A0A087XQ22_POEFO Loading...

Dynein light chain Tctex-type family member 5

AlphaFold DB , UniProt , Accession A0A087XQ22, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 175 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
1M36.5Very low37.4Very low235 Ų235172.9 Ų172.9100%1.15888%0.879SS**  0126.40-73.3-139.7-121.900108.1
2S41.1Very low37.2Very low114 Ų114166.3 Ų166.380%0.79787%0.87SS**  trans70.6109.5147.7-36.30000120.3
3E39.8Very low36.8Very low182 Ų182167.7 Ų167.785%0.8587%0.87SS**  trans-51.2164.5142-83.1-169.9128.800111.8
4P43.4Very low36.5Very low116 Ų116170.2 Ų170.275%0.75387%0.871SS**  cis-146.51633737.5-15.5000118.2
5L38.9Very low36.1Very low178 Ų178172.1 Ų172.193%0.93287%0.87SS**  trans-115.8128.3161.5-87.3158.2000109.4
6K36.3Very low35.7Very low191 Ų191171 Ų17183%0.8387%0.865SS**  trans-126.8113.1-177.7-160.3178.4-164.5176.90105.8
7D38.6Very low35.3Very low162 Ų162172.7 Ų172.787%0.86687%0.866SS**  trans-144132.8163.5-116.9-43.9000112
8K36.5Very low35Very low190 Ų190171.8 Ų171.883%0.82686%0.862SS**PPolyproline II helixtrans-92149.5-175.6-72.3174.4171.5177.80109.9
9P35.9Very low34.7Very low127 Ų127172.2 Ų172.283%0.82586%0.86SS**PPolyproline II helixtrans-101140.2152.77.711.7000112.1
10Q31.9Very low34.4Very low200 Ų200169.5 Ų169.594%0.93586%0.855SS**PPolyproline II helixtrans-66138.6178.6-68.8163.7-13.800112.2
11K32.6Very low34.1Very low207 Ų207171 Ų17190%0.986%0.86SS**  trans-92.7112.7173.5-166.9176.4-176.9-179.30109
12A34.7Very low33.5Very low93 Ų93162.9 Ų162.977%0.76984%0.836SS**  trans-77.5124.2172.500000110.7
13E31.6Very low33Very low185 Ų185163.6 Ų163.686%0.86484%0.841SS**  trans-78.2124.3172.2-70.1175.9103.500110.6
14K33.1Very low32.3Very low203 Ų203166.2 Ų166.288%0.88384%0.843SS**  trans-98.9109.8166.4-80.9-175177.6-179.90109.6
15K30.7Very low31.7Very low198 Ų198165.6 Ų165.686%0.86185%0.848SS**PPolyproline II helixtrans-73.7121.9168.5-71-178.9176.8-177.40109.7
16I29.3Very low31.2Very low155 Ų155166.2 Ų166.280%0.79584%0.843SS**PPolyproline II helixtrans-93.9119.5171.5-65171.9000108
17K28.8Very low30.7Very low200 Ų200165 Ų16587%0.8784%0.84SS**PPolyproline II helixtrans-90.4129.7171.6-75.5180175.2-179.20108.9
18I29.9Very low30.2Very low156 Ų156165.6 Ų165.680%0.884%0.835SS**  trans-105.8126.4174.4-57170.4000107.2
19H29.3Very low29.8Very low179 Ų179163.3 Ų163.383%0.82984%0.837SS**  trans-107139.8169.4-114.1-84.1000109.1
20P30Very low29.4Very low118 Ų118161 Ų16177%0.76684%0.837SS**  trans-86.2147-175.233-32.7000113.1
21E26.8Very low29.2Very low202 Ų202161.5 Ų161.594%0.94483%0.83SS**  trans-85.2145.4175.9-164.1-174.6146.400111.1
22G24.6Very low29.1Very low64 Ų64159.8 Ų159.866%0.6683%0.829SS**  trans-159.2128167.800000111.7
23S29.9Very low28.8Very low130 Ų130163.2 Ų163.291%0.90983%0.827SS**  trans-175.3126.7136-77.40000111.2
24R26.5Very low28.7Very low236 Ų236161.8 Ų161.889%0.89183%0.825SS**  trans-101.7129.1-174.4173.2-177-178.2178.62.6109.3
25A29.8Very low28.8Very low103 Ų103158.3 Ų158.385%0.85182%0.823SS**  trans-99.5137.6169.100000111.3
26K28.7Very low28.7Very low192 Ų192153.6 Ų153.684%0.83582%0.821SS**  trans-104.7143.2176.8-73.5175.8172.6176.30109.7
27E25.8Very low28.8Very low164 Ų164152.2 Ų152.277%0.76683%0.825SS**  trans-174157.2149.2-160.7141.193.600109.8
28K28.1Very low28.8Very low176 Ų176148 Ų14877%0.76582%0.816SS**  cis-152.8158.5-49.4-103.6170-165.5145.10107.1
29T27.4Very low28.8Very low141 Ų141148.6 Ų148.687%0.86582%0.815SS**  trans-50.8141.3170.8-55.70000115.3
30G28.3Very low28.8Very low79 Ų79145.3 Ų145.381%0.81481%0.808SS**  trans-150.6108.6161.900000111.9
31R26.3Very low28.6Very low210 Ų210147.2 Ų147.279%0.79281%0.808SS**  trans-101.7127.8175.6173.8-176.3-170.5170.84.6108
32I32.5Very low28.8Very low172 Ų172146 Ų14688%0.88280%0.802SS**  trans-137.5135.3164.7-55.9-179.5000109
33K28.2Very low29.3Very low165 Ų165149.6 Ų149.672%0.71781%0.811SS**  trans-87.3154.7-173.1-64.7172174.8179.20111.6
34D29.6Very low29.3Very low155 Ų155150.5 Ų150.583%0.82981%0.805SS**  trans-61167173.2-49-75.8000114.2
35P34.9Very low29.6Very low130 Ų130145.9 Ų145.984%0.84479%0.794SS**  -130.7148.8123.535.9-25.8000114.3
36A27.9Very low29.8Very low99 Ų99150 Ų15082%0.81880%0.795SS**  trans-68.7150.8-179.200000114.3
37S30.5Very low30.1Very low126 Ų126145.3 Ų145.388%0.88178%0.783SS**  trans-146.2142.5148.8-167.30000111
38T29.3Very low30.4Very low110 Ų110143.4 Ų143.468%0.67578%0.782SS**  trans-91.9131.6-158.2-46.30000111.5V40T38-V40 HydrophobicContact CG2-CG2 4.03Å
39H29.9Very low30.7Very low169 Ų169143.3 Ų143.378%0.78278%0.784SS**  trans-147.3110.7148.4-127.253.8000110.8
40V29.4Very low31.1Very low111 Ų111145.1 Ų145.167%0.67378%0.783SS**  trans-96.4116.9176.7-165.30000106.3T38T38-V40 HydrophobicContact CG2-CG2 4.03Å
41M26.4Very low31.4Very low157 Ų157150.4 Ų150.477%0.77379%0.786SS**  trans-120.1107.3162.2-71.7-178.2174.600106.8
42H30.5Very low31.9Very low178 Ų178148 Ų14882%0.82479%0.789SS**  trans-69125.2166.8-103.480.7000108.6
43V35.7Very low32.3Very low139 Ų139144.4 Ų144.484%0.84279%0.785SS**  trans-138.2125.2156.7-174.60000107.5
44D29.4Very low32.9Very low148 Ų148140.3 Ų140.379%0.79178%0.782SS**  trans-73.4161.7-176.2-168.737000112.8
45E32.1Very low33.9Very low140 Ų140137.2 Ų137.265%0.65478%0.778SS**  trans-60140.4-159.8-170.7173.9119.500118.9V47E45-V47 HydrophobicContact CG-CG2 4.12Å
46H35Very low34.1Very low188 Ų188136.9 Ų136.987%0.8777%0.774SS**  trans-146.2101.9142.9-67.4-59.8000110.6T48H46-T48 PolarHBondContact O-N 3.42Å
47V34.5Very low35.3Very low95 Ų95138.4 Ų138.458%0.57677%0.773SS**  trans-67.6116171.7176.50000109.4E45E45-V47 HydrophobicContact CG-CG2 4.12Å
48T32Very low36.4Very low124 Ų124136.6 Ų136.676%0.76176%0.76SS**  trans-113.1111.8159.741.70000107.5H46 H50H46-T48 PolarHBondContact O-N 3.42Å; T48-H50 PolarHBondContact O-N 3.44Å
49H34.5Very low37.5Very low174 Ų174136.4 Ų136.481%0.80676%0.761SS**  trans-67.496.4174-71.5-83.5000108.6
50H37.2Very low38.9Very low179 Ų179134 Ų13483%0.82975%0.754SS**  trans-87.9110.9160.7-119.1-100.6000106.8T48 D52T48-H50 PolarHBondContact O-N 3.44Å; H50-D52 PolarHBondContact O-N 3.25Å
51E33.6Very low40.6Very low190 Ų190134 Ų13489%0.88875%0.754SS**  trans-62.698.4175.3-71.2-178.8117.500109.1A53E51-A53 PolarHBondContact O-N 3.04Å
52D36.7Very low42.5Very low158 Ų158136 Ų13685%0.84575%0.754SS**  trans-60.5115.9167.1-123.3-42.5000107.7H50 A54H50-D52 PolarHBondContact O-N 3.25Å; D52-A54 VanDerWaalsContact C-N 3.29Å; D52-A54 PolarHBondContact O-N 2.89Å
53A41.3Very low44.2Very low97 Ų97129.3 Ų129.380%0.80272%0.724SS**  trans-62.893.7176.900000108.4E51 A55E51-A53 PolarHBondContact O-N 3.04Å; A53-A55 PolarHBondContact O-N 2.83Å
54A40.4Very low45.9Very low80 Ų80131.3 Ų131.366%0.66173%0.729SS**  trans-50.3111.7178.300000109.3D52 T56D52-A54 VanDerWaalsContact C-N 3.29Å; D52-A54 PolarHBondContact O-N 2.89Å; A54-T56 PolarHBondContact O-N 2.63Å; A54-T56 PolarHBondContact O-OG1 2.85Å
55A50.2Low47.6Very low90 Ų90126.5 Ų126.574%0.74471%0.709SS**  trans-53.999.2158.300000105.8A53 T57A53-A55 PolarHBondContact O-N 2.83Å; A55-T57 PolarHBondContact O-N 2.81Å
56T39.8Very low49.5Very low123 Ų123126.4 Ų126.476%0.75572%0.719SS**  trans-68.789.5-179.3-61.60000106A54 S58A54-T56 PolarHBondContact O-N 2.63Å; A54-T56 PolarHBondContact O-OG1 2.85Å; T56-S58 PolarHBondContact O-N 2.79Å
57T52.8Low51.3Low131 Ų131118.1 Ų118.180%0.80468%0.684SS**  trans-6486.6157.533.30000105.5A55 P59A55-T57 PolarHBondContact O-N 2.81Å; T57-P59 VanDerWaalsContact O-N 3.14Å
58S54.7Low53.6Low88 Ų88114.7 Ų114.762%0.61566%0.664SS**  trans-50.3123.8172.861.60000107.2T56T56-S58 PolarHBondContact O-N 2.79Å
59P50.6Low56Low105 Ų105116.9 Ų116.968%0.68266%0.659SS**  trans-57.2146.3175.624-32.4000109T57 T61T57-P59 VanDerWaalsContact O-N 3.14Å; P59-T61 VanDerWaalsContact C-N 3.33Å; P59-T61 PolarHBondContact O-N 3Å; P59-T61 PolarHBondContact O-OG1 3.31Å
60N59.6Low58.5Low120 Ų120113 Ų11364%0.64264%0.64SS**  trans-54.397.5175.6-72.1-11.1000109.2Y62N60-Y62 PolarHBondContact O-N 3.28Å
61T66.4Low61.1Low110 Ų110110 Ų11068%0.67563%0.629SS**  trans-87.293.4173.5-57.40000105.5P59 Q63P59-T61 VanDerWaalsContact C-N 3.33Å; P59-T61 PolarHBondContact O-N 3Å; P59-T61 PolarHBondContact O-OG1 3.31Å; T61-Q63 PolarHBondContact O-N 3.13Å
62Y66.3Low64Low198 Ų198101.4 Ų101.478%0.77659%0.589SS**  trans-50.7122.6-180-67-83.2000109.8N60N60-Y62 PolarHBondContact O-N 3.28Å
63Q66.3Low66.8Low38 Ų3895.2 Ų95.218%0.17856%0.558CS.*  trans-90.6124.1180-63.1178.98.100107.9T61 Y69T61-Q63 PolarHBondContact O-N 3.13Å; Q63-Y69 HydrophobicContact CG-CE2 3.82Å
64L70.1Confident69.4Low181 Ų18194.4 Ų94.495%0.94854%0.539SS*.  trans-78.4-14.5173.1-69.4163.2000111.8
65A66.5Low72.1Confident47 Ų4796.2 Ų96.239%0.38854%0.542SS..SBendtrans-77.7137.4177.500000110.5G67A65-G67 PolarHBondContact O-N 2.81Å
66T70.4Confident74.4Confident138 Ų13895.2 Ų95.285%0.84753%0.527SS*.SBendtrans-77.830.2-173.857.50000114F150T66-F150 WeakPolarHBondContact O-CZ 3.44Å
67G73.9Confident77.2Confident14 Ų1489.3 Ų89.314%0.14449%0.491CS..SBendtrans179.9171.9-177.900000115.8A65A65-G67 PolarHBondContact O-N 2.81Å
68P81.8Confident79.3Confident23 Ų2385.3 Ų85.315%0.14947%0.468CS..  trans-67.1140-178.826-32.1000112.5K70 L71 Y122 F150 Y173P68-K70 VanDerWaalsContact C-N 3.25Å; P68-K70 PolarHBondContact O-N 2.89Å; P68-L71 HydrophobicContact CG-CD2 3.84Å; P68-Y122 HydrophobicContact CB-CE2 4.15Å; P68-F150 HydrophobicContact CG-CD1 3.58Å; P68-F150 HydrophobicContact CG-CE1 4.06Å; P68-F150 HydrophobicContact CG-CG 4.23Å; P68-Y173 HydrophobicContact CB-CD2 3.93Å; P68-Y173 HydrophobicContact CB-CE2 3.49Å; P68-Y173 VanDerWaalsContact CB-CE2 3.49Å; P68-Y173 HydrophobicContact CG-CD2 4.39Å; P68-Y173 HydrophobicContact CG-CE2 4.24Å
69Y82.2Confident81.4Confident170 Ų17088 Ų8867%0.66747%0.465SS*.SBendtrans-65.6-28.5167.7-64.7-60.4000113.3Q63Q63-Y69 HydrophobicContact CG-CE2 3.82Å
70K87.1Confident83.7Confident94 Ų9483.1 Ų83.141%0.40943%0.434SS..SBendtrans-136120.2-178.8-175.7179.1-179.3-176.30109.1P68 L117 P120P68-K70 VanDerWaalsContact C-N 3.25Å; P68-K70 PolarHBondContact O-N 2.89Å; K70-L117 PolarHBondContact NZ-O 3.33Å; K70-P120 HydrophobicContact CB-CG 4.38Å
71L91.7Very high85.6Confident114 Ų11477.4 Ų77.460%0.59740%0.403SS*.  trans-70.8157.6175.3-65.3174.2000111.4P68 P73P68-L71 HydrophobicContact CG-CD2 3.84Å; L71-P73 WeakPolarHBondContact O-CD 3.45Å
72F94.6Very high87.1Confident10 Ų1078 Ų784%0.04440%0.397CS..  trans-64.4121175.7-159.4-104.3000110.6I74 I77 I119 Y122 T152 V169 G171F72-I74 PolarHBondContact O-N 2.84Å; F72-I77 HydrophobicContact CD1-CD1 3.73Å; F72-I77 HydrophobicContact CE1-CD1 3.14Å; F72-I77 HydrophobicContact CE2-CD1 4Å; F72-I77 HydrophobicContact CG-CD1 4.38Å; F72-I77 HydrophobicContact CZ-CD1 3.3Å; F72-I119 HydrophobicContact CD2-CD1 3.9Å; F72-I119 HydrophobicContact CD2-CG2 4.46Å; F72-I119 HydrophobicContact CE2-CD1 3.85Å; F72-Y122 HydrophobicContact CB-CD1 4.43Å; F72-Y122 HydrophobicContact CB-CE1 3.99Å; F72-Y122 AromaticContact CD2-CD1 3.73Å; F72-Y122 HydrophobicContact CD2-CD1 3.73Å; F72-Y122 HydrophobicContact CD2-CE1 4.14Å; F72-Y122 AromaticContact CD2-CG 3.98Å; F72-Y122 HydrophobicContact CD2-CG 3.98Å; F72-Y122 HydrophobicContact CE2-CD1 4.44Å; F72-Y122 HydrophobicContact CG-CD1 4.44Å; F72-Y122 HydrophobicContact CG-CE1 4.43Å; F72-T152 HydrophobicContact CB-CG2 3.56Å; F72-T152 HydrophobicContact CD1-CG2 3.42Å; F72-T152 VanDerWaalsContact CD1-CG2 3.42Å; F72-T152 HydrophobicContact CE1-CG2 4.36Å; F72-T152 HydrophobicContact CG-CG2 3.78Å; F72-V169 HydrophobicContact CE1-CG1 4.4Å; F72-V169 HydrophobicContact CZ-CG1 4.02Å; F72-G171 VanDerWaalsContact CE2-CA 3.45Å
73P95.5Very high88.6Confident29 Ų2972 Ų7219%0.18838%0.376CS..  trans-80.778.8-17033.2-35.3000111.9L71 T75 T76 I77 L117 I119L71-P73 WeakPolarHBondContact O-CD 3.45Å; P73-T75 VanDerWaalsContact C-N 3.34Å; P73-T75 PolarHBondContact O-N 2.93Å; P73-T76 PolarHBondContact O-N 3.09Å; P73-I77 HydrophobicContact CG-CD1 4.09Å; P73-I77 HydrophobicContact CG-CG1 4.32Å; P73-I77 WeakPolarHBondContact O-CG1 3.37Å; P73-I77 PolarHBondContact O-N 2.85Å; P73-I77 VanDerWaalsContact O-N 3.07Å; P73-L117 HydrophobicContact CG-CD1 3.76Å; P73-I119 HydrophobicContact CG-CD1 3.71Å; P73-I119 HydrophobicContact CG-CG1 4.11Å
74I97Very high90.1Very high79 Ų7971.5 Ų71.541%0.40537%0.373SS..Hα-helixtrans-51.8-48.9-175.6-68.1169.5000112.4F72 T76 I77 S78 T152 V154F72-I74 PolarHBondContact O-N 2.84Å; I74-T76 PolarHBondContact O-N 3.19Å; I74-I77 PolarHBondContact O-N 2.79Å; I74-S78 WeakPolarHBondContact O-CB 3.35Å; I74-S78 PolarHBondContact O-N 3.42Å; I74-T152 HydrophobicContact CD1-CG2 4.19Å; I74-T152 WeakPolarHBondContact CD1-OG1 3.26Å; I74-T152 HydrophobicContact CG1-CG2 4.07Å; I74-V154 HydrophobicContact CB-CG2 4.11Å; I74-V154 HydrophobicContact CG1-CG2 4.11Å; I74-V154 HydrophobicContact CG2-CG2 3.89Å
75T97.6Very high91.4Very high119 Ų11962.9 Ų62.973%0.7333%0.328SS*.Hα-helixtrans-63.6-45-176.1-50.80000112.1P73 S78 Y79P73-T75 VanDerWaalsContact C-N 3.34Å; P73-T75 PolarHBondContact O-N 2.93Å; T75-S78 PolarHBondContact O-N 2.81Å; T75-Y79 PolarHBondContact O-N 2.86Å; T75-Y79 VanDerWaalsContact O-N 3.1Å
76T97.8Very high92.9Very high68 Ų6861.7 Ų61.742%0.41732%0.316SS..Hα-helixtrans-63.9-43.9178.7-51.70000110.9P73 I74 S78 Y79 I80 L117P73-T76 PolarHBondContact O-N 3.09Å; I74-T76 PolarHBondContact O-N 3.19Å; T76-S78 VanDerWaalsContact C-N 3.34Å; T76-S78 PolarHBondContact O-N 3.09Å; T76-Y79 WeakPolarHBondContact O-CB 3.47Å; T76-Y79 PolarHBondContact O-N 3.41Å; T76-I80 HydrophobicContact CG2-CD1 4.32Å; T76-I80 WeakPolarHBondContact O-CG1 3.28Å; T76-I80 PolarHBondContact O-N 2.65Å; T76-L117 HydrophobicContact CG2-CD1 4.08Å; T76-L117 HydrophobicContact CG2-CD2 3.82Å
77I98Very high94.2Very high0 Ų062.2 Ų62.20%031%0.308CS..Hα-helixtrans-67.5-37.5179.1-65171.4000110.9F72 P73 I74 Y79 I80 L81 V114 L117 I119 V154 V169F72-I77 HydrophobicContact CD1-CD1 3.73Å; F72-I77 HydrophobicContact CE1-CD1 3.14Å; F72-I77 HydrophobicContact CE2-CD1 4Å; F72-I77 HydrophobicContact CG-CD1 4.38Å; F72-I77 HydrophobicContact CZ-CD1 3.3Å; P73-I77 HydrophobicContact CG-CD1 4.09Å; P73-I77 HydrophobicContact CG-CG1 4.32Å; P73-I77 WeakPolarHBondContact O-CG1 3.37Å; P73-I77 PolarHBondContact O-N 2.85Å; P73-I77 VanDerWaalsContact O-N 3.07Å; I74-I77 PolarHBondContact O-N 2.79Å; I77-Y79 PolarHBondContact O-N 3.13Å; I77-I80 PolarHBondContact O-N 3.38Å; I77-L81 HydrophobicContact CG2-CD1 4.5Å; I77-L81 HydrophobicContact CG2-CG 4.42Å; I77-L81 WeakPolarHBondContact O-CG 3.2Å; I77-L81 PolarHBondContact O-N 2.82Å; I77-V114 HydrophobicContact CD1-CG1 4.15Å; I77-V114 HydrophobicContact CG1-CG2 4.26Å; I77-V114 HydrophobicContact CG2-CG2 4.21Å; I77-L117 HydrophobicContact CD1-CD1 4.3Å; I77-L117 HydrophobicContact CG1-CD1 3.72Å; I77-I119 HydrophobicContact CD1-CD1 4.34Å; I77-V154 HydrophobicContact CB-CG2 4.27Å; I77-V154 HydrophobicContact CG2-CB 4.14Å; I77-V154 HydrophobicContact CG2-CG1 4.48Å; I77-V154 HydrophobicContact CG2-CG2 4.13Å; I77-V169 HydrophobicContact CG2-CB 4.08Å; I77-V169 HydrophobicContact CG2-CG1 4.22Å; I77-V169 HydrophobicContact CG2-CG2 4.08Å
78S98.3Very high95.2Very high47 Ų4763 Ų6333%0.32931%0.312SS..Hα-helixtrans-60.6-36.5173.6-176.30000112.1I74 T75 T76 K82I74-S78 WeakPolarHBondContact O-CB 3.35Å; I74-S78 PolarHBondContact O-N 3.42Å; T75-S78 PolarHBondContact O-N 2.81Å; T76-S78 VanDerWaalsContact C-N 3.34Å; T76-S78 PolarHBondContact O-N 3.09Å; S78-K82 WeakPolarHBondContact O-CB 3.43Å; S78-K82 PolarHBondContact O-N 3.13Å; S78-K82 VanDerWaalsContact O-N 3.13Å
79Y98.4Very high95.9Very high143 Ų14362 Ų6256%0.56131%0.305SS*.Hα-helixtrans-68.3-48175.1180-90.6000111.2T75 T76 I77 L81 K82 E83T75-Y79 PolarHBondContact O-N 2.86Å; T75-Y79 VanDerWaalsContact O-N 3.1Å; T76-Y79 WeakPolarHBondContact O-CB 3.47Å; T76-Y79 PolarHBondContact O-N 3.41Å; I77-Y79 PolarHBondContact O-N 3.13Å; Y79-L81 VanDerWaalsContact C-N 3.32Å; Y79-L81 PolarHBondContact O-N 2.82Å; Y79-K82 PolarHBondContact O-N 3.09Å; Y79-K82 VanDerWaalsContact O-N 3.13Å; Y79-E83 HydrophobicContact CE1-CB 4.28Å; Y79-E83 VanDerWaalsContact CE1-OE2 3.25Å; Y79-E83 WeakPolarHBondContact CE1-OE2 3.49Å; Y79-E83 WeakPolarHBondContact O-CB 3.34Å; Y79-E83 PolarHBondContact O-N 3.11Å; Y79-E83 PolarHBondContact OH-OE1 3.49Å
80I98.3Very high96.6Very high4 Ų461.1 Ų61.12%0.02130%0.3CS..Hα-helixtrans-54-49.3175.7-68.2166.3000110.4T76 I77 K82 E83 E84 R113 L117T76-I80 HydrophobicContact CG2-CD1 4.32Å; T76-I80 WeakPolarHBondContact O-CG1 3.28Å; T76-I80 PolarHBondContact O-N 2.65Å; I77-I80 PolarHBondContact O-N 3.38Å; I80-K82 PolarHBondContact O-N 3.31Å; I80-E83 PolarHBondContact O-N 3.33Å; I80-E84 HydrophobicContact CG2-CG 4.16Å; I80-E84 WeakPolarHBondContact O-CG 3.49Å; I80-E84 PolarHBondContact O-N 3.1Å; I80-R113 HydrophobicContact CD1-CB 4.25Å; I80-R113 HydrophobicContact CG2-CB 3.62Å; I80-R113 HydrophobicContact CG2-CG 4.32Å; I80-L117 HydrophobicContact CD1-CD1 4.02Å; I80-L117 HydrophobicContact CD1-CD2 4.4Å; I80-L117 HydrophobicContact CD1-CG 4.4Å
81L98.4Very high96.9Very high0 Ų063.7 Ų63.70%032%0.319CS..Hα-helixtrans-57.6-48.3178-72.9-178.9000111.8I77 Y79 E83 I85 I110 V154 H156 A167 V169I77-L81 HydrophobicContact CG2-CD1 4.5Å; I77-L81 HydrophobicContact CG2-CG 4.42Å; I77-L81 WeakPolarHBondContact O-CG 3.2Å; I77-L81 PolarHBondContact O-N 2.82Å; Y79-L81 VanDerWaalsContact C-N 3.32Å; Y79-L81 PolarHBondContact O-N 2.82Å; L81-E83 PolarHBondContact O-N 3.38Å; L81-I85 HydrophobicContact CB-CD1 4.32Å; L81-I85 HydrophobicContact CD2-CD1 4.46Å; L81-I85 WeakPolarHBondContact O-CB 3.21Å; L81-I85 VanDerWaalsContact O-CD1 3.23Å; L81-I85 WeakPolarHBondContact O-CD1 3.28Å; L81-I85 WeakPolarHBondContact O-CG1 3.42Å; L81-I85 PolarHBondContact O-N 2.65Å; L81-I85 VanDerWaalsContact O-N 3.1Å; L81-I110 HydrophobicContact CD2-CD1 3.67Å; L81-I110 HydrophobicContact CD2-CG1 4.06Å; L81-I110 HydrophobicContact CD2-CG2 3.68Å; L81-V154 HydrophobicContact CD1-CB 4.39Å; L81-V154 HydrophobicContact CD1-CG1 4.09Å; L81-H156 HydrophobicContact CB-CB 3.77Å; L81-H156 HydrophobicContact CD1-CB 4.06Å; L81-A167 HydrophobicContact CD2-CB 4.03Å; L81-V169 HydrophobicContact CD1-CG2 4.02Å; L81-V169 HydrophobicContact CD2-CG2 3.76Å; L81-V169 HydrophobicContact CG-CG2 4.18Å
82K98.3Very high97.1Very high122 Ų12259.1 Ų59.153%0.5329%0.294SS..Hα-helixtrans-61.8-44.9-179.9-177.1179.3178.8-176.30111.6S78 Y79 I80 T86S78-K82 WeakPolarHBondContact O-CB 3.43Å; S78-K82 PolarHBondContact O-N 3.13Å; S78-K82 VanDerWaalsContact O-N 3.13Å; Y79-K82 PolarHBondContact O-N 3.09Å; Y79-K82 VanDerWaalsContact O-N 3.13Å; I80-K82 PolarHBondContact O-N 3.31Å; K82-T86 WeakPolarHBondContact O-CB 3.23Å; K82-T86 PolarHBondContact O-N 2.85Å; K82-T86 VanDerWaalsContact O-N 3.09Å; K82-T86 PolarHBondContact O-OG1 2.72Å
83E98.3Very high97.2Very high73 Ų7364.4 Ų64.434%0.34132%0.319SS..Hα-helixtrans-62.7-58.6-179-178.5171.1-132.600111.2Y79 I80 L81 I85 T86 H87Y79-E83 HydrophobicContact CE1-CB 4.28Å; Y79-E83 VanDerWaalsContact CE1-OE2 3.25Å; Y79-E83 WeakPolarHBondContact CE1-OE2 3.49Å; Y79-E83 WeakPolarHBondContact O-CB 3.34Å; Y79-E83 PolarHBondContact O-N 3.11Å; Y79-E83 PolarHBondContact OH-OE1 3.49Å; I80-E83 PolarHBondContact O-N 3.33Å; L81-E83 PolarHBondContact O-N 3.38Å; E83-I85 PolarHBondContact O-N 2.81Å; E83-T86 PolarHBondContact O-N 2.78Å; E83-H87 WeakPolarHBondContact O-CB 3.4Å; E83-H87 PolarHBondContact O-N 3.36Å
84E97.9Very high97.3Very high27 Ų2766.4 Ų66.413%0.12632%0.324CS..Hα-helixtrans-64.2-43.1-174.7-61.7-57.8158.300112.1I80 H87 C88 L106 V109 I110 R113I80-E84 HydrophobicContact CG2-CG 4.16Å; I80-E84 WeakPolarHBondContact O-CG 3.49Å; I80-E84 PolarHBondContact O-N 3.1Å; E84-H87 PolarHBondContact O-N 3.28Å; E84-C88 WeakPolarHBondContact O-CB 3.16Å; E84-C88 PolarHBondContact O-N 2.83Å; E84-C88 PolarHBondContact O-SG 2.88Å; E84-C88 VanDerWaalsContact O-SG 3.4Å; E84-L106 HydrophobicContact CB-CD2 4.43Å; E84-V109 HydrophobicContact CB-CG1 4.44Å; E84-V109 VanDerWaalsContact CD-CG1 3.48Å; E84-V109 HydrophobicContact CG-CG1 3.92Å; E84-V109 WeakPolarHBondContact OE2-CG1 3.44Å; E84-I110 HydrophobicContact CB-CG1 4.35Å; E84-R113 IonicContact OE1-NE 3.65Å
85I98Very high97.3Very high0 Ų066.4 Ų66.40%032%0.322CS..Hα-helixtrans-66-43.9179.7-65.8168000110.4L81 E83 L89 H156 F158 C165 A167L81-I85 HydrophobicContact CB-CD1 4.32Å; L81-I85 HydrophobicContact CD2-CD1 4.46Å; L81-I85 WeakPolarHBondContact O-CB 3.21Å; L81-I85 VanDerWaalsContact O-CD1 3.23Å; L81-I85 WeakPolarHBondContact O-CD1 3.28Å; L81-I85 WeakPolarHBondContact O-CG1 3.42Å; L81-I85 PolarHBondContact O-N 2.65Å; L81-I85 VanDerWaalsContact O-N 3.1Å; E83-I85 PolarHBondContact O-N 2.81Å; I85-L89 HydrophobicContact CG2-CD1 4Å; I85-L89 VanDerWaalsContact O-CB 3.27Å; I85-L89 WeakPolarHBondContact O-CB 3.42Å; I85-L89 WeakPolarHBondContact O-CG 3.1Å; I85-L89 PolarHBondContact O-N 3.02Å; I85-H156 HydrophobicContact CD1-CB 4.38Å; I85-F158 HydrophobicContact CG2-CB 3.45Å; I85-F158 VanDerWaalsContact CG2-CB 3.45Å; I85-F158 HydrophobicContact CG2-CD1 4.18Å; I85-F158 HydrophobicContact CG2-CG 3.85Å; I85-C165 HydrophobicContact CG2-CB 4.12Å; I85-A167 HydrophobicContact CD1-CB 3.42Å; I85-A167 VanDerWaalsContact CD1-CB 3.42Å; I85-A167 HydrophobicContact CG1-CB 4.5Å
86T97.6Very high97.3Very high22 Ų2264.6 Ų64.614%0.13531%0.312CS..Hα-helixtrans-67.2-41.1178.6-56.30000110.7K82 E83 R90 F158K82-T86 WeakPolarHBondContact O-CB 3.23Å; K82-T86 PolarHBondContact O-N 2.85Å; K82-T86 VanDerWaalsContact O-N 3.09Å; K82-T86 PolarHBondContact O-OG1 2.72Å; E83-T86 PolarHBondContact O-N 2.78Å; T86-R90 HydrophobicContact CG2-CB 4.49Å; T86-R90 WeakPolarHBondContact O-CB 3.18Å; T86-R90 PolarHBondContact O-N 3.43Å; T86-R90 VanDerWaalsContact O-N 3.11Å; T86-F158 HydrophobicContact CG2-CE2 4.49Å
87H96.8Very high97.2Very high148 Ų14866.9 Ų66.969%0.68532%0.321SS*.Hα-helixtrans-61.7-46.9179.6176.3-102.6000111.9E83 E84E83-H87 WeakPolarHBondContact O-CB 3.4Å; E83-H87 PolarHBondContact O-N 3.36Å; E84-H87 PolarHBondContact O-N 3.28Å
88C95.2Very high97.1Very high32 Ų3270.9 Ų70.922%0.21634%0.34CS..Hα-helixtrans-78.1-32.7-177.4-64.90000114E84 M102 L106E84-C88 WeakPolarHBondContact O-CB 3.16Å; E84-C88 PolarHBondContact O-N 2.83Å; E84-C88 PolarHBondContact O-SG 2.88Å; E84-C88 VanDerWaalsContact O-SG 3.4Å; C88-M102 HydrophobicContact CB-SD 3.99Å; C88-L106 HydrophobicContact CB-CD2 3.91Å; C88-L106 HydrophobicContact CB-CG 4.33Å
89L96.9Very high97.1Very high0 Ų068.8 Ų68.80%033%0.325CS..Hα-helixtrans-111.2-7.5-166.2-54.9-174.1000115.1I85 D91 M92 M102 L106 I130 F158 N160 L163 C165I85-L89 HydrophobicContact CG2-CD1 4Å; I85-L89 VanDerWaalsContact O-CB 3.27Å; I85-L89 WeakPolarHBondContact O-CB 3.42Å; I85-L89 WeakPolarHBondContact O-CG 3.1Å; I85-L89 PolarHBondContact O-N 3.02Å; L89-D91 VanDerWaalsContact C-N 3.33Å; L89-D91 PolarHBondContact O-N 3.2Å; L89-M92 HydrophobicContact CD2-SD 3.62Å; L89-M92 PolarHBondContact O-N 2.93Å; L89-M102 HydrophobicContact CD2-CG 3.6Å; L89-M102 HydrophobicContact CD2-SD 4.37Å; L89-L106 HydrophobicContact CD1-CD1 3.87Å; L89-L106 HydrophobicContact CD2-CD1 4.04Å; L89-L106 HydrophobicContact CG-CD1 3.99Å; L89-I130 HydrophobicContact CD1-CD1 4.24Å; L89-I130 HydrophobicContact CD1-CG1 4.5Å; L89-I130 HydrophobicContact CD2-CD1 4.19Å; L89-F158 HydrophobicContact CB-CD1 4.02Å; L89-F158 HydrophobicContact CB-CE1 3.75Å; L89-F158 HydrophobicContact CD1-CD1 4.41Å; L89-N160 PolarHBondContact O-ND2 2.76Å; L89-L163 HydrophobicContact CB-CD1 4.33Å; L89-L163 HydrophobicContact CD1-CD1 4.25Å; L89-C165 HydrophobicContact CD1-CB 3.3Å
90R96.4Very high97Very high152 Ų15270.7 Ų70.757%0.57433%0.332SS*.THydrogen-bonded Turntrans-54.3-48.8-176.7178.8-177.2-65.6167.7-1.2112.7T86T86-R90 HydrophobicContact CG2-CB 4.49Å; T86-R90 WeakPolarHBondContact O-CB 3.18Å; T86-R90 PolarHBondContact O-N 3.43Å; T86-R90 VanDerWaalsContact O-N 3.11Å
91D94.8Very high96.9Very high148 Ų14876.1 Ų76.179%0.79136%0.357SS*.THydrogen-bonded Turntrans-107.18.4-173.8-55.7-55000112.9L89L89-D91 VanDerWaalsContact C-N 3.33Å; L89-D91 PolarHBondContact O-N 3.2Å
92M95.1Very high96.9Very high18 Ų1877.6 Ų77.69%0.08936%0.364CS..PPolyproline II helixtrans-82.5134.5-179.6-179.9174.7166.600111.5L89 H98 M102 N160 L163L89-M92 HydrophobicContact CD2-SD 3.62Å; L89-M92 PolarHBondContact O-N 2.93Å; M92-H98 HydrophobicContact CE-CB 4.48Å; M92-H98 WeakPolarHBondContact CE-CD2 3.14Å; M92-M102 HydrophobicContact CE-CB 4.06Å; M92-M102 HydrophobicContact CE-CG 4.29Å; M92-M102 HydrophobicContact SD-CB 4.25Å; M92-M102 HydrophobicContact SD-CE 3.99Å; M92-M102 HydrophobicContact SD-CG 3.84Å; M92-N160 PolarHBondContact O-ND2 2.94Å; M92-L163 HydrophobicContact CB-CD2 4.5Å; M92-L163 HydrophobicContact CE-CD2 4.4Å; M92-L163 HydrophobicContact CG-CD2 4.13Å; M92-L163 HydrophobicContact SD-CD2 4.37Å
93Q96.9Very high96.9Very high122 Ų12273.1 Ų73.157%0.5735%0.347SS*.PPolyproline II helixtrans-92.3144.7168.8-65.3-71.625.100111.3E95 S162Q93-E95 PolarHBondContact O-N 3.22Å; Q93-S162 WeakPolarHBondContact CA-OG 3.41Å; Q93-S162 PolarHBondContact OE1-OG 3.47Å
94Y97.8Very high96.9Very high70 Ų7075.2 Ų75.228%0.27536%0.36SS..PPolyproline II helixtrans-64.3118.5176.3-172.6-97.6000111.5P96 S99 Q132 S162 L163Y94-P96 HydrophobicContact CE1-CG 4Å; Y94-S99 WeakPolarHBondContact CD2-OG 3.29Å; Y94-Q132 HydrophobicContact CD1-CB 3.57Å; Y94-Q132 HydrophobicContact CD1-CG 3.59Å; Y94-Q132 HydrophobicContact CD2-CB 4.09Å; Y94-Q132 HydrophobicContact CE1-CB 3.62Å; Y94-Q132 HydrophobicContact CE1-CG 4.07Å; Y94-Q132 HydrophobicContact CE2-CB 4.13Å; Y94-Q132 VanDerWaalsContact CE2-N 3.29Å; Y94-Q132 HydrophobicContact CG-CB 3.8Å; Y94-Q132 HydrophobicContact CG-CG 3.92Å; Y94-S162 PolarHBondContact N-OG 2.98Å; Y94-L163 HydrophobicContact CD2-CB 4.01Å; Y94-L163 HydrophobicContact CG-CB 4.48Å
95E97.5Very high96.8Very high79 Ų7977.5 Ų77.537%0.36938%0.376SS..  trans-134.8131.1165.2-170.1-75.2131.700107.9Q93 L97 H98 S99Q93-E95 PolarHBondContact O-N 3.22Å; E95-L97 PolarHBondContact O-N 2.8Å; E95-L97 PolarHBondContact OE1-N 3.11Å; E95-L97 VanDerWaalsContact OE1-N 3.09Å; E95-L97 PolarHBondContact OE2-N 2.68Å; E95-L97 VanDerWaalsContact OE2-N 3.1Å; E95-H98 HydrophobicContact CB-CB 4.27Å; E95-H98 WeakPolarHBondContact OE2-CB 3.17Å; E95-H98 PolarHBondContact OE2-N 3.5Å; E95-S99 WeakPolarHBondContact O-CB 3.1Å; E95-S99 PolarHBondContact O-N 3.33Å; E95-S99 PolarHBondContact O-OG 3.35Å
96P95.9Very high96.8Very high81 Ų8177.5 Ų77.553%0.52638%0.376SS..Hα-helixtrans-56.8-44.2-170.2-28.534.6000116Y94 R100Y94-P96 HydrophobicContact CE1-CG 4Å; P96-R100 PolarHBondContact O-N 3.45Å
97L96.9Very high96.9Very high117 Ų11777.2 Ų77.261%0.61337%0.374SS*.Hα-helixtrans-73.1-46.3-176.3-64.8175000111E95 S99 R100 E101E95-L97 PolarHBondContact O-N 2.8Å; E95-L97 PolarHBondContact OE1-N 3.11Å; E95-L97 VanDerWaalsContact OE1-N 3.09Å; E95-L97 PolarHBondContact OE2-N 2.68Å; E95-L97 VanDerWaalsContact OE2-N 3.1Å; L97-S99 VanDerWaalsContact C-N 3.35Å; L97-S99 PolarHBondContact O-N 3.1Å; L97-R100 WeakPolarHBondContact O-CB 3.32Å; L97-R100 PolarHBondContact O-N 2.92Å; L97-E101 PolarHBondContact O-N 3.1Å; L97-E101 VanDerWaalsContact O-N 3.11Å
98H96.2Very high96.9Very high83 Ų8374.9 Ų74.938%0.38436%0.364SS..Hα-helixtrans-65.1-38.6177.9-168.154.1000111.6M92 E95 R100 E101 M102M92-H98 HydrophobicContact CE-CB 4.48Å; M92-H98 WeakPolarHBondContact CE-CD2 3.14Å; E95-H98 HydrophobicContact CB-CB 4.27Å; E95-H98 WeakPolarHBondContact OE2-CB 3.17Å; E95-H98 PolarHBondContact OE2-N 3.5Å; H98-R100 VanDerWaalsContact C-N 3.3Å; H98-R100 PolarHBondContact O-N 2.87Å; H98-E101 PolarHBondContact O-N 3.28Å; H98-M102 WeakPolarHBondContact O-CB 3.46Å; H98-M102 PolarHBondContact O-N 3.29Å
99S96.9Very high97.1Very high4 Ų475.6 Ų75.63%0.02837%0.367CS..Hα-helixtrans-65.4-35.2175.7-58.30000111.9Y94 E95 L97 T103Y94-S99 WeakPolarHBondContact CD2-OG 3.29Å; E95-S99 WeakPolarHBondContact O-CB 3.1Å; E95-S99 PolarHBondContact O-N 3.33Å; E95-S99 PolarHBondContact O-OG 3.35Å; L97-S99 VanDerWaalsContact C-N 3.35Å; L97-S99 PolarHBondContact O-N 3.1Å; S99-T103 WeakPolarHBondContact O-CB 3.27Å; S99-T103 PolarHBondContact O-N 3.35Å; S99-T103 PolarHBondContact O-OG1 2.88Å
100R96.8Very high97.1Very high183 Ų18375.6 Ų75.669%0.69137%0.367SS*.Hα-helixtrans-64.3-48.3174.2176.1-175.6173.7179.8-1.9111.1P96 L97 H98 T103 L104P96-R100 PolarHBondContact O-N 3.45Å; L97-R100 WeakPolarHBondContact O-CB 3.32Å; L97-R100 PolarHBondContact O-N 2.92Å; H98-R100 VanDerWaalsContact C-N 3.3Å; H98-R100 PolarHBondContact O-N 2.87Å; R100-T103 WeakPolarHBondContact O-CB 3.27Å; R100-T103 PolarHBondContact O-N 3.17Å; R100-L104 PolarHBondContact O-N 3.27Å
101E97.4Very high97.2Very high118 Ų11872.1 Ų72.155%0.55135%0.354SS*.Hα-helixtrans-62-46.9176.8-68.9173175.600111L97 H98 T103 L104 T105L97-E101 PolarHBondContact O-N 3.1Å; L97-E101 VanDerWaalsContact O-N 3.11Å; H98-E101 PolarHBondContact O-N 3.28Å; E101-T103 VanDerWaalsContact C-N 3.26Å; E101-T103 PolarHBondContact O-N 3.49Å; E101-L104 WeakPolarHBondContact O-CB 3.48Å; E101-L104 PolarHBondContact O-N 3Å; E101-T105 PolarHBondContact O-N 3.31Å; E101-T105 PolarHBondContact O-OG1 2.86Å
102M97.4Very high97.3Very high30 Ų3068.1 Ų68.115%0.14834%0.335CS..Hα-helixtrans-59.1-37178.1-174.857.771.100112.3C88 L89 M92 H98 L104 T105 L106 I130C88-M102 HydrophobicContact CB-SD 3.99Å; L89-M102 HydrophobicContact CD2-CG 3.6Å; L89-M102 HydrophobicContact CD2-SD 4.37Å; M92-M102 HydrophobicContact CE-CB 4.06Å; M92-M102 HydrophobicContact CE-CG 4.29Å; M92-M102 HydrophobicContact SD-CB 4.25Å; M92-M102 HydrophobicContact SD-CE 3.99Å; M92-M102 HydrophobicContact SD-CG 3.84Å; H98-M102 WeakPolarHBondContact O-CB 3.46Å; H98-M102 PolarHBondContact O-N 3.29Å; M102-L104 VanDerWaalsContact C-N 3.32Å; M102-L104 PolarHBondContact O-N 3.38Å; M102-T105 PolarHBondContact O-N 3.07Å; M102-L106 HydrophobicContact CG-CD1 4.25Å; M102-L106 WeakPolarHBondContact O-CB 3.13Å; M102-L106 PolarHBondContact O-N 3.37Å; M102-L106 HydrophobicContact SD-CG 4.34Å; M102-I130 HydrophobicContact CB-CD1 4.23Å; M102-I130 HydrophobicContact CG-CD1 4.01Å
103T98Very high97.4Very high28 Ų2871.3 Ų71.317%0.17235%0.346CS..Hα-helixtrans-60.1-43.3175.7-600000111.3S99 R100 E101 C107 V128 I130S99-T103 WeakPolarHBondContact O-CB 3.27Å; S99-T103 PolarHBondContact O-N 3.35Å; S99-T103 PolarHBondContact O-OG1 2.88Å; R100-T103 WeakPolarHBondContact O-CB 3.27Å; R100-T103 PolarHBondContact O-N 3.17Å; E101-T103 VanDerWaalsContact C-N 3.26Å; E101-T103 PolarHBondContact O-N 3.49Å; T103-C107 PolarHBondContact O-N 2.77Å; T103-C107 PolarHBondContact O-SG 2.96Å; T103-V128 HydrophobicContact CG2-CB 4.02Å; T103-V128 HydrophobicContact CG2-CG1 4.07Å; T103-V128 WeakPolarHBondContact CG2-O 3.38Å; T103-I130 WeakPolarHBondContact OG1-CD1 3.5Å; T103-I130 WeakPolarHBondContact OG1-CG1 3.18Å
104L97.6Very high97.4Very high118 Ų11865.6 Ų65.662%0.61832%0.319SS*.Hα-helixtrans-68.2-44.5177.5-63.7175.6000111.3R100 E101 M102 L106 C107 E108R100-L104 PolarHBondContact O-N 3.27Å; E101-L104 WeakPolarHBondContact O-CB 3.48Å; E101-L104 PolarHBondContact O-N 3Å; M102-L104 VanDerWaalsContact C-N 3.32Å; M102-L104 PolarHBondContact O-N 3.38Å; L104-L106 PolarHBondContact O-N 2.95Å; L104-C107 WeakPolarHBondContact O-CB 3.47Å; L104-C107 PolarHBondContact O-N 3.16Å; L104-E108 PolarHBondContact O-N 2.77Å
105T97.7Very high97.3Very high74 Ų7469.1 Ų69.145%0.45434%0.336SS..Hα-helixtrans-57.9-49.3176.5-59.60000111.2E101 M102 C107 E108 V109E101-T105 PolarHBondContact O-N 3.31Å; E101-T105 PolarHBondContact O-OG1 2.86Å; M102-T105 PolarHBondContact O-N 3.07Å; T105-C107 VanDerWaalsContact C-N 3.31Å; T105-C107 PolarHBondContact O-N 3.31Å; T105-E108 PolarHBondContact O-N 3.43Å; T105-E108 VanDerWaalsContact O-N 3.12Å; T105-V109 HydrophobicContact CG2-CG2 4.37Å; T105-V109 WeakPolarHBondContact O-CG2 3.3Å; T105-V109 PolarHBondContact O-N 3.4Å
106L97.9Very high97.3Very high0 Ų070.2 Ų70.20%034%0.341CS..Hα-helixtrans-59.9-41.2176.6-86.6172.9000112E84 C88 L89 M102 L104 E108 V109 I110 I130E84-L106 HydrophobicContact CB-CD2 4.43Å; C88-L106 HydrophobicContact CB-CD2 3.91Å; C88-L106 HydrophobicContact CB-CG 4.33Å; L89-L106 HydrophobicContact CD1-CD1 3.87Å; L89-L106 HydrophobicContact CD2-CD1 4.04Å; L89-L106 HydrophobicContact CG-CD1 3.99Å; M102-L106 HydrophobicContact CG-CD1 4.25Å; M102-L106 WeakPolarHBondContact O-CB 3.13Å; M102-L106 PolarHBondContact O-N 3.37Å; M102-L106 HydrophobicContact SD-CG 4.34Å; L104-L106 PolarHBondContact O-N 2.95Å; L106-E108 VanDerWaalsContact C-N 3.31Å; L106-E108 PolarHBondContact O-N 3.44Å; L106-V109 PolarHBondContact O-N 3.08Å; L106-I110 VanDerWaalsContact O-CB 3.31Å; L106-I110 WeakPolarHBondContact O-CB 3.43Å; L106-I110 WeakPolarHBondContact O-CD1 3.45Å; L106-I110 WeakPolarHBondContact O-CG1 3.36Å; L106-I110 PolarHBondContact O-N 2.79Å; L106-I130 HydrophobicContact CD1-CD1 4.07Å
107C98.2Very high97.2Very high16 Ų1668.2 Ų68.211%0.10833%0.326CS..Hα-helixtrans-59.5-42.6175.3-71.70000111.9T103 L104 T105 R111 V128T103-C107 PolarHBondContact O-N 2.77Å; T103-C107 PolarHBondContact O-SG 2.96Å; L104-C107 WeakPolarHBondContact O-CB 3.47Å; L104-C107 PolarHBondContact O-N 3.16Å; T105-C107 VanDerWaalsContact C-N 3.31Å; T105-C107 PolarHBondContact O-N 3.31Å; C107-R111 WeakPolarHBondContact O-CB 3.19Å; C107-R111 PolarHBondContact O-N 2.7Å; C107-V128 WeakPolarHBondContact SG-CG2 3.22Å
108E98Very high97Very high100 Ų10070.2 Ų70.247%0.46733%0.334SS..Hα-helixtrans-69.1-44.6-179.8-164.962.1-110.500112.6L104 T105 L106 R111 T112L104-E108 PolarHBondContact O-N 2.77Å; T105-E108 PolarHBondContact O-N 3.43Å; T105-E108 VanDerWaalsContact O-N 3.12Å; L106-E108 VanDerWaalsContact C-N 3.31Å; L106-E108 PolarHBondContact O-N 3.44Å; E108-R111 WeakPolarHBondContact O-CB 3.33Å; E108-R111 PolarHBondContact O-N 2.87Å; E108-R111 IonicContact OE1-NH1 2.88Å; E108-R111 PolarHBondContact OE1-NH1 2.92Å; E108-R111 IonicContact OE2-CZ 3.86Å; E108-R111 IonicContact OE2-NH1 2.63Å; E108-R111 PolarHBondContact OE2-NH1 2.79Å; E108-T112 WeakPolarHBondContact O-CB 3.44Å; E108-T112 PolarHBondContact O-N 3.38Å; E108-T112 PolarHBondContact O-OG1 2.84Å
109V98Very high96.7Very high46 Ų4667.4 Ų67.428%0.27932%0.322SS..Hα-helixtrans-61.7-50.3178173.60000110.1E84 T105 L106 R111 T112 R113E84-V109 HydrophobicContact CB-CG1 4.44Å; E84-V109 VanDerWaalsContact CD-CG1 3.48Å; E84-V109 HydrophobicContact CG-CG1 3.92Å; E84-V109 WeakPolarHBondContact OE2-CG1 3.44Å; T105-V109 HydrophobicContact CG2-CG2 4.37Å; T105-V109 WeakPolarHBondContact O-CG2 3.3Å; T105-V109 PolarHBondContact O-N 3.4Å; L106-V109 PolarHBondContact O-N 3.08Å; V109-R111 VanDerWaalsContact C-N 3.3Å; V109-R111 PolarHBondContact O-N 2.98Å; V109-T112 PolarHBondContact O-N 3.19Å; V109-R113 HydrophobicContact CG1-CG 4.41Å; V109-R113 VanDerWaalsContact O-CG 3.26Å; V109-R113 WeakPolarHBondContact O-CG 3.38Å; V109-R113 PolarHBondContact O-N 3.42Å
110I98.3Very high96.4Very high0 Ų070.1 Ų70.10%034%0.339CS..Hα-helixtrans-59.2-43.4176.4-65.9163.8000110.3L81 E84 L106 T112 R113 V114 I126 V128 A167 V169L81-I110 HydrophobicContact CD2-CD1 3.67Å; L81-I110 HydrophobicContact CD2-CG1 4.06Å; L81-I110 HydrophobicContact CD2-CG2 3.68Å; E84-I110 HydrophobicContact CB-CG1 4.35Å; L106-I110 VanDerWaalsContact O-CB 3.31Å; L106-I110 WeakPolarHBondContact O-CB 3.43Å; L106-I110 WeakPolarHBondContact O-CD1 3.45Å; L106-I110 WeakPolarHBondContact O-CG1 3.36Å; L106-I110 PolarHBondContact O-N 2.79Å; I110-T112 VanDerWaalsContact C-N 3.33Å; I110-T112 PolarHBondContact O-N 3.07Å; I110-R113 PolarHBondContact O-N 3.48Å; I110-V114 HydrophobicContact CG2-CG2 4.17Å; I110-V114 WeakPolarHBondContact O-CB 3.14Å; I110-V114 WeakPolarHBondContact O-CG2 3.44Å; I110-V114 PolarHBondContact O-N 2.84Å; I110-I126 HydrophobicContact CB-CD1 4.43Å; I110-I126 HydrophobicContact CG2-CD1 3.94Å; I110-I126 HydrophobicContact CG2-CG1 4.45Å; I110-I126 HydrophobicContact CG2-CG2 4.26Å; I110-V128 HydrophobicContact CD1-CG2 4.22Å; I110-A167 HydrophobicContact CD1-CB 4.45Å; I110-V169 HydrophobicContact CG2-CG2 3.97Å
111R97.3Very high96Very high79 Ų7963.3 Ų63.330%0.29831%0.313SS..Hα-helixtrans-59.5-45.4178.4-169.9-176.5-59.7106-0.4111.9C107 E108 V109 V114 K115 I126C107-R111 WeakPolarHBondContact O-CB 3.19Å; C107-R111 PolarHBondContact O-N 2.7Å; E108-R111 WeakPolarHBondContact O-CB 3.33Å; E108-R111 PolarHBondContact O-N 2.87Å; E108-R111 IonicContact OE1-NH1 2.88Å; E108-R111 PolarHBondContact OE1-NH1 2.92Å; E108-R111 IonicContact OE2-CZ 3.86Å; E108-R111 IonicContact OE2-NH1 2.63Å; E108-R111 PolarHBondContact OE2-NH1 2.79Å; V109-R111 VanDerWaalsContact C-N 3.3Å; V109-R111 PolarHBondContact O-N 2.98Å; R111-V114 PolarHBondContact O-N 3.49Å; R111-K115 HydrophobicContact CG-CD 4.29Å; R111-K115 WeakPolarHBondContact O-CB 3.46Å; R111-K115 WeakPolarHBondContact O-CG 3.48Å; R111-K115 PolarHBondContact O-N 2.97Å; R111-I126 HydrophobicContact CB-CD1 3.52Å; R111-I126 HydrophobicContact CG-CD1 4.03Å
112T97.9Very high95.9Very high64 Ų6458.8 Ų58.839%0.39329%0.291SS..Hα-helixtrans-62.6-51.6-179.3-58.50000110E108 V109 I110 V114 K115 E116E108-T112 WeakPolarHBondContact O-CB 3.44Å; E108-T112 PolarHBondContact O-N 3.38Å; E108-T112 PolarHBondContact O-OG1 2.84Å; V109-T112 PolarHBondContact O-N 3.19Å; I110-T112 VanDerWaalsContact C-N 3.33Å; I110-T112 PolarHBondContact O-N 3.07Å; T112-V114 VanDerWaalsContact C-N 3.33Å; T112-V114 PolarHBondContact O-N 3.35Å; T112-K115 PolarHBondContact O-N 3.44Å; T112-K115 VanDerWaalsContact O-N 3.1Å; T112-E116 WeakPolarHBondContact O-CG 3.25Å; T112-E116 PolarHBondContact O-N 3.17Å
113R97.8Very high95.7Very high85 Ų8563.3 Ų63.332%0.32131%0.31SS..Hα-helixtrans-60.6-38.3178.8-63.4-70-73138.6-4.4113I80 E84 V109 I110 E116I80-R113 HydrophobicContact CD1-CB 4.25Å; I80-R113 HydrophobicContact CG2-CB 3.62Å; I80-R113 HydrophobicContact CG2-CG 4.32Å; E84-R113 IonicContact OE1-NE 3.65Å; V109-R113 HydrophobicContact CG1-CG 4.41Å; V109-R113 VanDerWaalsContact O-CG 3.26Å; V109-R113 WeakPolarHBondContact O-CG 3.38Å; V109-R113 PolarHBondContact O-N 3.42Å; I110-R113 PolarHBondContact O-N 3.48Å; R113-E116 IonicContact CZ-OE2 3.81Å; R113-E116 IonicContact NH1-OE2 2.76Å; R113-E116 PolarHBondContact NH1-OE2 3.4Å
114V96.7Very high95.6Very high2 Ų264.4 Ų64.41%0.01232%0.317CS..Hα-helixtrans-70.8-38.3175.9174.20000111.3I77 I110 R111 T112 E116 L117 T124I77-V114 HydrophobicContact CD1-CG1 4.15Å; I77-V114 HydrophobicContact CG1-CG2 4.26Å; I77-V114 HydrophobicContact CG2-CG2 4.21Å; I110-V114 HydrophobicContact CG2-CG2 4.17Å; I110-V114 WeakPolarHBondContact O-CB 3.14Å; I110-V114 WeakPolarHBondContact O-CG2 3.44Å; I110-V114 PolarHBondContact O-N 2.84Å; R111-V114 PolarHBondContact O-N 3.49Å; T112-V114 VanDerWaalsContact C-N 3.33Å; T112-V114 PolarHBondContact O-N 3.35Å; V114-E116 VanDerWaalsContact C-N 3.32Å; V114-E116 PolarHBondContact O-N 2.96Å; V114-L117 WeakPolarHBondContact O-CB 3.39Å; V114-L117 PolarHBondContact O-N 3.05Å; V114-T124 HydrophobicContact CG1-CG2 4Å
115K95.1Very high95.6Very high145 Ų14562.4 Ų62.463%0.6331%0.309SS*.Hα-helixtrans-65.9-33.2176.3-80.1-176.7173.7-175.50112.8R111 T112 L117 M118R111-K115 HydrophobicContact CG-CD 4.29Å; R111-K115 WeakPolarHBondContact O-CB 3.46Å; R111-K115 WeakPolarHBondContact O-CG 3.48Å; R111-K115 PolarHBondContact O-N 2.97Å; T112-K115 PolarHBondContact O-N 3.44Å; T112-K115 VanDerWaalsContact O-N 3.1Å; K115-L117 PolarHBondContact O-N 3.47Å; K115-M118 PolarHBondContact O-N 2.93Å
116E96.4Very high95.6Very high102 Ų10260 Ų6048%0.47729%0.294SS..THydrogen-bonded Turntrans-60.3-21.8174.4-73.3168.1-17600113.2T112 R113 V114 M118T112-E116 WeakPolarHBondContact O-CG 3.25Å; T112-E116 PolarHBondContact O-N 3.17Å; R113-E116 IonicContact CZ-OE2 3.81Å; R113-E116 IonicContact NH1-OE2 2.76Å; R113-E116 PolarHBondContact NH1-OE2 3.4Å; V114-E116 VanDerWaalsContact C-N 3.32Å; V114-E116 PolarHBondContact O-N 2.96Å; E116-M118 PolarHBondContact O-N 3.43Å
117L94.4Very high95.6Very high39 Ų3963.3 Ų63.320%0.20431%0.311CS..THydrogen-bonded Turntrans-70.4-8174.5-54.9-179.9000113.2K70 P73 T76 I77 I80 V114 K115 I119K70-L117 PolarHBondContact NZ-O 3.33Å; P73-L117 HydrophobicContact CG-CD1 3.76Å; T76-L117 HydrophobicContact CG2-CD1 4.08Å; T76-L117 HydrophobicContact CG2-CD2 3.82Å; I77-L117 HydrophobicContact CD1-CD1 4.3Å; I77-L117 HydrophobicContact CG1-CD1 3.72Å; I80-L117 HydrophobicContact CD1-CD1 4.02Å; I80-L117 HydrophobicContact CD1-CD2 4.4Å; I80-L117 HydrophobicContact CD1-CG 4.4Å; V114-L117 WeakPolarHBondContact O-CB 3.39Å; V114-L117 PolarHBondContact O-N 3.05Å; K115-L117 PolarHBondContact O-N 3.47Å; L117-I119 VanDerWaalsContact C-N 3.31Å; L117-I119 HydrophobicContact CB-CD1 4.07Å; L117-I119 HydrophobicContact CB-CG1 3.85Å; L117-I119 HydrophobicContact CD1-CD1 4.35Å; L117-I119 PolarHBondContact O-N 2.91Å
118M92.2Very high95.6Very high159 Ų15963 Ų6378%0.78331%0.309SS*.  trans44.555.2176.9-63-174.717900111.5K115 E116 P120K115-M118 PolarHBondContact O-N 2.93Å; E116-M118 PolarHBondContact O-N 3.43Å; M118-P120 VanDerWaalsContact O-CD 3.26Å; M118-P120 WeakPolarHBondContact O-CD 3.37Å
119I90.8Very high95.5Very high23 Ų2361.1 Ų61.112%0.11830%0.3CS..  trans-82.9108.4-178.8-49.1156.6000107.2F72 P73 I77 L117 Y122F72-I119 HydrophobicContact CD2-CD1 3.9Å; F72-I119 HydrophobicContact CD2-CG2 4.46Å; F72-I119 HydrophobicContact CE2-CD1 3.85Å; P73-I119 HydrophobicContact CG-CD1 3.71Å; P73-I119 HydrophobicContact CG-CG1 4.11Å; I77-I119 HydrophobicContact CD1-CD1 4.34Å; L117-I119 VanDerWaalsContact C-N 3.31Å; L117-I119 HydrophobicContact CB-CD1 4.07Å; L117-I119 HydrophobicContact CB-CG1 3.85Å; L117-I119 HydrophobicContact CD1-CD1 4.35Å; L117-I119 PolarHBondContact O-N 2.91Å; I119-Y122 HydrophobicContact CG2-CD2 3.49Å; I119-Y122 VanDerWaalsContact CG2-CD2 3.49Å; I119-Y122 HydrophobicContact CG2-CE2 4.13Å; I119-Y122 HydrophobicContact CG2-CG 4.06Å
120P89.6Confident95.5Very high61 Ų6160.2 Ų60.240%0.39629%0.293SS..THydrogen-bonded Turntrans-68.6146.1-175.130.2-35.1000110.2K70 M118 Y122K70-P120 HydrophobicContact CB-CG 4.38Å; M118-P120 VanDerWaalsContact O-CD 3.26Å; M118-P120 WeakPolarHBondContact O-CD 3.37Å; P120-Y122 WeakPolarHBondContact O-CD2 3.42Å; P120-Y122 PolarHBondContact O-N 2.98Å
121R90.3Very high95.4Very high40 Ų4060.6 Ų60.615%0.15130%0.297CS..THydrogen-bonded Turntrans60.727.1171.7-56.5-167.677.9179.133.8115.5Y173 F174 E175R121-Y173 HydrophobicContact CB-CD2 4.14Å; R121-Y173 HydrophobicContact CB-CE2 3.63Å; R121-Y173 PolarHBondContact NH1-OH 2.78Å; R121-Y173 WeakPolarHBondContact O-CA 3.41Å; R121-Y173 VanDerWaalsContact O-CD2 3.26Å; R121-Y173 WeakPolarHBondContact O-CD2 3.42Å; R121-F174 WeakPolarHBondContact CB-O 3.42Å; R121-F174 PolarHBondContact NE-O 2.93Å; R121-F174 PolarHBondContact O-N 3.21Å; R121-E175 IonicContact CZ-OE1 3.19Å; R121-E175 IonicContact NH1-OE1 2.75Å; R121-E175 PolarHBondContact NH1-OE1 2.98Å; R121-E175 IonicContact NH1-OE2 3.64Å; R121-E175 IonicContact NH2-OE1 2.72Å; R121-E175 PolarHBondContact NH2-OE1 3.33Å; R121-E175 PolarHBondContact NH2-OXT 3.42Å
122Y93.8Very high95.4Very high23 Ų2360.8 Ų60.89%0.0930%0.302CS..EExtended strand (participates in β ladder)trans-117.5128.9171.5-85.1-89.8000111P68 F72 I119 P120 F150 I172 Y173P68-Y122 HydrophobicContact CB-CE2 4.15Å; F72-Y122 HydrophobicContact CB-CD1 4.43Å; F72-Y122 HydrophobicContact CB-CE1 3.99Å; F72-Y122 AromaticContact CD2-CD1 3.73Å; F72-Y122 HydrophobicContact CD2-CD1 3.73Å; F72-Y122 HydrophobicContact CD2-CE1 4.14Å; F72-Y122 AromaticContact CD2-CG 3.98Å; F72-Y122 HydrophobicContact CD2-CG 3.98Å; F72-Y122 HydrophobicContact CE2-CD1 4.44Å; F72-Y122 HydrophobicContact CG-CD1 4.44Å; F72-Y122 HydrophobicContact CG-CE1 4.43Å; I119-Y122 HydrophobicContact CG2-CD2 3.49Å; I119-Y122 VanDerWaalsContact CG2-CD2 3.49Å; I119-Y122 HydrophobicContact CG2-CE2 4.13Å; I119-Y122 HydrophobicContact CG2-CG 4.06Å; P120-Y122 WeakPolarHBondContact O-CD2 3.42Å; P120-Y122 PolarHBondContact O-N 2.98Å; Y122-F150 WeakPolarHBondContact CE1-O 3.42Å; Y122-F150 PolarHBondContact OH-O 3.01Å; Y122-I172 CarbonylContact C-O 3.54Å; Y122-I172 WeakPolarHBondContact CA-O 3.32Å; Y122-Y173 HydrophobicContact CD2-CD2 4.1Å; Y122-Y173 HydrophobicContact CE1-CD2 4.46Å; Y122-Y173 AromaticContact CE2-CD2 3.74Å; Y122-Y173 HydrophobicContact CE2-CD2 3.74Å; Y122-Y173 HydrophobicContact CE2-CE2 4.49Å; Y122-Y173 AromaticContact CZ-CD2 3.94Å
123K94.4Very high95.3Very high125 Ų12561.6 Ų61.654%0.54330%0.303SS..EExtended strand (participates in β ladder)trans-86.1132.9163-69.5176.5-177.7170.80108.2I172 F174K123-I172 PolarHBondContact N-O 2.97Å; K123-I172 PolarHBondContact O-N 2.76Å; K123-F174 HydrophobicContact CD-CB 4.12Å; K123-F174 HydrophobicContact CD-CD1 4.48Å; K123-F174 HydrophobicContact CD-CG 4.32Å; K123-F174 HydrophobicContact CG-CB 4.2Å; K123-F174 HydrophobicContact CG-CD1 3.95Å; K123-F174 HydrophobicContact CG-CG 4.25Å
124T95.4Very high95.1Very high52 Ų5263.2 Ų63.232%0.31932%0.318SS..EExtended strand (participates in β ladder)trans-110.5129-179.1-55.60000110.2V114 I126 V169 Y170V114-T124 HydrophobicContact CG1-CG2 4Å; T124-I126 HydrophobicContact CG2-CD1 4.33Å; T124-I126 HydrophobicContact CG2-CG1 4.05Å; T124-V169 HydrophobicContact CG2-CG1 3.6Å; T124-Y170 WeakPolarHBondContact CA-O 3.19Å
125V96.8Very high94.8Very high75 Ų7567.1 Ų67.146%0.45536%0.359SS..EExtended strand (participates in β ladder)trans-116.4131.5172.2-178.40000108.6V169 Y170 I172V125-V169 CarbonylContact O-C 3.57Å; V125-V169 WeakPolarHBondContact O-CA 3.49Å; V125-Y170 HydrophobicContact CB-CD2 4.28Å; V125-Y170 HydrophobicContact CG1-CD2 4.39Å; V125-Y170 PolarHBondContact N-O 3.37Å; V125-Y170 PolarHBondContact O-N 2.77Å; V125-I172 HydrophobicContact CG2-CD1 4Å
126I97.8Very high94.7Very high25 Ų2565 Ų6513%0.12835%0.351CS..EExtended strand (participates in β ladder)trans-121.4129.6-177.9-60.3165.5000108.2I110 R111 T124 V128 T168 V169I110-I126 HydrophobicContact CB-CD1 4.43Å; I110-I126 HydrophobicContact CG2-CD1 3.94Å; I110-I126 HydrophobicContact CG2-CG1 4.45Å; I110-I126 HydrophobicContact CG2-CG2 4.26Å; R111-I126 HydrophobicContact CB-CD1 3.52Å; R111-I126 HydrophobicContact CG-CD1 4.03Å; T124-I126 HydrophobicContact CG2-CD1 4.33Å; T124-I126 HydrophobicContact CG2-CG1 4.05Å; I126-V128 HydrophobicContact CG2-CG2 4.06Å; I126-T168 WeakPolarHBondContact CA-O 3.41Å; I126-V169 HydrophobicContact CG1-CG1 4.25Å; I126-V169 HydrophobicContact CG1-CG2 4.21Å
127L97.8Very high94.4Very high68 Ų6863.9 Ų63.936%0.35637%0.367SS..EExtended strand (participates in β ladder)trans-125.2121.6177-175.663.8000108.6H129 A167 T168L127-H129 VanDerWaalsContact CD2-NE2 3.28Å; L127-H129 WeakPolarHBondContact CD2-NE2 3.4Å; L127-H129 VanDerWaalsContact CG-NE2 3.34Å; L127-H129 WeakPolarHBondContact CG-NE2 3.41Å; L127-A167 CarbonylContact O-C 3.56Å; L127-A167 VanDerWaalsContact O-CA 3.3Å; L127-A167 WeakPolarHBondContact O-CA 3.34Å; L127-T168 PolarHBondContact N-O 2.84Å; L127-T168 PolarHBondContact O-N 2.74Å
128V98Very high94.2Very high11 Ų1166.8 Ų66.87%0.06738%0.38CS..EExtended strand (participates in β ladder)trans-122.6134177.2-179.20000108.8T103 C107 I110 I126 I130 S166 A167T103-V128 HydrophobicContact CG2-CB 4.02Å; T103-V128 HydrophobicContact CG2-CG1 4.07Å; T103-V128 WeakPolarHBondContact CG2-O 3.38Å; C107-V128 WeakPolarHBondContact SG-CG2 3.22Å; I110-V128 HydrophobicContact CD1-CG2 4.22Å; I126-V128 HydrophobicContact CG2-CG2 4.06Å; V128-I130 HydrophobicContact CG1-CG1 4.28Å; V128-S166 CarbonylContact C-O 3.57Å; V128-S166 WeakPolarHBondContact CA-O 3.37Å; V128-A167 HydrophobicContact CG2-CB 3.99Å
129H97.3Very high94.3Very high60 Ų6067.9 Ų67.928%0.27838%0.384SS..EExtended strand (participates in β ladder)trans-122.7119.3175.5-61.5-72.7000109L127 I140 C165 S166L127-H129 VanDerWaalsContact CD2-NE2 3.28Å; L127-H129 WeakPolarHBondContact CD2-NE2 3.4Å; L127-H129 VanDerWaalsContact CG-NE2 3.34Å; L127-H129 WeakPolarHBondContact CG-NE2 3.41Å; H129-I140 HydrophobicContact CB-CD1 4.37Å; H129-I140 VanDerWaalsContact CD2-CD1 3.47Å; H129-I140 WeakPolarHBondContact CD2-CD1 3.48Å; H129-C165 CarbonylContact O-C 3.56Å; H129-C165 WeakPolarHBondContact O-CA 3.25Å; H129-S166 PolarHBondContact N-O 3.26Å; H129-S166 PolarHBondContact O-N 3.19Å
130I97.4Very high94.4Very high26 Ų2670.2 Ų70.213%0.13340%0.396CS..EExtended strand (participates in β ladder)trans-113.1135168.8-57-179.7000107.9L89 M102 T103 L106 V128 L163 F164 C165L89-I130 HydrophobicContact CD1-CD1 4.24Å; L89-I130 HydrophobicContact CD1-CG1 4.5Å; L89-I130 HydrophobicContact CD2-CD1 4.19Å; M102-I130 HydrophobicContact CB-CD1 4.23Å; M102-I130 HydrophobicContact CG-CD1 4.01Å; T103-I130 WeakPolarHBondContact OG1-CD1 3.5Å; T103-I130 WeakPolarHBondContact OG1-CG1 3.18Å; L106-I130 HydrophobicContact CD1-CD1 4.07Å; V128-I130 HydrophobicContact CG1-CG1 4.28Å; I130-L163 HydrophobicContact CG2-CD2 4.26Å; I130-F164 WeakPolarHBondContact CA-O 3.37Å; I130-C165 HydrophobicContact CG1-CB 4.37Å
131G96.3Very high94.6Very high9 Ų971.8 Ų71.89%0.09341%0.408CS..EExtended strand (participates in β ladder)trans-151.3160176.300000112.8L163 F164G131-L163 CarbonylContact O-C 3.48Å; G131-L163 WeakPolarHBondContact O-CA 3.34Å; G131-L163 VanDerWaalsContact O-CB 3.28Å; G131-L163 WeakPolarHBondContact O-CB 3.16Å; G131-F164 VanDerWaalsContact C-CE1 3.5Å; G131-F164 VanDerWaalsContact CA-CE1 3.47Å; G131-F164 PolarHBondContact N-O 2.79Å; G131-F164 VanDerWaalsContact N-O 3.09Å; G131-F164 VanDerWaalsContact O-CD1 3.26Å; G131-F164 WeakPolarHBondContact O-CD1 3.32Å; G131-F164 PolarHBondContact O-N 2.75Å
132Q97Very high94.7Very high83 Ų8372.7 Ų72.739%0.38842%0.42SS..EExtended strand (participates in β ladder)trans-66.4145.7179.1-164.11783.700111.3Y94 N134 Q136Y94-Q132 HydrophobicContact CD1-CB 3.57Å; Y94-Q132 HydrophobicContact CD1-CG 3.59Å; Y94-Q132 HydrophobicContact CD2-CB 4.09Å; Y94-Q132 HydrophobicContact CE1-CB 3.62Å; Y94-Q132 HydrophobicContact CE1-CG 4.07Å; Y94-Q132 HydrophobicContact CE2-CB 4.13Å; Y94-Q132 VanDerWaalsContact CE2-N 3.29Å; Y94-Q132 HydrophobicContact CG-CB 3.8Å; Y94-Q132 HydrophobicContact CG-CG 3.92Å; Q132-N134 HydrophobicContact CG-CB 4.26Å; Q132-Q136 PolarHBondContact O-NE2 3.21Å
133L95.4Very high94.8Very high80 Ų8082.9 Ų82.942%0.41946%0.459SS..  trans-9993.9170.4-167.172000109.4N160 S162L133-N160 WeakPolarHBondContact CD2-O 3.31Å; L133-S162 PolarHBondContact N-O 3.48Å
134N94.4Very high94.6Very high120 Ų12080.2 Ų80.264%0.64246%0.455SS*.SBendtrans-134.532.5-176.4-166.533.2000112.4Q132 Q136Q132-N134 HydrophobicContact CG-CB 4.26Å; N134-Q136 VanDerWaalsContact C-N 3.34Å; N134-Q136 VanDerWaalsContact CB-OE1 3.3Å; N134-Q136 PolarHBondContact O-N 2.94Å; N134-Q136 PolarHBondContact O-OE1 2.87Å
135G90.6Very high94.6Very high84 Ų8486.6 Ų86.687%0.86649%0.486SS*.SBendtrans81.92.9178.400000115.8
136Q92.2Very high94.5Very high100 Ų10087.2 Ų87.247%0.46748%0.481SS..  trans-79.8153.9171.171.6-84.238.200112.6Q132 N134Q132-Q136 PolarHBondContact O-NE2 3.21Å; N134-Q136 VanDerWaalsContact C-N 3.34Å; N134-Q136 VanDerWaalsContact CB-OE1 3.3Å; N134-Q136 PolarHBondContact O-N 2.94Å; N134-Q136 PolarHBondContact O-OE1 2.87Å
137G90.3Very high94.2Very high78 Ų7889 Ų8980%0.80449%0.49SS*.  trans-101.5146.8172.400000112
138M91.1Very high93.9Very high100 Ų10090.9 Ų90.949%0.49351%0.507SS..  trans-136.1135.2172.6-171.5-176.967.600109.7I140 F164M138-I140 HydrophobicContact CE-CD1 3.41Å; M138-I140 VanDerWaalsContact CE-CD1 3.41Å; M138-I140 HydrophobicContact CE-CG1 3.85Å; M138-I140 HydrophobicContact SD-CD1 4.4Å; M138-I140 HydrophobicContact SD-CG1 4.38Å; M138-F164 HydrophobicContact CE-CD2 3.93Å; M138-F164 HydrophobicContact CE-CE2 3.1Å; M138-F164 HydrophobicContact CE-CZ 3.48Å; M138-F164 VanDerWaalsContact CE-CZ 3.48Å; M138-F164 HydrophobicContact SD-CE2 3.82Å; M138-F164 HydrophobicContact SD-CZ 3.59Å; M138-F164 VanDerWaalsContact SD-CZ 3.59Å
139Q93.4Very high93.6Very high182 Ų18295.8 Ų95.885%0.8553%0.533SS*.  trans-121.9125173.6-176.5178.4-10.500109.2
140I93.4Very high93.3Very high72 Ų7295.2 Ų95.237%0.36953%0.529SS..  trans-107.8130.5175.3-60.9163.1000108.1H129 M138H129-I140 HydrophobicContact CB-CD1 4.37Å; H129-I140 VanDerWaalsContact CD2-CD1 3.47Å; H129-I140 WeakPolarHBondContact CD2-CD1 3.48Å; M138-I140 HydrophobicContact CE-CD1 3.41Å; M138-I140 VanDerWaalsContact CE-CD1 3.41Å; M138-I140 HydrophobicContact CE-CG1 3.85Å; M138-I140 HydrophobicContact SD-CD1 4.4Å; M138-I140 HydrophobicContact SD-CG1 4.38Å
141S93.9Very high93.2Very high95 Ų9594.9 Ų94.966%0.66453%0.528SS*.  trans-137.8135172.264.30000110
142S92.5Very high93.2Very high58 Ų5895.9 Ų95.941%0.40653%0.532SS..  trans-113.6146.3170.850.20000110.4Y170S142-Y170 WeakPolarHBondContact CB-OH 3.26Å; S142-Y170 PolarHBondContact OG-OH 3.36Å
143R94.2Very high93.2Very high237 Ų23796.6 Ų96.689%0.89453%0.534SS*.  trans-128.2125.5174-64.5-67-168.5160.22.1107
144C92Very high93.4Very high69 Ų6993.2 Ų93.247%0.46652%0.517SS..  trans-128.6142.2-176.3-59.40000109.3W146C144-W146 HydrophobicContact CB-CB 4.32Å; C144-W146 HydrophobicContact CB-CD2 3.95Å; C144-W146 HydrophobicContact CB-CE3 4.19Å; C144-W146 HydrophobicContact CB-CG 4.02Å
145L94.3Very high93.5Very high186 Ų18690.1 Ų90.197%0.97451%0.505SS*.  trans-100.2108.1160.9179.966.6000105.9
146W94.6Very high93.8Very high89 Ų8988 Ų8834%0.33747%0.472SS..  trans-150.5163.9-167.869.1-6.7000111.1C144 D151 F153 Y170C144-W146 HydrophobicContact CB-CB 4.32Å; C144-W146 HydrophobicContact CB-CD2 3.95Å; C144-W146 HydrophobicContact CB-CE3 4.19Å; C144-W146 HydrophobicContact CB-CG 4.02Å; W146-D151 WeakPolarHBondContact CA-OD2 3.26Å; W146-D151 HydrophobicContact CB-CB 3.75Å; W146-D151 VanDerWaalsContact CB-OD2 3.27Å; W146-D151 WeakPolarHBondContact CB-OD2 3.32Å; W146-D151 HydrophobicContact CD2-CB 3.78Å; W146-D151 HydrophobicContact CE3-CB 3.53Å; W146-D151 HydrophobicContact CG-CB 3.92Å; W146-D151 HydrophobicContact CZ3-CB 4.37Å; W146-F153 HydrophobicContact CH2-CB 4.08Å; W146-F153 AromaticContact CH2-CD1 3.52Å; W146-F153 HydrophobicContact CH2-CD1 3.52Å; W146-F153 HydrophobicContact CH2-CE1 4.28Å; W146-F153 HydrophobicContact CH2-CG 4.12Å; W146-F153 HydrophobicContact CZ2-CD1 4.23Å; W146-F153 HydrophobicContact CZ3-CB 4.31Å; W146-Y170 HydrophobicContact CZ3-CD1 4.19Å
147D92.3Very high94.1Very high61 Ų6187.2 Ų87.233%0.32648%0.477SS..  trans-73.2118.4175.9-171-54.1000109.8N149 F150 D151D147-N149 PolarHBondContact O-N 2.78Å; D147-N149 VanDerWaalsContact O-N 3.16Å; D147-N149 WeakPolarHBondContact OD1-CA 3.33Å; D147-N149 VanDerWaalsContact OD1-CB 3.25Å; D147-N149 WeakPolarHBondContact OD1-CB 3.4Å; D147-N149 PolarHBondContact OD1-N 3.25Å; D147-N149 PolarHBondContact OD1-ND2 2.93Å; D147-N149 VanDerWaalsContact OD1-ND2 3.08Å; D147-F150 HydrophobicContact CB-CD2 4.44Å; D147-F150 PolarHBondContact O-N 2.85Å; D147-F150 PolarHBondContact OD1-N 2.83Å; D147-F150 WeakPolarHBondContact OD2-CD2 3.37Å; D147-D151 PolarHBondContact N-OD2 3.2Å; D147-D151 WeakPolarHBondContact O-CB 3.48Å; D147-D151 PolarHBondContact O-N 3.12Å
148P92.1Very high94.4Very high109 Ų10985.2 Ų85.271%0.70845%0.447SS*.THydrogen-bonded Turntrans-68.7-13.9-175.930.2-36.5000114.1
149N90.9Very high94.6Very high114 Ų11488.3 Ų88.361%0.6146%0.457SS*.THydrogen-bonded Turntrans-93.2-35.4-178.6-49.8-66.5000111.8D147D147-N149 PolarHBondContact O-N 2.78Å; D147-N149 VanDerWaalsContact O-N 3.16Å; D147-N149 WeakPolarHBondContact OD1-CA 3.33Å; D147-N149 VanDerWaalsContact OD1-CB 3.25Å; D147-N149 WeakPolarHBondContact OD1-CB 3.4Å; D147-N149 PolarHBondContact OD1-N 3.25Å; D147-N149 PolarHBondContact OD1-ND2 2.93Å; D147-N149 VanDerWaalsContact OD1-ND2 3.08Å
150F91.9Very high94.7Very high47 Ų4780.9 Ų80.921%0.20642%0.424CS..THydrogen-bonded Turntrans-116.2-31.1-168.3-50.6-49.5000113.7T66 P68 Y122 D147 Y173T66-F150 WeakPolarHBondContact O-CZ 3.44Å; P68-F150 HydrophobicContact CG-CD1 3.58Å; P68-F150 HydrophobicContact CG-CE1 4.06Å; P68-F150 HydrophobicContact CG-CG 4.23Å; Y122-F150 WeakPolarHBondContact CE1-O 3.42Å; Y122-F150 PolarHBondContact OH-O 3.01Å; D147-F150 HydrophobicContact CB-CD2 4.44Å; D147-F150 PolarHBondContact O-N 2.85Å; D147-F150 PolarHBondContact OD1-N 2.83Å; D147-F150 WeakPolarHBondContact OD2-CD2 3.37Å; F150-Y173 HydrophobicContact CB-CD1 4.16Å; F150-Y173 HydrophobicContact CB-CG 4Å; F150-Y173 HydrophobicContact CD2-CD1 4.25Å; F150-Y173 HydrophobicContact CG-CD1 4.36Å
151D95.1Very high94.9Very high19 Ų1983.1 Ų83.110%0.10244%0.441CS..  trans-84.9138.9177.2-59.8-30.7000110.2W146 D147 G171 I172 Y173W146-D151 WeakPolarHBondContact CA-OD2 3.26Å; W146-D151 HydrophobicContact CB-CB 3.75Å; W146-D151 VanDerWaalsContact CB-OD2 3.27Å; W146-D151 WeakPolarHBondContact CB-OD2 3.32Å; W146-D151 HydrophobicContact CD2-CB 3.78Å; W146-D151 HydrophobicContact CE3-CB 3.53Å; W146-D151 HydrophobicContact CG-CB 3.92Å; W146-D151 HydrophobicContact CZ3-CB 4.37Å; D147-D151 PolarHBondContact N-OD2 3.2Å; D147-D151 WeakPolarHBondContact O-CB 3.48Å; D147-D151 PolarHBondContact O-N 3.12Å; D151-G171 WeakPolarHBondContact CA-O 3.47Å; D151-I172 VanDerWaalsContact OD1-CA 3.26Å; D151-I172 WeakPolarHBondContact OD1-CA 3.18Å; D151-Y173 PolarHBondContact OD1-N 2.93Å
152T96.3Very high95Very high31 Ų3179.6 Ų79.619%0.1942%0.416CS..EExtended strand (participates in β ladder)trans-154174.5-178-162.90000112.1F72 I74 Y170 G171F72-T152 HydrophobicContact CB-CG2 3.56Å; F72-T152 HydrophobicContact CD1-CG2 3.42Å; F72-T152 VanDerWaalsContact CD1-CG2 3.42Å; F72-T152 HydrophobicContact CE1-CG2 4.36Å; F72-T152 HydrophobicContact CG-CG2 3.78Å; I74-T152 HydrophobicContact CD1-CG2 4.19Å; I74-T152 WeakPolarHBondContact CD1-OG1 3.26Å; I74-T152 HydrophobicContact CG1-CG2 4.07Å; T152-Y170 WeakPolarHBondContact O-CA 3.38Å; T152-G171 PolarHBondContact N-O 2.63Å; T152-G171 PolarHBondContact O-N 3.42Å
153F97.2Very high95.2Very high98 Ų9876.8 Ų76.843%0.4340%0.397SS..EExtended strand (participates in β ladder)trans-146.1156.7177.478.3-65.5000111.8W146 T168 V169 Y170W146-F153 HydrophobicContact CH2-CB 4.08Å; W146-F153 AromaticContact CH2-CD1 3.52Å; W146-F153 HydrophobicContact CH2-CD1 3.52Å; W146-F153 HydrophobicContact CH2-CE1 4.28Å; W146-F153 HydrophobicContact CH2-CG 4.12Å; W146-F153 HydrophobicContact CZ2-CD1 4.23Å; W146-F153 HydrophobicContact CZ3-CB 4.31Å; F153-T168 HydrophobicContact CD2-CG2 3.94Å; F153-V169 CarbonylContact C-O 3.5Å; F153-V169 WeakPolarHBondContact CA-O 3.48Å; F153-Y170 HydrophobicContact CB-CD1 3.62Å; F153-Y170 HydrophobicContact CB-CE1 3.93Å; F153-Y170 HydrophobicContact CB-CG 4.33Å; F153-Y170 HydrophobicContact CG-CE1 4.43Å
154V97.7Very high95.4Very high9 Ų967.5 Ų67.56%0.05536%0.363CS..EExtended strand (participates in β ladder)trans-131.7131.7173.2-169.20000108I74 I77 L81 T168 V169I74-V154 HydrophobicContact CB-CG2 4.11Å; I74-V154 HydrophobicContact CG1-CG2 4.11Å; I74-V154 HydrophobicContact CG2-CG2 3.89Å; I77-V154 HydrophobicContact CB-CG2 4.27Å; I77-V154 HydrophobicContact CG2-CB 4.14Å; I77-V154 HydrophobicContact CG2-CG1 4.48Å; I77-V154 HydrophobicContact CG2-CG2 4.13Å; L81-V154 HydrophobicContact CD1-CB 4.39Å; L81-V154 HydrophobicContact CD1-CG1 4.09Å; V154-T168 CarbonylContact O-C 3.49Å; V154-T168 WeakPolarHBondContact O-CA 3.26Å; V154-V169 PolarHBondContact N-O 2.98Å; V154-V169 PolarHBondContact O-N 3.19Å
155S97.4Very high95.6Very high55 Ų5564.2 Ų64.239%0.38534%0.341SS..EExtended strand (participates in β ladder)trans-125.3141.4177.1-170.60000110.8A167 T168S155-A167 CarbonylContact C-O 3.6Å; S155-A167 VanDerWaalsContact CA-O 3.29Å; S155-A167 WeakPolarHBondContact CA-O 3.49Å; S155-A167 PolarHBondContact OG-O 2.95Å; S155-T168 PolarHBondContact OG-OG1 3.24Å; S155-T168 VanDerWaalsContact OG-OG1 3.13Å
156H97.9Very high95.8Very high40 Ų4056 Ų5619%0.18530%0.298CS..EExtended strand (participates in β ladder)trans-133.4139.3172.6-170.564.6000110L81 I85 A167L81-H156 HydrophobicContact CB-CB 3.77Å; L81-H156 HydrophobicContact CD1-CB 4.06Å; I85-H156 HydrophobicContact CD1-CB 4.38Å; H156-A167 PolarHBondContact N-O 3.23Å; H156-A167 PolarHBondContact O-N 3.18Å
157S96.9Very high96Very high82 Ų8251.7 Ų51.757%0.57328%0.282SS*.EExtended strand (participates in β ladder)trans-125137.6177.3-62.10000110.3C165 S166S157-C165 CarbonylContact C-O 3.53Å; S157-C165 WeakPolarHBondContact CA-O 3.26Å; S157-S166 PolarHBondContact OG-OG 3.22Å
158F97.4Very high96.2Very high37 Ų3749.1 Ų49.116%0.16227%0.269CS..EExtended strand (participates in β ladder)trans-131.1150.4-177173.1-95000109.8I85 T86 L89 N160 L163 F164 C165I85-F158 HydrophobicContact CG2-CB 3.45Å; I85-F158 VanDerWaalsContact CG2-CB 3.45Å; I85-F158 HydrophobicContact CG2-CD1 4.18Å; I85-F158 HydrophobicContact CG2-CG 3.85Å; T86-F158 HydrophobicContact CG2-CE2 4.49Å; L89-F158 HydrophobicContact CB-CD1 4.02Å; L89-F158 HydrophobicContact CB-CE1 3.75Å; L89-F158 HydrophobicContact CD1-CD1 4.41Å; F158-N160 HydrophobicContact CE1-CB 3.88Å; F158-N160 HydrophobicContact CZ-CB 3.95Å; F158-L163 HydrophobicContact CE1-CD1 4.49Å; F158-F164 WeakPolarHBondContact O-CA 3.37Å; F158-C165 HydrophobicContact CB-CB 4.4Å; F158-C165 PolarHBondContact N-O 2.88Å; F158-C165 PolarHBondContact O-N 3.28Å
159K96.1Very high96.5Very high164 Ų16444 Ų4471%0.71324%0.235SC*.EExtended strand (participates in β ladder)trans-143.9142.5172.964.1178.8-176.6176.80110
160N95.6Very high96.9Very high27 Ų2739.7 Ų39.714%0.14421%0.211CC..  trans-121.1-156.1166.571.914.5000109.4L89 M92 L133 F158 S162 L163L89-N160 PolarHBondContact O-ND2 2.76Å; M92-N160 PolarHBondContact O-ND2 2.94Å; L133-N160 WeakPolarHBondContact CD2-O 3.31Å; F158-N160 HydrophobicContact CE1-CB 3.88Å; F158-N160 HydrophobicContact CZ-CB 3.95Å; N160-S162 PolarHBondContact OD1-N 3.23Å; N160-L163 PolarHBondContact N-O 3.1Å; N160-L163 WeakPolarHBondContact OD1-CG 3.21Å; N160-L163 PolarHBondContact OD1-N 2.89Å; N160-L163 PolarHBondContact OD1-O 2.72Å
161T96Very high97.1Very high119 Ų11937.4 Ų37.473%0.7320%0.201SC*.SBendtrans-74.7-24.3-178.351.20000114.6
162S97Very high97.1Very high20 Ų2039.6 Ų39.614%0.1421%0.212CC..SBendtrans-126.4-16.5-173.964.70000115.7Q93 Y94 L133 N160Q93-S162 WeakPolarHBondContact CA-OG 3.41Å; Q93-S162 PolarHBondContact OE1-OG 3.47Å; Y94-S162 PolarHBondContact N-OG 2.98Å; L133-S162 PolarHBondContact N-O 3.48Å; N160-S162 PolarHBondContact OD1-N 3.23Å
163L97.1Very high97Very high0 Ų039.7 Ų39.70%021%0.209CC..EExtended strand (participates in β ladder)trans-138.3162.8179.460.179.5000113.1L89 M92 Y94 I130 G131 F158 N160L89-L163 HydrophobicContact CB-CD1 4.33Å; L89-L163 HydrophobicContact CD1-CD1 4.25Å; M92-L163 HydrophobicContact CB-CD2 4.5Å; M92-L163 HydrophobicContact CE-CD2 4.4Å; M92-L163 HydrophobicContact CG-CD2 4.13Å; M92-L163 HydrophobicContact SD-CD2 4.37Å; Y94-L163 HydrophobicContact CD2-CB 4.01Å; Y94-L163 HydrophobicContact CG-CB 4.48Å; I130-L163 HydrophobicContact CG2-CD2 4.26Å; G131-L163 CarbonylContact O-C 3.48Å; G131-L163 WeakPolarHBondContact O-CA 3.34Å; G131-L163 VanDerWaalsContact O-CB 3.28Å; G131-L163 WeakPolarHBondContact O-CB 3.16Å; F158-L163 HydrophobicContact CE1-CD1 4.49Å; N160-L163 PolarHBondContact N-O 3.1Å; N160-L163 WeakPolarHBondContact OD1-CG 3.21Å; N160-L163 PolarHBondContact OD1-N 2.89Å; N160-L163 PolarHBondContact OD1-O 2.72Å
164F96.8Very high96.4Very high41 Ų4138.9 Ų38.918%0.1821%0.205CC..EExtended strand (participates in β ladder)trans-115.9156.7162.771.9-95.4000109.8I130 G131 M138 F158I130-F164 WeakPolarHBondContact CA-O 3.37Å; G131-F164 VanDerWaalsContact C-CE1 3.5Å; G131-F164 VanDerWaalsContact CA-CE1 3.47Å; G131-F164 PolarHBondContact N-O 2.79Å; G131-F164 VanDerWaalsContact N-O 3.09Å; G131-F164 VanDerWaalsContact O-CD1 3.26Å; G131-F164 WeakPolarHBondContact O-CD1 3.32Å; G131-F164 PolarHBondContact O-N 2.75Å; M138-F164 HydrophobicContact CE-CD2 3.93Å; M138-F164 HydrophobicContact CE-CE2 3.1Å; M138-F164 HydrophobicContact CE-CZ 3.48Å; M138-F164 VanDerWaalsContact CE-CZ 3.48Å; M138-F164 HydrophobicContact SD-CE2 3.82Å; M138-F164 HydrophobicContact SD-CZ 3.59Å; M138-F164 VanDerWaalsContact SD-CZ 3.59Å; F158-F164 WeakPolarHBondContact O-CA 3.37Å
165C97.6Very high95.2Very high1 Ų144.8 Ų44.81%0.00723%0.232CC..EExtended strand (participates in β ladder)trans-134.5137.6168.5179.60000110.2I85 L89 H129 I130 S157 F158I85-C165 HydrophobicContact CG2-CB 4.12Å; L89-C165 HydrophobicContact CD1-CB 3.3Å; H129-C165 CarbonylContact O-C 3.56Å; H129-C165 WeakPolarHBondContact O-CA 3.25Å; I130-C165 HydrophobicContact CG1-CB 4.37Å; S157-C165 CarbonylContact C-O 3.53Å; S157-C165 WeakPolarHBondContact CA-O 3.26Å; F158-C165 HydrophobicContact CB-CB 4.4Å; F158-C165 PolarHBondContact N-O 2.88Å; F158-C165 PolarHBondContact O-N 3.28Å
166S97.6Very high95.1Very high12 Ų1244.3 Ų44.38%0.08423%0.225CC..EExtended strand (participates in β ladder)trans-130.6121.5169.6-170.10000109V128 H129 S157V128-S166 CarbonylContact C-O 3.57Å; V128-S166 WeakPolarHBondContact CA-O 3.37Å; H129-S166 PolarHBondContact N-O 3.26Å; H129-S166 PolarHBondContact O-N 3.19Å; S157-S166 PolarHBondContact OG-OG 3.22Å
167A98.2Very high95Very high0 Ų044.5 Ų44.50%023%0.227CC..EExtended strand (participates in β ladder)trans-118.9137.8178.200000110.2L81 I85 I110 L127 V128 S155 H156L81-A167 HydrophobicContact CD2-CB 4.03Å; I85-A167 HydrophobicContact CD1-CB 3.42Å; I85-A167 VanDerWaalsContact CD1-CB 3.42Å; I85-A167 HydrophobicContact CG1-CB 4.5Å; I110-A167 HydrophobicContact CD1-CB 4.45Å; L127-A167 CarbonylContact O-C 3.56Å; L127-A167 VanDerWaalsContact O-CA 3.3Å; L127-A167 WeakPolarHBondContact O-CA 3.34Å; V128-A167 HydrophobicContact CG2-CB 3.99Å; S155-A167 CarbonylContact C-O 3.6Å; S155-A167 VanDerWaalsContact CA-O 3.29Å; S155-A167 WeakPolarHBondContact CA-O 3.49Å; S155-A167 PolarHBondContact OG-O 2.95Å; H156-A167 PolarHBondContact N-O 3.23Å; H156-A167 PolarHBondContact O-N 3.18Å
168T98.3Very high94.9Very high7 Ų742.4 Ų42.44%0.04321%0.208CC..EExtended strand (participates in β ladder)trans-133.4130.6177.3-53.50000110.1I126 L127 F153 V154 S155 Y170I126-T168 WeakPolarHBondContact CA-O 3.41Å; L127-T168 PolarHBondContact N-O 2.84Å; L127-T168 PolarHBondContact O-N 2.74Å; F153-T168 HydrophobicContact CD2-CG2 3.94Å; V154-T168 CarbonylContact O-C 3.49Å; V154-T168 WeakPolarHBondContact O-CA 3.26Å; S155-T168 PolarHBondContact OG-OG1 3.24Å; S155-T168 VanDerWaalsContact OG-OG1 3.13Å; T168-Y170 HydrophobicContact CG2-CD2 4.22Å; T168-Y170 HydrophobicContact CG2-CE1 4.13Å; T168-Y170 HydrophobicContact CG2-CE2 3.6Å
169V98.3Very high94.7Very high0 Ų042.8 Ų42.80%021%0.21CC..EExtended strand (participates in β ladder)trans-113.7122.4176.2-175.90000107.9F72 I77 L81 I110 T124 V125 I126 F153 V154F72-V169 HydrophobicContact CE1-CG1 4.4Å; F72-V169 HydrophobicContact CZ-CG1 4.02Å; I77-V169 HydrophobicContact CG2-CB 4.08Å; I77-V169 HydrophobicContact CG2-CG1 4.22Å; I77-V169 HydrophobicContact CG2-CG2 4.08Å; L81-V169 HydrophobicContact CD1-CG2 4.02Å; L81-V169 HydrophobicContact CD2-CG2 3.76Å; L81-V169 HydrophobicContact CG-CG2 4.18Å; I110-V169 HydrophobicContact CG2-CG2 3.97Å; T124-V169 HydrophobicContact CG2-CG1 3.6Å; V125-V169 CarbonylContact O-C 3.57Å; V125-V169 WeakPolarHBondContact O-CA 3.49Å; I126-V169 HydrophobicContact CG1-CG1 4.25Å; I126-V169 HydrophobicContact CG1-CG2 4.21Å; F153-V169 CarbonylContact C-O 3.5Å; F153-V169 WeakPolarHBondContact CA-O 3.48Å; V154-V169 PolarHBondContact N-O 2.98Å; V154-V169 PolarHBondContact O-N 3.19Å
170Y97.6Very high94.7Very high24 Ų2435.2 Ų35.29%0.09418%0.179CC..EExtended strand (participates in β ladder)trans-101.4130.4172.6-57.2-91.5000109T124 V125 S142 W146 T152 F153 T168T124-Y170 WeakPolarHBondContact CA-O 3.19Å; V125-Y170 HydrophobicContact CB-CD2 4.28Å; V125-Y170 HydrophobicContact CG1-CD2 4.39Å; V125-Y170 PolarHBondContact N-O 3.37Å; V125-Y170 PolarHBondContact O-N 2.77Å; S142-Y170 WeakPolarHBondContact CB-OH 3.26Å; S142-Y170 PolarHBondContact OG-OH 3.36Å; W146-Y170 HydrophobicContact CZ3-CD1 4.19Å; T152-Y170 WeakPolarHBondContact O-CA 3.38Å; F153-Y170 HydrophobicContact CB-CD1 3.62Å; F153-Y170 HydrophobicContact CB-CE1 3.93Å; F153-Y170 HydrophobicContact CB-CG 4.33Å; F153-Y170 HydrophobicContact CG-CE1 4.43Å; T168-Y170 HydrophobicContact CG2-CD2 4.22Å; T168-Y170 HydrophobicContact CG2-CE1 4.13Å; T168-Y170 HydrophobicContact CG2-CE2 3.6Å
171G96.7Very high94.6Very high0 Ų035.7 Ų35.70%018%0.181CC..EExtended strand (participates in β ladder)trans-105.9114.2168.500000109.1F72 D151 T152F72-G171 VanDerWaalsContact CE2-CA 3.45Å; D151-G171 WeakPolarHBondContact CA-O 3.47Å; T152-G171 PolarHBondContact N-O 2.63Å; T152-G171 PolarHBondContact O-N 3.42Å
172I95.7Very high94.5Very high65 Ų6529.8 Ų29.833%0.33314%0.142SC..EExtended strand (participates in β ladder)trans-112.6114.9-179.4-57.7153.4000107.8Y122 K123 V125 D151Y122-I172 CarbonylContact C-O 3.54Å; Y122-I172 WeakPolarHBondContact CA-O 3.32Å; K123-I172 PolarHBondContact N-O 2.97Å; K123-I172 PolarHBondContact O-N 2.76Å; V125-I172 HydrophobicContact CG2-CD1 4Å; D151-I172 VanDerWaalsContact OD1-CA 3.26Å; D151-I172 WeakPolarHBondContact OD1-CA 3.18Å
173Y93.6Very high94.3Very high32 Ų3230.5 Ų30.513%0.12514%0.142CC..EExtended strand (participates in β ladder)trans-65133.3175.8-173.9-115.4000109.5P68 R121 Y122 F150 D151P68-Y173 HydrophobicContact CB-CD2 3.93Å; P68-Y173 HydrophobicContact CB-CE2 3.49Å; P68-Y173 VanDerWaalsContact CB-CE2 3.49Å; P68-Y173 HydrophobicContact CG-CD2 4.39Å; P68-Y173 HydrophobicContact CG-CE2 4.24Å; R121-Y173 HydrophobicContact CB-CD2 4.14Å; R121-Y173 HydrophobicContact CB-CE2 3.63Å; R121-Y173 PolarHBondContact NH1-OH 2.78Å; R121-Y173 WeakPolarHBondContact O-CA 3.41Å; R121-Y173 VanDerWaalsContact O-CD2 3.26Å; R121-Y173 WeakPolarHBondContact O-CD2 3.42Å; Y122-Y173 HydrophobicContact CD2-CD2 4.1Å; Y122-Y173 HydrophobicContact CE1-CD2 4.46Å; Y122-Y173 AromaticContact CE2-CD2 3.74Å; Y122-Y173 HydrophobicContact CE2-CD2 3.74Å; Y122-Y173 HydrophobicContact CE2-CE2 4.49Å; Y122-Y173 AromaticContact CZ-CD2 3.94Å; F150-Y173 HydrophobicContact CB-CD1 4.16Å; F150-Y173 HydrophobicContact CB-CG 4Å; F150-Y173 HydrophobicContact CD2-CD1 4.25Å; F150-Y173 HydrophobicContact CG-CD1 4.36Å; D151-Y173 PolarHBondContact OD1-N 2.93Å
174F85.4Confident94.1Very high82 Ų8233.1 Ų33.136%0.3615%0.154SC..  trans-130.9126178.8108.6-95.4000109.7R121 K123R121-F174 WeakPolarHBondContact CB-O 3.42Å; R121-F174 PolarHBondContact NE-O 2.93Å; R121-F174 PolarHBondContact O-N 3.21Å; K123-F174 HydrophobicContact CD-CB 4.12Å; K123-F174 HydrophobicContact CD-CD1 4.48Å; K123-F174 HydrophobicContact CD-CG 4.32Å; K123-F174 HydrophobicContact CG-CB 4.2Å; K123-F174 HydrophobicContact CG-CD1 3.95Å; K123-F174 HydrophobicContact CG-CG 4.25Å
175E73.1Confident93.8Very high133 Ų13332.4 Ų32.462%0.62115%0.152SC*.  trans-91.20173.8-180110.6-126.700111.7R121R121-E175 IonicContact CZ-OE1 3.19Å; R121-E175 IonicContact NH1-OE1 2.75Å; R121-E175 PolarHBondContact NH1-OE1 2.98Å; R121-E175 IonicContact NH1-OE2 3.64Å; R121-E175 IonicContact NH2-OE1 2.72Å; R121-E175 PolarHBondContact NH2-OE1 3.33Å; R121-E175 PolarHBondContact NH2-OXT 3.42Å

Retrieved 175 of 175 residues in 112.3 ms (Link to these results)