.9-53.1-160.900119.4
230R39.4Very low45.8Very low243 Ų243164.6 Ų164.692%0.91780%0.797SS**  trans-15562.8137.4-136172.2-122.7-113.41.9115.5
231H48.5Very low45.6Very low174 Ų174168.6 Ų168.681%0.80680%0.796SS**  trans-85.9109.8150.7-78.578.4000107.5
232H45.3Very low46.1Very low183 Ų183162.8 Ų162.885%0.84778%0.777SS**  174.8146.5126.8-80.4-56000110.5
233H50.3Low46.3Very low188 Ų188167.2 Ų167.287%0.8779%0.787SS**  trans-93.5175.3-151.9-93.3-3.9000114.6
234P58.4Low46.1Very low102 Ų102165.8 Ų165.866%0.66278%0.781SS**  trans-92.8162.2-162.337.3-31.2000112.1
235H38.8Very low46Very low180 Ų180167.9 Ų167.983%0.83379%0.789SS**  trans-153.8121.8148.3-100.9-67.2000112.2
236A44.7Very low45.9Very low89 Ų89165.7 Ų165.774%0.73678%0.778SS**  trans-75.3142.9167.200000110.5
237H46.3Very low45.8Very low180 Ų180165.6 Ų165.683%0.83377%0.772SS**  trans-133.5140158.7-74.5-72.5000111.4
238M47.6Very low45.2Very low150 Ų150165.3 Ų165.374%0.73976%0.761SS**  trans-91.9146.2-168.5-98.8-88.2-178.500111.5
239R45.8Very low44.8Very low202 Ų202163.7 Ų163.776%0.76276%0.761SS**  trans83.6119.2145.3-54.5-103.3-179.1-134.6-1.6119.9
240H42.8Very low45.6Very low183 Ų183161.5 Ų161.585%0.84776%0.758SS**  160.6155.5120.2-85.4-20.7000108.7
241R41.9Very low46.1Very low191 Ų191155.9 Ų155.972%0.72175%0.753SS**  cis-176.9136.8-32.1169.4162.2-173.31701.4103.5
242H44.8Very low45.6Very low113 Ų113152.6 Ų152.652%0.52376%0.756SS.*  trans67.1120.9158.2-68.5-23.4000121.5
243H49.7Very low45.3Very low184 Ų184147.8 Ų147.885%0.85276%0.756SS**  -167.8147.692.1-100.8-70.7000113.2
244H46Very low44.6Very low140 Ų140144 Ų14465%0.64875%0.751SS**  trans-73.6151.3-177.5-69.7-99.9000114.4
245H45.5Very low44.1Very low177 Ų177143.8 Ų143.882%0.81976%0.757SS**  -178.9153.5102.5-116.239.3000113.7
246H41.2Very low44.4Very low140 Ų140142.6 Ų142.665%0.64876%0.756SS**  trans-86.8173.3-165.2-90.4-93.6000116
247H39.3Very low44.2Very low161 Ų161144 Ų14475%0.74575%0.751SS**  trans121.5102.2147.8-65.3-75.4000113.4
248H37.4Very low44.4Very low138 Ų138142.1 Ų142.164%0.63976%0.755SS**  101.699.260.8-85.6-60.4000113.4
249H41.7Very low44.5Very low166 Ų166137.9 Ų137.977%0.76974%0.74SS**  trans52.9145.8144.8-59.2-66.2000126.7
250P62.4Low44.4Very low107 Ų107138.6 Ų138.670%0.69574%0.744SS**  trans-88.5179.4165.644.8-37.9000110.4
251P49Very low44.9Very low126 Ų126133.7 Ų133.782%0.81874%0.743SS**  -160.1176.458.639.9-15.4000117.5
252A39.7Very low45.2Very low105 Ų105130 Ų13087%0.86874%0.744SS**  trans-156.4105.7148.800000110.1
253G37.2Very low45.7Very low82 Ų82131.9 Ų131.985%0.84576%0.757SS**  trans-84.7149.1163.900000110.4
254S35.5Very low45.6Very low109 Ų109131.3 Ų131.376%0.76276%0.759SS**  trans-129.5108.3154.7-164.50000107.8
255A49.5Very low45.9Very low97 Ų97131.5 Ų131.580%0.80276%0.762SS**  trans-88.3114.6163.900000106.9
256L44.1Very low45.5Very low155 Ų155128.6 Ų128.681%0.81276%0.759SS**  trans-144.7113.3162.5-71.3177.3000109.2
257D41.9Very low45.5Very low118 Ų118125.8 Ų125.863%0.63176%0.755SS**  trans57.2119.8145.3-150.8-20.7000120.6S259D257-S259 PolarHBondContact O-N 3.25Å; D257-S259 PolarHBondContact OD1-N 3.35Å; D257-S259 PolarHBondContact OD1-OG 2.68Å; D257-S259 PolarHBondContact OD2-OG 3.39Å
258P50.1Low45.9Very low141 Ų141124.8 Ų124.892%0.91676%0.76SS**SBendtrans-80.910.7172.533.8-33.7000114.6
259S49.9Very low46.3Very low60 Ų60125.9 Ų125.942%0.4277%0.765SS.*  trans-98.9134.1172.162.70000110.3D257D257-S259 PolarHBondContact O-N 3.25Å; D257-S259 PolarHBondContact OD1-N 3.35Å; D257-S259 PolarHBondContact OD1-OG 2.68Å; D257-S259 PolarHBondContact OD2-OG 3.39Å
260Y42.3Very low46.3Very low218 Ų218122.6 Ų122.686%0.85577%0.767SS**  trans91.285.2-176.2-58.6-83000116.4
261G53.6Low45Very low80 Ų80122 Ų12283%0.82577%0.771SS**  trans-78.7143.7150.200000111.2
262P48.8Very low44.8Very low112 Ų112127.1 Ų127.173%0.72777%0.774SS**  trans-132.5122.5146.630-13.1000111.8
263L54.6Low44.9Very low153 Ų153129.2 Ų129.280%0.80177%0.769SS**  trans51.489.2143.9-52.3177.3000117.2M265L263-M265 VanDerWaalsContact C-N 3.33Å; L263-M265 PolarHBondContact O-N 3.36Å
264L48.7Very low45Very low172 Ų172130.8 Ų130.890%0.90176%0.764SS**  trans-58.995154.4-85.9149.4000109.3
265M50.9Low45.3Very low145 Ų145129.8 Ų129.871%0.71476%0.763SS**  trans-75.6126.9150.8-70.7-67.298.500107.1L263 S267L263-M265 VanDerWaalsContact C-N 3.33Å; L263-M265 PolarHBondContact O-N 3.36Å; M265-S267 PolarHBondContact O-N 3.14Å
266P37.9Very low44.9Very low115 Ų115130.9 Ų130.975%0.74776%0.762SS**  trans-60.5111.7170-18.630.6000108.6V268P266-V268 PolarHBondContact O-N 3.25Å
267S41.9Very low44.7Very low82 Ų82131.1 Ų131.157%0.57376%0.759SS**  trans-63.7104.9167.9179.80000107.7M265 H269M265-S267 PolarHBondContact O-N 3.14Å; S267-H269 PolarHBondContact O-N 3.13Å; S267-H269 PolarHBondContact OG-CD2 2.82Å; S267-H269 VanDerWaalsContact OG-CD2 3.25Å; S267-H269 PolarHBondContact OG-CE1 3.29Å; S267-H269 PolarHBondContact OG-NE2 3.41Å
268V47.5Very low44.4Very low140 Ų140131.4 Ų131.485%0.84877%0.768SS**  trans-69.387.6165-84.30000107.7P266 A270P266-V268 PolarHBondContact O-N 3.25Å; V268-A270 PolarHBondContact O-N 3.17Å; V268-A270 VanDerWaalsContact O-N 3.08Å
269H46Very low43.5Very low161 Ų161131 Ų13175%0.74576%0.759SS**  trans-67.7105.9164.4-71.4-80.9000107.7S267 A271S267-H269 PolarHBondContact O-N 3.13Å; S267-H269 PolarHBondContact OG-CD2 2.82Å; S267-H269 VanDerWaalsContact OG-CD2 3.25Å; S267-H269 PolarHBondContact OG-CE1 3.29Å; S267-H269 PolarHBondContact OG-NE2 3.41Å; H269-A271 PolarHBondContact O-N 2.86Å
270A40.2Very low43.3Very low97 Ų97135.9 Ų135.980%0.80278%0.778SS**  trans-58108.6161.100000107.4V268 R272V268-A270 PolarHBondContact O-N 3.17Å; V268-A270 VanDerWaalsContact O-N 3.08Å; A270-R272 VanDerWaalsContact C-N 3.3Å; A270-R272 PolarHBondContact O-N 3.43Å
271A34.9Very low42.9Very low95 Ų95131.8 Ų131.879%0.78578%0.776SS**  trans-63.594.7172.100000108.2H269 I273H269-A271 PolarHBondContact O-N 2.86Å; A271-I273 PolarHBondContact O-N 3.38Å; A271-I273 VanDerWaalsContact O-N 3.1Å
272R45.3Very low42.3Very low233 Ų233137.6 Ų137.688%0.87978%0.779SS**  trans-7298.7167.3-178.4-178.9-97.9149-7.8106.8A270 P274A270-R272 VanDerWaalsContact C-N 3.3Å; A270-R272 PolarHBondContact O-N 3.43Å; R272-P274 WeakPolarHBondContact O-CD 3.4Å
273I41.9Very low41.7Very low148 Ų148138.7 Ų138.776%0.75978%0.784SS**PPolyproline II helixtrans-64.2125.6167.9-57.4173.2000107.1A271 A275A271-I273 PolarHBondContact O-N 3.38Å; A271-I273 VanDerWaalsContact O-N 3.1Å; I273-A275 PolarHBondContact O-N 3.4Å
274P39.3Very low40.6Very low115 Ų115140 Ų14075%0.74779%0.786SS**PPolyproline II helixtrans-67.5126.4169.5-14.229000109.1R272R272-P274 WeakPolarHBondContact O-CD 3.4Å
275A41.7Very low40.6Very low88 Ų88136.6 Ų136.673%0.72777%0.774SS**PPolyproline II helixtrans-62.6139.517100000109.9I273 Q277I273-A275 PolarHBondContact O-N 3.4Å; A275-Q277 PolarHBondContact O-N 3.15Å
276P40.8Very low39.9Very low120 Ų120136.2 Ų136.278%0.77978%0.78SS**PPolyproline II helixtrans-66.2125.2172.926.1-30.8000109.7C278P276-C278 PolarHBondContact O-N 3.34Å
277Q41.1Very low39.6Very low160 Ų160136.6 Ų136.675%0.74878%0.78SS**  trans-67.7113.8171.8176.6-179.2-40.300109A275 D279A275-Q277 PolarHBondContact O-N 3.15Å; Q277-D279 PolarHBondContact NE2-OD2 3.34Å
278C34.2Very low39.8Very low124 Ų124139.6 Ų139.684%0.83880%0.795SS**  trans-87.8105.3170.9-00000108.6P276P276-C278 PolarHBondContact O-N 3.34Å
279D32.3Very low39.4Very low133 Ų133138.8 Ų138.871%0.71179%0.79SS**  trans-78.5127.5166.4-93.1-52.3000110Q277Q277-D279 PolarHBondContact NE2-OD2 3.34Å
280I45.4Very low39.1Very low163 Ų163135.7 Ų135.784%0.83679%0.787SS**  trans-89.7109.5-176.1-144.5158.3000108.4
281T33.3Very low38.9Very low131 Ų131136.1 Ų136.180%0.80479%0.79SS**  trans-140.792.2163.5560000111
282K41.8Very low39.2Very low202 Ų202137.7 Ų137.788%0.87879%0.79SS**  trans7.8112.3141.9-178179.7175.7176.50116.1
283T35.3Very low38.9Very low136 Ų136131 Ų13183%0.83478%0.779SS**  trans-167.5135.2132.9-53.60000110.2
284E31.5Very low38.9Very low181 Ų181128.9 Ų128.985%0.84678%0.783SS**  trans4.7157.3172.2-98.8-154.8123.500126.3
285P48.8Very low39.1Very low100 Ų100132.2 Ų132.265%0.64978%0.781SS**  trans-97.5133.2-171.637.9-28.3000113.3
286T35.9Very low39Very low137 Ų137132.9 Ų132.984%0.8479%0.787SS**  trans-166.1136.8150.56.10000110.8
287T33.3Very low38.9Very low122 Ų122129.6 Ų129.675%0.74878%0.775SS**  trans77.999170-43.80000115.8T289T287-T289 PolarHBondContact O-N 3.1Å; T287-T289 VanDerWaalsContact O-N 3.11Å
288V45.6Very low39.2Very low146 Ų146126.2 Ų126.289%0.88577%0.774SS**  trans-68.199.7169.7-152.40000107.9
289T38.2Very low39.5Very low122 Ų122129.4 Ų129.475%0.74877%0.774SS**  trans-101110.4164.6-58.80000106.9T287 A291T287-T289 PolarHBondContact O-N 3.1Å; T287-T289 VanDerWaalsContact O-N 3.11Å; T289-A291 PolarHBondContact O-N 3.36Å
290S39.6Very low39.9Very low97 Ų97132.2 Ų132.268%0.67878%0.783SS**  trans-45.9120.7172.4-65.40000111T292S290-T292 VanDerWaalsContact C-N 3.25Å; S290-T292 PolarHBondContact O-N 3.31Å
291A37.3Very low39.6Very low105 Ų105127.6 Ų127.687%0.86878%0.775SS**  trans-74.286.7163.200000107.6T289 S293T289-A291 PolarHBondContact O-N 3.36Å; A291-S293 PolarHBondContact O-N 3.38Å
292T41Very low40Very low129 Ų129128.2 Ų128.279%0.79178%0.779SS**  trans-66.5122168.116.70000108.9S290 A294S290-T292 VanDerWaalsContact C-N 3.25Å; S290-T292 PolarHBondContact O-N 3.31Å; T292-A294 PolarHBondContact O-N 2.96Å
293S37.8Very low40.2Very low91 Ų91124.2 Ų124.264%0.63677%0.771SS**  trans-55.2123.8175.3-159.30000110.4A291 W295A291-S293 PolarHBondContact O-N 3.38Å; S293-W295 PolarHBondContact O-N 3.4Å; S293-W295 VanDerWaalsContact O-N 3.1Å; S293-W295 VanDerWaalsContact OG-CD1 3.28Å; S293-W295 PolarHBondContact OG-NE1 3.13Å
294A42.6Very low40.4Very low104 Ų104124.4 Ų124.486%0.8677%0.767SS**  trans-82.485.8-178.100000110.7T292T292-A294 PolarHBondContact O-N 2.96Å
295W43.1Very low41.1Very low186 Ų186122.6 Ų122.671%0.70576%0.762SS**  trans-128.870.3158.226.1-58.3000106.9S293 G297S293-W295 PolarHBondContact O-N 3.4Å; S293-W295 VanDerWaalsContact O-N 3.1Å; S293-W295 VanDerWaalsContact OG-CD1 3.28Å; S293-W295 PolarHBondContact OG-NE1 3.13Å; W295-G297 PolarHBondContact O-N 2.95Å
296A41.1Very low40.6Very low101 Ų101122.6 Ų122.684%0.83576%0.76SS**  trans-81.597.6163.900000107.4
297G38.3Very low41.3Very low52 Ų52122.2 Ų122.254%0.53676%0.759SS.*  trans-56.6134.4161.500000109.7W295 F299W295-G297 PolarHBondContact O-N 2.95Å; G297-F299 PolarHBondContact O-N 3Å; G297-F299 VanDerWaalsContact O-N 3.08Å
298A45.9Very low41.7Very low88 Ų88121.1 Ų121.173%0.72776%0.757SS**  trans-68.8100.6174.200000109.8
299F40.8Very low41.3Very low192 Ų192121 Ų12184%0.84276%0.756SS**  trans-115.692.6160.8-52.7-77.6000107.8G297 G301G297-F299 PolarHBondContact O-N 3Å; G297-F299 VanDerWaalsContact O-N 3.08Å; F299-G301 PolarHBondContact O-N 3.31Å
300H41.1Very low41.4Very low192 Ų192119 Ų11989%0.88976%0.76SS**  trans-8393.3166.3-76.5-86.6000108.4
301G39.6Very low41.4Very low66 Ų66124 Ų12468%0.6877%0.769SS**  trans-137.485.2165.400000108.1F299 V303F299-G301 PolarHBondContact O-N 3.31Å; G301-V303 PolarHBondContact O-N 3.23Å; G301-V303 VanDerWaalsContact O-N 3.12Å
302T41.2Very low41.7Very low143 Ų143125.5 Ų125.588%0.87776%0.763SS**  trans-70.8103.9171.6-165.10000107.7
303V45.8Very low41.5Very low119 Ų119125.1 Ų125.172%0.72176%0.76SS**  trans-108.9108.6156.1176.10000105.7G301 I305G301-V303 PolarHBondContact O-N 3.23Å; G301-V303 VanDerWaalsContact O-N 3.12Å; V303-I305 HydrophobicContact CG1-CG1 4.18Å; V303-I305 PolarHBondContact O-N 3.07Å; V303-I305 VanDerWaalsContact O-N 3.17Å
304D40.6Very low41.5Very low139 Ų139124.2 Ų124.274%0.74377%0.765SS**  trans-62.3103.8171.7-167.35.8000108.2
305I45.2Very low41.4Very low144 Ų144127.5 Ų127.574%0.73877%0.768SS**  trans-101.392.7170-60.4170.5000106.6V303 P307V303-I305 HydrophobicContact CG1-CG1 4.18Å; V303-I305 PolarHBondContact O-N 3.07Å; V303-I305 VanDerWaalsContact O-N 3.17Å; I305-P307 WeakPolarHBondContact O-CD 3.4Å
306V39.2Very low41.6Very low100 Ų100126.6 Ų126.661%0.60677%0.771SS**  trans-56121.2168.7170.60000109.7S308V306-S308 PolarHBondContact O-N 3.49Å
307P49.7Very low41.5Very low128 Ų128129.9 Ų129.983%0.83177%0.769SS**  trans-9291.5166.233-23.4000107.7I305I305-P307 WeakPolarHBondContact O-CD 3.4Å
308S41.5Very low41.7Very low99 Ų99133.3 Ų133.369%0.69277%0.771SS**  trans-154.393.9167-158.70000111.5V306V306-S308 PolarHBondContact O-N 3.49Å
309V38.7Very low41.1Very low145 Ų145136 Ų13688%0.87977%0.773SS**  trans-153.4105137.9-84.80000107.4
310G40.3Very low41.2Very low79 Ų79134.4 Ų134.481%0.81477%0.766SS**  trans-74.2133.5159.700000109.1
311F38.8Very low41.3Very low201 Ų201130.9 Ų130.988%0.88276%0.763SS**  trans-134112.1157.4-147.6-92.3000108.7
312D44.4Very low41.6Very low137 Ų137136.2 Ų136.273%0.73377%0.767SS**  trans-79.6133172.5174.6-90.5000109.3
313T36.5Very low42.1Very low121 Ų121138.3 Ų138.374%0.74277%0.767SS**  176136.7129.322.40000111.1
314G38.1Very low42.1Very low72 Ų72137.4 Ų137.474%0.74277%0.766SS**  trans-84.5172.6-162.500000117.5
315L40.5Very low42.8Very low173 Ų173136 Ų13691%0.90676%0.764SS**  trans-137.1115.2147.3-131.5101.5000108.8H317L315-H317 PolarHBondContact O-N 3.11Å
316Q47Very low43.1Very low167 Ų167140.6 Ų140.678%0.7877%0.773SS**  trans-60.4124.7165.1-82.6-113.150.900109.8
317H38.4Very low43.2Very low171 Ų171150.3 Ų150.379%0.79280%0.801SS**  trans-129.5100.3152.3-152.3-107.1000108.7L315 D319L315-H317 PolarHBondContact O-N 3.11Å; H317-D319 PolarHBondContact O-N 3.46Å
318Q41.5Very low42.9Very low124 Ų124151.4 Ų151.458%0.57980%0.799SS**  trans-65.7119.3164.7-90.9-151.129.600108.6K320Q318-K320 HydrophobicContact CB-CG 4.5Å
319D34.1Very low43Very low143 Ų143154.2 Ų154.277%0.76581%0.805SS**  trans-95.2108.3153.2-154.2-86.4000108.3H317 S321H317-D319 PolarHBondContact O-N 3.46Å; D319-S321 PolarHBondContact O-N 3.43Å
320K42.8Very low43.2Very low160 Ų160154.7 Ų154.770%0.69680%0.8SS**  trans-86.8101174.6-71.1168.9157.5-171.10107.5Q318 K322Q318-K320 HydrophobicContact CB-CG 4.5Å; K320-K322 PolarHBondContact O-N 2.96Å
321S44.1Very low43.4Very low117 Ų117159.1 Ų159.182%0.81880%0.8SS**  trans-61.5100.815859.10000108.8D319D319-S321 PolarHBondContact O-N 3.43Å
322K45.6Very low43.7Very low179 Ų179156.5 Ų156.578%0.77880%0.795SS**  trans-117.192.4165.5-164.5172-177.6-175.20108.1K320K320-K322 PolarHBondContact O-N 2.96Å
323E52.2Low43.6Very low186 Ų186157.8 Ų157.887%0.86980%0.799SS**  trans-50.7139.3154.3-78.6-173.7120.200109.3
324S45.5Very low44.1Very low100 Ų100160.4 Ų160.470%0.69980%0.803SS**  trans-141114.5156.9-69.40000107.5
325P55.8Low44.6Very low109 Ų109167.2 Ų167.271%0.70881%0.807SS**  trans-86140.1170.533-28.1000110.3
326W50Low45Very low241 Ų241166.8 Ų166.891%0.91380%0.799SS**  trans12.4113.1146.4-50.790.3000118.5
327Y42.7Very low44.8Very low304 Ų304166.7 Ų166.7100%1.19280%0.801SS**  175.80108.6-111.3-83000111

Retrieved 327 of 327 residues in 69.9 ms (Link to these results)