A0A096LZP9_POEFO Loading...

Ribosome production factor 1

May be required for ribosome biogenesis.

AlphaFold DB , UniProt , Accession A0A096LZP9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 351 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
1K37.1Very low33.4Very low258 Ų258152.4 Ų152.4100%1.12281%0.808SS**  0104.10-87.3178.7172.2177.10107.2
2M33.8Very low32.8Very low173 Ų173145 Ų14585%0.85280%0.796SS**  trans46.3127.3151.4-58.6179.3-164.900118
3D33.5Very low32.4Very low131 Ų131142.7 Ų142.770%0.70180%0.796SS**  cis-163.7135.111.5-90.2-28.3000107.5
4V35.7Very low31.9Very low118 Ų118146.3 Ų146.372%0.71580%0.799SS**  60114.9103.1-171.10000111.5
5T34.8Very low31.9Very low122 Ų122144.6 Ų144.675%0.74880%0.803SS**  176.5129.258.12.50000106.3
6E29.2Very low31.6Very low175 Ų175147.8 Ų147.882%0.81881%0.806SS**  35.1136.484.6-68.9-163.5-176.100115.1
7V31.2Very low31.4Very low120 Ų120150.7 Ų150.773%0.72781%0.809SS**  cis-170.3164.111.7126.70000106.9
8P47.2Very low31.1Very low108 Ų108154.1 Ų154.170%0.70182%0.815SS**  trans-94.3167.6-172.336.5-29.4000113.3
9T29.4Very low30.8Very low138 Ų138156.7 Ų156.785%0.84782%0.819SS**  trans-152.614416247.40000107.5
10D28.2Very low30.6Very low150 Ų150158 Ų15880%0.80282%0.817SS**  cis-156.4157.79.3-157.6-4.2000109.6
11Q27.2Very low30.4Very low183 Ų183156.3 Ų156.386%0.85582%0.819SS**  trans-70.4174177-57.4-176.1-6.200112.7
12G26.2Very low29.9Very low64 Ų64151.4 Ų151.466%0.6680%0.802SS**  trans118.776.8136.500000116.9
13S27.7Very low29.5Very low115 Ų115151.5 Ų151.580%0.80480%0.798SS**  trans1.8119.9136.957.90000117.9
14K26Very low29.1Very low193 Ų193150.4 Ų150.484%0.83981%0.807SS**  trans-143.1105.7138.4-75.5-166179.1165.10111.4K16K14-K16 PolarHBondContact O-N 3.37Å
15S31Very low28.7Very low121 Ų121152.2 Ų152.285%0.84681%0.805SS**  trans-38.9119.3152.948.60000112.2
16K27.4Very low28.3Very low196 Ų196153 Ų15385%0.85281%0.809SS**  trans-125.3103.2163.4-90-178.8179.1171.10110.4K14K14-K16 PolarHBondContact O-N 3.37Å
17K27.8Very low28Very low197 Ų197153 Ų15386%0.85781%0.807SS**  trans20.4117.1143.9-78.3174.8172.7173.40116.5K19K17-K19 PolarHBondContact O-N 2.97Å
18K26.7Very low27.8Very low211 Ų211153.5 Ų153.592%0.91781%0.81SS**  trans-39.4102.4149.5-82.4175.6172.7170.80110.2K20K18-K20 PolarHBondContact O-N 3.46Å
19K25.5Very low26.7Very low205 Ų205157 Ų15789%0.89181%0.814SS**  trans-81.698.7160.5-97.1-178174.5179.10107.5K17 S21K17-K19 PolarHBondContact O-N 2.97Å; K19-S21 PolarHBondContact O-N 3.23Å; K19-S21 VanDerWaalsContact O-N 3.12Å
20K26.3Very low26.6Very low182 Ų182158.2 Ų158.279%0.79182%0.815SS**  trans-56.2108.4156.6-82.7176.4173174.20107K18 M22K18-K20 PolarHBondContact O-N 3.46Å; K20-M22 VanDerWaalsContact C-N 3.27Å; K20-M22 PolarHBondContact O-N 2.98Å
21S25.9Very low26.4Very low122 Ų122156.6 Ų156.685%0.85381%0.811SS**  trans-73.888.7165.551.80000108.4K19 K23K19-S21 PolarHBondContact O-N 3.23Å; K19-S21 VanDerWaalsContact O-N 3.12Å; S21-K23 PolarHBondContact O-N 3.18Å
22M27.2Very low26.3Very low156 Ų156157 Ų15777%0.76881%0.813SS**  trans-74.4117.5163.5-77.7-170.7161.100109.1K20K20-M22 VanDerWaalsContact C-N 3.27Å; K20-M22 PolarHBondContact O-N 2.98Å
23K25.3Very low26.2Very low175 Ų175159.1 Ų159.176%0.76181%0.813SS**  trans40.7115.8144-67.8172.9179.2169.10118.8S21S21-K23 PolarHBondContact O-N 3.18Å
24A25.7Very low26.2Very low107 Ų107163.5 Ų163.588%0.88482%0.818SS**  -118.183.2128.700000108
25K27.1Very low26.1Very low157 Ų157162.8 Ų162.868%0.68382%0.817SS**  trans-83.4111.6160.8-83.4-177.3173.8-176.10105.6K27K25-K27 PolarHBondContact O-N 2.93Å
26T25.4Very low25.8Very low137 Ų137165.3 Ų165.384%0.8482%0.816SS**  trans-69.879.7163.1-42.50000107.5V28T26-V28 PolarHBondContact O-N 3.46Å
27K24Very low26.1Very low176 Ų176162 Ų16277%0.76582%0.817SS**  trans-76.2105.1159.7-90.6-174.7168.3-168.70105.5K25 K29K25-K27 PolarHBondContact O-N 2.93Å; K27-K29 PolarHBondContact O-N 2.94Å; K27-K29 VanDerWaalsContact O-N 3.16Å
28V26.7Very low25.9Very low131 Ų131157.5 Ų157.579%0.79481%0.811SS**  trans-59.4116.7157.6177.80000105.6T26 N30T26-V28 PolarHBondContact O-N 3.46Å; V28-N30 PolarHBondContact O-N 3.36Å
29K24.3Very low26.3Very low181 Ų181152.8 Ų152.879%0.78781%0.811SS**  trans-60.9120176.3-90.3175.6168.6179.80108K27 T31K27-K29 PolarHBondContact O-N 2.94Å; K27-K29 VanDerWaalsContact O-N 3.16Å; K29-T31 PolarHBondContact O-N 3.27Å
30N26.8Very low26.3Very low163 Ų163146.6 Ų146.687%0.87280%0.798SS**  trans-63.6106.3148.7-83.5-1.8000106.2V28V28-N30 PolarHBondContact O-N 3.36Å
31T24.8Very low26.6Very low117 Ų117145.8 Ų145.872%0.71880%0.797SS**  trans-89109.6157.6-11.30000105.5K29 V33K29-T31 PolarHBondContact O-N 3.27Å; T31-V33 VanDerWaalsContact C-N 3.33Å; T31-V33 PolarHBondContact O-N 2.99Å
32E24.4Very low26.8Very low191 Ų191147.6 Ų147.689%0.89380%0.797SS**  trans-61.6101.1159.1-76.3174.8160.400106.9
33V24.5Very low26.9Very low109 Ų109147.4 Ų147.466%0.66179%0.794SS**  trans-88.9113.2152.4-178.70000104.6T31 E35T31-V33 VanDerWaalsContact C-N 3.33Å; T31-V33 PolarHBondContact O-N 2.99Å; V33-E35 VanDerWaalsContact C-N 3.28Å; V33-E35 HydrophobicContact CG1-CG 4.2Å; V33-E35 PolarHBondContact O-N 3.38Å
34K27.4Very low27.3Very low207 Ų207143.4 Ų143.490%0.979%0.794SS**  trans-60.197.9158.7-85.3177.6170.6178.80106.3
35E24.3Very low27.5Very low178 Ų178145 Ų14583%0.83279%0.788SS**  trans-89.7115.8159.9-92.7178.6173.500107.6V33V33-E35 VanDerWaalsContact C-N 3.28Å; V33-E35 HydrophobicContact CG1-CG 4.2Å; V33-E35 PolarHBondContact O-N 3.38Å
36E24Very low28.4Very low173 Ų173142.9 Ų142.981%0.80879%0.79SS**  trans-50.1146.9170.7-69.5167.7144.700110.9S38E36-S38 PolarHBondContact O-N 3.46Å
37S34.8Very low29.2Very low126 Ų126141.6 Ų141.688%0.88178%0.782SS**  trans-43.6102.6161.448.30000111.1
38S23.4Very low30.1Very low104 Ų104138.8 Ų138.873%0.72778%0.78SS**  trans-119.4112.7155.254.70000107.7E36 A40E36-S38 PolarHBondContact O-N 3.46Å; S38-A40 PolarHBondContact O-N 3.38Å
39A35.2Very low31.4Very low111 Ų111138 Ų13892%0.91778%0.78SS**  trans-61.989.3164.600000107.7
40A25.7Very low32.7Very low75 Ų75133.6 Ų133.662%0.6276%0.761SS**  trans-99.1100.3167.200000107.4S38 N42S38-A40 PolarHBondContact O-N 3.38Å; A40-N42 PolarHBondContact O-N 3.06Å
41E31.7Very low34.3Very low166 Ų166129.9 Ų129.978%0.77675%0.745SS**  trans-48102.6159.5-70.5179.2149.700108.8Q43E41-Q43 PolarHBondContact O-N 2.92Å
42N30Very low36Very low160 Ų160129.9 Ų129.986%0.85676%0.757SS**  trans-73.184.9161.4-86.3-40.9000106.8A40 A44A40-N42 PolarHBondContact O-N 3.06Å; N42-A44 PolarHBondContact O-N 3Å
43Q29.2Very low37.8Very low152 Ų152126.6 Ų126.671%0.7175%0.751SS**  trans-49.3112160.5-70.8-179.1-0.200107.4E41 D45E41-Q43 PolarHBondContact O-N 2.92Å; Q43-D45 PolarHBondContact O-N 3.11Å; Q43-D45 VanDerWaalsContact O-N 3.09Å
44A33.8Very low39.9Very low91 Ų91125.1 Ų125.175%0.75274%0.735SS**  trans-68.7104.2168.900000107.2N42 P46N42-A44 PolarHBondContact O-N 3Å; A44-P46 VanDerWaalsContact O-CD 3.31Å; A44-P46 WeakPolarHBondContact O-CD 3.16Å; A44-P46 VanDerWaalsContact O-N 3.14Å
45D29.4Very low42.3Very low140 Ų140117.5 Ų117.575%0.74971%0.708SS**  trans-51.9118170.1-76.8-38.5000109.8Q43 T47Q43-D45 PolarHBondContact O-N 3.11Å; Q43-D45 VanDerWaalsContact O-N 3.09Å; D45-T47 VanDerWaalsContact C-N 3.28Å; D45-T47 PolarHBondContact O-N 3.16Å; D45-T47 VanDerWaalsContact O-N 3.15Å
46P46.3Very low45Very low112 Ų112110.4 Ų110.473%0.72768%0.677SS**  trans-91.147.9-173.437.3-34.7000110.9A44A44-P46 VanDerWaalsContact O-CD 3.31Å; A44-P46 WeakPolarHBondContact O-CD 3.16Å; A44-P46 VanDerWaalsContact O-N 3.14Å
47T42.1Very low47.8Very low111 Ų111106.6 Ų106.668%0.68167%0.669SS**  trans-150.880.2-177.9530000111D45D45-T47 VanDerWaalsContact C-N 3.28Å; D45-T47 PolarHBondContact O-N 3.16Å; D45-T47 VanDerWaalsContact O-N 3.15Å
48T44.1Very low50.4Low117 Ų117106.2 Ų106.272%0.71865%0.654SS**  -168.56496.733.90000108.3F50T48-F50 PolarHBondContact O-N 3.3Å; T48-F50 VanDerWaalsContact O-N 3.16Å
49S53.2Low53.5Low113 Ų113102.4 Ų102.479%0.7963%0.625SS**  trans-72.7101.815854.20000106.9
50F51.2Low56.1Low90 Ų90106.7 Ų106.740%0.39562%0.623SS.*  trans-52.9147.8171.4-71.3-87.2000109.9T48 F54 M68T48-F50 PolarHBondContact O-N 3.3Å; T48-F50 VanDerWaalsContact O-N 3.16Å; F50-F54 HydrophobicContact CB-CB 3.88Å; F50-F54 HydrophobicContact CB-CD1 3.86Å; F50-F54 HydrophobicContact CB-CG 4.03Å; F50-F54 HydrophobicContact CD1-CD1 4.05Å; F50-F54 HydrophobicContact CD1-CE1 4.17Å; F50-F54 HydrophobicContact CD1-CG 4.25Å; F50-F54 AromaticContact CG-CD1 3.89Å; F50-F54 HydrophobicContact CG-CD1 3.89Å; F50-F54 HydrophobicContact CG-CE1 4.27Å; F50-F54 HydrophobicContact CG-CG 4.32Å; F50-M68 HydrophobicContact CD2-CE 4.43Å; F50-M68 HydrophobicContact CE2-CE 3.71Å
51P60.4Low59.3Low84 Ų84106.9 Ų106.955%0.54561%0.613SS.*  trans-52.9148.3-179.720.1-31.4000110.8T53 F54P51-T53 PolarHBondContact O-N 3.37Å; P51-F54 HydrophobicContact CG-CB 4.49Å; P51-F54 WeakPolarHBondContact O-CB 3.47Å; P51-F54 PolarHBondContact O-N 2.9Å
52A61Low62.2Low117 Ų117107.2 Ų107.297%0.96761%0.613SS**THydrogen-bonded Turntrans-56.1-15.6-17500000114.3
53T61.3Low65.2Low122 Ų122107.3 Ų107.375%0.74861%0.608SS**THydrogen-bonded Turntrans-85.6-11177.453.30000114.4P51 S55P51-T53 PolarHBondContact O-N 3.37Å; T53-S55 PolarHBondContact O-N 3.06Å
54F70.1Confident68Low78 Ų78107.3 Ų107.334%0.34260%0.601SS.*  trans-77.2114.7-173.9-171.3-107.3000112.2F50 P51 I59F50-F54 HydrophobicContact CB-CB 3.88Å; F50-F54 HydrophobicContact CB-CD1 3.86Å; F50-F54 HydrophobicContact CB-CG 4.03Å; F50-F54 HydrophobicContact CD1-CD1 4.05Å; F50-F54 HydrophobicContact CD1-CE1 4.17Å; F50-F54 HydrophobicContact CD1-CG 4.25Å; F50-F54 AromaticContact CG-CD1 3.89Å; F50-F54 HydrophobicContact CG-CD1 3.89Å; F50-F54 HydrophobicContact CG-CE1 4.27Å; F50-F54 HydrophobicContact CG-CG 4.32Å; P51-F54 HydrophobicContact CG-CB 4.49Å; P51-F54 WeakPolarHBondContact O-CB 3.47Å; P51-F54 PolarHBondContact O-N 2.9Å; F54-I59 HydrophobicContact CE1-CD1 3.97Å; F54-I59 HydrophobicContact CE1-CG1 3.83Å; F54-I59 HydrophobicContact CZ-CD1 4.34Å; F54-I59 HydrophobicContact CZ-CG1 3.73Å
55S78Confident70.8Confident48 Ų48107.7 Ų107.734%0.33658%0.583SS.*  trans-87.1128.5177.4-176.30000111.2T53 S57 E58T53-S55 PolarHBondContact O-N 3.06Å; S55-S57 PolarHBondContact O-N 3.45Å; S55-S57 PolarHBondContact OG-N 2.96Å; S55-E58 WeakPolarHBondContact CB-OE1 3.49Å; S55-E58 WeakPolarHBondContact O-CB 3.38Å; S55-E58 PolarHBondContact O-N 2.95Å
56V80.7Confident73.7Confident28 Ų28106.5 Ų106.517%0.1757%0.573CS.*G310 helixtrans-54.7-26.7174.2-1790000111.6E58 I59 R65 M68 F69V56-E58 VanDerWaalsContact C-N 3.28Å; V56-E58 PolarHBondContact O-N 3.39Å; V56-I59 HydrophobicContact CG1-CD1 4.39Å; V56-I59 PolarHBondContact O-N 3.17Å; V56-R65 HydrophobicContact CG1-CG 4.14Å; V56-R65 WeakPolarHBondContact O-CG 3.45Å; V56-M68 HydrophobicContact CG1-CB 3.98Å; V56-M68 HydrophobicContact CG2-CB 4.49Å; V56-F69 HydrophobicContact CG1-CB 4.01Å
57S83.1Confident75.9Confident93 Ų93106.6 Ų106.665%0.6557%0.567SS**G310 helixtrans-66.1-24.5178.2-580000114.1S55 I59S55-S57 PolarHBondContact O-N 3.45Å; S55-S57 PolarHBondContact OG-N 2.96Å; S57-I59 VanDerWaalsContact C-N 3.3Å; S57-I59 PolarHBondContact O-N 3.14Å
58E87.8Confident78.1Confident119 Ų119103.9 Ų103.956%0.55655%0.547SS*.G310 helixtrans-76.7-17.3-177.5-68.7161.7-16200112.7S55 V56 K60S55-E58 WeakPolarHBondContact CB-OE1 3.49Å; S55-E58 WeakPolarHBondContact O-CB 3.38Å; S55-E58 PolarHBondContact O-N 2.95Å; V56-E58 VanDerWaalsContact C-N 3.28Å; V56-E58 PolarHBondContact O-N 3.39Å; E58-K60 PolarHBondContact O-N 3.32Å
59I88.9Confident80.4Confident24 Ų24103 Ų10312%0.12353%0.533CS..  trans-68.3106.3179.7-58171.6000109.4F54 V56 S57 N61 R64 R65 M68F54-I59 HydrophobicContact CE1-CD1 3.97Å; F54-I59 HydrophobicContact CE1-CG1 3.83Å; F54-I59 HydrophobicContact CZ-CD1 4.34Å; F54-I59 HydrophobicContact CZ-CG1 3.73Å; V56-I59 HydrophobicContact CG1-CD1 4.39Å; V56-I59 PolarHBondContact O-N 3.17Å; S57-I59 VanDerWaalsContact C-N 3.3Å; S57-I59 PolarHBondContact O-N 3.14Å; I59-N61 VanDerWaalsContact C-N 3.32Å; I59-N61 HydrophobicContact CG2-CB 4.45Å; I59-N61 PolarHBondContact O-N 3.45Å; I59-R64 HydrophobicContact CG2-CB 3.96Å; I59-R65 HydrophobicContact CB-CB 4.12Å; I59-R65 HydrophobicContact CB-CG 4.47Å; I59-R65 HydrophobicContact CG2-CB 4.17Å; I59-R65 PolarHBondContact O-NE 3.05Å; I59-R65 PolarHBondContact O-NH2 3.42Å; I59-M68 HydrophobicContact CD1-CB 4.07Å; I59-M68 HydrophobicContact CD1-CG 3.88Å
60K90.4Very high82.2Confident201 Ų201100.7 Ų100.787%0.87451%0.511SS*.  trans-60.7-35.5179.4-66.7-175.9-179.51790113.7E58 K62 R65E58-K60 PolarHBondContact O-N 3.32Å; K60-K62 PolarHBondContact O-N 2.91Å; K60-R65 PolarHBondContact O-NH2 2.99Å
61N93.8Very high84.1Confident78 Ų78101.9 Ų101.942%0.41752%0.516SS..  trans-72.6118.9179.7-177.9-49.4000112.1I59 Q63 R64 R65I59-N61 VanDerWaalsContact C-N 3.32Å; I59-N61 HydrophobicContact CG2-CB 4.45Å; I59-N61 PolarHBondContact O-N 3.45Å; N61-Q63 PolarHBondContact O-N 2.89Å; N61-Q63 PolarHBondContact OD1-N 3.05Å; N61-R64 HydrophobicContact CB-CB 4.23Å; N61-R64 HydrophobicContact CB-CG 4.42Å; N61-R64 PolarHBondContact O-N 3.33Å; N61-R64 PolarHBondContact OD1-N 3.05Å; N61-R64 VanDerWaalsContact OD1-N 3.1Å; N61-R65 VanDerWaalsContact O-CB 3.23Å; N61-R65 WeakPolarHBondContact O-CB 3.28Å; N61-R65 PolarHBondContact O-N 2.88Å
62K92.3Very high85.6Confident174 Ų174100.6 Ų100.676%0.75750%0.504SS*.Hα-helixtrans-59.4-43.2-177.8-176.5-179.8177.7-178.30113.8K60 R65 H66K60-K62 PolarHBondContact O-N 2.91Å; K62-R65 PolarHBondContact O-N 3.04Å; K62-H66 WeakPolarHBondContact O-CB 3.31Å; K62-H66 PolarHBondContact O-N 3.43Å
63Q91.9Very high87.1Confident161 Ų16199.3 Ų99.375%0.75248%0.477SS*.Hα-helixtrans-67.9-47.5-177.5-69.4177-20.700110.7N61 R65 H66 L67N61-Q63 PolarHBondContact O-N 2.89Å; N61-Q63 PolarHBondContact OD1-N 3.05Å; Q63-R65 PolarHBondContact O-N 2.91Å; Q63-H66 PolarHBondContact O-N 3.29Å; Q63-L67 PolarHBondContact O-N 3.05Å
64R88.6Confident88.5Confident153 Ų15398.9 Ų98.958%0.57747%0.466SS*.Hα-helixtrans-62.3-42.8175.7-69-173.968.7-177.60.7111.6I59 N61 H66 L67 M68I59-R64 HydrophobicContact CG2-CB 3.96Å; N61-R64 HydrophobicContact CB-CB 4.23Å; N61-R64 HydrophobicContact CB-CG 4.42Å; N61-R64 PolarHBondContact O-N 3.33Å; N61-R64 PolarHBondContact OD1-N 3.05Å; N61-R64 VanDerWaalsContact OD1-N 3.1Å; R64-H66 PolarHBondContact O-N 2.89Å; R64-L67 PolarHBondContact O-N 2.86Å; R64-M68 WeakPolarHBondContact O-CB 3.49Å; R64-M68 VanDerWaalsContact O-CG 3.31Å; R64-M68 WeakPolarHBondContact O-CG 3.39Å; R64-M68 PolarHBondContact O-N 3.29Å
65R91.7Very high89.6Confident99 Ų9999.3 Ų99.337%0.37447%0.469SS..Hα-helixtrans-58.7-46.8176-172.1-173-53.4161.63.4111.9V56 I59 K60 N61 K62 Q63 F69V56-R65 HydrophobicContact CG1-CG 4.14Å; V56-R65 WeakPolarHBondContact O-CG 3.45Å; I59-R65 HydrophobicContact CB-CB 4.12Å; I59-R65 HydrophobicContact CB-CG 4.47Å; I59-R65 HydrophobicContact CG2-CB 4.17Å; I59-R65 PolarHBondContact O-NE 3.05Å; I59-R65 PolarHBondContact O-NH2 3.42Å; K60-R65 PolarHBondContact O-NH2 2.99Å; N61-R65 VanDerWaalsContact O-CB 3.23Å; N61-R65 WeakPolarHBondContact O-CB 3.28Å; N61-R65 PolarHBondContact O-N 2.88Å; K62-R65 PolarHBondContact O-N 3.04Å; Q63-R65 PolarHBondContact O-N 2.91Å; R65-F69 VanDerWaalsContact O-CB 3.3Å; R65-F69 WeakPolarHBondContact O-CB 3.39Å; R65-F69 PolarHBondContact O-N 3.22Å
66H90.9Very high90.2Very high114 Ų114102.4 Ų102.453%0.52848%0.477SS..Hα-helixtrans-64.6-46-179.5-17772000112.1K62 Q63 R64 M68 F69 M70K62-H66 WeakPolarHBondContact O-CB 3.31Å; K62-H66 PolarHBondContact O-N 3.43Å; Q63-H66 PolarHBondContact O-N 3.29Å; R64-H66 PolarHBondContact O-N 2.89Å; H66-M68 PolarHBondContact O-N 3.2Å; H66-F69 PolarHBondContact O-N 3.43Å; H66-M70 WeakPolarHBondContact O-CG 3.46Å; H66-M70 PolarHBondContact O-N 2.92Å
67L92.4Very high90.9Very high115 Ų115108.8 Ų108.860%0.60250%0.498SS*.Hα-helixtrans-60.7-46.7178.2-172.3152000111.2Q63 R64 F69 M70 K71Q63-L67 PolarHBondContact O-N 3.05Å; R64-L67 PolarHBondContact O-N 2.86Å; L67-F69 PolarHBondContact O-N 3.29Å; L67-M70 PolarHBondContact O-N 2.87Å; L67-K71 PolarHBondContact O-N 2.96Å
68M88.4Confident91.4Very high53 Ų53111.1 Ų111.126%0.26150%0.496SS..Hα-helixtrans-62.5-42.3176.4-73-62.5-167.200112.1F50 V56 I59 R64 H66 M70 K71 L72F50-M68 HydrophobicContact CD2-CE 4.43Å; F50-M68 HydrophobicContact CE2-CE 3.71Å; V56-M68 HydrophobicContact CG1-CB 3.98Å; V56-M68 HydrophobicContact CG2-CB 4.49Å; I59-M68 HydrophobicContact CD1-CB 4.07Å; I59-M68 HydrophobicContact CD1-CG 3.88Å; R64-M68 WeakPolarHBondContact O-CB 3.49Å; R64-M68 VanDerWaalsContact O-CG 3.31Å; R64-M68 WeakPolarHBondContact O-CG 3.39Å; R64-M68 PolarHBondContact O-N 3.29Å; H66-M68 PolarHBondContact O-N 3.2Å; M68-M70 VanDerWaalsContact C-N 3.33Å; M68-M70 PolarHBondContact O-N 2.96Å; M68-K71 PolarHBondContact O-N 2.96Å; M68-L72 WeakPolarHBondContact O-CB 3.46Å; M68-L72 PolarHBondContact O-N 2.99Å
69F91.6Very high91.7Very high98 Ų98110.9 Ų110.943%0.4350%0.495SS..Hα-helixtrans-62.4-39.1176.1178-107.9000112.3V56 R65 H66 L67 K73V56-F69 HydrophobicContact CG1-CB 4.01Å; R65-F69 VanDerWaalsContact O-CB 3.3Å; R65-F69 WeakPolarHBondContact O-CB 3.39Å; R65-F69 PolarHBondContact O-N 3.22Å; H66-F69 PolarHBondContact O-N 3.43Å; L67-F69 PolarHBondContact O-N 3.29Å; F69-K73 WeakPolarHBondContact O-CB 3.42Å; F69-K73 PolarHBondContact O-N 2.98Å
70M92.3Very high91.8Very high66 Ų66117.3 Ų117.333%0.32552%0.522SS..Hα-helixtrans-63.6-44.2174.5-73.2-61.4109.100111.7H66 L67 M68 K73 Q74H66-M70 WeakPolarHBondContact O-CG 3.46Å; H66-M70 PolarHBondContact O-N 2.92Å; L67-M70 PolarHBondContact O-N 2.87Å; M68-M70 VanDerWaalsContact C-N 3.33Å; M68-M70 PolarHBondContact O-N 2.96Å; M70-K73 HydrophobicContact CE-CD 4.45Å; M70-K73 PolarHBondContact O-N 3.39Å; M70-Q74 WeakPolarHBondContact O-CG 3.42Å; M70-Q74 PolarHBondContact O-N 2.88Å
71K91.6Very high92Very high115 Ų115112.4 Ų112.450%0.551%0.505SS..Hα-helixtrans-61.3-48.9176.7-167.3177.6178.7-179.20111.6L67 M68 K73 Q74 E75L67-K71 PolarHBondContact O-N 2.96Å; M68-K71 PolarHBondContact O-N 2.96Å; K71-K73 VanDerWaalsContact C-N 3.29Å; K71-K73 PolarHBondContact O-N 3.22Å; K71-Q74 WeakPolarHBondContact O-CB 3.43Å; K71-Q74 PolarHBondContact O-N 3.1Å; K71-E75 PolarHBondContact O-N 2.96Å
72L90.4Very high92Very high57 Ų57114.4 Ų114.430%0.29851%0.512SS..Hα-helixtrans-56-42.4174.3-174.398.8000111.9M68 E75 K76M68-L72 WeakPolarHBondContact O-CB 3.46Å; M68-L72 PolarHBondContact O-N 2.99Å; L72-E75 PolarHBondContact O-N 3.42Å; L72-K76 HydrophobicContact CD2-CD 4.31Å; L72-K76 HydrophobicContact CG-CD 4.34Å; L72-K76 WeakPolarHBondContact O-CB 3.31Å; L72-K76 WeakPolarHBondContact O-CG 3.39Å; L72-K76 PolarHBondContact O-N 2.91Å
73K92.5Very high91.9Very high89 Ų89110.9 Ų110.939%0.38750%0.501SS..Hα-helixtrans-66.5-37178.1-170.7176.7-177.4177.60111.9F69 M70 K71 R77F69-K73 WeakPolarHBondContact O-CB 3.42Å; F69-K73 PolarHBondContact O-N 2.98Å; M70-K73 HydrophobicContact CE-CD 4.45Å; M70-K73 PolarHBondContact O-N 3.39Å; K71-K73 VanDerWaalsContact C-N 3.29Å; K71-K73 PolarHBondContact O-N 3.22Å; K73-R77 WeakPolarHBondContact O-CB 3.46Å; K73-R77 VanDerWaalsContact O-CG 3.26Å; K73-R77 WeakPolarHBondContact O-CG 3.32Å; K73-R77 PolarHBondContact O-N 3.25Å
74Q92.3Very high91.8Very high113 Ų113110.6 Ų110.653%0.52850%0.497SS..Hα-helixtrans-66.4-45.8174.6-71.1176.2500111.4M70 K71 R77 K78M70-Q74 WeakPolarHBondContact O-CG 3.42Å; M70-Q74 PolarHBondContact O-N 2.88Å; K71-Q74 WeakPolarHBondContact O-CB 3.43Å; K71-Q74 PolarHBondContact O-N 3.1Å; Q74-R77 WeakPolarHBondContact O-CB 3.31Å; Q74-R77 PolarHBondContact O-N 3.09Å; Q74-K78 PolarHBondContact O-N 3.15Å
75E91.4Very high92Very high87 Ų87108.7 Ų108.741%0.40749%0.493SS..Hα-helixtrans-61.1-48.5176.5-74.1169.1-170.200111.6K71 L72 R77 K78 Q79K71-E75 PolarHBondContact O-N 2.96Å; L72-E75 PolarHBondContact O-N 3.42Å; E75-R77 VanDerWaalsContact C-N 3.25Å; E75-R77 PolarHBondContact O-N 3.39Å; E75-K78 PolarHBondContact O-N 3.16Å; E75-K78 VanDerWaalsContact O-N 3.1Å; E75-Q79 WeakPolarHBondContact O-CG 3.49Å; E75-Q79 PolarHBondContact O-N 3.33Å
76K92.5Very high91.9Very high114 Ų114110.6 Ų110.650%0.49650%0.504SS..Hα-helixtrans-57.8-35.9174.3-75-177.9178.5-176.30112.5L72 K80L72-K76 HydrophobicContact CD2-CD 4.31Å; L72-K76 HydrophobicContact CG-CD 4.34Å; L72-K76 WeakPolarHBondContact O-CB 3.31Å; L72-K76 WeakPolarHBondContact O-CG 3.39Å; L72-K76 PolarHBondContact O-N 2.91Å; K76-K80 WeakPolarHBondContact O-CB 3.48Å; K76-K80 VanDerWaalsContact O-CG 3.25Å; K76-K80 WeakPolarHBondContact O-CG 3.42Å; K76-K80 PolarHBondContact O-N 2.93Å
77R93.4Very high91.7Very high161 Ų161110.9 Ų110.961%0.60850%0.5SS*.Hα-helixtrans-67.6-45174.7-79.1171.9175.2-175.7-2.6111.8K73 Q74 E75 K80 L81K73-R77 WeakPolarHBondContact O-CB 3.46Å; K73-R77 VanDerWaalsContact O-CG 3.26Å; K73-R77 WeakPolarHBondContact O-CG 3.32Å; K73-R77 PolarHBondContact O-N 3.25Å; Q74-R77 WeakPolarHBondContact O-CB 3.31Å; Q74-R77 PolarHBondContact O-N 3.09Å; E75-R77 VanDerWaalsContact C-N 3.25Å; E75-R77 PolarHBondContact O-N 3.39Å; R77-K80 PolarHBondContact O-N 3.41Å; R77-L81 WeakPolarHBondContact O-CB 3.25Å; R77-L81 PolarHBondContact O-N 2.93Å
78K94.4Very high91.4Very high142 Ų142113.2 Ų113.262%0.61750%0.501SS*.Hα-helixtrans-60.3-48176.5-71.7179.8-179.4-179.50110.9Q74 E75 L81 Q82Q74-K78 PolarHBondContact O-N 3.15Å; E75-K78 PolarHBondContact O-N 3.16Å; E75-K78 VanDerWaalsContact O-N 3.1Å; K78-L81 WeakPolarHBondContact O-CB 3.34Å; K78-L81 PolarHBondContact O-N 3.46Å; K78-Q82 WeakPolarHBondContact O-CG 3.38Å; K78-Q82 PolarHBondContact O-N 3.23Å
79Q93.4Very high91.4Very high115 Ų115117.8 Ų117.854%0.53752%0.519SS..Hα-helixtrans-59.7-47.9176.4-70.9172.6-6.200111.9E75 L81 Q82 L83E75-Q79 WeakPolarHBondContact O-CG 3.49Å; E75-Q79 PolarHBondContact O-N 3.33Å; Q79-L81 VanDerWaalsContact C-N 3.29Å; Q79-L81 PolarHBondContact O-N 3Å; Q79-Q82 PolarHBondContact O-N 3.46Å; Q79-L83 WeakPolarHBondContact O-CB 3.34Å; Q79-L83 PolarHBondContact O-N 2.89Å
80K92.7Very high91.2Very high159 Ų159118.8 Ų118.869%0.69153%0.526SS*.Hα-helixtrans-58.5-39.5175.6-79.3-178.3180-169.60112.6K76 R77 K84K76-K80 WeakPolarHBondContact O-CB 3.48Å; K76-K80 VanDerWaalsContact O-CG 3.25Å; K76-K80 WeakPolarHBondContact O-CG 3.42Å; K76-K80 PolarHBondContact O-N 2.93Å; R77-K80 PolarHBondContact O-N 3.41Å; K80-K84 WeakPolarHBondContact O-CB 3.39Å; K80-K84 PolarHBondContact O-N 2.63Å
81L93.1Very high90.9Very high97 Ų97120.3 Ų120.351%0.50853%0.528SS..Hα-helixtrans-66.7-44.3177.5-174.969.1000111.5R77 K78 Q79 K84 K85R77-L81 WeakPolarHBondContact O-CB 3.25Å; R77-L81 PolarHBondContact O-N 2.93Å; K78-L81 WeakPolarHBondContact O-CB 3.34Å; K78-L81 PolarHBondContact O-N 3.46Å; Q79-L81 VanDerWaalsContact C-N 3.29Å; Q79-L81 PolarHBondContact O-N 3Å; L81-K84 PolarHBondContact O-N 3.38Å; L81-K85 WeakPolarHBondContact O-CG 3.31Å; L81-K85 PolarHBondContact O-N 2.69Å
82Q94.1Very high90.6Very high121 Ų121122.1 Ų122.157%0.56554%0.538SS*.Hα-helixtrans-61.7-46176.2-72.5173.8-10.400111.3K78 Q79 K84 K85 K86K78-Q82 WeakPolarHBondContact O-CG 3.38Å; K78-Q82 PolarHBondContact O-N 3.23Å; Q79-Q82 PolarHBondContact O-N 3.46Å; Q82-K84 VanDerWaalsContact C-N 3.35Å; Q82-K84 PolarHBondContact O-N 2.87Å; Q82-K85 WeakPolarHBondContact O-CB 3.38Å; Q82-K85 PolarHBondContact O-N 3.08Å; Q82-K85 VanDerWaalsContact O-N 3.14Å; Q82-K86 PolarHBondContact O-N 3.23Å
83L91.3Very high90.6Very high100 Ų100123.9 Ų123.952%0.52456%0.561SS.*Hα-helixtrans-62.5-41.2177.4-163.3151.9000111.5Q79 K85 K86 R87Q79-L83 WeakPolarHBondContact O-CB 3.34Å; Q79-L83 PolarHBondContact O-N 2.89Å; L83-K85 VanDerWaalsContact C-N 3.34Å; L83-K85 PolarHBondContact O-N 3.37Å; L83-K86 PolarHBondContact O-N 2.88Å; L83-R87 WeakPolarHBondContact O-CB 3.32Å; L83-R87 PolarHBondContact O-N 3.33Å
84K88.9Confident90.3Very high154 Ų154123.9 Ų123.967%0.6757%0.565SS**Hα-helixtrans-62-39.4173.5-173.2-179.6179.8-176.70112.3K80 L81 Q82 R88K80-K84 WeakPolarHBondContact O-CB 3.39Å; K80-K84 PolarHBondContact O-N 2.63Å; L81-K84 PolarHBondContact O-N 3.38Å; Q82-K84 VanDerWaalsContact C-N 3.35Å; Q82-K84 PolarHBondContact O-N 2.87Å; K84-R88 WeakPolarHBondContact O-CB 3.41Å; K84-R88 PolarHBondContact O-N 3.06Å
85K92.1Very high89.9Confident113 Ų113120.6 Ų120.649%0.49156%0.561SS.*Hα-helixtrans-65.7-44175.7-74.3178.8179.7-1740111.4L81 Q82 L83 R88 K89L81-K85 WeakPolarHBondContact O-CG 3.31Å; L81-K85 PolarHBondContact O-N 2.69Å; Q82-K85 WeakPolarHBondContact O-CB 3.38Å; Q82-K85 PolarHBondContact O-N 3.08Å; Q82-K85 VanDerWaalsContact O-N 3.14Å; L83-K85 VanDerWaalsContact C-N 3.34Å; L83-K85 PolarHBondContact O-N 3.37Å; K85-R88 PolarHBondContact O-N 3.17Å; K85-K89 PolarHBondContact O-N 3.29Å; K85-K89 VanDerWaalsContact O-N 3.11Å
86K90.1Very high89.1Confident140 Ų140124.8 Ų124.861%0.60959%0.586SS**Hα-helixtrans-60.3-53.5175.7-71.4-175.4177-171.30111.5Q82 L83 R88 K89 E90Q82-K86 PolarHBondContact O-N 3.23Å; L83-K86 PolarHBondContact O-N 2.88Å; K86-R88 PolarHBondContact O-N 3.25Å; K86-R88 VanDerWaalsContact O-N 3.16Å; K86-K89 WeakPolarHBondContact O-CB 3.34Å; K86-K89 PolarHBondContact O-N 3.39Å; K86-E90 WeakPolarHBondContact O-CG 3.24Å; K86-E90 PolarHBondContact O-N 3.07Å
87R86.2Confident88.6Confident119 Ų119128 Ų12845%0.44960%0.6SS.*Hα-helixtrans-57.4-33.6177.4-167-176.9-74.3-162.2-3.6112.9L83 R91 E102L83-R87 WeakPolarHBondContact O-CB 3.32Å; L83-R87 PolarHBondContact O-N 3.33Å; R87-R91 VanDerWaalsContact O-CB 3.31Å; R87-R91 WeakPolarHBondContact O-CB 3.46Å; R87-R91 PolarHBondContact O-N 2.73Å; R87-E102 IonicContact CZ-OE1 2.87Å; R87-E102 IonicContact NH1-OE1 3.63Å; R87-E102 PolarHBondContact NH1-OE1 2.97Å; R87-E102 IonicContact NH2-OE1 3.71Å
88R86.4Confident88Confident165 Ų165121.3 Ų121.362%0.62358%0.579SS**Hα-helixtrans-68.2-45.5175-172.817968.7-170.74.2111.8K84 K85 K86 R91 E92K84-R88 WeakPolarHBondContact O-CB 3.41Å; K84-R88 PolarHBondContact O-N 3.06Å; K85-R88 PolarHBondContact O-N 3.17Å; K86-R88 PolarHBondContact O-N 3.25Å; K86-R88 VanDerWaalsContact O-N 3.16Å; R88-R91 PolarHBondContact O-N 3.09Å; R88-E92 WeakPolarHBondContact O-CB 3.41Å; R88-E92 PolarHBondContact O-N 3.35Å
89K88.9Confident87.3Confident148 Ų148118.9 Ų118.964%0.64358%0.578SS**Hα-helixtrans-63.2-43.9176.7-71-176.2175.6-166.40111.6K85 K86 R91 E92 A93K85-K89 PolarHBondContact O-N 3.29Å; K85-K89 VanDerWaalsContact O-N 3.11Å; K86-K89 WeakPolarHBondContact O-CB 3.34Å; K86-K89 PolarHBondContact O-N 3.39Å; K89-R91 VanDerWaalsContact C-N 3.33Å; K89-R91 PolarHBondContact O-N 3.2Å; K89-E92 PolarHBondContact O-N 2.99Å; K89-A93 WeakPolarHBondContact O-CB 3.26Å; K89-A93 PolarHBondContact O-N 3.39Å
90E86.8Confident86.9Confident120 Ų120119.2 Ų119.256%0.56159%0.59SS**Hα-helixtrans-60.1-43.3176.1-71.3159.8-162.900111.4K86 A93 L94K86-E90 WeakPolarHBondContact O-CG 3.24Å; K86-E90 PolarHBondContact O-N 3.07Å; E90-A93 PolarHBondContact O-N 3.06Å; E90-L94 VanDerWaalsContact O-CB 3.28Å; E90-L94 WeakPolarHBondContact O-CB 3.47Å; E90-L94 PolarHBondContact O-N 3.19Å
91R85.4Confident86.5Confident97 Ų97119.4 Ų119.437%0.36659%0.591SS.*Hα-helixtrans-65.2-38.7176.4178.2173.8-65.3178.1-6113R87 R88 K89 L94 G95 A98 P99R87-R91 VanDerWaalsContact O-CB 3.31Å; R87-R91 WeakPolarHBondContact O-CB 3.46Å; R87-R91 PolarHBondContact O-N 2.73Å; R88-R91 PolarHBondContact O-N 3.09Å; K89-R91 VanDerWaalsContact C-N 3.33Å; K89-R91 PolarHBondContact O-N 3.2Å; R91-L94 PolarHBondContact O-N 2.97Å; R91-G95 PolarHBondContact O-N 3.07Å; R91-A98 HydrophobicContact CB-CB 4.28Å; R91-A98 HydrophobicContact CG-CB 3.71Å; R91-P99 PolarHBondContact NH2-O 3.25Å
92E86.5Confident86.1Confident153 Ų153121.6 Ų121.672%0.71560%0.598SS**Hα-helixtrans-66.2-39.8176.3-172.6172.3-170.800111.4R88 K89R88-E92 WeakPolarHBondContact O-CB 3.41Å; R88-E92 PolarHBondContact O-N 3.35Å; K89-E92 PolarHBondContact O-N 2.99Å
93A89.1Confident85.8Confident94 Ų94121.1 Ų121.178%0.77760%0.603SS**Hα-helixtrans-69.1-35.1175.100000113.2K89 E90K89-A93 WeakPolarHBondContact O-CB 3.26Å; K89-A93 PolarHBondContact O-N 3.39Å; E90-A93 PolarHBondContact O-N 3.06Å
94L86.8Confident85.8Confident90 Ų90120.7 Ų120.747%0.47161%0.607SS.*Hα-helixtrans-89.4-13.4-175.5-149.362000113.3E90 R91 D96 K97 A98E90-L94 VanDerWaalsContact O-CB 3.28Å; E90-L94 WeakPolarHBondContact O-CB 3.47Å; E90-L94 PolarHBondContact O-N 3.19Å; R91-L94 PolarHBondContact O-N 2.97Å; L94-D96 PolarHBondContact O-N 2.94Å; L94-K97 HydrophobicContact CD1-CB 4.39Å; L94-K97 WeakPolarHBondContact CD2-O 3.42Å; L94-K97 HydrophobicContact CG-CB 3.87Å; L94-K97 WeakPolarHBondContact O-CB 3.43Å; L94-K97 PolarHBondContact O-N 2.96Å; L94-A98 HydrophobicContact CB-CB 4.29Å
95G83.8Confident85.9Confident43 Ų43121.9 Ų121.944%0.44361%0.612SS.*G310 helixtrans51.4-121.4175.800000112.5R91 K97 A98R91-G95 PolarHBondContact O-N 3.07Å; G95-K97 VanDerWaalsContact C-N 3.27Å; G95-K97 PolarHBondContact O-N 2.91Å; G95-A98 WeakPolarHBondContact O-CB 3.41Å; G95-A98 PolarHBondContact O-N 3.44Å
96D75.7Confident85.9Confident176 Ų176119.1 Ų119.194%0.94160%0.604SS**G310 helixtrans-71.7-17.4-178.9-59.5-36.6000114L94 A98L94-D96 PolarHBondContact O-N 2.94Å; D96-A98 PolarHBondContact O-N 3.3Å
97K81.6Confident85.8Confident182 Ų182115.6 Ų115.679%0.79159%0.591SS**G310 helixtrans-84.22.1173.9-65.3178.9-176.7179.60112.4L94 G95L94-K97 HydrophobicContact CD1-CB 4.39Å; L94-K97 WeakPolarHBondContact CD2-O 3.42Å; L94-K97 HydrophobicContact CG-CB 3.87Å; L94-K97 WeakPolarHBondContact O-CB 3.43Å; L94-K97 PolarHBondContact O-N 2.96Å; G95-K97 VanDerWaalsContact C-N 3.27Å; G95-K97 PolarHBondContact O-N 2.91Å
98A81.2Confident85.8Confident20 Ų20113.6 Ų113.617%0.16559%0.587CS.*SBendtrans-67.6137.4-179.400000112.6R91 L94 G95 D96R91-A98 HydrophobicContact CB-CB 4.28Å; R91-A98 HydrophobicContact CG-CB 3.71Å; L94-A98 HydrophobicContact CB-CB 4.29Å; G95-A98 WeakPolarHBondContact O-CB 3.41Å; G95-A98 PolarHBondContact O-N 3.44Å; D96-A98 PolarHBondContact O-N 3.3Å
99P79.8Confident85.9Confident91 Ų91110.5 Ų110.559%0.59158%0.583SS**PPolyproline II helixtrans-53.9133.1173.1-27.133.5000111.6R91R91-P99 PolarHBondContact NH2-O 3.25Å
100P83.7Confident85.9Confident121 Ų121106.2 Ų106.279%0.78657%0.565SS**PPolyproline II helixtrans-51.9144.6177.3-27.634.2000111.6E102P100-E102 PolarHBondContact O-N 3.43Å
101K84.3Confident86.1Confident164 Ų164104 Ų10471%0.71355%0.552SS**PPolyproline II helixtrans-68126176.9-171.2-178.7177.2-172.90109V103K101-V103 PolarHBondContact O-N 3.37Å
102E85.8Confident86.4Confident143 Ų143102.5 Ų102.567%0.66855%0.553SS**PPolyproline II helixtrans-50.8122.7171.5-67.1166.2-128.100110.3R87 P100R87-E102 IonicContact CZ-OE1 2.87Å; R87-E102 IonicContact NH1-OE1 3.63Å; R87-E102 PolarHBondContact NH1-OE1 2.97Å; R87-E102 IonicContact NH2-OE1 3.71Å; P100-E102 PolarHBondContact O-N 3.43Å
103V88.2Confident86.4Confident110 Ų110103 Ų10367%0.66755%0.553SS**PPolyproline II helixtrans-74.6131.3178.1-179.80000108.4K101 K105K101-V103 PolarHBondContact O-N 3.37Å; V103-K105 PolarHBondContact O-N 2.99Å
104P91.4Very high86.4Confident92 Ų9299.1 Ų99.160%0.59752%0.52SS*.PPolyproline II helixtrans-62.1134.8176.925.8-33.5000110.6T106 N109P104-T106 VanDerWaalsContact C-N 3.33Å; P104-T106 HydrophobicContact CB-CG2 4.39Å; P104-T106 HydrophobicContact CG-CG2 4.37Å; P104-T106 PolarHBondContact O-N 3.42Å; P104-N109 PolarHBondContact O-ND2 2.85Å
105K91.1Very high86.4Confident178 Ų178103.6 Ų103.677%0.77454%0.538SS*.  trans-72.385.6171.8-70.8176.6177.6-171.50109.4V103 Q110V103-K105 PolarHBondContact O-N 2.99Å; K105-Q110 HydrophobicContact CB-CG 4.34Å
106T90.5Very high86.6Confident56 Ų56104.9 Ų104.934%0.34454%0.538SS..  trans-86.6163.9173.964.90000110.3P104 E108 N109 Q110P104-T106 VanDerWaalsContact C-N 3.33Å; P104-T106 HydrophobicContact CB-CG2 4.39Å; P104-T106 HydrophobicContact CG-CG2 4.37Å; P104-T106 PolarHBondContact O-N 3.42Å; T106-E108 PolarHBondContact O-N 3.1Å; T106-N109 PolarHBondContact O-N 3.2Å; T106-N109 WeakPolarHBondContact OG1-CB 3.38Å; T106-N109 PolarHBondContact OG1-N 2.71Å; T106-N109 VanDerWaalsContact OG1-N 3.17Å; T106-N109 PolarHBondContact OG1-ND2 3.34Å; T106-N109 PolarHBondContact OG1-OD1 2.93Å; T106-Q110 WeakPolarHBondContact O-CB 3.42Å; T106-Q110 WeakPolarHBondContact O-CG 3.42Å; T106-Q110 PolarHBondContact O-N 3.19Å
107I88.6Confident87.3Confident65 Ų6598.7 Ų98.733%0.33351%0.506SS..THydrogen-bonded Turntrans-61.1-36.5175.9-67.2170.5000111Q110 R111 F349I107-Q110 CarbonylContact O-C 3.42Å; I107-Q110 PolarHBondContact O-N 3.12Å; I107-R111 PolarHBondContact O-N 3.1Å; I107-R111 VanDerWaalsContact O-N 3.07Å; I107-F349 HydrophobicContact CG2-CE2 3.99Å; I107-F349 HydrophobicContact CG2-CZ 3.76Å
108E86.2Confident87.7Confident78 Ų7890.9 Ų90.936%0.36447%0.474SS..THydrogen-bonded Turntrans-65.8-44.9177.3-48-49.8145.300111T106 Q110 R111 R287T106-E108 PolarHBondContact O-N 3.1Å; E108-Q110 PolarHBondContact O-N 3.26Å; E108-R111 WeakPolarHBondContact O-CB 3.4Å; E108-R111 PolarHBondContact O-N 3.31Å; E108-R287 IonicContact OE1-CZ 3.99Å; E108-R287 IonicContact OE1-NE 2.63Å; E108-R287 PolarHBondContact OE1-NE 3.45Å; E108-R287 IonicContact OE1-NH2 3.05Å; E108-R287 PolarHBondContact OE1-NH2 2.99Å
109N88.3Confident88Confident100 Ų10095.4 Ų95.454%0.53550%0.495SS..THydrogen-bonded Turntrans-68.7-19.7178.7-64.3-4.1000113.2P104 T106P104-N109 PolarHBondContact O-ND2 2.85Å; T106-N109 PolarHBondContact O-N 3.2Å; T106-N109 WeakPolarHBondContact OG1-CB 3.38Å; T106-N109 PolarHBondContact OG1-N 2.71Å; T106-N109 VanDerWaalsContact OG1-N 3.17Å; T106-N109 PolarHBondContact OG1-ND2 3.34Å; T106-N109 PolarHBondContact OG1-OD1 2.93Å
110Q89.9Confident88.2Confident58 Ų5897.2 Ų97.227%0.27151%0.507SS..THydrogen-bonded Turntrans-110.720179.7-62.5-165.4-37.100111.8K105 T106 I107 E108 V112 R347K105-Q110 HydrophobicContact CB-CG 4.34Å; T106-Q110 WeakPolarHBondContact O-CB 3.42Å; T106-Q110 WeakPolarHBondContact O-CG 3.42Å; T106-Q110 PolarHBondContact O-N 3.19Å; I107-Q110 CarbonylContact O-C 3.42Å; I107-Q110 PolarHBondContact O-N 3.12Å; E108-Q110 PolarHBondContact O-N 3.26Å; Q110-V112 PolarHBondContact O-N 3Å; Q110-R347 WeakPolarHBondContact O-CD 3.16Å; Q110-R347 VanDerWaalsContact OE1-CZ 3.3Å
111R90.7Very high88.3Confident73 Ų73100.3 Ų100.328%0.27551%0.511SS..PPolyproline II helixtrans-57.1134.8174.7-172.7174.9-178.7170.41.8107.9I107 E108 F113 F349 L351I107-R111 PolarHBondContact O-N 3.1Å; I107-R111 VanDerWaalsContact O-N 3.07Å; E108-R111 WeakPolarHBondContact O-CB 3.4Å; E108-R111 PolarHBondContact O-N 3.31Å; R111-F113 PolarHBondContact O-N 2.79Å; R111-F349 HydrophobicContact CG-CD2 4.01Å; R111-F349 HydrophobicContact CG-CE2 4.42Å; R111-F349 PolarHBondContact NH2-O 3.49Å; R111-L351 PolarHBondContact NH2-O 3.02Å
112V91Very high88.6Confident66 Ų6695.8 Ų95.840%0.450%0.495SS..PPolyproline II helixtrans-69.6125.7171.3-179.10000106.3Q110 D114 R347Q110-V112 PolarHBondContact O-N 3Å; V112-D114 PolarHBondContact O-N 3.39Å; V112-R347 HydrophobicContact CG2-CB 3.94Å; V112-R347 PolarHBondContact N-O 2.89Å
113F87.8Confident88.7Confident162 Ų16297.1 Ų97.171%0.71150%0.501SS*.PPolyproline II helixtrans-56.4131.8175.2-178.6-101000109R111R111-F113 PolarHBondContact O-N 2.79Å
114D87.4Confident88.8Confident14 Ų1497.6 Ų97.68%0.07550%0.496CS..  trans-104.7125.3176.1-157.9-44.7000107.6V112 T116 T117 K348V112-D114 PolarHBondContact O-N 3.39Å; D114-T116 VanDerWaalsContact CG-OG1 3.31Å; D114-T116 PolarHBondContact O-N 3.38Å; D114-T116 PolarHBondContact OD1-N 3.25Å; D114-T116 VanDerWaalsContact OD1-N 3.09Å; D114-T116 PolarHBondContact OD1-OG1 2.81Å; D114-T117 VanDerWaalsContact O-CB 3.32Å; D114-T117 WeakPolarHBondContact O-CB 3.46Å; D114-T117 PolarHBondContact O-N 3.19Å; D114-T117 VanDerWaalsContact O-N 3.08Å; D114-T117 PolarHBondContact O-OG1 2.8Å; D114-K348 VanDerWaalsContact OD2-CE 3.26Å; D114-K348 WeakPolarHBondContact OD2-CE 3.48Å
115E87.1Confident88.6Confident183 Ų18394.1 Ų94.186%0.85547%0.473SS*.THydrogen-bonded Turntrans-61.3-23.3178.6-65.9165.6-169.900111.9T117E115-T117 PolarHBondContact O-N 3.02Å
116T88.5Confident88.5Confident71 Ų7188.7 Ų88.744%0.43646%0.461SS..THydrogen-bonded Turntrans-83.67.9177.763.30000113.8D114 V118 T255 R256D114-T116 VanDerWaalsContact CG-OG1 3.31Å; D114-T116 PolarHBondContact O-N 3.38Å; D114-T116 PolarHBondContact OD1-N 3.25Å; D114-T116 VanDerWaalsContact OD1-N 3.09Å; D114-T116 PolarHBondContact OD1-OG1 2.81Å; T116-V118 PolarHBondContact O-N 3.46Å; T116-T255 CarbonylContact O-C 3.46Å; T116-T255 VanDerWaalsContact O-CA 3.24Å; T116-T255 WeakPolarHBondContact O-CA 3.47Å; T116-R256 PolarHBondContact O-N 3.25Å
117T90.3Very high88.4Confident45 Ų4592.7 Ų92.728%0.27647%0.474SS..BIsolated β-bridgetrans-67.5123.1174.2-54.10000108.8D114 E115D114-T117 VanDerWaalsContact O-CB 3.32Å; D114-T117 WeakPolarHBondContact O-CB 3.46Å; D114-T117 PolarHBondContact O-N 3.19Å; D114-T117 VanDerWaalsContact O-N 3.08Å; D114-T117 PolarHBondContact O-OG1 2.8Å; E115-T117 PolarHBondContact O-N 3.02Å
118V89.1Confident88.5Confident18 Ų1892.1 Ų92.111%0.10947%0.471CS..PPolyproline II helixtrans-79.6129-177.4172.40000109.5T116 V125 T254 R256T116-V118 PolarHBondContact O-N 3.46Å; V118-V125 HydrophobicContact CG1-CB 4.15Å; V118-V125 HydrophobicContact CG1-CG1 3.71Å; V118-V125 HydrophobicContact CG1-CG2 4.13Å; V118-V125 HydrophobicContact CG2-CG1 4.24Å; V118-V125 HydrophobicContact CG2-CG2 4.39Å; V118-T254 PolarHBondContact N-O 3.34Å; V118-R256 HydrophobicContact CG2-CB 4.16Å
119D88.2Confident88.6Confident115 Ų11590.8 Ų90.862%0.61547%0.465SS*.PPolyproline II helixtrans-84.4128.9165.7-74.6-35.7000109E121 D122D119-E121 PolarHBondContact O-N 2.92Å; D119-D122 VanDerWaalsContact O-CB 3.31Å; D119-D122 WeakPolarHBondContact O-CB 3.41Å; D119-D122 PolarHBondContact O-N 2.99Å
120P83.9Confident88.6Confident129 Ų12988.2 Ų88.284%0.83846%0.463SS*.THydrogen-bonded Turntrans-61.6-17.2-176.1-25.434.3000115.4
121E86.8Confident88.6Confident187 Ų18789.7 Ų89.787%0.87448%0.476SS*.THydrogen-bonded Turntrans-95.92.3-179.4-61.3-176.6170.400112.5D119 E123D119-E121 PolarHBondContact O-N 2.92Å; E121-E123 PolarHBondContact O-N 3.32Å
122D90.2Very high88.6Confident69 Ų6988 Ų8837%0.36947%0.472SS..  trans-73.2113.4179.1-168.6-14.2000111.3D119 E124 V125 A126D119-D122 VanDerWaalsContact O-CB 3.31Å; D119-D122 WeakPolarHBondContact O-CB 3.41Å; D119-D122 PolarHBondContact O-N 2.99Å; D122-E124 VanDerWaalsContact C-N 3.3Å; D122-E124 PolarHBondContact O-N 3.03Å; D122-E124 PolarHBondContact OD1-N 2.89Å; D122-V125 HydrophobicContact CB-CB 4.41Å; D122-V125 HydrophobicContact CB-CG2 4.17Å; D122-V125 PolarHBondContact O-N 3.31Å; D122-A126 PolarHBondContact O-N 3.15Å
123E88.6Confident88.5Confident170 Ų17088.7 Ų88.779%0.79447%0.471SS*.Hα-helixtrans-64.5-31.7-179.4-64.8-176175.100112.7E121 A126 F127E121-E123 PolarHBondContact O-N 3.32Å; E123-A126 PolarHBondContact O-N 2.96Å; E123-F127 WeakPolarHBondContact O-CB 3.37Å; E123-F127 PolarHBondContact O-N 2.65Å
124E88.8Confident88.6Confident121 Ų12181.1 Ų81.157%0.56544%0.438SS*.Hα-helixtrans-65.8-45.8179.8-174-177.4155.500110.2D122 A126 F127 D128D122-E124 VanDerWaalsContact C-N 3.3Å; D122-E124 PolarHBondContact O-N 3.03Å; D122-E124 PolarHBondContact OD1-N 2.89Å; E124-A126 VanDerWaalsContact C-N 3.34Å; E124-A126 PolarHBondContact O-N 3.49Å; E124-F127 PolarHBondContact O-N 2.91Å; E124-D128 PolarHBondContact O-N 3.02Å
125V87.9Confident88.7Confident19 Ų1981.9 Ų81.912%0.11544%0.444CS..Hα-helixtrans-66.8-38.6179.4-178.20000111V118 D122 F127 D128 E129V118-V125 HydrophobicContact CG1-CB 4.15Å; V118-V125 HydrophobicContact CG1-CG1 3.71Å; V118-V125 HydrophobicContact CG1-CG2 4.13Å; V118-V125 HydrophobicContact CG2-CG1 4.24Å; V118-V125 HydrophobicContact CG2-CG2 4.39Å; D122-V125 HydrophobicContact CB-CB 4.41Å; D122-V125 HydrophobicContact CB-CG2 4.17Å; D122-V125 PolarHBondContact O-N 3.31Å; V125-F127 VanDerWaalsContact C-N 3.32Å; V125-F127 PolarHBondContact O-N 3.26Å; V125-D128 PolarHBondContact O-N 3.25Å; V125-E129 HydrophobicContact CG1-CG 4.32Å; V125-E129 WeakPolarHBondContact O-CB 3.24Å; V125-E129 VanDerWaalsContact O-CG 3.31Å; V125-E129 WeakPolarHBondContact O-CG 3.38Å; V125-E129 PolarHBondContact O-N 2.87Å
126A88.6Confident88.9Confident64 Ų6474.9 Ų74.953%0.52942%0.418SS..Hα-helixtrans-63.1-38.9175.400000112.3D122 E123 E124 G130D122-A126 PolarHBondContact O-N 3.15Å; E123-A126 PolarHBondContact O-N 2.96Å; E124-A126 VanDerWaalsContact C-N 3.34Å; E124-A126 PolarHBondContact O-N 3.49Å; A126-G130 PolarHBondContact O-N 3.24Å
127F89.6Confident89.1Confident140 Ų14072.2 Ų72.261%0.61440%0.4SS*.Hα-helixtrans-67.4-44.7176.4-177-96.3000112.1E123 E124 V125 E129 G130 T131E123-F127 WeakPolarHBondContact O-CB 3.37Å; E123-F127 PolarHBondContact O-N 2.65Å; E124-F127 PolarHBondContact O-N 2.91Å; V125-F127 VanDerWaalsContact C-N 3.32Å; V125-F127 PolarHBondContact O-N 3.26Å; F127-E129 PolarHBondContact O-N 3.28Å; F127-G130 PolarHBondContact O-N 2.99Å; F127-T131 HydrophobicContact CE1-CG2 4.25Å; F127-T131 HydrophobicContact CE2-CG2 4.26Å; F127-T131 HydrophobicContact CZ-CG2 4.03Å; F127-T131 PolarHBondContact O-N 3.5Å; F127-T131 VanDerWaalsContact O-N 3.12Å; F127-T131 PolarHBondContact O-OG1 3.44Å
128D89.1Confident89.1Confident52 Ų5273.1 Ų73.128%0.27840%0.4SS..Hα-helixtrans-56.9-50.5173.8-78.9-9.4000110.6E124 V125 G130 T131 D132 R256E124-D128 PolarHBondContact O-N 3.02Å; V125-D128 PolarHBondContact O-N 3.25Å; D128-G130 VanDerWaalsContact C-N 3.27Å; D128-G130 PolarHBondContact O-N 3.48Å; D128-T131 PolarHBondContact O-N 2.9Å; D128-T131 PolarHBondContact O-OG1 3.48Å; D128-D132 WeakPolarHBondContact O-CB 3.49Å; D128-D132 PolarHBondContact O-N 2.93Å; D128-R256 IonicContact OD2-CZ 3.82Å; D128-R256 IonicContact OD2-NE 3.64Å; D128-R256 IonicContact OD2-NH2 3.87Å; D128-R256 PolarHBondContact OD2-NH2 3.48Å
129E89.2Confident89.2Confident50 Ų5077.7 Ų77.723%0.23442%0.424CS..Hα-helixtrans-62.6-32.7178.5-76.3-164.5-165.500112.9V125 F127 T131 H259 R263V125-E129 HydrophobicContact CG1-CG 4.32Å; V125-E129 WeakPolarHBondContact O-CB 3.24Å; V125-E129 VanDerWaalsContact O-CG 3.31Å; V125-E129 WeakPolarHBondContact O-CG 3.38Å; V125-E129 PolarHBondContact O-N 2.87Å; F127-E129 PolarHBondContact O-N 3.28Å; E129-T131 VanDerWaalsContact C-N 3.34Å; E129-H259 IonicContact OE1-CE1 2.92Å; E129-H259 IonicContact OE1-CG 2.71Å; E129-H259 IonicContact OE1-ND1 2.66Å; E129-H259 PolarHBondContact OE1-ND1 2.91Å; E129-R263 PolarHBondContact O-NH2 3.5Å; E129-R263 IonicContact OE2-CZ 3.02Å; E129-R263 IonicContact OE2-NH1 3.97Å; E129-R263 PolarHBondContact OE2-NH1 3.28Å
130G88.4Confident89.3Confident47 Ų4774.4 Ų74.449%0.48542%0.417SS..Hα-helixtrans-72.2-26.117800000113.9A126 F127 D128 S135A126-G130 PolarHBondContact O-N 3.24Å; F127-G130 PolarHBondContact O-N 2.99Å; D128-G130 VanDerWaalsContact C-N 3.27Å; D128-G130 PolarHBondContact O-N 3.48Å; G130-S135 WeakPolarHBondContact O-CB 3.48Å
131T89.4Confident89.6Confident89 Ų8974.8 Ų74.855%0.54641%0.411SS..Hα-helixtrans-107.2-5.2-175.655.50000113.8F127 D128 E129F127-T131 HydrophobicContact CE1-CG2 4.25Å; F127-T131 HydrophobicContact CE2-CG2 4.26Å; F127-T131 HydrophobicContact CZ-CG2 4.03Å; F127-T131 PolarHBondContact O-N 3.5Å; F127-T131 VanDerWaalsContact O-N 3.12Å; F127-T131 PolarHBondContact O-OG1 3.44Å; D128-T131 PolarHBondContact O-N 2.9Å; D128-T131 PolarHBondContact O-OG1 3.48Å; E129-T131 VanDerWaalsContact C-N 3.34Å
132D89.8Confident89.6Confident36 Ų3668.8 Ų68.819%0.19339%0.388CS..SBendtrans-60.6168.2-179.5-162.711.7000114.2D128 F134 S135 R263D128-D132 WeakPolarHBondContact O-CB 3.49Å; D128-D132 PolarHBondContact O-N 2.93Å; D132-F134 PolarHBondContact O-N 3.25Å; D132-F134 WeakPolarHBondContact OD2-CD2 3.26Å; D132-S135 WeakPolarHBondContact O-CB 3.28Å; D132-S135 PolarHBondContact O-N 2.71Å; D132-S135 PolarHBondContact O-OG 3.46Å; D132-R263 IonicContact OD2-NE 2.65Å
133E88.9Confident89.6Confident81 Ų8170.7 Ų70.738%0.37940%0.398SS..THydrogen-bonded Turntrans-65-13.8-178.7-54.6103.4-178.500113.6H214 P219E133-H214 PolarHBondContact O-NE2 2.92Å; E133-P219 WeakPolarHBondContact OE2-CD 3.41Å
134F91.2Very high89.8Confident3 Ų362.8 Ų62.81%0.01336%0.361CS..THydrogen-bonded Turntrans-94.4-6.2175.3-50-66.1000113.8D132 A136 Y137 F138 Y196 H214 P219 R263 L264 A267D132-F134 PolarHBondContact O-N 3.25Å; D132-F134 WeakPolarHBondContact OD2-CD2 3.26Å; F134-A136 VanDerWaalsContact C-N 3.27Å; F134-A136 PolarHBondContact O-N 3.45Å; F134-Y137 WeakPolarHBondContact O-CA 3.43Å; F134-Y137 WeakPolarHBondContact O-CB 3.33Å; F134-Y137 PolarHBondContact O-N 3.33Å; F134-F138 HydrophobicContact CB-CD2 3.65Å; F134-F138 HydrophobicContact CB-CE2 3.62Å; F134-F138 HydrophobicContact CG-CE2 4.43Å; F134-F138 WeakPolarHBondContact O-CD2 3.46Å; F134-F138 PolarHBondContact O-N 3.22Å; F134-Y196 HydrophobicContact CE1-CE1 4.35Å; F134-H214 AromaticContact CD1-CD2 3.8Å; F134-H214 AromaticContact CD1-NE2 3.86Å; F134-H214 HydrophobicContact CE1-CB 3.96Å; F134-H214 AromaticContact CE1-CD2 3.57Å; F134-H214 AromaticContact CE1-CG 3.69Å; F134-P219 HydrophobicContact CE2-CG 4.18Å; F134-P219 HydrophobicContact CZ-CG 3.61Å; F134-R263 HydrophobicContact CD2-CB 4.03Å; F134-R263 HydrophobicContact CE2-CB 4.42Å; F134-L264 HydrophobicContact CE1-CB 4.45Å; F134-L264 HydrophobicContact CE1-CD1 3.74Å; F134-L264 HydrophobicContact CZ-CB 3.94Å; F134-L264 HydrophobicContact CZ-CD1 3.75Å; F134-L264 HydrophobicContact CZ-CG 4.44Å; F134-A267 HydrophobicContact CD1-CB 4.12Å
135S90.1Very high90.1Very high30 Ų3060.2 Ų60.221%0.2135%0.348CS..Hα-helixtrans-51.6-42.6-17655.50000113.1G130 D132 Y137 F138 N139G130-S135 WeakPolarHBondContact O-CB 3.48Å; D132-S135 WeakPolarHBondContact O-CB 3.28Å; D132-S135 PolarHBondContact O-N 2.71Å; D132-S135 PolarHBondContact O-OG 3.46Å; S135-Y137 VanDerWaalsContact C-N 3.31Å; S135-Y137 PolarHBondContact O-N 2.73Å; S135-F138 PolarHBondContact O-N 2.55Å; S135-F138 VanDerWaalsContact O-N 3.1Å; S135-N139 WeakPolarHBondContact O-CB 3.37Å; S135-N139 PolarHBondContact O-N 3.36Å; S135-N139 PolarHBondContact O-ND2 2.94Å; S135-N139 VanDerWaalsContact O-ND2 3.16Å
136A90.4Very high90.5Very high36 Ų3659.3 Ų59.330%0.29834%0.343SS..Hα-helixtrans-59.7-38.5177.400000113.3F134 L141 T142F134-A136 VanDerWaalsContact C-N 3.27Å; F134-A136 PolarHBondContact O-N 3.45Å; A136-L141 WeakPolarHBondContact O-CB 3.42Å; A136-L141 PolarHBondContact O-N 2.96Å; A136-T142 HydrophobicContact CB-CG2 4.37Å; A136-T142 PolarHBondContact O-N 3.1Å
137Y92.3Very high90.9Very high16 Ų1656.7 Ų56.76%0.06332%0.32CS..Hα-helixtrans-69.7-45.8173.2163.6-90.3000110.5F134 S135 N139 G140 T142 P144 A266 A267 F269 Q271F134-Y137 WeakPolarHBondContact O-CA 3.43Å; F134-Y137 WeakPolarHBondContact O-CB 3.33Å; F134-Y137 PolarHBondContact O-N 3.33Å; S135-Y137 VanDerWaalsContact C-N 3.31Å; S135-Y137 PolarHBondContact O-N 2.73Å; Y137-N139 PolarHBondContact O-N 3.16Å; Y137-G140 PolarHBondContact O-N 3.31Å; Y137-T142 PolarHBondContact N-OG1 2.97Å; Y137-P144 HydrophobicContact CE2-CG 4.2Å; Y137-A266 PolarHBondContact OH-O 2.98Å; Y137-A266 VanDerWaalsContact OH-O 3.06Å; Y137-A267 HydrophobicContact CD1-CB 3.59Å; Y137-A267 HydrophobicContact CD2-CB 4.39Å; Y137-A267 VanDerWaalsContact CE1-CA 3.48Å; Y137-A267 HydrophobicContact CE1-CB 3.86Å; Y137-A267 HydrophobicContact CG-CB 3.9Å; Y137-F269 WeakPolarHBondContact CE2-O 3.23Å; Y137-F269 PolarHBondContact OH-O 3.43Å; Y137-Q271 HydrophobicContact CE1-CG 3.91Å; Y137-Q271 HydrophobicContact CE2-CG 3.87Å; Y137-Q271 VanDerWaalsContact CZ-CG 3.45Å; Y137-Q271 PolarHBondContact O-NE2 3.05Å; Y137-Q271 VanDerWaalsContact O-NE2 3.11Å; Y137-Q271 WeakPolarHBondContact OH-CG 3.35Å
138F91.1Very high91.3Very high64 Ų6450 Ų5028%0.28129%0.29SS..Hα-helixtrans-65.6-29.4-176.7-79.5-73.6000113.5F134 S135 G140 R263 A266 Q271F134-F138 HydrophobicContact CB-CD2 3.65Å; F134-F138 HydrophobicContact CB-CE2 3.62Å; F134-F138 HydrophobicContact CG-CE2 4.43Å; F134-F138 WeakPolarHBondContact O-CD2 3.46Å; F134-F138 PolarHBondContact O-N 3.22Å; S135-F138 PolarHBondContact O-N 2.55Å; S135-F138 VanDerWaalsContact O-N 3.1Å; F138-G140 VanDerWaalsContact C-N 3.25Å; F138-G140 PolarHBondContact O-N 2.85Å; F138-R263 HydrophobicContact CE2-CB 3.92Å; F138-R263 HydrophobicContact CE2-CG 4.1Å; F138-R263 HydrophobicContact CZ-CB 4.06Å; F138-R263 HydrophobicContact CZ-CG 4.08Å; F138-A266 HydrophobicContact CE1-CB 4.32Å; F138-A266 HydrophobicContact CZ-CB 3.99Å; F138-Q271 PolarHBondContact O-NE2 2.79Å
139N91.3Very high91.6Very high113 Ų11347.7 Ų47.760%0.60428%0.278SS*.THydrogen-bonded Turntrans-81.61.7173.3-65.9-28.7000113.6S135 Y137 L141S135-N139 WeakPolarHBondContact O-CB 3.37Å; S135-N139 PolarHBondContact O-N 3.36Å; S135-N139 PolarHBondContact O-ND2 2.94Å; S135-N139 VanDerWaalsContact O-ND2 3.16Å; Y137-N139 PolarHBondContact O-N 3.16Å; N139-L141 VanDerWaalsContact C-N 3.28Å; N139-L141 HydrophobicContact CB-CD1 4.3Å; N139-L141 HydrophobicContact CB-CG 4.15Å; N139-L141 PolarHBondContact O-N 3.45Å
140G89.4Confident91.8Very high47 Ų4745.3 Ų45.349%0.48527%0.267SS..THydrogen-bonded Turntrans72.815.7177.900000114.8Y137 F138Y137-G140 PolarHBondContact O-N 3.31Å; F138-G140 VanDerWaalsContact C-N 3.25Å; F138-G140 PolarHBondContact O-N 2.85Å
141L89.5Confident91.9Very high136 Ų13643.9 Ų43.971%0.71225%0.249SC*.SBendtrans-78.5-31.8-178.9-59.1173.6000112A136 N139A136-L141 WeakPolarHBondContact O-CB 3.42Å; A136-L141 PolarHBondContact O-N 2.96Å; N139-L141 VanDerWaalsContact C-N 3.28Å; N139-L141 HydrophobicContact CB-CD1 4.3Å; N139-L141 HydrophobicContact CB-CG 4.15Å; N139-L141 PolarHBondContact O-N 3.45Å
142T87.6Confident91.7Very high61 Ų6142 Ų4237%0.37424%0.236SC..  trans-127135-175.957.90000111.8A136 Y137A136-T142 HydrophobicContact CB-CG2 4.37Å; A136-T142 PolarHBondContact O-N 3.1Å; Y137-T142 PolarHBondContact N-OG1 2.97Å
143N89.7Confident91.6Very high110 Ų11049.5 Ų49.559%0.58826%0.262SS*.  trans-92.9138.2172-76.9-40.9000110.1K145N143-K145 PolarHBondContact O-N 3.11Å
144P93.4Very high91.7Very high3 Ų347.2 Ų47.22%0.01925%0.254CS..  trans-69.8134.9-177.827.4-32.8000111Y137 N171 T195 Y196 A267 P270Y137-P144 HydrophobicContact CE2-CG 4.2Å; P144-N171 WeakPolarHBondContact O-CB 3.45Å; P144-N171 PolarHBondContact O-ND2 3.48Å; P144-T195 WeakPolarHBondContact CA-OG1 3.33Å; P144-Y196 HydrophobicContact CB-CD2 4.06Å; P144-Y196 HydrophobicContact CB-CE2 3.89Å; P144-A267 VanDerWaalsContact CB-O 3.26Å; P144-A267 WeakPolarHBondContact CB-O 3.48Å; P144-P270 HydrophobicContact CG-CG 4.45Å
145K95.4Very high91.8Very high67 Ų6754.3 Ų54.329%0.29128%0.281SS..  trans-125.1113.4171.1-170.9-174.8-177.8-179.70108.1N143 R192 D193 F194 T195 Y196N143-K145 PolarHBondContact O-N 3.11Å; K145-R192 PolarHBondContact NZ-O 3.44Å; K145-D193 WeakPolarHBondContact CD-O 3.36Å; K145-F194 HydrophobicContact CB-CD1 4.42Å; K145-F194 HydrophobicContact CD-CD1 4.05Å; K145-F194 HydrophobicContact CD-CE1 4.18Å; K145-F194 HydrophobicContact CD-CG 4.38Å; K145-F194 HydrophobicContact CG-CD1 3.73Å; K145-F194 HydrophobicContact CG-CE1 3.89Å; K145-F194 HydrophobicContact CG-CG 4.47Å; K145-T195 PolarHBondContact N-OG1 3.33Å; K145-T195 PolarHBondContact O-N 3.06Å; K145-T195 PolarHBondContact O-OG1 3.1Å; K145-Y196 PolarHBondContact O-N 2.84Å
146V96.6Very high91.9Very high0 Ų055 Ų550%029%0.293CS..EExtended strand (participates in β ladder)trans-107.9124.1-167-173.20000110.4I148 I169 N171 A172 H173 Y196 L268V146-I148 HydrophobicContact CG1-CG1 4.22Å; V146-I169 HydrophobicContact CB-CG2 4.26Å; V146-I169 HydrophobicContact CG2-CG2 3.82Å; V146-N171 PolarHBondContact N-O 3.41Å; V146-A172 HydrophobicContact CB-CB 4.22Å; V146-A172 CarbonylContact O-C 3.56Å; V146-A172 VanDerWaalsContact O-CA 3.3Å; V146-A172 WeakPolarHBondContact O-CA 3.24Å; V146-H173 PolarHBondContact O-N 3.31Å; V146-Y196 HydrophobicContact CG2-CD2 4.15Å; V146-L268 HydrophobicContact CG2-CD2 4.47Å
147L97.1Very high92Very high9 Ų956 Ų565%0.04729%0.289CS..EExtended strand (participates in β ladder)trans-91.3115.9168179.366000109.6T149 Y175 I185 C189 F194 Y196 M197 M198L147-T149 HydrophobicContact CD1-CG2 4.09Å; L147-T149 HydrophobicContact CD2-CG2 3.58Å; L147-T149 HydrophobicContact CG-CG2 3.57Å; L147-Y175 HydrophobicContact CD1-CD2 3.4Å; L147-Y175 VanDerWaalsContact CD1-CD2 3.4Å; L147-Y175 HydrophobicContact CD1-CE2 4.34Å; L147-Y175 HydrophobicContact CD1-CG 4.15Å; L147-I185 HydrophobicContact CD2-CG2 4.06Å; L147-C189 WeakPolarHBondContact CD2-SG 3.43Å; L147-F194 HydrophobicContact CB-CD1 3.69Å; L147-F194 HydrophobicContact CB-CE1 3.88Å; L147-F194 HydrophobicContact CB-CG 4.16Å; L147-F194 HydrophobicContact CD1-CE1 4.32Å; L147-F194 HydrophobicContact CD1-CZ 4.31Å; L147-Y196 PolarHBondContact N-O 3.28Å; L147-M197 HydrophobicContact CD2-CG 4.39Å; L147-M197 WeakPolarHBondContact O-CA 3.3Å; L147-M198 PolarHBondContact O-N 2.8Å
148I97.2Very high92.1Very high0 Ų055.2 Ų55.20%029%0.286CS..EExtended strand (participates in β ladder)trans-97.2118.1170.2-57.5177.5000108.6V146 C162 L165 A166 A172 H173 V174 Y175 M198V146-I148 HydrophobicContact CG1-CG1 4.22Å; I148-C162 HydrophobicContact CG2-CB 3.96Å; I148-L165 HydrophobicContact CD1-CB 3.88Å; I148-A166 HydrophobicContact CD1-CB 4.11Å; I148-A172 HydrophobicContact CD1-CB 3.89Å; I148-A172 HydrophobicContact CG1-CB 4.37Å; I148-H173 PolarHBondContact N-O 2.94Å; I148-V174 HydrophobicContact CB-CG2 4.27Å; I148-V174 CarbonylContact O-C 3.5Å; I148-V174 VanDerWaalsContact O-CA 3.31Å; I148-V174 WeakPolarHBondContact O-CA 3.31Å; I148-Y175 PolarHBondContact O-N 2.86Å; I148-M198 HydrophobicContact CG1-CB 4.38Å; I148-M198 HydrophobicContact CG1-SD 4.47Å
149T95.1Very high92.3Very high3 Ų353.6 Ų53.62%0.01828%0.281CS..EExtended strand (participates in β ladder)trans-123171.3174.870.30000111.2L147 Y175 M198 V199 I200L147-T149 HydrophobicContact CD1-CG2 4.09Å; L147-T149 HydrophobicContact CD2-CG2 3.58Å; L147-T149 HydrophobicContact CG-CG2 3.57Å; T149-Y175 VanDerWaalsContact CA-O 3.31Å; T149-Y175 WeakPolarHBondContact CA-O 3.41Å; T149-Y175 WeakPolarHBondContact CB-O 3.4Å; T149-Y175 WeakPolarHBondContact CG2-O 3.23Å; T149-M198 PolarHBondContact N-O 2.93Å; T149-M198 PolarHBondContact OG1-O 3.49Å; T149-V199 WeakPolarHBondContact O-CA 3.28Å; T149-I200 PolarHBondContact O-N 3.28Å
150T94.5Very high92.5Very high0 Ų054.8 Ų54.80%028%0.277CS..EExtended strand (participates in β ladder)trans-122.6169.4178.163.40000111.5P154 T158 C162 Y176 I200T150-P154 HydrophobicContact CG2-CB 3.95Å; T150-P154 HydrophobicContact CG2-CG 4.21Å; T150-P154 VanDerWaalsContact OG1-CG 3.3Å; T150-P154 WeakPolarHBondContact OG1-CG 3.21Å; T150-T158 HydrophobicContact CG2-CG2 4.37Å; T150-C162 WeakPolarHBondContact CG2-SG 3.4Å; T150-Y176 HydrophobicContact CG2-CD1 4.04Å; T150-Y176 HydrophobicContact CG2-CE1 4.14Å; T150-I200 CarbonylContact C-O 3.52Å; T150-I200 VanDerWaalsContact CA-O 3.28Å; T150-I200 WeakPolarHBondContact CA-O 3.27Å
151S89.1Confident92.8Very high17 Ų1752.5 Ų52.512%0.11925%0.254CS..SBendtrans-54.1166.4157.366.40000111.4R153 I200S151-R153 PolarHBondContact O-N 3.04Å; S151-I200 PolarHBondContact N-O 3.33Å
152D86.6Confident93.1Very high51 Ų5146 Ų4627%0.27322%0.22SC..SBendtrans-59.8139.8175.2-168.137.6000111.1G179D152-G179 PolarHBondContact OD1-N 3.28Å
153R87.8Confident93.5Very high193 Ų19347.9 Ų47.973%0.72822%0.224SC*.SBendtrans46.667.9179.4-62.4175.8173.696-9.1114S151 Q202S151-R153 PolarHBondContact O-N 3.04Å; R153-Q202 PolarHBondContact O-NE2 3.31Å
154P91.3Very high93.7Very high33 Ų3344.1 Ų44.121%0.21420%0.203CC..  trans-64.815017931.4-37.8000112T150 T158 V159 Y176T150-P154 HydrophobicContact CG2-CB 3.95Å; T150-P154 HydrophobicContact CG2-CG 4.21Å; T150-P154 VanDerWaalsContact OG1-CG 3.3Å; T150-P154 WeakPolarHBondContact OG1-CG 3.21Å; P154-T158 HydrophobicContact CB-CG2 4.46Å; P154-V159 HydrophobicContact CB-CG2 3.9Å; P154-V159 HydrophobicContact CG-CG2 3.84Å; P154-Y176 HydrophobicContact CG-CD1 3.88Å; P154-Y176 HydrophobicContact CG-CE1 4.27Å
155R91.8Very high93.8Very high152 Ų15244.2 Ų44.257%0.57420%0.203SC*.  trans-96162.9176.6-63.4-74.9-171.8-176.11.8110.6R157 T158 V159 L205R155-R157 VanDerWaalsContact C-N 3.27Å; R155-R157 PolarHBondContact O-N 3.2Å; R155-R157 VanDerWaalsContact O-N 3.08Å; R155-T158 WeakPolarHBondContact O-CB 3.33Å; R155-T158 PolarHBondContact O-N 2.76Å; R155-V159 PolarHBondContact O-N 2.86Å; R155-L205 HydrophobicContact CB-CD2 4.24Å; R155-L205 HydrophobicContact CG-CD2 3.57Å
156G91.7Very high93.8Very high45 Ų4542.2 Ų42.246%0.46420%0.2SC..Hα-helixtrans-55.2-34.1-169.700000115.3R160G156-R160 WeakPolarHBondContact O-CB 3.47Å; G156-R160 VanDerWaalsContact O-CG 3.23Å; G156-R160 WeakPolarHBondContact O-CG 3.19Å; G156-R160 PolarHBondContact O-N 3.12Å; G156-R160 VanDerWaalsContact O-N 3.08Å
157R94.1Very high93.7Very high55 Ų5545 Ų4521%0.20822%0.219CC..Hα-helixtrans-66.1-45.5175.7-168.9-173.6-177.580.92.3111.9R155 R160 F161 M206 V228 L230 E233R155-R157 VanDerWaalsContact C-N 3.27Å; R155-R157 PolarHBondContact O-N 3.2Å; R155-R157 VanDerWaalsContact O-N 3.08Å; R157-R160 PolarHBondContact O-N 3.48Å; R157-F161 WeakPolarHBondContact O-CB 3.33Å; R157-F161 PolarHBondContact O-N 2.98Å; R157-M206 WeakPolarHBondContact CD-SD 3.41Å; R157-M206 VanDerWaalsContact NE-CE 3.33Å; R157-M206 PolarHBondContact NE-SD 3.2Å; R157-M206 VanDerWaalsContact NE-SD 3.4Å; R157-V228 PolarHBondContact NH2-O 2.91Å; R157-L230 HydrophobicContact CG-CD1 3.97Å; R157-E233 IonicContact CZ-OE1 3.31Å; R157-E233 VanDerWaalsContact CZ-OE1 3.31Å; R157-E233 IonicContact CZ-OE2 3.92Å; R157-E233 IonicContact NH1-OE1 2.66Å; R157-E233 PolarHBondContact NH1-OE1 2.71Å; R157-E233 IonicContact NH1-OE2 3.96Å; R157-E233 IonicContact NH2-OE1 3.08Å; R157-E233 PolarHBondContact NH2-OE1 2.65Å; R157-E233 VanDerWaalsContact NH2-OE1 3.08Å; R157-E233 IonicContact NH2-OE2 2.94Å; R157-E233 PolarHBondContact NH2-OE2 2.91Å
158T94.4Very high93.5Very high0 Ų044.8 Ų44.80%022%0.218CC..Hα-helixtrans-65.4-41.5178.8-48.70000111.2T150 P154 R155 F161 C162 I200 Q202 P207T150-T158 HydrophobicContact CG2-CG2 4.37Å; P154-T158 HydrophobicContact CB-CG2 4.46Å; R155-T158 WeakPolarHBondContact O-CB 3.33Å; R155-T158 PolarHBondContact O-N 2.76Å; T158-F161 WeakPolarHBondContact O-CB 3.28Å; T158-F161 PolarHBondContact O-N 2.95Å; T158-C162 PolarHBondContact O-N 3.35Å; T158-C162 PolarHBondContact O-SG 2.8Å; T158-I200 HydrophobicContact CG2-CG2 3.77Å; T158-Q202 HydrophobicContact CG2-CB 4.3Å; T158-Q202 WeakPolarHBondContact OG1-CB 3.43Å; T158-Q202 PolarHBondContact OG1-OE1 2.95Å; T158-P207 HydrophobicContact CG2-CG 4.42Å
159V94.9Very high93.4Very high30 Ų3045.2 Ų45.218%0.18222%0.221CC..Hα-helixtrans-57.6-53.1174.8168.10000110.9P154 R155 F161 C162 E163 Y176P154-V159 HydrophobicContact CB-CG2 3.9Å; P154-V159 HydrophobicContact CG-CG2 3.84Å; R155-V159 PolarHBondContact O-N 2.86Å; V159-F161 PolarHBondContact O-N 2.91Å; V159-C162 WeakPolarHBondContact O-CB 3.17Å; V159-C162 PolarHBondContact O-N 3.04Å; V159-E163 WeakPolarHBondContact CG1-OE1 3.22Å; V159-E163 WeakPolarHBondContact O-CG 3.44Å; V159-E163 PolarHBondContact O-N 3.09Å; V159-Y176 WeakPolarHBondContact CG1-OH 3.49Å; V159-Y176 HydrophobicContact CG2-CE1 4.27Å
160R95.4Very high93.3Very high138 Ų13845.9 Ų45.952%0.52123%0.225SC..Hα-helixtrans-61.2-31.4176.9-69.7170.4-175.5177.83.3113.1G156 R157 Q164 L230G156-R160 WeakPolarHBondContact O-CB 3.47Å; G156-R160 VanDerWaalsContact O-CG 3.23Å; G156-R160 WeakPolarHBondContact O-CG 3.19Å; G156-R160 PolarHBondContact O-N 3.12Å; G156-R160 VanDerWaalsContact O-N 3.08Å; R157-R160 PolarHBondContact O-N 3.48Å; R160-Q164 WeakPolarHBondContact O-CB 3.45Å; R160-Q164 VanDerWaalsContact O-CG 3.28Å; R160-Q164 WeakPolarHBondContact O-CG 3.49Å; R160-Q164 PolarHBondContact O-N 2.77Å; R160-Q164 VanDerWaalsContact O-N 3.1Å; R160-L230 HydrophobicContact CB-CD1 4.17Å
161F96.3Very high93.2Very high0 Ų049.1 Ų49.10%024%0.242CC..Hα-helixtrans-68.4-43.6174.8-179.1-120.2000111.1R157 T158 V159 Q164 L165 I200 P207 V228 L230 P312 F314R157-F161 WeakPolarHBondContact O-CB 3.33Å; R157-F161 PolarHBondContact O-N 2.98Å; T158-F161 WeakPolarHBondContact O-CB 3.28Å; T158-F161 PolarHBondContact O-N 2.95Å; V159-F161 PolarHBondContact O-N 2.91Å; F161-Q164 PolarHBondContact O-N 3.32Å; F161-L165 HydrophobicContact CD1-CD1 4.02Å; F161-L165 HydrophobicContact CE1-CD1 3.57Å; F161-L165 HydrophobicContact CE1-CG 4.26Å; F161-L165 HydrophobicContact CE2-CD1 4.35Å; F161-L165 HydrophobicContact CE2-CD2 4.22Å; F161-L165 HydrophobicContact CE2-CG 4.16Å; F161-L165 HydrophobicContact CZ-CD1 3.75Å; F161-L165 HydrophobicContact CZ-CD2 4.06Å; F161-L165 HydrophobicContact CZ-CG 4.02Å; F161-L165 WeakPolarHBondContact O-CG 3.43Å; F161-L165 PolarHBondContact O-N 3.44Å; F161-I200 HydrophobicContact CD1-CG2 4.14Å; F161-I200 HydrophobicContact CE1-CD1 4.3Å; F161-I200 HydrophobicContact CE1-CG2 4.38Å; F161-P207 HydrophobicContact CB-CG 4.28Å; F161-P207 HydrophobicContact CD1-CB 4.08Å; F161-P207 HydrophobicContact CD1-CG 4.01Å; F161-P207 HydrophobicContact CE1-CB 4.4Å; F161-P207 HydrophobicContact CG-CG 4.29Å; F161-V228 HydrophobicContact CD2-CG1 3.65Å; F161-V228 HydrophobicContact CE2-CG1 3.78Å; F161-V228 HydrophobicContact CG-CG1 4.11Å; F161-V228 HydrophobicContact CZ-CG1 4.33Å; F161-L230 HydrophobicContact CB-CD2 3.89Å; F161-L230 HydrophobicContact CD2-CD2 4.12Å; F161-L230 HydrophobicContact CG-CD2 4.48Å; F161-P312 HydrophobicContact CD2-CB 4.2Å; F161-P312 HydrophobicContact CD2-CG 4.41Å; F161-P312 HydrophobicContact CE2-CB 4.03Å; F161-P312 HydrophobicContact CE2-CG 4.1Å; F161-F314 AromaticContact CE2-CD1 3.58Å; F161-F314 HydrophobicContact CE2-CD1 3.58Å; F161-F314 AromaticContact CE2-CE1 3.9Å; F161-F314 HydrophobicContact CE2-CE1 3.9Å; F161-F314 HydrophobicContact CE2-CG 4.27Å; F161-F314 AromaticContact CZ-CD1 3.66Å; F161-F314 HydrophobicContact CZ-CD1 3.66Å; F161-F314 AromaticContact CZ-CE1 3.85Å; F161-F314 HydrophobicContact CZ-CE1 3.85Å; F161-F314 HydrophobicContact CZ-CG 4.03Å; F161-F314 HydrophobicContact CZ-CZ 4.38Å
162C96.1Very high93.5Very high0 Ų049.1 Ų49.10%024%0.243CC..Hα-helixtrans-64.3-42.3176.9-61.50000112.1I148 T150 T158 V159 Q164 L165 A166 V174I148-C162 HydrophobicContact CG2-CB 3.96Å; T150-C162 WeakPolarHBondContact CG2-SG 3.4Å; T158-C162 PolarHBondContact O-N 3.35Å; T158-C162 PolarHBondContact O-SG 2.8Å; V159-C162 WeakPolarHBondContact O-CB 3.17Å; V159-C162 PolarHBondContact O-N 3.04Å; C162-Q164 VanDerWaalsContact C-N 3.3Å; C162-Q164 PolarHBondContact O-N 3.36Å; C162-L165 PolarHBondContact O-N 3.06Å; C162-A166 PolarHBondContact O-N 3.49Å; C162-V174 HydrophobicContact CB-CG1 4.19Å
163E94.9Very high94Very high100 Ų10050.4 Ų50.447%0.46725%0.247SC..Hα-helixtrans-59.1-42173.1-69166.1-177.700111.6V159 A166 S167V159-E163 WeakPolarHBondContact CG1-OE1 3.22Å; V159-E163 WeakPolarHBondContact O-CG 3.44Å; V159-E163 PolarHBondContact O-N 3.09Å; E163-A166 PolarHBondContact O-N 3.25Å; E163-S167 PolarHBondContact O-N 2.78Å
164Q94.7Very high94.4Very high30 Ų3043.1 Ų43.114%0.1422%0.224CC..Hα-helixtrans-68-35.3176.2-78.1176.22400112.5R160 F161 C162 S167 V168 P312R160-Q164 WeakPolarHBondContact O-CB 3.45Å; R160-Q164 VanDerWaalsContact O-CG 3.28Å; R160-Q164 WeakPolarHBondContact O-CG 3.49Å; R160-Q164 PolarHBondContact O-N 2.77Å; R160-Q164 VanDerWaalsContact O-N 3.1Å; F161-Q164 PolarHBondContact O-N 3.32Å; C162-Q164 VanDerWaalsContact C-N 3.3Å; C162-Q164 PolarHBondContact O-N 3.36Å; Q164-S167 PolarHBondContact O-N 3.06Å; Q164-S167 PolarHBondContact O-OG 2.99Å; Q164-V168 WeakPolarHBondContact O-CG2 3.3Å; Q164-V168 PolarHBondContact O-N 2.98Å; Q164-P312 HydrophobicContact CB-CG 4.05Å
165L95.5Very high94.5Very high5 Ų547.5 Ų47.53%0.02624%0.237CC..Hα-helixtrans-65.8-41.5173.2-71.8174.7000111.1I148 F161 C162 S167 V168 I169 M198 I200 F314I148-L165 HydrophobicContact CD1-CB 3.88Å; F161-L165 HydrophobicContact CD1-CD1 4.02Å; F161-L165 HydrophobicContact CE1-CD1 3.57Å; F161-L165 HydrophobicContact CE1-CG 4.26Å; F161-L165 HydrophobicContact CE2-CD1 4.35Å; F161-L165 HydrophobicContact CE2-CD2 4.22Å; F161-L165 HydrophobicContact CE2-CG 4.16Å; F161-L165 HydrophobicContact CZ-CD1 3.75Å; F161-L165 HydrophobicContact CZ-CD2 4.06Å; F161-L165 HydrophobicContact CZ-CG 4.02Å; F161-L165 WeakPolarHBondContact O-CG 3.43Å; F161-L165 PolarHBondContact O-N 3.44Å; C162-L165 PolarHBondContact O-N 3.06Å; L165-S167 VanDerWaalsContact C-N 3.27Å; L165-S167 PolarHBondContact O-N 2.88Å; L165-V168 PolarHBondContact O-N 3.13Å; L165-I169 PolarHBondContact O-N 2.79Å; L165-M198 HydrophobicContact CD1-SD 4.02Å; L165-I200 HydrophobicContact CD1-CD1 3.96Å; L165-I200 HydrophobicContact CD1-CG1 4.28Å; L165-F314 HydrophobicContact CD2-CE1 3.7Å; L165-F314 HydrophobicContact CD2-CZ 3.87Å
166A95.1Very high94.5Very high26 Ų2644.4 Ų44.422%0.21523%0.226CC..Hα-helixtrans-63.5-31.7176.300000113I148 C162 E163 V168 I169 A172 V174I148-A166 HydrophobicContact CD1-CB 4.11Å; C162-A166 PolarHBondContact O-N 3.49Å; E163-A166 PolarHBondContact O-N 3.25Å; A166-V168 PolarHBondContact O-N 3.09Å; A166-I169 VanDerWaalsContact O-O 3.07Å; A166-A172 HydrophobicContact CB-CB 4.28Å; A166-V174 HydrophobicContact CB-CG2 3.52Å
167S93.4Very high94.4Very high59 Ų5944.9 Ų44.941%0.41321%0.214SC..THydrogen-bonded Turntrans-71.5-15.9172.6700000114.6E163 Q164 L165E163-S167 PolarHBondContact O-N 2.78Å; Q164-S167 PolarHBondContact O-N 3.06Å; Q164-S167 PolarHBondContact O-OG 2.99Å; L165-S167 VanDerWaalsContact C-N 3.27Å; L165-S167 PolarHBondContact O-N 2.88Å
168V94Very high94Very high4 Ų453 Ų532%0.02425%0.245CC..THydrogen-bonded Turntrans-101.6-38.6-176.8175.90000111.3Q164 L165 A166 P170 F269 F292 F294Q164-V168 WeakPolarHBondContact O-CG2 3.3Å; Q164-V168 PolarHBondContact O-N 2.98Å; L165-V168 PolarHBondContact O-N 3.13Å; A166-V168 PolarHBondContact O-N 3.09Å; V168-P170 WeakPolarHBondContact O-CD 3.16Å; V168-F269 HydrophobicContact CG1-CE1 4.37Å; V168-F292 HydrophobicContact CG1-CE1 4.45Å; V168-F292 HydrophobicContact CG1-CZ 3.75Å; V168-F294 HydrophobicContact CG1-CB 4.3Å; V168-F294 HydrophobicContact CG1-CD1 4.31Å; V168-F294 HydrophobicContact CG1-CD2 3.53Å; V168-F294 HydrophobicContact CG1-CE2 3.78Å; V168-F294 HydrophobicContact CG1-CG 3.81Å; V168-F294 HydrophobicContact CG1-CZ 4.25Å; V168-F294 HydrophobicContact CG2-CB 4.33Å; V168-F294 HydrophobicContact CG2-CD1 3.74Å; V168-F294 HydrophobicContact CG2-CD2 4.44Å; V168-F294 HydrophobicContact CG2-CE1 4.09Å; V168-F294 HydrophobicContact CG2-CG 3.93Å
169I94.9Very high93.6Very high9 Ų955.5 Ų55.55%0.04627%0.27CS..SBendtrans-89.8116178.4-59173.7000108.1V146 L165 A166 A172 M198 L268 F269V146-I169 HydrophobicContact CB-CG2 4.26Å; V146-I169 HydrophobicContact CG2-CG2 3.82Å; L165-I169 PolarHBondContact O-N 2.79Å; A166-I169 VanDerWaalsContact O-O 3.07Å; I169-A172 HydrophobicContact CB-CB 3.97Å; I169-A172 HydrophobicContact CG2-CB 4.05Å; I169-A172 WeakPolarHBondContact O-CB 3.33Å; I169-A172 PolarHBondContact O-N 2.93Å; I169-M198 HydrophobicContact CD1-CE 3.7Å; I169-L268 WeakPolarHBondContact CG2-O 3.38Å; I169-F269 HydrophobicContact CG1-CE1 4.19Å; I169-F269 HydrophobicContact CG1-CZ 4.04Å
170P92.7Very high93.5Very high16 Ų1657.1 Ų57.110%0.10428%0.278CS..THydrogen-bonded Turntrans-60.5150.7175.7-23.536.4000111.6V168 A172 Y245 P270V168-P170 WeakPolarHBondContact O-CD 3.16Å; P170-A172 PolarHBondContact O-N 3.06Å; P170-A172 VanDerWaalsContact O-N 3.09Å; P170-Y245 HydrophobicContact CB-CD1 3.59Å; P170-Y245 HydrophobicContact CB-CE1 3.64Å; P170-Y245 HydrophobicContact CG-CD1 3.64Å; P170-Y245 HydrophobicContact CG-CE1 4.23Å; P170-Y245 HydrophobicContact CG-CG 4.37Å; P170-P270 HydrophobicContact CB-CG 3.83Å; P170-P270 HydrophobicContact CG-CG 4.09Å
171N92.8Very high93.3Very high68 Ų6853.2 Ų53.236%0.36428%0.275SS..THydrogen-bonded Turntrans56.524.2179.5-51.5-28.5000114.4P144 V146P144-N171 WeakPolarHBondContact O-CB 3.45Å; P144-N171 PolarHBondContact O-ND2 3.48Å; V146-N171 PolarHBondContact N-O 3.41Å
172A95.7Very high93Very high17 Ų1754 Ų5414%0.1428%0.279CS..EExtended strand (participates in β ladder)trans-88.1130.8176.500000111.6V146 I148 A166 I169 P170V146-A172 HydrophobicContact CB-CB 4.22Å; V146-A172 CarbonylContact O-C 3.56Å; V146-A172 VanDerWaalsContact O-CA 3.3Å; V146-A172 WeakPolarHBondContact O-CA 3.24Å; I148-A172 HydrophobicContact CD1-CB 3.89Å; I148-A172 HydrophobicContact CG1-CB 4.37Å; A166-A172 HydrophobicContact CB-CB 4.28Å; I169-A172 HydrophobicContact CB-CB 3.97Å; I169-A172 HydrophobicContact CG2-CB 4.05Å; I169-A172 WeakPolarHBondContact O-CB 3.33Å; I169-A172 PolarHBondContact O-N 2.93Å; P170-A172 PolarHBondContact O-N 3.06Å; P170-A172 VanDerWaalsContact O-N 3.09Å
173H96.1Very high92.7Very high78 Ų7859.6 Ų59.636%0.36130%0.303SS..EExtended strand (participates in β ladder)trans-115.4130.2177.2-62.2-79.1000110.7V146 I148 Y175 F194V146-H173 PolarHBondContact O-N 3.31Å; I148-H173 PolarHBondContact N-O 2.94Å; H173-Y175 HydrophobicContact CB-CD2 4.13Å; H173-Y175 HydrophobicContact CB-CE2 3.77Å; H173-F194 HydrophobicContact CB-CE1 4.27Å; H173-F194 HydrophobicContact CB-CZ 4.45Å; H173-F194 AromaticContact CD2-CE1 3.89Å
174V96.3Very high92.6Very high40 Ų4062.5 Ų62.524%0.24231%0.31CS..EExtended strand (participates in β ladder)trans-94.9117.4178.5-173.80000110I148 C162 A166 Y176I148-V174 HydrophobicContact CB-CG2 4.27Å; I148-V174 CarbonylContact O-C 3.5Å; I148-V174 VanDerWaalsContact O-CA 3.31Å; I148-V174 WeakPolarHBondContact O-CA 3.31Å; C162-V174 HydrophobicContact CB-CG1 4.19Å; A166-V174 HydrophobicContact CB-CG2 3.52Å; V174-Y176 HydrophobicContact CG1-CE1 3.84Å
175Y94.3Very high92.5Very high125 Ų12561.7 Ų61.749%0.4931%0.306SS..  trans-129.7132.7171.1-68.6-80.7000111.3L147 I148 T149 H173L147-Y175 HydrophobicContact CD1-CD2 3.4Å; L147-Y175 VanDerWaalsContact CD1-CD2 3.4Å; L147-Y175 HydrophobicContact CD1-CE2 4.34Å; L147-Y175 HydrophobicContact CD1-CG 4.15Å; I148-Y175 PolarHBondContact O-N 2.86Å; T149-Y175 VanDerWaalsContact CA-O 3.31Å; T149-Y175 WeakPolarHBondContact CA-O 3.41Å; T149-Y175 WeakPolarHBondContact CB-O 3.4Å; T149-Y175 WeakPolarHBondContact CG2-O 3.23Å; H173-Y175 HydrophobicContact CB-CD2 4.13Å; H173-Y175 HydrophobicContact CB-CE2 3.77Å
176Y91.3Very high92.5Very high88 Ų8862.2 Ų62.235%0.34531%0.309SS..  trans-88.1137.7179.9-54.1-61.1000111.6T150 P154 V159 V174 R178T150-Y176 HydrophobicContact CG2-CD1 4.04Å; T150-Y176 HydrophobicContact CG2-CE1 4.14Å; P154-Y176 HydrophobicContact CG-CD1 3.88Å; P154-Y176 HydrophobicContact CG-CE1 4.27Å; V159-Y176 WeakPolarHBondContact CG1-OH 3.49Å; V159-Y176 HydrophobicContact CG2-CE1 4.27Å; V174-Y176 HydrophobicContact CG1-CE1 3.84Å; Y176-R178 VanDerWaalsContact C-N 3.31Å; Y176-R178 PolarHBondContact O-N 3.3Å
177R88.8Confident92.5Very high55 Ų5564.6 Ų64.621%0.20832%0.322CS..  trans-65.9-26.3-170-161.4169.379.3-173.21.9115.2G179 L180 I185R177-G179 PolarHBondContact O-N 3.03Å; R177-L180 WeakPolarHBondContact CD-O 3.13Å; R177-L180 HydrophobicContact CG-CB 4.1Å; R177-L180 WeakPolarHBondContact CG-O 3.4Å; R177-L180 PolarHBondContact NE-O 2.93Å; R177-L180 WeakPolarHBondContact O-CB 3.17Å; R177-L180 WeakPolarHBondContact O-CG 3.46Å; R177-L180 PolarHBondContact O-N 3.33Å; R177-I185 HydrophobicContact CG-CD1 3.51Å
178R86.8Confident92.5Very high226 Ų22666 Ų6685%0.85332%0.323SS*.THydrogen-bonded Turntrans41.145.4-179.7-62.5-175.8177.8-172.70.4113.6Y176Y176-R178 VanDerWaalsContact C-N 3.31Å; Y176-R178 PolarHBondContact O-N 3.3Å
179G86.4Confident92.6Very high52 Ų5266 Ų6654%0.53632%0.323SS..THydrogen-bonded Turntrans83.5-1-179.900000117.7D152 R177D152-G179 PolarHBondContact OD1-N 3.28Å; R177-G179 PolarHBondContact O-N 3.03Å
180L91.4Very high92.6Very high64 Ų6468.3 Ų68.334%0.33534%0.337SS..  trans-70.7143.7176.5-66.6169.5000112.3R177 I185R177-L180 WeakPolarHBondContact CD-O 3.13Å; R177-L180 HydrophobicContact CG-CB 4.1Å; R177-L180 WeakPolarHBondContact CG-O 3.4Å; R177-L180 PolarHBondContact NE-O 2.93Å; R177-L180 WeakPolarHBondContact O-CB 3.17Å; R177-L180 WeakPolarHBondContact O-CG 3.46Å; R177-L180 PolarHBondContact O-N 3.33Å; L180-I185 HydrophobicContact CB-CD1 3.89Å; L180-I185 HydrophobicContact CB-CG1 4.03Å
181A91.3Very high92.8Very high56 Ų5671.4 Ų71.446%0.46336%0.364SS..  trans-78.8144.7173.100000111K183 R184 I185A181-K183 VanDerWaalsContact C-N 3.27Å; A181-K183 PolarHBondContact O-N 3.48Å; A181-R184 WeakPolarHBondContact O-CB 3.04Å; A181-R184 PolarHBondContact O-N 2.93Å; A181-I185 PolarHBondContact O-N 3.37Å
182L90.7Very high92.9Very high16 Ų1675 Ų758%0.08437%0.373CS..Hα-helixtrans-57.6-38.6-179.7-67.5177.9000112.5R184 I185 I186 M197 V199 F326L182-R184 PolarHBondContact O-N 3.1Å; L182-R184 VanDerWaalsContact O-N 3.13Å; L182-I185 HydrophobicContact CD2-CD1 4.33Å; L182-I185 PolarHBondContact O-N 3.43Å; L182-I186 WeakPolarHBondContact O-CG1 3.49Å; L182-I186 PolarHBondContact O-N 3.07Å; L182-M197 HydrophobicContact CD2-CE 4.16Å; L182-M197 HydrophobicContact CD2-SD 4.11Å; L182-V199 HydrophobicContact CD1-CG2 4.19Å; L182-V199 HydrophobicContact CD2-CG1 4.39Å; L182-V199 HydrophobicContact CD2-CG2 3.73Å; L182-F326 HydrophobicContact CB-CD1 3.93Å; L182-F326 HydrophobicContact CB-CE1 4.29Å; L182-F326 HydrophobicContact CD1-CD1 3.66Å; L182-F326 HydrophobicContact CD1-CD2 4.39Å; L182-F326 HydrophobicContact CD1-CE1 3.64Å; L182-F326 HydrophobicContact CD1-CE2 4.36Å; L182-F326 HydrophobicContact CD1-CG 4.06Å; L182-F326 HydrophobicContact CD1-CZ 4Å; L182-F326 HydrophobicContact CG-CD1 4.44Å
183K90.6Very high92.8Very high118 Ų11880.3 Ų80.351%0.51340%0.398SS..Hα-helixtrans-58.2-25.6175.6-65.2-164.9175.7-161.20114A181 P187 D327A181-K183 VanDerWaalsContact C-N 3.27Å; A181-K183 PolarHBondContact O-N 3.48Å; K183-P187 WeakPolarHBondContact O-CD 3.45Å; K183-D327 VanDerWaalsContact CE-OD1 3.29Å; K183-D327 WeakPolarHBondContact CE-OD1 3.22Å; K183-D327 IonicContact NZ-OD1 2.74Å; K183-D327 PolarHBondContact NZ-OD1 3.34Å; K183-D327 IonicContact NZ-OD2 3.98Å
184R92.1Very high92.8Very high161 Ų16177.3 Ų77.361%0.60838%0.384SS*.Hα-helixtrans-86.2-25.8174.6-65.9-176.266.6-174.91.1112.7A181 L182 Q188A181-R184 WeakPolarHBondContact O-CB 3.04Å; A181-R184 PolarHBondContact O-N 2.93Å; L182-R184 PolarHBondContact O-N 3.1Å; L182-R184 VanDerWaalsContact O-N 3.13Å; R184-Q188 WeakPolarHBondContact O-CG 3.35Å
185I93.4Very high92.8Very high12 Ų1276.6 Ų76.66%0.06238%0.38CS..Hα-helixtrans-81.5-38.3-177.4-63.6168000110.3L147 R177 L180 A181 L182 Q188 C189 M197L147-I185 HydrophobicContact CD2-CG2 4.06Å; R177-I185 HydrophobicContact CG-CD1 3.51Å; L180-I185 HydrophobicContact CB-CD1 3.89Å; L180-I185 HydrophobicContact CB-CG1 4.03Å; A181-I185 PolarHBondContact O-N 3.37Å; L182-I185 HydrophobicContact CD2-CD1 4.33Å; L182-I185 PolarHBondContact O-N 3.43Å; I185-Q188 CarbonylContact O-C 3.56Å; I185-Q188 WeakPolarHBondContact O-CA 3.15Å; I185-Q188 WeakPolarHBondContact O-CB 3.35Å; I185-Q188 PolarHBondContact O-N 3.33Å; I185-C189 VanDerWaalsContact CG2-SG 3.55Å; I185-C189 PolarHBondContact O-N 2.9Å; I185-C189 PolarHBondContact O-SG 2.94Å; I185-M197 HydrophobicContact CG2-SD 4.09Å
186I94Very high92.9Very high16 Ų1670.8 Ų70.88%0.08236%0.357CS..Hα-helixtrans-54-52.5-179.7-71.1161.9000111.8L182 Q188 C189 V190 M197 L215 T325 F326L182-I186 WeakPolarHBondContact O-CG1 3.49Å; L182-I186 PolarHBondContact O-N 3.07Å; I186-Q188 VanDerWaalsContact C-N 3.27Å; I186-Q188 PolarHBondContact O-N 3.1Å; I186-C189 WeakPolarHBondContact O-CB 3.28Å; I186-C189 PolarHBondContact O-N 3.39Å; I186-V190 WeakPolarHBondContact O-CG2 3.19Å; I186-V190 PolarHBondContact O-N 2.86Å; I186-M197 HydrophobicContact CD1-CE 4.12Å; I186-M197 HydrophobicContact CG1-CE 3.77Å; I186-M197 HydrophobicContact CG1-SD 4.26Å; I186-L215 HydrophobicContact CG1-CD2 4.4Å; I186-L215 HydrophobicContact CG2-CD2 3.75Å; I186-T325 HydrophobicContact CG2-CG2 4.34Å; I186-F326 HydrophobicContact CD1-CB 4.12Å
187P94.8Very high93.1Very high76 Ų7666.6 Ų66.649%0.49434%0.341SS..Hα-helixtrans-60.4-34.5176.2-24.934.4000113.7K183 C189 V190 A191K183-P187 WeakPolarHBondContact O-CD 3.45Å; P187-C189 VanDerWaalsContact C-N 3.33Å; P187-V190 PolarHBondContact O-N 2.87Å; P187-A191 WeakPolarHBondContact O-CB 3.24Å; P187-A191 PolarHBondContact O-N 2.76Å
188Q94.4Very high93.5Very high90 Ų9064.3 Ų64.342%0.42133%0.332SS..Hα-helixtrans-70.4-30.8176.2-64.7177.91.300112.5R184 I185 I186 R192R184-Q188 WeakPolarHBondContact O-CG 3.35Å; I185-Q188 CarbonylContact O-C 3.56Å; I185-Q188 WeakPolarHBondContact O-CA 3.15Å; I185-Q188 WeakPolarHBondContact O-CB 3.35Å; I185-Q188 PolarHBondContact O-N 3.33Å; I186-Q188 VanDerWaalsContact C-N 3.27Å; I186-Q188 PolarHBondContact O-N 3.1Å; Q188-R192 WeakPolarHBondContact O-CB 3.33Å; Q188-R192 VanDerWaalsContact O-CG 3.26Å; Q188-R192 WeakPolarHBondContact O-CG 2.89Å; Q188-R192 PolarHBondContact O-N 2.88Å
189C95.1Very high93.9Very high4 Ų453.6 Ų53.63%0.02729%0.292CS..Hα-helixtrans-70.1-46.8175.2-65.90000110.2L147 I185 I186 P187 A191 R192 D193 F194 L215L147-C189 WeakPolarHBondContact CD2-SG 3.43Å; I185-C189 VanDerWaalsContact CG2-SG 3.55Å; I185-C189 PolarHBondContact O-N 2.9Å; I185-C189 PolarHBondContact O-SG 2.94Å; I186-C189 WeakPolarHBondContact O-CB 3.28Å; I186-C189 PolarHBondContact O-N 3.39Å; P187-C189 VanDerWaalsContact C-N 3.33Å; C189-A191 VanDerWaalsContact C-N 3.35Å; C189-A191 PolarHBondContact O-N 2.9Å; C189-R192 CarbonylContact O-C 3.47Å; C189-R192 PolarHBondContact O-N 2.82Å; C189-D193 PolarHBondContact O-N 2.97Å; C189-D193 VanDerWaalsContact O-N 3.17Å; C189-F194 HydrophobicContact CB-CB 3.92Å; C189-F194 HydrophobicContact CB-CD2 4.34Å; C189-F194 HydrophobicContact CB-CG 4.47Å; C189-F194 PolarHBondContact O-N 2.55Å; C189-L215 HydrophobicContact CB-CD1 3.44Å; C189-L215 VanDerWaalsContact CB-CD1 3.44Å
190V95.7Very high94.4Very high56 Ų5651.1 Ų51.134%0.33927%0.267SS..Hα-helixtrans-59.1-46.4175.8175.70000110.6I186 P187 R192 D193 L215 P216I186-V190 WeakPolarHBondContact O-CG2 3.19Å; I186-V190 PolarHBondContact O-N 2.86Å; P187-V190 PolarHBondContact O-N 2.87Å; V190-R192 PolarHBondContact O-N 2.97Å; V190-R192 VanDerWaalsContact O-N 3.08Å; V190-D193 PolarHBondContact O-N 3.28Å; V190-D193 VanDerWaalsContact O-N 3.09Å; V190-L215 HydrophobicContact CG2-CB 4.39Å; V190-P216 HydrophobicContact CG1-CB 4.11Å; V190-P216 HydrophobicContact CG2-CB 3.86Å
191A96.2Very high94.6Very high82 Ų8250.6 Ų50.668%0.67826%0.264SS*.THydrogen-bonded Turntrans-65.7-10.8176.900000114.9P187 C189P187-A191 WeakPolarHBondContact O-CB 3.24Å; P187-A191 PolarHBondContact O-N 2.76Å; C189-A191 VanDerWaalsContact C-N 3.35Å; C189-A191 PolarHBondContact O-N 2.9Å
192R95.1Very high94.7Very high144 Ų14450.1 Ų50.154%0.54325%0.253SS..THydrogen-bonded Turntrans-11514.6177.9-68.3177.9-178-153.70.4112.2K145 Q188 C189 V190 F194K145-R192 PolarHBondContact NZ-O 3.44Å; Q188-R192 WeakPolarHBondContact O-CB 3.33Å; Q188-R192 VanDerWaalsContact O-CG 3.26Å; Q188-R192 WeakPolarHBondContact O-CG 2.89Å; Q188-R192 PolarHBondContact O-N 2.88Å; C189-R192 CarbonylContact O-C 3.47Å; C189-R192 PolarHBondContact O-N 2.82Å; V190-R192 PolarHBondContact O-N 2.97Å; V190-R192 VanDerWaalsContact O-N 3.08Å; R192-F194 VanDerWaalsContact C-N 3.26Å; R192-F194 HydrophobicContact CB-CD2 3.76Å; R192-F194 HydrophobicContact CB-CE2 3.83Å; R192-F194 PolarHBondContact O-N 3.48Å
193D94.8Very high94.8Very high127 Ų12752.5 Ų52.568%0.67927%0.265SS*.THydrogen-bonded Turntrans58.134.8177.9-46.1-52.5000113.6K145 C189 V190K145-D193 WeakPolarHBondContact CD-O 3.36Å; C189-D193 PolarHBondContact O-N 2.97Å; C189-D193 VanDerWaalsContact O-N 3.17Å; V190-D193 PolarHBondContact O-N 3.28Å; V190-D193 VanDerWaalsContact O-N 3.09Å
194F96.2Very high94.8Very high15 Ų1556.9 Ų56.97%0.06628%0.279CS..  trans-77.7126.4167.6-75.6-83.1000109.6K145 L147 H173 C189 R192 L215K145-F194 HydrophobicContact CB-CD1 4.42Å; K145-F194 HydrophobicContact CD-CD1 4.05Å; K145-F194 HydrophobicContact CD-CE1 4.18Å; K145-F194 HydrophobicContact CD-CG 4.38Å; K145-F194 HydrophobicContact CG-CD1 3.73Å; K145-F194 HydrophobicContact CG-CE1 3.89Å; K145-F194 HydrophobicContact CG-CG 4.47Å; L147-F194 HydrophobicContact CB-CD1 3.69Å; L147-F194 HydrophobicContact CB-CE1 3.88Å; L147-F194 HydrophobicContact CB-CG 4.16Å; L147-F194 HydrophobicContact CD1-CE1 4.32Å; L147-F194 HydrophobicContact CD1-CZ 4.31Å; H173-F194 HydrophobicContact CB-CE1 4.27Å; H173-F194 HydrophobicContact CB-CZ 4.45Å; H173-F194 AromaticContact CD2-CE1 3.89Å; C189-F194 HydrophobicContact CB-CB 3.92Å; C189-F194 HydrophobicContact CB-CD2 4.34Å; C189-F194 HydrophobicContact CB-CG 4.47Å; C189-F194 PolarHBondContact O-N 2.55Å; R192-F194 VanDerWaalsContact C-N 3.26Å; R192-F194 HydrophobicContact CB-CD2 3.76Å; R192-F194 HydrophobicContact CB-CE2 3.83Å; R192-F194 PolarHBondContact O-N 3.48Å; F194-L215 WeakPolarHBondContact O-CB 3.48Å
195T95.3Very high94.7Very high25 Ų2554.2 Ų54.215%0.15328%0.276CS..  trans-87.4-27.4177.761.80000111.7P144 K145 H214 L215P144-T195 WeakPolarHBondContact CA-OG1 3.33Å; K145-T195 PolarHBondContact N-OG1 3.33Å; K145-T195 PolarHBondContact O-N 3.06Å; K145-T195 PolarHBondContact O-OG1 3.1Å; T195-H214 PolarHBondContact O-ND1 3.04Å; T195-L215 PolarHBondContact O-N 3.05Å
196Y96Very high94.6Very high3 Ų357.7 Ų57.71%0.01229%0.293CS..EExtended strand (participates in β ladder)trans-132.7143.3-180-62.7-79.2000112.2F134 P144 K145 V146 L147 C213 H214 L264 A267 L268F134-Y196 HydrophobicContact CE1-CE1 4.35Å; P144-Y196 HydrophobicContact CB-CD2 4.06Å; P144-Y196 HydrophobicContact CB-CE2 3.89Å; K145-Y196 PolarHBondContact O-N 2.84Å; V146-Y196 HydrophobicContact CG2-CD2 4.15Å; L147-Y196 PolarHBondContact N-O 3.28Å; Y196-C213 WeakPolarHBondContact CA-O 3.46Å; Y196-H214 HydrophobicContact CD1-CB 4.12Å; Y196-H214 AromaticContact CD1-ND1 3.75Å; Y196-H214 HydrophobicContact CE1-CB 3.79Å; Y196-H214 AromaticContact CE1-CG 3.7Å; Y196-H214 AromaticContact CE1-ND1 3.08Å; Y196-H214 WeakPolarHBondContact CE1-ND1 3.47Å; Y196-H214 AromaticContact CZ-CE1 3.79Å; Y196-H214 AromaticContact CZ-ND1 3.29Å; Y196-H214 VanDerWaalsContact CZ-ND1 3.29Å; Y196-H214 PolarHBondContact OH-CE1 3.37Å; Y196-H214 PolarHBondContact OH-ND1 3.16Å; Y196-L264 HydrophobicContact CE1-CD1 4.12Å; Y196-A267 HydrophobicContact CE2-CB 4.47Å; Y196-A267 WeakPolarHBondContact CE2-O 3.41Å; Y196-A267 WeakPolarHBondContact OH-CB 3.22Å; Y196-L268 HydrophobicContact CD1-CD2 3.72Å; Y196-L268 HydrophobicContact CD2-CD2 3.95Å; Y196-L268 HydrophobicContact CE1-CD2 4.23Å; Y196-L268 HydrophobicContact CE2-CD2 4.47Å; Y196-L268 HydrophobicContact CG-CD2 3.6Å
197M95.7Very high94.7Very high0 Ų057.3 Ų57.30%029%0.292CS..EExtended strand (participates in β ladder)trans-120.7119.2167.4-178.3-175.965.600109.8L147 L182 I185 I186 V199 C213 L215L147-M197 HydrophobicContact CD2-CG 4.39Å; L147-M197 WeakPolarHBondContact O-CA 3.3Å; L182-M197 HydrophobicContact CD2-CE 4.16Å; L182-M197 HydrophobicContact CD2-SD 4.11Å; I185-M197 HydrophobicContact CG2-SD 4.09Å; I186-M197 HydrophobicContact CD1-CE 4.12Å; I186-M197 HydrophobicContact CG1-CE 3.77Å; I186-M197 HydrophobicContact CG1-SD 4.26Å; M197-V199 HydrophobicContact CE-CG2 4.05Å; M197-V199 HydrophobicContact CG-CG2 4.14Å; M197-V199 HydrophobicContact SD-CG2 4.24Å; M197-C213 HydrophobicContact CB-CB 4.39Å; M197-C213 HydrophobicContact CE-CB 4.19Å; M197-C213 PolarHBondContact N-O 2.8Å; M197-C213 PolarHBondContact O-N 3.14Å; M197-L215 HydrophobicContact CB-CD1 4.17Å
198M97.1Very high94.7Very high7 Ų756.6 Ų56.63%0.03428%0.284CS..EExtended strand (participates in β ladder)trans-106.6123.8173.9-173.7-178.9-65.800109.5L147 I148 T149 L165 I169 I200 L210 V211 L212 L268L147-M198 PolarHBondContact O-N 2.8Å; I148-M198 HydrophobicContact CG1-CB 4.38Å; I148-M198 HydrophobicContact CG1-SD 4.47Å; T149-M198 PolarHBondContact N-O 2.93Å; T149-M198 PolarHBondContact OG1-O 3.49Å; L165-M198 HydrophobicContact CD1-SD 4.02Å; I169-M198 HydrophobicContact CD1-CE 3.7Å; M198-I200 HydrophobicContact CG-CD1 4.03Å; M198-I200 HydrophobicContact SD-CD1 4.07Å; M198-L210 HydrophobicContact CG-CD1 4.22Å; M198-L210 HydrophobicContact CG-CD2 4.46Å; M198-L210 HydrophobicContact CG-CG 4.1Å; M198-L210 HydrophobicContact SD-CD1 3.9Å; M198-L210 HydrophobicContact SD-CG 4.44Å; M198-V211 CarbonylContact C-O 3.48Å; M198-V211 WeakPolarHBondContact CA-O 3.34Å; M198-L212 HydrophobicContact CB-CD1 4.05Å; M198-L212 HydrophobicContact CE-CD1 4.01Å; M198-L212 HydrophobicContact CG-CD1 4.39Å; M198-L268 HydrophobicContact CE-CD1 4.18Å
199V96Very high94.8Very high1 Ų152.6 Ų52.61%0.00627%0.267CS..EExtended strand (participates in β ladder)trans-114.9116.4178.8-169.60000109.4T149 L182 M197 L210 V211T149-V199 WeakPolarHBondContact O-CA 3.28Å; L182-V199 HydrophobicContact CD1-CG2 4.19Å; L182-V199 HydrophobicContact CD2-CG1 4.39Å; L182-V199 HydrophobicContact CD2-CG2 3.73Å; M197-V199 HydrophobicContact CE-CG2 4.05Å; M197-V199 HydrophobicContact CG-CG2 4.14Å; M197-V199 HydrophobicContact SD-CG2 4.24Å; V199-L210 WeakPolarHBondContact O-CA 3.35Å; V199-V211 HydrophobicContact CB-CB 4.16Å; V199-V211 PolarHBondContact N-O 2.85Å; V199-V211 PolarHBondContact O-N 2.98Å
200I96.8Very high94.9Very high0 Ų052.7 Ų52.70%027%0.266CS..EExtended strand (participates in β ladder)trans-94.2116.6176.4-54-56.6000110.4T149 T150 S151 T158 F161 L165 M198 P207 L210T149-I200 PolarHBondContact O-N 3.28Å; T150-I200 CarbonylContact C-O 3.52Å; T150-I200 VanDerWaalsContact CA-O 3.28Å; T150-I200 WeakPolarHBondContact CA-O 3.27Å; S151-I200 PolarHBondContact N-O 3.33Å; T158-I200 HydrophobicContact CG2-CG2 3.77Å; F161-I200 HydrophobicContact CD1-CG2 4.14Å; F161-I200 HydrophobicContact CE1-CD1 4.3Å; F161-I200 HydrophobicContact CE1-CG2 4.38Å; L165-I200 HydrophobicContact CD1-CD1 3.96Å; L165-I200 HydrophobicContact CD1-CG1 4.28Å; M198-I200 HydrophobicContact CG-CD1 4.03Å; M198-I200 HydrophobicContact SD-CD1 4.07Å; I200-P207 HydrophobicContact CG2-CB 4.15Å; I200-L210 HydrophobicContact CD1-CB 4.11Å; I200-L210 HydrophobicContact CD1-CD1 3.62Å; I200-L210 HydrophobicContact CD1-CG 3.78Å
201N94.9Very high94.9Very high54 Ų5450.3 Ų50.329%0.28925%0.252SS..EExtended strand (participates in β ladder)trans-93.2143.5173.7-72.5-21.4000111.2N208 G209N201-N208 PolarHBondContact O-N 3.39Å; N201-G209 PolarHBondContact N-O 2.83Å; N201-G209 PolarHBondContact O-N 2.83Å
202Q93.3Very high94.9Very high46 Ų4646.4 Ų46.422%0.21522%0.22CC..EExtended strand (participates in β ladder)trans-117.3145.7175.372.8-174.1-0.900111.3R153 T158 M206R153-Q202 PolarHBondContact O-NE2 3.31Å; T158-Q202 HydrophobicContact CG2-CB 4.3Å; T158-Q202 WeakPolarHBondContact OG1-CB 3.43Å; T158-Q202 PolarHBondContact OG1-OE1 2.95Å; Q202-M206 CarbonylContact C-O 3.59Å; Q202-M206 VanDerWaalsContact CA-O 3.29Å; Q202-M206 WeakPolarHBondContact CA-O 3.45Å
203D93.3Very high95Very high66 Ų6639.6 Ų39.635%0.35319%0.194SC..EExtended strand (participates in β ladder)trans-132.7139.1166.9176.636.4000108.2L205 M206 N208D203-L205 VanDerWaalsContact C-N 3.26Å; D203-L205 PolarHBondContact O-N 3.02Å; D203-L205 VanDerWaalsContact O-N 3.13Å; D203-M206 PolarHBondContact N-O 2.95Å; D203-M206 PolarHBondContact O-N 3.1Å; D203-N208 HydrophobicContact CB-CB 4Å; D203-N208 WeakPolarHBondContact CB-ND2 3.37Å
204R90.3Very high95Very high209 Ų20934.4 Ų34.479%0.78917%0.166SC*.THydrogen-bonded Turntrans4548.6178.5-69.5175.3-75.5-178.7-3.9113.9M206R204-M206 PolarHBondContact O-N 2.98Å
205L90.1Very high94.9Very high106 Ų10634 Ų3456%0.55516%0.164SC*.THydrogen-bonded Turntrans6511.7179.1-42.9176.7000115.1R155 D203R155-L205 HydrophobicContact CB-CD2 4.24Å; R155-L205 HydrophobicContact CG-CD2 3.57Å; D203-L205 VanDerWaalsContact C-N 3.26Å; D203-L205 PolarHBondContact O-N 3.02Å; D203-L205 VanDerWaalsContact O-N 3.13Å
206M91.8Very high94.8Very high85 Ų8536.2 Ų36.242%0.41918%0.179SC..EExtended strand (participates in β ladder)trans-123140.1-179.7-64.7-67.5-69.900110.4R157 Q202 D203 R204 N208R157-M206 WeakPolarHBondContact CD-SD 3.41Å; R157-M206 VanDerWaalsContact NE-CE 3.33Å; R157-M206 PolarHBondContact NE-SD 3.2Å; R157-M206 VanDerWaalsContact NE-SD 3.4Å; Q202-M206 CarbonylContact C-O 3.59Å; Q202-M206 VanDerWaalsContact CA-O 3.29Å; Q202-M206 WeakPolarHBondContact CA-O 3.45Å; D203-M206 PolarHBondContact N-O 2.95Å; D203-M206 PolarHBondContact O-N 3.1Å; R204-M206 PolarHBondContact O-N 2.98Å; M206-N208 PolarHBondContact O-N 3.42Å
207P95.1Very high94.5Very high8 Ų841.9 Ų41.95%0.05221%0.21CC..EExtended strand (participates in β ladder)trans-63.1131.3171.5-17.630.2000110.5T158 F161 I200 V228T158-P207 HydrophobicContact CG2-CG 4.42Å; F161-P207 HydrophobicContact CB-CG 4.28Å; F161-P207 HydrophobicContact CD1-CB 4.08Å; F161-P207 HydrophobicContact CD1-CG 4.01Å; F161-P207 HydrophobicContact CE1-CB 4.4Å; F161-P207 HydrophobicContact CG-CG 4.29Å; I200-P207 HydrophobicContact CG2-CB 4.15Å; P207-V228 HydrophobicContact CB-CG2 4.24Å; P207-V228 HydrophobicContact CG-CG1 4.39Å
208N95.6Very high94.3Very high61 Ų6142 Ų4233%0.32621%0.21SC..EExtended strand (participates in β ladder)trans-132.3-28.7-172.8-17717.3000112.9N201 D203 M206 V225N201-N208 PolarHBondContact O-N 3.39Å; D203-N208 HydrophobicContact CB-CB 4Å; D203-N208 WeakPolarHBondContact CB-ND2 3.37Å; M206-N208 PolarHBondContact O-N 3.42Å; N208-V225 PolarHBondContact O-N 3.39Å
209G96.1Very high94.2Very high6 Ų642.2 Ų42.26%0.06221%0.213CC..EExtended strand (participates in β ladder)trans-130.4148.8-179.400000111.7N201 F223N201-G209 PolarHBondContact N-O 2.83Å; N201-G209 PolarHBondContact O-N 2.83Å; G209-F223 WeakPolarHBondContact CA-O 3.02Å
210L96.9Very high94.2Very high5 Ų542.4 Ų42.43%0.02621%0.214CC..EExtended strand (participates in β ladder)trans-134.1120.3172-179.9153.9000107M198 V199 I200 L212 F223 V225 L316M198-L210 HydrophobicContact CG-CD1 4.22Å; M198-L210 HydrophobicContact CG-CD2 4.46Å; M198-L210 HydrophobicContact CG-CG 4.1Å; M198-L210 HydrophobicContact SD-CD1 3.9Å; M198-L210 HydrophobicContact SD-CG 4.44Å; V199-L210 WeakPolarHBondContact O-CA 3.35Å; I200-L210 HydrophobicContact CD1-CB 4.11Å; I200-L210 HydrophobicContact CD1-CD1 3.62Å; I200-L210 HydrophobicContact CD1-CG 3.78Å; L210-L212 HydrophobicContact CD2-CB 3.95Å; L210-F223 HydrophobicContact CB-CB 4.39Å; L210-F223 HydrophobicContact CD2-CD2 3.64Å; L210-F223 HydrophobicContact CD2-CE2 4.3Å; L210-F223 HydrophobicContact CD2-CG 4.49Å; L210-F223 PolarHBondContact N-O 3.12Å; L210-F223 PolarHBondContact O-N 2.7Å; L210-V225 HydrophobicContact CB-CG2 3.49Å; L210-V225 VanDerWaalsContact CB-CG2 3.49Å; L210-L316 HydrophobicContact CD1-CD2 4.41Å
211V96.5Very high94.2Very high7 Ų742.4 Ų42.44%0.04221%0.214CC..EExtended strand (participates in β ladder)trans-104.4126.6169.4-179.40000106.7M198 V199 T220 A221 F326M198-V211 CarbonylContact C-O 3.48Å; M198-V211 WeakPolarHBondContact CA-O 3.34Å; V199-V211 HydrophobicContact CB-CB 4.16Å; V199-V211 PolarHBondContact N-O 2.85Å; V199-V211 PolarHBondContact O-N 2.98Å; V211-T220 HydrophobicContact CG1-CG2 3.54Å; V211-A221 WeakPolarHBondContact CA-O 3.29Å; V211-F326 HydrophobicContact CG1-CD2 4.05Å
212L96.9Very high94.3Very high0 Ų043 Ų430%022%0.215CC..EExtended strand (participates in β ladder)trans-118119.2176.2-174.560.4000108.5M198 L210 T220 A221 F223 L264 F265 L268M198-L212 HydrophobicContact CB-CD1 4.05Å; M198-L212 HydrophobicContact CE-CD1 4.01Å; M198-L212 HydrophobicContact CG-CD1 4.39Å; L210-L212 HydrophobicContact CD2-CB 3.95Å; L212-T220 CarbonylContact O-C 3.53Å; L212-T220 WeakPolarHBondContact O-CA 3.07Å; L212-A221 PolarHBondContact N-O 3.38Å; L212-A221 PolarHBondContact O-N 3.27Å; L212-F223 HydrophobicContact CB-CE2 4.43Å; L212-L264 HydrophobicContact CD2-CD1 4.08Å; L212-L264 HydrophobicContact CD2-CD2 3.85Å; L212-L264 HydrophobicContact CD2-CG 3.71Å; L212-L264 HydrophobicContact CG-CD1 4.29Å; L212-L264 HydrophobicContact CG-CD2 4.31Å; L212-L264 HydrophobicContact CG-CG 4.37Å; L212-F265 HydrophobicContact CD2-CD1 4.44Å; L212-F265 HydrophobicContact CD2-CE1 4.32Å; L212-L268 HydrophobicContact CD1-CD1 4.48Å; L212-L268 HydrophobicContact CD1-CD2 3.86Å; L212-L268 HydrophobicContact CD2-CD1 3.81Å; L212-L268 HydrophobicContact CD2-CD2 4.09Å; L212-L268 HydrophobicContact CD2-CG 4.3Å; L212-L268 HydrophobicContact CG-CD2 4.45Å
213C95.9Very high94.5Very high0 Ų040.8 Ų40.80%020%0.204CC..EExtended strand (participates in β ladder)trans-116.9127.5-179.3-173.60000108.5Y196 M197 T220Y196-C213 WeakPolarHBondContact CA-O 3.46Å; M197-C213 HydrophobicContact CB-CB 4.39Å; M197-C213 HydrophobicContact CE-CB 4.19Å; M197-C213 PolarHBondContact N-O 2.8Å; M197-C213 PolarHBondContact O-N 3.14Å; C213-T220 HydrophobicContact CB-CG2 4.36Å; C213-T220 PolarHBondContact SG-OG1 3.05Å; C213-T220 VanDerWaalsContact SG-OG1 3.36Å
214H95.5Very high94.7Very high19 Ų1941.6 Ų41.69%0.08821%0.205CC..EExtended strand (participates in β ladder)trans-82.9139.5164.8-176.546.5000109.1E133 F134 T195 Y196 G218 P219 L264E133-H214 PolarHBondContact O-NE2 2.92Å; F134-H214 AromaticContact CD1-CD2 3.8Å; F134-H214 AromaticContact CD1-NE2 3.86Å; F134-H214 HydrophobicContact CE1-CB 3.96Å; F134-H214 AromaticContact CE1-CD2 3.57Å; F134-H214 AromaticContact CE1-CG 3.69Å; T195-H214 PolarHBondContact O-ND1 3.04Å; Y196-H214 HydrophobicContact CD1-CB 4.12Å; Y196-H214 AromaticContact CD1-ND1 3.75Å; Y196-H214 HydrophobicContact CE1-CB 3.79Å; Y196-H214 AromaticContact CE1-CG 3.7Å; Y196-H214 AromaticContact CE1-ND1 3.08Å; Y196-H214 WeakPolarHBondContact CE1-ND1 3.47Å; Y196-H214 AromaticContact CZ-CE1 3.79Å; Y196-H214 AromaticContact CZ-ND1 3.29Å; Y196-H214 VanDerWaalsContact CZ-ND1 3.29Å; Y196-H214 PolarHBondContact OH-CE1 3.37Å; Y196-H214 PolarHBondContact OH-ND1 3.16Å; H214-G218 CarbonylContact O-C 3.5Å; H214-G218 WeakPolarHBondContact O-CA 3.4Å; H214-G218 PolarHBondContact O-N 2.77Å; H214-P219 PolarHBondContact N-O 2.8Å; H214-L264 HydrophobicContact CB-CD1 4.39Å
215L94.6Very high95Very high5 Ų531.8 Ų31.83%0.02617%0.168CC..SBendtrans-121.8149.6-176.1-65.7179.7000109.1I186 C189 V190 F194 T195 M197 T325I186-L215 HydrophobicContact CG1-CD2 4.4Å; I186-L215 HydrophobicContact CG2-CD2 3.75Å; C189-L215 HydrophobicContact CB-CD1 3.44Å; C189-L215 VanDerWaalsContact CB-CD1 3.44Å; V190-L215 HydrophobicContact CG2-CB 4.39Å; F194-L215 WeakPolarHBondContact O-CB 3.48Å; T195-L215 PolarHBondContact O-N 3.05Å; M197-L215 HydrophobicContact CB-CD1 4.17Å; L215-T325 HydrophobicContact CD2-CG2 3.87Å
216P92.1Very high95.3Very high72 Ų7228.2 Ų28.247%0.46815%0.152SC..SBendcis-80-33.68.329.7-34.8000115.3V190 T325V190-P216 HydrophobicContact CG1-CB 4.11Å; V190-P216 HydrophobicContact CG2-CB 3.86Å; P216-T325 WeakPolarHBondContact O-CG2 3.5Å
217D90.4Very high95.4Very high123 Ų12328.4 Ų28.466%0.65816%0.162SC*.SBendtrans-129.321-172.8-64.2-55.8000113
218G90.8Very high95.5Very high1 Ų128.4 Ų28.41%0.0116%0.162CC..  trans-79.9174.6-177.500000114.2H214 G324 T325H214-G218 CarbonylContact O-C 3.5Å; H214-G218 WeakPolarHBondContact O-CA 3.4Å; H214-G218 PolarHBondContact O-N 2.77Å; G218-G324 CarbonylContact O-C 3.6Å; G218-G324 WeakPolarHBondContact O-CA 3.29Å; G218-T325 PolarHBondContact O-N 2.86Å
219P95.1Very high95.5Very high13 Ų1332.3 Ų32.38%0.08417%0.172CC..  trans-70.7157.2-172.628.8-36.4000112.9E133 F134 H214 L321 Q322 G324E133-P219 WeakPolarHBondContact OE2-CD 3.41Å; F134-P219 HydrophobicContact CE2-CG 4.18Å; F134-P219 HydrophobicContact CZ-CG 3.61Å; H214-P219 PolarHBondContact N-O 2.8Å; P219-L321 HydrophobicContact CB-CD1 4.3Å; P219-Q322 CarbonylContact C-O 3.54Å; P219-Q322 WeakPolarHBondContact CA-O 3.13Å; P219-Q322 WeakPolarHBondContact CB-O 3.38Å; P219-G324 CarbonylContact C-O 3.57Å
220T96Very high95.4Very high5 Ų532.5 Ų32.53%0.03117%0.171CC..EExtended strand (participates in β ladder)trans-116.7112.8177-57.70000111V211 L212 C213 Q322 G324 T325 F326V211-T220 HydrophobicContact CG1-CG2 3.54Å; L212-T220 CarbonylContact O-C 3.53Å; L212-T220 WeakPolarHBondContact O-CA 3.07Å; C213-T220 HydrophobicContact CB-CG2 4.36Å; C213-T220 PolarHBondContact SG-OG1 3.05Å; C213-T220 VanDerWaalsContact SG-OG1 3.36Å; T220-Q322 PolarHBondContact N-O 3.15Å; T220-Q322 PolarHBondContact O-N 2.83Å; T220-G324 PolarHBondContact N-O 3.13Å; T220-G324 PolarHBondContact OG1-O 2.89Å; T220-T325 VanDerWaalsContact OG1-C 3.25Å; T220-T325 WeakPolarHBondContact OG1-CA 3.47Å; T220-F326 HydrophobicContact CG2-CB 4.3Å; T220-F326 HydrophobicContact CG2-CD2 4.29Å; T220-F326 PolarHBondContact OG1-N 3.4Å; T220-F326 VanDerWaalsContact OG1-N 3.15Å
221A97.2Very high95.2Very high0 Ų033.9 Ų33.90%018%0.176CC..EExtended strand (participates in β ladder)trans-99.4126.4175.700000111V211 L212 F223 I261 L264 L318 L321V211-A221 WeakPolarHBondContact CA-O 3.29Å; L212-A221 PolarHBondContact N-O 3.38Å; L212-A221 PolarHBondContact O-N 3.27Å; A221-F223 HydrophobicContact CB-CD2 4.25Å; A221-F223 HydrophobicContact CB-CE2 3.39Å; A221-F223 HydrophobicContact CB-CZ 3.68Å; A221-I261 HydrophobicContact CB-CD1 4.02Å; A221-L264 HydrophobicContact CB-CD2 3.5Å; A221-L318 HydrophobicContact CB-CD1 4.23Å; A221-L321 HydrophobicContact CB-CD1 3.98Å
222H96.8Very high94.9Very high65 Ų6541.5 Ų41.530%0.30121%0.209SC..EExtended strand (participates in β ladder)trans-105.6122.8174.6-179.4-135.9000110.1R319 S320H222-R319 WeakPolarHBondContact O-CA 3.49Å; H222-R319 WeakPolarHBondContact O-CB 3.4Å; H222-R319 PolarHBondContact O-N 2.88Å; H222-S320 WeakPolarHBondContact CB-OG 3.47Å; H222-S320 PolarHBondContact N-O 3.37Å; H222-S320 PolarHBondContact O-N 2.77Å
223F97.6Very high94.8Very high0 Ų045.1 Ų45.10%023%0.226CC..EExtended strand (participates in β ladder)trans-116141.9-179.9-58.9-86.8000111.1G209 L210 L212 A221 I261 F265 I290 L316 K317 L318G209-F223 WeakPolarHBondContact CA-O 3.02Å; L210-F223 HydrophobicContact CB-CB 4.39Å; L210-F223 HydrophobicContact CD2-CD2 3.64Å; L210-F223 HydrophobicContact CD2-CE2 4.3Å; L210-F223 HydrophobicContact CD2-CG 4.49Å; L210-F223 PolarHBondContact N-O 3.12Å; L210-F223 PolarHBondContact O-N 2.7Å; L212-F223 HydrophobicContact CB-CE2 4.43Å; A221-F223 HydrophobicContact CB-CD2 4.25Å; A221-F223 HydrophobicContact CB-CE2 3.39Å; A221-F223 HydrophobicContact CB-CZ 3.68Å; F223-I261 HydrophobicContact CE1-CG2 4.29Å; F223-I261 HydrophobicContact CZ-CD1 4.14Å; F223-I261 HydrophobicContact CZ-CG2 4.16Å; F223-F265 HydrophobicContact CE1-CE2 4.2Å; F223-F265 AromaticContact CE1-CZ 3.82Å; F223-F265 HydrophobicContact CE1-CZ 3.82Å; F223-F265 HydrophobicContact CE2-CE1 4.37Å; F223-F265 AromaticContact CE2-CZ 3.9Å; F223-F265 HydrophobicContact CE2-CZ 3.9Å; F223-F265 HydrophobicContact CZ-CE1 4.27Å; F223-F265 AromaticContact CZ-CE2 3.95Å; F223-F265 HydrophobicContact CZ-CE2 3.95Å; F223-F265 AromaticContact CZ-CZ 3.42Å; F223-F265 HydrophobicContact CZ-CZ 3.42Å; F223-F265 VanDerWaalsContact CZ-CZ 3.42Å; F223-I290 HydrophobicContact CE1-CD1 4.22Å; F223-L316 HydrophobicContact CB-CB 4.23Å; F223-L316 HydrophobicContact CB-CD2 4.18Å; F223-L316 HydrophobicContact CD1-CB 4.02Å; F223-L316 HydrophobicContact CD1-CD1 4.49Å; F223-L316 HydrophobicContact CG-CB 4.33Å; F223-L316 HydrophobicContact CG-CD1 4.44Å; F223-K317 WeakPolarHBondContact CA-O 3.35Å; F223-L318 HydrophobicContact CD1-CB 4.19Å; F223-L318 HydrophobicContact CD1-CD1 3.9Å; F223-L318 HydrophobicContact CE1-CB 4.13Å; F223-L318 HydrophobicContact CE1-CD1 3.48Å; F223-L318 VanDerWaalsContact CE1-CD1 3.48Å; F223-L318 HydrophobicContact CE1-CG 4.4Å; F223-L318 HydrophobicContact CZ-CD1 3.85Å
224K96.9Very high94.6Very high83 Ų8345.8 Ų45.836%0.36123%0.229SC..EExtended strand (participates in β ladder)trans-82.3124.7158.9178.2173.6179178.70108.7L316 K317 R319K224-L316 CarbonylContact O-C 3.43Å; K224-L316 WeakPolarHBondContact O-CA 3.39Å; K224-K317 PolarHBondContact N-O 3.05Å; K224-K317 PolarHBondContact O-N 3.26Å; K224-R319 HydrophobicContact CB-CG 4.02Å
225V97.2Very high94.4Very high3 Ų353.9 Ų53.92%0.01826%0.264CS..EExtended strand (participates in β ladder)trans-93.3130.3173.2-167.30000108.8N208 L210 V228 F314 T315 L316N208-V225 PolarHBondContact O-N 3.39Å; L210-V225 HydrophobicContact CB-CG2 3.49Å; L210-V225 VanDerWaalsContact CB-CG2 3.49Å; V225-V228 HydrophobicContact CG1-CG2 3.39Å; V225-F314 HydrophobicContact CG1-CB 4.09Å; V225-F314 HydrophobicContact CG1-CD2 4.28Å; V225-F314 HydrophobicContact CG1-CG 4.46Å; V225-T315 CarbonylContact C-O 3.58Å; V225-T315 WeakPolarHBondContact CA-O 3.24Å; V225-L316 HydrophobicContact CB-CD2 4.3Å; V225-L316 HydrophobicContact CG1-CD2 4.22Å; V225-L316 HydrophobicContact CG2-CD2 3.72Å
226S95.9Very high94.1Very high32 Ų3264.9 Ų64.922%0.22431%0.305CS..EExtended strand (participates in β ladder)trans-133.5166.2173.955.20000111V228 T315S226-V228 PolarHBondContact O-N 3.42Å; S226-V228 VanDerWaalsContact O-N 3.11Å; S226-T315 VanDerWaalsContact C-OG1 3.31Å; S226-T315 PolarHBondContact N-O 3.5Å; S226-T315 PolarHBondContact O-N 2.66Å; S226-T315 PolarHBondContact O-OG1 3.03Å; S226-T315 PolarHBondContact OG-O 2.98Å; S226-T315 PolarHBondContact OG-OG1 2.85Å
227S95Very high93.9Very high88 Ų8868 Ų6862%0.61531%0.307SS*.EExtended strand (participates in β ladder)trans54.734.9172.9-54.10000114.8R229S227-R229 PolarHBondContact O-N 2.76Å; S227-R229 VanDerWaalsContact O-N 3.15Å
228V96Very high93.6Very high9 Ų962.4 Ų62.46%0.05528%0.279CS..EExtended strand (participates in β ladder)trans-66.5113179.4-175.80000110.3R157 F161 P207 V225 S226 R313 F314R157-V228 PolarHBondContact NH2-O 2.91Å; F161-V228 HydrophobicContact CD2-CG1 3.65Å; F161-V228 HydrophobicContact CE2-CG1 3.78Å; F161-V228 HydrophobicContact CG-CG1 4.11Å; F161-V228 HydrophobicContact CZ-CG1 4.33Å; P207-V228 HydrophobicContact CB-CG2 4.24Å; P207-V228 HydrophobicContact CG-CG1 4.39Å; V225-V228 HydrophobicContact CG1-CG2 3.39Å; S226-V228 PolarHBondContact O-N 3.42Å; S226-V228 VanDerWaalsContact O-N 3.11Å; V228-R313 CarbonylContact C-O 3.58Å; V228-R313 WeakPolarHBondContact CA-O 3.33Å; V228-F314 HydrophobicContact CG2-CB 3.99Å
229R95.3Very high93.4Very high142 Ų14270.7 Ų70.754%0.53632%0.315SS..EExtended strand (participates in β ladder)trans-114.1119.3172.2-66.6-72.5-173.9158.7-2.2108.5S227 E233 P312 R313S227-R229 PolarHBondContact O-N 2.76Å; S227-R229 VanDerWaalsContact O-N 3.15Å; R229-E233 WeakPolarHBondContact CD-OE2 3.41Å; R229-P312 CarbonylContact O-C 3.6Å; R229-P312 VanDerWaalsContact O-CA 3.3Å; R229-P312 WeakPolarHBondContact O-CA 3.4Å; R229-P312 WeakPolarHBondContact O-CB 3.48Å; R229-R313 HydrophobicContact CB-CB 4.18Å; R229-R313 PolarHBondContact N-O 3.19Å; R229-R313 PolarHBondContact O-N 2.97Å
230L95.2Very high93Very high10 Ų1077 Ų775%0.05234%0.343CS..  trans-73.7155.9175.4-62.3179.8000110.2R157 R160 F161 K232 E233R157-L230 HydrophobicContact CG-CD1 3.97Å; R160-L230 HydrophobicContact CB-CD1 4.17Å; F161-L230 HydrophobicContact CB-CD2 3.89Å; F161-L230 HydrophobicContact CD2-CD2 4.12Å; F161-L230 HydrophobicContact CG-CD2 4.48Å; L230-K232 PolarHBondContact O-N 3.49Å; L230-K232 VanDerWaalsContact O-N 3.1Å; L230-E233 HydrophobicContact CB-CG 4.5Å; L230-E233 PolarHBondContact N-OE2 3.36Å; L230-E233 WeakPolarHBondContact O-CB 3.17Å; L230-E233 PolarHBondContact O-N 3.44Å
231R91.9Very high92.8Very high35 Ų3578 Ų7813%0.13235%0.35CS..G310 helixtrans-49.3-39.8178.8-175.5-178.6173.8-142.4-15.5114.4E233 I234 R237 G238 K239 E240 L310R231-E233 PolarHBondContact O-N 2.66Å; R231-I234 PolarHBondContact O-N 2.8Å; R231-R237 WeakPolarHBondContact O-CD 3.36Å; R231-G238 PolarHBondContact NH2-O 3.29Å; R231-K239 PolarHBondContact NH2-O 2.78Å; R231-E240 IonicContact CZ-OE1 3.85Å; R231-E240 IonicContact NH1-OE1 2.82Å; R231-E240 PolarHBondContact NH1-OE1 3.23Å; R231-E240 VanDerWaalsContact NH2-CA 3.3Å; R231-L310 WeakPolarHBondContact CD-O 3.31Å; R231-L310 WeakPolarHBondContact CG-O 3.49Å; R231-L310 PolarHBondContact NE-O 2.94Å
232K91.6Very high92.5Very high167 Ų16780.5 Ų80.573%0.72637%0.365SS*.G310 helixtrans-65.6-22.8179.8-68-174.6178.5-178.50113.4L230L230-K232 PolarHBondContact O-N 3.49Å; L230-K232 VanDerWaalsContact O-N 3.1Å
233E93.4Very high92.2Very high76 Ų7686.7 Ų86.736%0.35539%0.394SS..G310 helixtrans-87.6-9-178.8-59.2174.7177.100112.7R157 R229 L230 R231R157-E233 IonicContact CZ-OE1 3.31Å; R157-E233 VanDerWaalsContact CZ-OE1 3.31Å; R157-E233 IonicContact CZ-OE2 3.92Å; R157-E233 IonicContact NH1-OE1 2.66Å; R157-E233 PolarHBondContact NH1-OE1 2.71Å; R157-E233 IonicContact NH1-OE2 3.96Å; R157-E233 IonicContact NH2-OE1 3.08Å; R157-E233 PolarHBondContact NH2-OE1 2.65Å; R157-E233 VanDerWaalsContact NH2-OE1 3.08Å; R157-E233 IonicContact NH2-OE2 2.94Å; R157-E233 PolarHBondContact NH2-OE2 2.91Å; R229-E233 WeakPolarHBondContact CD-OE2 3.41Å; L230-E233 HydrophobicContact CB-CG 4.5Å; L230-E233 PolarHBondContact N-OE2 3.36Å; L230-E233 WeakPolarHBondContact O-CB 3.17Å; L230-E233 PolarHBondContact O-N 3.44Å; R231-E233 PolarHBondContact O-N 2.66Å
234I92.7Very high92Very high13 Ų1389.8 Ų89.87%0.06741%0.408CS..SBendtrans-89129.7-175.2-61.6172.4000109.8R231 E309 G311 R313R231-I234 PolarHBondContact O-N 2.8Å; I234-E309 HydrophobicContact CG2-CB 4.33Å; I234-E309 WeakPolarHBondContact CG2-OE2 3.26Å; I234-G311 VanDerWaalsContact CD1-O 3.29Å; I234-G311 WeakPolarHBondContact CD1-O 3.44Å; I234-R313 HydrophobicContact CD1-CG 3.85Å
235K91.4Very high91.9Very high189 Ų18988.8 Ų88.882%0.82240%0.403SS*.THydrogen-bonded Turntrans-74.7144.7174.4-64.2-176.5179.2-177.70110.2R237K235-R237 PolarHBondContact O-N 3.45Å
236R87.9Confident91.8Very high236 Ų23688.8 Ų88.889%0.89140%0.403SS*.THydrogen-bonded Turntrans57.233.9179.1-56.2179.2177.4174.7-2.1113.5Q308R236-Q308 PolarHBondContact O-NE2 2.78Å
237R87Confident91.7Very high137 Ų13789.4 Ų89.452%0.51740%0.402SS..  trans-60.4147.7176.771.7-175.9-171.2-80.3-4.3111.9R231 K235 Q308R231-R237 WeakPolarHBondContact O-CD 3.36Å; K235-R237 PolarHBondContact O-N 3.45Å; R237-Q308 PolarHBondContact O-NE2 2.95Å
238G83.8Confident91.8Very high6 Ų687.6 Ų87.66%0.06239%0.387CS..  trans-75.1177.2171.200000113.7R231 E309R231-G238 PolarHBondContact NH2-O 3.29Å; G238-E309 PolarHBondContact N-O 2.99Å
239K87.4Confident91.8Very high176 Ų17690.1 Ų90.177%0.76540%0.4SS*.SBendtrans-62.2177166.6-70-170.8179.2-1760110.5R231 L310R231-K239 PolarHBondContact NH2-O 2.78Å; K239-L310 WeakPolarHBondContact O-CD2 3.48Å
240E87.6Confident91.9Very high144 Ų14486.3 Ų86.367%0.67339%0.39SS*.PPolyproline II helixtrans-62.4148.1-178.6-45.6-134.3111.900110.2R231 T242R231-E240 IonicContact CZ-OE1 3.85Å; R231-E240 IonicContact NH1-OE1 2.82Å; R231-E240 PolarHBondContact NH1-OE1 3.23Å; R231-E240 VanDerWaalsContact NH2-CA 3.3Å; E240-T242 PolarHBondContact O-N 3.22Å
241P90.2Very high91.9Very high28 Ų2889 Ų8918%0.18241%0.405CS..PPolyproline II helixtrans-51.2131.8167.9-24.334.4000110F294 L310P241-F294 HydrophobicContact CB-CE1 3.99Å; P241-F294 HydrophobicContact CG-CE1 4.02Å; P241-L310 HydrophobicContact CG-CB 4.46Å
242T91.1Very high92Very high51 Ų5191.5 Ų91.531%0.31342%0.42SS..PPolyproline II helixtrans-73.2159.7164.257.10000109.9E240 H244 Q279E240-T242 PolarHBondContact O-N 3.22Å; T242-H244 PolarHBondContact O-N 3.23Å; T242-H244 PolarHBondContact OG1-CD2 3.03Å; T242-H244 VanDerWaalsContact OG1-CD2 3.27Å; T242-Q279 PolarHBondContact O-NE2 2.78Å; T242-Q279 VanDerWaalsContact O-NE2 3.12Å; T242-Q279 PolarHBondContact OG1-NE2 2.93Å
243E90.6Very high92.2Very high195 Ų19584.5 Ų84.591%0.91139%0.39SS*.SBendtrans-71.7-5.7-178.8-63.4174.6-179.800114.5
244H93.6Very high92.1Very high65 Ų6583.2 Ų83.230%0.30139%0.388SS..SBendtrans-58.5143.6177.1-63.1-55000113.1T242 Q274 G277 Q279T242-H244 PolarHBondContact O-N 3.23Å; T242-H244 PolarHBondContact OG1-CD2 3.03Å; T242-H244 VanDerWaalsContact OG1-CD2 3.27Å; H244-Q274 HydrophobicContact CB-CB 4.07Å; H244-Q274 PolarHBondContact ND1-OE1 2.68Å; H244-G277 VanDerWaalsContact CD2-CA 3.4Å; H244-G277 WeakPolarHBondContact CD2-CA 3.44Å; H244-Q279 PolarHBondContact O-OE1 3.15Å
245Y94.3Very high92.2Very high62 Ų6282.6 Ų82.624%0.24338%0.384CS..PPolyproline II helixtrans-69.5124.2175.1-59.7-22.2000111P170 P270 N272 Q274P170-Y245 HydrophobicContact CB-CD1 3.59Å; P170-Y245 HydrophobicContact CB-CE1 3.64Å; P170-Y245 HydrophobicContact CG-CD1 3.64Å; P170-Y245 HydrophobicContact CG-CE1 4.23Å; P170-Y245 HydrophobicContact CG-CG 4.37Å; Y245-P270 HydrophobicContact CD1-CG 4.29Å; Y245-P270 HydrophobicContact CD2-CB 3.96Å; Y245-P270 HydrophobicContact CD2-CG 4.1Å; Y245-P270 HydrophobicContact CE1-CG 4.37Å; Y245-P270 HydrophobicContact CE2-CB 4.2Å; Y245-P270 HydrophobicContact CE2-CG 4.19Å; Y245-P270 HydrophobicContact CG-CB 4.36Å; Y245-P270 HydrophobicContact CG-CG 4.15Å; Y245-N272 WeakPolarHBondContact CD2-OD1 3.47Å; Y245-Q274 PolarHBondContact O-N 3.37Å
246P95.4Very high92.2Very high4 Ų479.7 Ų79.73%0.02637%0.368CS..PPolyproline II helixtrans-80155.9-177.233.7-35.9000111.8F269 Q279 F294P246-F269 HydrophobicContact CG-CD1 3.9Å; P246-F269 HydrophobicContact CG-CE1 4.08Å; P246-Q279 WeakPolarHBondContact CA-O 3.35Å; P246-Q279 HydrophobicContact CB-CB 3.87Å; P246-F294 HydrophobicContact CB-CE2 3.65Å; P246-F294 HydrophobicContact CB-CZ 4.25Å; P246-F294 HydrophobicContact CG-CE2 4.02Å
247E94.9Very high92.5Very high44 Ų4469.4 Ų69.421%0.20633%0.331CS..EExtended strand (participates in β ladder)trans-70.7147.2165.9-67.4164.4-124.700110.3P273 F275 Q279 V280 A281 Y297E247-P273 HydrophobicContact CB-CB 4.43Å; E247-P273 HydrophobicContact CG-CB 3.71Å; E247-P273 HydrophobicContact CG-CG 4.31Å; E247-F275 HydrophobicContact CG-CD1 4.18Å; E247-F275 HydrophobicContact CG-CE1 3.92Å; E247-F275 VanDerWaalsContact OE1-CD1 3.27Å; E247-F275 WeakPolarHBondContact OE1-CD1 3.06Å; E247-Q279 PolarHBondContact N-O 2.82Å; E247-V280 HydrophobicContact CB-CB 4.32Å; E247-V280 HydrophobicContact CB-CG2 4.03Å; E247-V280 CarbonylContact O-C 3.59Å; E247-V280 VanDerWaalsContact O-CA 3.28Å; E247-V280 WeakPolarHBondContact O-CA 3.49Å; E247-V280 WeakPolarHBondContact O-CG2 3.31Å; E247-A281 PolarHBondContact O-N 3.11Å; E247-Y297 WeakPolarHBondContact OE1-CE1 3.35Å; E247-Y297 VanDerWaalsContact OE1-CZ 3.26Å; E247-Y297 PolarHBondContact OE1-OH 2.9Å
248V95.8Very high92.9Very high50 Ų5062.9 Ų62.930%0.30331%0.306SS..EExtended strand (participates in β ladder)trans-112.1127.6176-1740000109.5L250 F269 A281 F283V248-L250 HydrophobicContact CG1-CD2 4.09Å; V248-L250 HydrophobicContact CG1-CG 4.31Å; V248-F269 HydrophobicContact CG1-CD2 4.44Å; V248-F269 HydrophobicContact CG2-CB 3.51Å; V248-F269 HydrophobicContact CG2-CD1 4.06Å; V248-F269 HydrophobicContact CG2-CD2 3.56Å; V248-F269 HydrophobicContact CG2-CE2 4.3Å; V248-F269 HydrophobicContact CG2-CG 3.43Å; V248-F269 VanDerWaalsContact CG2-CG 3.43Å; V248-A281 CarbonylContact C-O 3.59Å; V248-A281 WeakPolarHBondContact CA-O 3.48Å; V248-F283 HydrophobicContact CG1-CD2 4.24Å; V248-F283 HydrophobicContact CG1-CE2 4.31Å
249I96.6Very high93.4Very high63 Ų6365 Ų6532%0.32332%0.315SS..EExtended strand (participates in β ladder)trans-115.8121.1175-63.2179.5000108.4N251 V280 A281 T282 F283I249-N251 WeakPolarHBondContact CG2-ND2 3.18Å; I249-N251 WeakPolarHBondContact CG2-OD1 3.32Å; I249-V280 HydrophobicContact CB-CG2 4.44Å; I249-V280 HydrophobicContact CD1-CG2 3.48Å; I249-V280 VanDerWaalsContact CD1-CG2 3.48Å; I249-V280 HydrophobicContact CG1-CG2 3.62Å; I249-A281 PolarHBondContact N-O 2.89Å; I249-T282 HydrophobicContact CB-CG2 4.02Å; I249-T282 HydrophobicContact CD1-CG2 4.12Å; I249-T282 HydrophobicContact CG1-CG2 4.46Å; I249-T282 CarbonylContact O-C 3.58Å; I249-T282 WeakPolarHBondContact O-CA 3.42Å; I249-F283 PolarHBondContact O-N 2.81Å
250L96.6Very high93.6Very high62 Ų6258.2 Ų58.233%0.32529%0.289SS..EExtended strand (participates in β ladder)trans-109.6118.1172.5-57.3178.7000108.2V248 F253 G262 F265 A266 F283V248-L250 HydrophobicContact CG1-CD2 4.09Å; V248-L250 HydrophobicContact CG1-CG 4.31Å; L250-F253 HydrophobicContact CB-CD2 3.93Å; L250-F253 HydrophobicContact CB-CE2 4.18Å; L250-F253 HydrophobicContact CD2-CE2 4.26Å; L250-G262 WeakPolarHBondContact CD1-O 3.44Å; L250-F265 HydrophobicContact CD2-CB 4.11Å; L250-A266 HydrophobicContact CD1-CB 3.99Å; L250-F283 HydrophobicContact CD2-CB 3.78Å; L250-F283 HydrophobicContact CD2-CD2 3.78Å; L250-F283 HydrophobicContact CD2-CG 4.05Å
251N96.2Very high94Very high67 Ų6751.4 Ų51.436%0.35826%0.257SS..EExtended strand (participates in β ladder)trans-117.2134.1-178.8-68.3-36.7000110.9I249 F283 H284 N285I249-N251 WeakPolarHBondContact CG2-ND2 3.18Å; I249-N251 WeakPolarHBondContact CG2-OD1 3.32Å; N251-F283 PolarHBondContact N-O 2.91Å; N251-H284 HydrophobicContact CB-CB 4.45Å; N251-H284 WeakPolarHBondContact CB-ND1 3.32Å; N251-N285 WeakPolarHBondContact O-CB 3.38Å; N251-N285 PolarHBondContact O-N 3.45Å
252N94.1Very high94.3Very high86 Ų8650.2 Ų50.246%0.4625%0.25SC..SBendtrans62.139.1173.2-50.5-28.7000114.8H284 N285N252-H284 PolarHBondContact ND2-CE1 3.19Å; N252-H284 VanDerWaalsContact ND2-CE1 3.35Å; N252-N285 HydrophobicContact CB-CB 4.25Å; N252-N285 WeakPolarHBondContact CB-O 3.21Å; N252-N285 PolarHBondContact ND2-O 2.68Å; N252-N285 WeakPolarHBondContact O-CB 3.4Å; N252-N285 PolarHBondContact O-ND2 3Å
253F94.9Very high94.4Very high20 Ų2049 Ų499%0.08824%0.24CC..  trans-97.886.1166.8-70.4-82.5000107.3L250 G258 H259 I261 F265 F283 N285 I290 L351L250-F253 HydrophobicContact CB-CD2 3.93Å; L250-F253 HydrophobicContact CB-CE2 4.18Å; L250-F253 HydrophobicContact CD2-CE2 4.26Å; F253-G258 WeakPolarHBondContact CB-O 3.28Å; F253-G258 VanDerWaalsContact CD1-O 3.3Å; F253-G258 WeakPolarHBondContact CD1-O 3.4Å; F253-H259 PolarHBondContact O-CD2 2.86Å; F253-H259 VanDerWaalsContact O-CD2 3.25Å; F253-H259 PolarHBondContact O-NE2 2.82Å; F253-I261 HydrophobicContact CE1-CG2 4.01Å; F253-F265 HydrophobicContact CZ-CD2 4.39Å; F253-F283 HydrophobicContact CE2-CB 4.15Å; F253-F283 HydrophobicContact CZ-CB 4.34Å; F253-N285 HydrophobicContact CD1-CB 4.43Å; F253-N285 HydrophobicContact CD2-CB 4.49Å; F253-N285 HydrophobicContact CE1-CB 4.2Å; F253-N285 HydrophobicContact CE2-CB 4.27Å; F253-N285 HydrophobicContact CZ-CB 4.13Å; F253-I290 HydrophobicContact CE1-CD1 3.77Å; F253-I290 HydrophobicContact CE1-CG1 4.16Å; F253-I290 HydrophobicContact CZ-CD1 4Å; F253-I290 HydrophobicContact CZ-CG1 4.14Å; F253-I290 HydrophobicContact CZ-CG2 3.97Å; F253-L351 WeakPolarHBondContact CA-OXT 3.41Å
254T92.6Very high94.6Very high50 Ų5039.8 Ų39.831%0.30720%0.197SC..  trans-109.2-22.5-166.655.30000113.2V118 L351V118-T254 PolarHBondContact N-O 3.34Å; T254-L351 PolarHBondContact N-OXT 2.93Å
255T93.8Very high94.8Very high0 Ų036.9 Ų36.90%018%0.183CC..BIsolated β-bridgetrans-83.1163.7177.162.80000110.5T116 L257 G258 H259 Q350 L351T116-T255 CarbonylContact O-C 3.46Å; T116-T255 VanDerWaalsContact O-CA 3.24Å; T116-T255 WeakPolarHBondContact O-CA 3.47Å; T255-L257 VanDerWaalsContact C-N 3.27Å; T255-L257 PolarHBondContact O-N 3.28Å; T255-G258 CarbonylContact O-C 3.53Å; T255-G258 VanDerWaalsContact O-CA 3.24Å; T255-G258 WeakPolarHBondContact O-CA 3.26Å; T255-G258 PolarHBondContact O-N 2.8Å; T255-G258 PolarHBondContact OG1-N 3.15Å; T255-H259 PolarHBondContact O-CD2 2.84Å; T255-H259 PolarHBondContact O-N 2.89Å; T255-Q350 WeakPolarHBondContact CB-O 3.46Å; T255-Q350 PolarHBondContact OG1-O 3.26Å; T255-L351 WeakPolarHBondContact OG1-CA 3.11Å; T255-L351 PolarHBondContact OG1-OXT 3.31Å
256R92.6Very high94.8Very high127 Ų12734.7 Ų34.748%0.47918%0.178SC..Hα-helixtrans-54.4-44.9175.4-168.1172.6-176.4-176.81.8111.9T116 V118 D128 G258 H259 S260T116-R256 PolarHBondContact O-N 3.25Å; V118-R256 HydrophobicContact CG2-CB 4.16Å; D128-R256 IonicContact OD2-CZ 3.82Å; D128-R256 IonicContact OD2-NE 3.64Å; D128-R256 IonicContact OD2-NH2 3.87Å; D128-R256 PolarHBondContact OD2-NH2 3.48Å; R256-G258 VanDerWaalsContact C-N 3.33Å; R256-G258 PolarHBondContact O-N 3.36Å; R256-H259 WeakPolarHBondContact O-CB 3.48Å; R256-H259 PolarHBondContact O-N 2.86Å; R256-S260 PolarHBondContact O-N 3.46Å; R256-S260 PolarHBondContact O-OG 2.85Å
257L94.1Very high94.7Very high21 Ų2134.5 Ų34.511%0.1118%0.177CC..Hα-helixtrans-64.4-38.1173.6-177.2152.7000112T255 S260 I261 L318 W335 L351T255-L257 VanDerWaalsContact C-N 3.27Å; T255-L257 PolarHBondContact O-N 3.28Å; L257-S260 PolarHBondContact O-N 2.76Å; L257-I261 HydrophobicContact CD2-CG1 4.2Å; L257-I261 WeakPolarHBondContact O-CG1 3.08Å; L257-I261 PolarHBondContact O-N 3.18Å; L257-L318 HydrophobicContact CD1-CD2 4.43Å; L257-L318 HydrophobicContact CD2-CD2 3.68Å; L257-L318 HydrophobicContact CG-CD2 4.45Å; L257-W335 HydrophobicContact CD1-CB 3.5Å; L257-W335 VanDerWaalsContact CD1-CB 3.5Å; L257-W335 HydrophobicContact CD1-CD2 3.65Å; L257-W335 HydrophobicContact CD1-CE3 4.4Å; L257-W335 HydrophobicContact CD1-CG 3.21Å; L257-L351 HydrophobicContact CD2-CD2 3.26Å; L257-L351 HydrophobicContact CD2-CG 3.96Å
258G94.7Very high94.7Very high0 Ų032.6 Ų32.60%017%0.168CC..Hα-helixtrans-56.4-48.5171.500000112.3F253 T255 R256 I261 G262 L351F253-G258 WeakPolarHBondContact CB-O 3.28Å; F253-G258 VanDerWaalsContact CD1-O 3.3Å; F253-G258 WeakPolarHBondContact CD1-O 3.4Å; T255-G258 CarbonylContact O-C 3.53Å; T255-G258 VanDerWaalsContact O-CA 3.24Å; T255-G258 WeakPolarHBondContact O-CA 3.26Å; T255-G258 PolarHBondContact O-N 2.8Å; T255-G258 PolarHBondContact OG1-N 3.15Å; R256-G258 VanDerWaalsContact C-N 3.33Å; R256-G258 PolarHBondContact O-N 3.36Å; G258-I261 PolarHBondContact O-N 2.91Å; G258-G262 PolarHBondContact O-N 3.36Å; G258-L351 WeakPolarHBondContact CA-OXT 3.34Å
259H93.6Very high94.7Very high51 Ų5130.3 Ų30.324%0.23615%0.154CC..Hα-helixtrans-59.5-49.1176.4-85.4-118.4000111.4E129 F253 T255 R256 I261 G262 R263E129-H259 IonicContact OE1-CE1 2.92Å; E129-H259 IonicContact OE1-CG 2.71Å; E129-H259 IonicContact OE1-ND1 2.66Å; E129-H259 PolarHBondContact OE1-ND1 2.91Å; F253-H259 PolarHBondContact O-CD2 2.86Å; F253-H259 VanDerWaalsContact O-CD2 3.25Å; F253-H259 PolarHBondContact O-NE2 2.82Å; T255-H259 PolarHBondContact O-CD2 2.84Å; T255-H259 PolarHBondContact O-N 2.89Å; R256-H259 WeakPolarHBondContact O-CB 3.48Å; R256-H259 PolarHBondContact O-N 2.86Å; H259-I261 VanDerWaalsContact C-N 3.33Å; H259-I261 PolarHBondContact O-N 3.2Å; H259-G262 CarbonylContact O-C 2.86Å; H259-G262 WeakPolarHBondContact O-CA 3.48Å; H259-G262 PolarHBondContact O-N 3.33Å; H259-G262 VanDerWaalsContact O-N 3.09Å; H259-R263 WeakPolarHBondContact O-CB 2.89Å; H259-R263 VanDerWaalsContact O-CG 3.28Å; H259-R263 WeakPolarHBondContact O-CG 3.49Å; H259-R263 PolarHBondContact O-N 2.98Å
260S93.4Very high94.5Very high32 Ų3227.6 Ų27.622%0.22414%0.141CC..Hα-helixtrans-57.3-44.4177.5-49.70000112.3R256 L257 L264R256-S260 PolarHBondContact O-N 3.46Å; R256-S260 PolarHBondContact O-OG 2.85Å; L257-S260 PolarHBondContact O-N 2.76Å; S260-L264 WeakPolarHBondContact O-CB 3.46Å; S260-L264 PolarHBondContact O-N 2.9Å
261I95.9Very high94.1Very high1 Ų128.8 Ų28.81%0.00514%0.144CC..Hα-helixtrans-69.7-37.1176.8-65.7-62.8000111.9A221 F223 F253 L257 G258 H259 L264 F265 I290 L318 L321 L351A221-I261 HydrophobicContact CB-CD1 4.02Å; F223-I261 HydrophobicContact CE1-CG2 4.29Å; F223-I261 HydrophobicContact CZ-CD1 4.14Å; F223-I261 HydrophobicContact CZ-CG2 4.16Å; F253-I261 HydrophobicContact CE1-CG2 4.01Å; L257-I261 HydrophobicContact CD2-CG1 4.2Å; L257-I261 WeakPolarHBondContact O-CG1 3.08Å; L257-I261 PolarHBondContact O-N 3.18Å; G258-I261 PolarHBondContact O-N 2.91Å; H259-I261 VanDerWaalsContact C-N 3.33Å; H259-I261 PolarHBondContact O-N 3.2Å; I261-L264 HydrophobicContact CD1-CD2 4.48Å; I261-L264 PolarHBondContact O-N 2.88Å; I261-F265 HydrophobicContact CG2-CD2 3.73Å; I261-F265 HydrophobicContact CG2-CE2 3.37Å; I261-F265 HydrophobicContact CG2-CZ 4.35Å; I261-F265 WeakPolarHBondContact O-CD2 3.08Å; I261-F265 PolarHBondContact O-N 3.32Å; I261-I290 HydrophobicContact CG2-CD1 4.08Å; I261-L318 HydrophobicContact CD1-CD1 3.85Å; I261-L318 HydrophobicContact CD1-CD2 4.17Å; I261-L318 HydrophobicContact CG1-CD2 4.16Å; I261-L321 HydrophobicContact CD1-CD1 3.98Å; I261-L321 HydrophobicContact CD1-CD2 4.34Å; I261-L351 HydrophobicContact CB-CD2 4.15Å; I261-L351 HydrophobicContact CG1-CD2 4.04Å; I261-L351 HydrophobicContact CG2-CD2 4.33Å
262G95.5Very high93.9Very high3 Ų329.8 Ų29.83%0.03115%0.15CC..Hα-helixtrans-60.5-48.7174.700000111.1L250 G258 H259 L264 F265 A266L250-G262 WeakPolarHBondContact CD1-O 3.44Å; G258-G262 PolarHBondContact O-N 3.36Å; H259-G262 CarbonylContact O-C 2.86Å; H259-G262 WeakPolarHBondContact O-CA 3.48Å; H259-G262 PolarHBondContact O-N 3.33Å; H259-G262 VanDerWaalsContact O-N 3.09Å; G262-L264 PolarHBondContact O-N 3.4Å; G262-F265 PolarHBondContact O-N 3.19Å; G262-F265 VanDerWaalsContact O-N 3.12Å; G262-A266 PolarHBondContact O-N 3.33Å
263R93.9Very high93.8Very high26 Ų2627.7 Ų27.710%0.09814%0.141CC..Hα-helixtrans-59.5-45.2175.8-70.2175.169.978.55.2111.6E129 D132 F134 F138 H259 F265 A266 A267E129-R263 PolarHBondContact O-NH2 3.5Å; E129-R263 IonicContact OE2-CZ 3.02Å; E129-R263 IonicContact OE2-NH1 3.97Å; E129-R263 PolarHBondContact OE2-NH1 3.28Å; D132-R263 IonicContact OD2-NE 2.65Å; F134-R263 HydrophobicContact CD2-CB 4.03Å; F134-R263 HydrophobicContact CE2-CB 4.42Å; F138-R263 HydrophobicContact CE2-CB 3.92Å; F138-R263 HydrophobicContact CE2-CG 4.1Å; F138-R263 HydrophobicContact CZ-CB 4.06Å; F138-R263 HydrophobicContact CZ-CG 4.08Å; H259-R263 WeakPolarHBondContact O-CB 2.89Å; H259-R263 VanDerWaalsContact O-CG 3.28Å; H259-R263 WeakPolarHBondContact O-CG 3.49Å; H259-R263 PolarHBondContact O-N 2.98Å; R263-F265 VanDerWaalsContact C-N 3.3Å; R263-F265 PolarHBondContact O-N 3.01Å; R263-A266 PolarHBondContact O-N 3.48Å; R263-A267 VanDerWaalsContact O-CB 3.29Å; R263-A267 WeakPolarHBondContact O-CB 3.35Å; R263-A267 PolarHBondContact O-N 3.47Å
264L95.1Very high93.7Very high2 Ų230.7 Ų30.71%0.0116%0.155CC..Hα-helixtrans-57.1-40.3174.1179.265.8000112.4F134 Y196 L212 H214 A221 S260 I261 G262F134-L264 HydrophobicContact CE1-CB 4.45Å; F134-L264 HydrophobicContact CE1-CD1 3.74Å; F134-L264 HydrophobicContact CZ-CB 3.94Å; F134-L264 HydrophobicContact CZ-CD1 3.75Å; F134-L264 HydrophobicContact CZ-CG 4.44Å; Y196-L264 HydrophobicContact CE1-CD1 4.12Å; L212-L264 HydrophobicContact CD2-CD1 4.08Å; L212-L264 HydrophobicContact CD2-CD2 3.85Å; L212-L264 HydrophobicContact CD2-CG 3.71Å; L212-L264 HydrophobicContact CG-CD1 4.29Å; L212-L264 HydrophobicContact CG-CD2 4.31Å; L212-L264 HydrophobicContact CG-CG 4.37Å; H214-L264 HydrophobicContact CB-CD1 4.39Å; A221-L264 HydrophobicContact CB-CD2 3.5Å; S260-L264 WeakPolarHBondContact O-CB 3.46Å; S260-L264 PolarHBondContact O-N 2.9Å; I261-L264 HydrophobicContact CD1-CD2 4.48Å; I261-L264 PolarHBondContact O-N 2.88Å; G262-L264 PolarHBondContact O-N 3.4Å
265F96Very high93.7Very high4 Ų434.4 Ų34.42%0.01817%0.167CC..Hα-helixtrans-75.4-38.9177.2-75.1-52.1000113.7L212 F223 L250 F253 I261 G262 R263 A267 L268 F269 F283 I290 L316L212-F265 HydrophobicContact CD2-CD1 4.44Å; L212-F265 HydrophobicContact CD2-CE1 4.32Å; F223-F265 HydrophobicContact CE1-CE2 4.2Å; F223-F265 AromaticContact CE1-CZ 3.82Å; F223-F265 HydrophobicContact CE1-CZ 3.82Å; F223-F265 HydrophobicContact CE2-CE1 4.37Å; F223-F265 AromaticContact CE2-CZ 3.9Å; F223-F265 HydrophobicContact CE2-CZ 3.9Å; F223-F265 HydrophobicContact CZ-CE1 4.27Å; F223-F265 AromaticContact CZ-CE2 3.95Å; F223-F265 HydrophobicContact CZ-CE2 3.95Å; F223-F265 AromaticContact CZ-CZ 3.42Å; F223-F265 HydrophobicContact CZ-CZ 3.42Å; F223-F265 VanDerWaalsContact CZ-CZ 3.42Å; L250-F265 HydrophobicContact CD2-CB 4.11Å; F253-F265 HydrophobicContact CZ-CD2 4.39Å; I261-F265 HydrophobicContact CG2-CD2 3.73Å; I261-F265 HydrophobicContact CG2-CE2 3.37Å; I261-F265 HydrophobicContact CG2-CZ 4.35Å; I261-F265 WeakPolarHBondContact O-CD2 3.08Å; I261-F265 PolarHBondContact O-N 3.32Å; G262-F265 PolarHBondContact O-N 3.19Å; G262-F265 VanDerWaalsContact O-N 3.12Å; R263-F265 VanDerWaalsContact C-N 3.3Å; R263-F265 PolarHBondContact O-N 3.01Å; F265-A267 VanDerWaalsContact C-N 3.29Å; F265-A267 PolarHBondContact O-N 3.25Å; F265-L268 HydrophobicContact CD1-CD1 4.11Å; F265-L268 PolarHBondContact O-N 3Å; F265-F269 WeakPolarHBondContact O-CD2 3.43Å; F265-F283 HydrophobicContact CB-CD1 4.4Å; F265-F283 HydrophobicContact CB-CD2 4.39Å; F265-F283 HydrophobicContact CB-CE1 4.31Å; F265-F283 HydrophobicContact CB-CE2 4.31Å; F265-F283 HydrophobicContact CB-CG 4.44Å; F265-F283 HydrophobicContact CB-CZ 4.27Å; F265-F283 HydrophobicContact CD1-CD1 4.03Å; F265-F283 AromaticContact CD1-CE1 3.51Å; F265-F283 HydrophobicContact CD1-CE1 3.51Å; F265-F283 AromaticContact CD1-CZ 3.95Å; F265-F283 HydrophobicContact CD1-CZ 3.95Å; F265-F283 HydrophobicContact CD2-CD1 4.1Å; F265-F283 HydrophobicContact CD2-CE1 4.42Å; F265-F283 HydrophobicContact CE1-CD1 4.33Å; F265-F283 AromaticContact CE1-CE1 3.86Å; F265-F283 HydrophobicContact CE1-CE1 3.86Å; F265-F283 HydrophobicContact CE2-CD1 4.39Å; F265-F283 AromaticContact CG-CD1 3.92Å; F265-F283 HydrophobicContact CG-CD1 3.92Å; F265-F283 AromaticContact CG-CE1 3.84Å; F265-F283 HydrophobicContact CG-CE1 3.84Å; F265-F283 HydrophobicContact CG-CG 4.39Å; F265-F283 HydrophobicContact CG-CZ 4.24Å; F265-F283 HydrophobicContact CZ-CE1 4.45Å; F265-I290 HydrophobicContact CE2-CD1 3.75Å; F265-I290 HydrophobicContact CE2-CG2 4.44Å; F265-I290 HydrophobicContact CZ-CD1 4.41Å; F265-L316 HydrophobicContact CE1-CD1 3.97Å; F265-L316 HydrophobicContact CZ-CD1 3.65Å
266A94.9Very high93.7Very high16 Ų1640 Ų4013%0.13220%0.201CC..Hα-helixtrans-58.8-45.4174.500000110.6Y137 F138 L250 G262 R263 L268 F269Y137-A266 PolarHBondContact OH-O 2.98Å; Y137-A266 VanDerWaalsContact OH-O 3.06Å; F138-A266 HydrophobicContact CE1-CB 4.32Å; F138-A266 HydrophobicContact CZ-CB 3.99Å; L250-A266 HydrophobicContact CD1-CB 3.99Å; G262-A266 PolarHBondContact O-N 3.33Å; R263-A266 PolarHBondContact O-N 3.48Å; A266-L268 PolarHBondContact O-N 2.97Å; A266-F269 PolarHBondContact O-N 3.09Å
267A94.3Very high93.6Very high0 Ų034 Ų340%018%0.179CC..THydrogen-bonded Turntrans-67-9.4-175.700000114.9F134 Y137 P144 Y196 R263 F265 F269F134-A267 HydrophobicContact CD1-CB 4.12Å; Y137-A267 HydrophobicContact CD1-CB 3.59Å; Y137-A267 HydrophobicContact CD2-CB 4.39Å; Y137-A267 VanDerWaalsContact CE1-CA 3.48Å; Y137-A267 HydrophobicContact CE1-CB 3.86Å; Y137-A267 HydrophobicContact CG-CB 3.9Å; P144-A267 VanDerWaalsContact CB-O 3.26Å; P144-A267 WeakPolarHBondContact CB-O 3.48Å; Y196-A267 HydrophobicContact CE2-CB 4.47Å; Y196-A267 WeakPolarHBondContact CE2-O 3.41Å; Y196-A267 WeakPolarHBondContact OH-CB 3.22Å; R263-A267 VanDerWaalsContact O-CB 3.29Å; R263-A267 WeakPolarHBondContact O-CB 3.35Å; R263-A267 PolarHBondContact O-N 3.47Å; F265-A267 VanDerWaalsContact C-N 3.29Å; F265-A267 PolarHBondContact O-N 3.25Å; A267-F269 VanDerWaalsContact C-N 3.29Å; A267-F269 PolarHBondContact O-N 2.95Å
268L94.2Very high93.6Very high3 Ų338.5 Ų38.52%0.01619%0.194CC..THydrogen-bonded Turntrans-73.1-19.8170.9-61.7178.6000114V146 I169 Y196 M198 L212 F265 A266V146-L268 HydrophobicContact CG2-CD2 4.47Å; I169-L268 WeakPolarHBondContact CG2-O 3.38Å; Y196-L268 HydrophobicContact CD1-CD2 3.72Å; Y196-L268 HydrophobicContact CD2-CD2 3.95Å; Y196-L268 HydrophobicContact CE1-CD2 4.23Å; Y196-L268 HydrophobicContact CE2-CD2 4.47Å; Y196-L268 HydrophobicContact CG-CD2 3.6Å; M198-L268 HydrophobicContact CE-CD1 4.18Å; L212-L268 HydrophobicContact CD1-CD1 4.48Å; L212-L268 HydrophobicContact CD1-CD2 3.86Å; L212-L268 HydrophobicContact CD2-CD1 3.81Å; L212-L268 HydrophobicContact CD2-CD2 4.09Å; L212-L268 HydrophobicContact CD2-CG 4.3Å; L212-L268 HydrophobicContact CG-CD2 4.45Å; F265-L268 HydrophobicContact CD1-CD1 4.11Å; F265-L268 PolarHBondContact O-N 3Å; A266-L268 PolarHBondContact O-N 2.97Å
269F94.9Very high93.6Very high2 Ų238.8 Ų38.81%0.00920%0.195CC..SBendtrans-112.8147.7-174.8-63.4-93.7000110.2Y137 V168 I169 P246 V248 F265 A266 A267 A281 F283Y137-F269 WeakPolarHBondContact CE2-O 3.23Å; Y137-F269 PolarHBondContact OH-O 3.43Å; V168-F269 HydrophobicContact CG1-CE1 4.37Å; I169-F269 HydrophobicContact CG1-CE1 4.19Å; I169-F269 HydrophobicContact CG1-CZ 4.04Å; P246-F269 HydrophobicContact CG-CD1 3.9Å; P246-F269 HydrophobicContact CG-CE1 4.08Å; V248-F269 HydrophobicContact CG1-CD2 4.44Å; V248-F269 HydrophobicContact CG2-CB 3.51Å; V248-F269 HydrophobicContact CG2-CD1 4.06Å; V248-F269 HydrophobicContact CG2-CD2 3.56Å; V248-F269 HydrophobicContact CG2-CE2 4.3Å; V248-F269 HydrophobicContact CG2-CG 3.43Å; V248-F269 VanDerWaalsContact CG2-CG 3.43Å; F265-F269 WeakPolarHBondContact O-CD2 3.43Å; A266-F269 PolarHBondContact O-N 3.09Å; A267-F269 VanDerWaalsContact C-N 3.29Å; A267-F269 PolarHBondContact O-N 2.95Å; F269-A281 HydrophobicContact CE1-CB 4Å; F269-A281 HydrophobicContact CZ-CB 3.89Å; F269-F283 AromaticContact CE2-CE2 3.73Å; F269-F283 HydrophobicContact CE2-CE2 3.73Å; F269-F283 AromaticContact CE2-CZ 3.95Å; F269-F283 HydrophobicContact CE2-CZ 3.95Å; F269-F283 HydrophobicContact CZ-CE2 4.25Å; F269-F283 HydrophobicContact CZ-CZ 4.38Å
270P92.7Very high93.7Very high7 Ų736.8 Ų36.85%0.04519%0.187CC..  trans-58.7143.7171-22.333.9000111.9P144 P170 Y245 N272P144-P270 HydrophobicContact CG-CG 4.45Å; P170-P270 HydrophobicContact CB-CG 3.83Å; P170-P270 HydrophobicContact CG-CG 4.09Å; Y245-P270 HydrophobicContact CD1-CG 4.29Å; Y245-P270 HydrophobicContact CD2-CB 3.96Å; Y245-P270 HydrophobicContact CD2-CG 4.1Å; Y245-P270 HydrophobicContact CE1-CG 4.37Å; Y245-P270 HydrophobicContact CE2-CB 4.2Å; Y245-P270 HydrophobicContact CE2-CG 4.19Å; Y245-P270 HydrophobicContact CG-CB 4.36Å; Y245-P270 HydrophobicContact CG-CG 4.15Å; P270-N272 WeakPolarHBondContact CB-OD1 3.33Å; P270-N272 PolarHBondContact O-N 3.39Å
271Q89.8Confident93.9Very high86 Ų8635.3 Ų35.340%0.40218%0.176SC..SBendtrans-71.1-12.6179.8-68.6-164.8-29.900114.5Y137 F138 P273Y137-Q271 HydrophobicContact CE1-CG 3.91Å; Y137-Q271 HydrophobicContact CE2-CG 3.87Å; Y137-Q271 VanDerWaalsContact CZ-CG 3.45Å; Y137-Q271 PolarHBondContact O-NE2 3.05Å; Y137-Q271 VanDerWaalsContact O-NE2 3.11Å; Y137-Q271 WeakPolarHBondContact OH-CG 3.35Å; F138-Q271 PolarHBondContact O-NE2 2.79Å; Q271-P273 VanDerWaalsContact C-CD 3.4Å; Q271-P273 WeakPolarHBondContact O-CD 3.39Å
272N91Very high93.9Very high88 Ų8836.3 Ų36.347%0.47118%0.183SC..SBendtrans-102.179-175.856.5-14.2000111.2Y245 P270Y245-N272 WeakPolarHBondContact CD2-OD1 3.47Å; P270-N272 WeakPolarHBondContact CB-OD1 3.33Å; P270-N272 PolarHBondContact O-N 3.39Å
273P91.9Very high94.1Very high42 Ų4236.5 Ų36.527%0.27318%0.183SC..  trans-66.1142.417929.5-36.6000111.2E247 Q271 F275E247-P273 HydrophobicContact CB-CB 4.43Å; E247-P273 HydrophobicContact CG-CB 3.71Å; E247-P273 HydrophobicContact CG-CG 4.31Å; Q271-P273 VanDerWaalsContact C-CD 3.4Å; Q271-P273 WeakPolarHBondContact O-CD 3.39Å; P273-F275 HydrophobicContact CG-CE1 4.22Å; P273-F275 HydrophobicContact CG-CZ 3.93Å
274Q93.7Very high94.2Very high83 Ų8338.1 Ų38.139%0.38819%0.191SC..  trans-100.996.9177.8-69.9-178.7-3.400110.4H244 Y245 V276 G277H244-Q274 HydrophobicContact CB-CB 4.07Å; H244-Q274 PolarHBondContact ND1-OE1 2.68Å; Y245-Q274 PolarHBondContact O-N 3.37Å; Q274-V276 PolarHBondContact O-N 3.09Å; Q274-G277 PolarHBondContact O-N 3.21Å
275F92.5Very high94.3Very high128 Ų12838.2 Ų38.256%0.56119%0.192SC*.THydrogen-bonded Turntrans-59.7-22.4-177.6-57.4-67000114.3E247 P273 G277 R278E247-F275 HydrophobicContact CG-CD1 4.18Å; E247-F275 HydrophobicContact CG-CE1 3.92Å; E247-F275 VanDerWaalsContact OE1-CD1 3.27Å; E247-F275 WeakPolarHBondContact OE1-CD1 3.06Å; P273-F275 HydrophobicContact CG-CE1 4.22Å; P273-F275 HydrophobicContact CG-CZ 3.93Å; F275-G277 PolarHBondContact O-N 3.4Å; F275-R278 VanDerWaalsContact O-CG 3.28Å; F275-R278 WeakPolarHBondContact O-CG 3.5Å; F275-R278 PolarHBondContact O-N 3.26Å; F275-R278 VanDerWaalsContact O-N 3.1Å
276V93.3Very high94.2Very high118 Ų11841.7 Ų41.772%0.71521%0.208SC*.THydrogen-bonded Turntrans-58.7-38.1175.2-178.70000111.3Q274 R278Q274-V276 PolarHBondContact O-N 3.09Å; V276-R278 VanDerWaalsContact C-N 3.28Å; V276-R278 PolarHBondContact O-N 3.08Å
277G90.6Very high94.1Very high1 Ų145.4 Ų45.41%0.0122%0.219CC..THydrogen-bonded Turntrans-67.9-27.9178.100000113.5H244 Q274 F275 Q279 R296H244-G277 VanDerWaalsContact CD2-CA 3.4Å; H244-G277 WeakPolarHBondContact CD2-CA 3.44Å; Q274-G277 PolarHBondContact O-N 3.21Å; F275-G277 PolarHBondContact O-N 3.4Å; G277-Q279 PolarHBondContact O-N 2.95Å; G277-R296 PolarHBondContact O-NE 3.1Å
278R94.1Very high94Very high116 Ų11646 Ų4644%0.43822%0.222SC..  trans51.741.9-173.2-55.8179.8178.91390.1112.4F275 V276 R296 Y297F275-R278 VanDerWaalsContact O-CG 3.28Å; F275-R278 WeakPolarHBondContact O-CG 3.5Å; F275-R278 PolarHBondContact O-N 3.26Å; F275-R278 VanDerWaalsContact O-N 3.1Å; V276-R278 VanDerWaalsContact C-N 3.28Å; V276-R278 PolarHBondContact O-N 3.08Å; R278-R296 HydrophobicContact CB-CG 4.41Å; R278-R296 CarbonylContact O-C 3.6Å; R278-R296 VanDerWaalsContact O-CA 3.24Å; R278-R296 WeakPolarHBondContact O-CA 3.44Å; R278-R296 WeakPolarHBondContact O-CG 3.42Å; R278-Y297 HydrophobicContact CB-CD1 4.29Å; R278-Y297 HydrophobicContact CB-CD2 4.2Å; R278-Y297 HydrophobicContact CB-CE1 4.1Å; R278-Y297 HydrophobicContact CB-CE2 3.96Å; R278-Y297 HydrophobicContact CB-CG 4.35Å; R278-Y297 WeakPolarHBondContact CB-O 3.1Å; R278-Y297 WeakPolarHBondContact CD-O 3.22Å; R278-Y297 HydrophobicContact CG-CE2 4.1Å; R278-Y297 WeakPolarHBondContact O-CD1 3.4Å; R278-Y297 PolarHBondContact O-N 3.03Å
279Q94.6Very high94.1Very high5 Ų549.5 Ų49.52%0.02324%0.237CC..EExtended strand (participates in β ladder)trans-107.2144.3-179-63-172.1-10.300110.3T242 H244 P246 E247 G277 F294 H295 L310T242-Q279 PolarHBondContact O-NE2 2.78Å; T242-Q279 VanDerWaalsContact O-NE2 3.12Å; T242-Q279 PolarHBondContact OG1-NE2 2.93Å; H244-Q279 PolarHBondContact O-OE1 3.15Å; P246-Q279 WeakPolarHBondContact CA-O 3.35Å; P246-Q279 HydrophobicContact CB-CB 3.87Å; E247-Q279 PolarHBondContact N-O 2.82Å; G277-Q279 PolarHBondContact O-N 2.95Å; Q279-F294 HydrophobicContact CB-CE2 4.31Å; Q279-F294 HydrophobicContact CB-CZ 4.05Å; Q279-F294 HydrophobicContact CG-CZ 4.38Å; Q279-F294 VanDerWaalsContact OE1-CZ 3.3Å; Q279-H295 CarbonylContact C-O 3.59Å; Q279-H295 WeakPolarHBondContact CA-O 3.3Å; Q279-L310 HydrophobicContact CG-CD1 4.04Å
280V95.8Very high94.2Very high10 Ų1049.4 Ų49.46%0.06124%0.237CC..EExtended strand (participates in β ladder)trans-143.3129.9-179.466.50000111.7E247 I249 T282 F294 H295 Y297E247-V280 HydrophobicContact CB-CB 4.32Å; E247-V280 HydrophobicContact CB-CG2 4.03Å; E247-V280 CarbonylContact O-C 3.59Å; E247-V280 VanDerWaalsContact O-CA 3.28Å; E247-V280 WeakPolarHBondContact O-CA 3.49Å; E247-V280 WeakPolarHBondContact O-CG2 3.31Å; I249-V280 HydrophobicContact CB-CG2 4.44Å; I249-V280 HydrophobicContact CD1-CG2 3.48Å; I249-V280 VanDerWaalsContact CD1-CG2 3.48Å; I249-V280 HydrophobicContact CG1-CG2 3.62Å; V280-T282 HydrophobicContact CG1-CG2 4.41Å; V280-T282 HydrophobicContact CG2-CG2 4.08Å; V280-F294 WeakPolarHBondContact O-CA 3.3Å; V280-F294 WeakPolarHBondContact O-CD2 3.29Å; V280-H295 HydrophobicContact CG1-CB 3.89Å; V280-H295 PolarHBondContact N-O 2.78Å; V280-H295 PolarHBondContact O-N 2.78Å; V280-Y297 HydrophobicContact CB-CD1 4.38Å; V280-Y297 HydrophobicContact CG1-CD1 4.21Å
281A96.7Very high94.5Very high0 Ų051.7 Ų51.70%025%0.246CC..EExtended strand (participates in β ladder)trans-97.1115.2168.500000108.9E247 V248 I249 F269 F292 F294E247-A281 PolarHBondContact O-N 3.11Å; V248-A281 CarbonylContact C-O 3.59Å; V248-A281 WeakPolarHBondContact CA-O 3.48Å; I249-A281 PolarHBondContact N-O 2.89Å; F269-A281 HydrophobicContact CE1-CB 4Å; F269-A281 HydrophobicContact CZ-CB 3.89Å; A281-F292 HydrophobicContact CB-CE2 4.17Å; A281-F292 HydrophobicContact CB-CZ 4.48Å; A281-F294 HydrophobicContact CB-CD2 4.02Å; A281-F294 HydrophobicContact CB-CE2 4.43Å
282T97.3Very high94.9Very high22 Ų2247.8 Ų47.814%0.13523%0.228CC..EExtended strand (participates in β ladder)trans-108.1124.9-179.359.20000109.9I249 V280 F292 R293I249-T282 HydrophobicContact CB-CG2 4.02Å; I249-T282 HydrophobicContact CD1-CG2 4.12Å; I249-T282 HydrophobicContact CG1-CG2 4.46Å; I249-T282 CarbonylContact O-C 3.58Å; I249-T282 WeakPolarHBondContact O-CA 3.42Å; V280-T282 HydrophobicContact CG1-CG2 4.41Å; V280-T282 HydrophobicContact CG2-CG2 4.08Å; T282-F292 WeakPolarHBondContact O-CA 3.4Å; T282-R293 PolarHBondContact N-O 3.19Å; T282-R293 PolarHBondContact O-N 2.9Å; T282-R293 WeakPolarHBondContact OG1-CB 3.41Å; T282-R293 PolarHBondContact OG1-O 2.89Å; T282-R293 VanDerWaalsContact OG1-O 3.1Å
283F98Very high95.2Very high8 Ų846.1 Ų46.14%0.03522%0.215CC..EExtended strand (participates in β ladder)trans-106.9106.2164.4-61.2-97.6000107.9V248 I249 L250 N251 F253 F265 F269 I290 F292V248-F283 HydrophobicContact CG1-CD2 4.24Å; V248-F283 HydrophobicContact CG1-CE2 4.31Å; I249-F283 PolarHBondContact O-N 2.81Å; L250-F283 HydrophobicContact CD2-CB 3.78Å; L250-F283 HydrophobicContact CD2-CD2 3.78Å; L250-F283 HydrophobicContact CD2-CG 4.05Å; N251-F283 PolarHBondContact N-O 2.91Å; F253-F283 HydrophobicContact CE2-CB 4.15Å; F253-F283 HydrophobicContact CZ-CB 4.34Å; F265-F283 HydrophobicContact CB-CD1 4.4Å; F265-F283 HydrophobicContact CB-CD2 4.39Å; F265-F283 HydrophobicContact CB-CE1 4.31Å; F265-F283 HydrophobicContact CB-CE2 4.31Å; F265-F283 HydrophobicContact CB-CG 4.44Å; F265-F283 HydrophobicContact CB-CZ 4.27Å; F265-F283 HydrophobicContact CD1-CD1 4.03Å; F265-F283 AromaticContact CD1-CE1 3.51Å; F265-F283 HydrophobicContact CD1-CE1 3.51Å; F265-F283 AromaticContact CD1-CZ 3.95Å; F265-F283 HydrophobicContact CD1-CZ 3.95Å; F265-F283 HydrophobicContact CD2-CD1 4.1Å; F265-F283 HydrophobicContact CD2-CE1 4.42Å; F265-F283 HydrophobicContact CE1-CD1 4.33Å; F265-F283 AromaticContact CE1-CE1 3.86Å; F265-F283 HydrophobicContact CE1-CE1 3.86Å; F265-F283 HydrophobicContact CE2-CD1 4.39Å; F265-F283 AromaticContact CG-CD1 3.92Å; F265-F283 HydrophobicContact CG-CD1 3.92Å; F265-F283 AromaticContact CG-CE1 3.84Å; F265-F283 HydrophobicContact CG-CE1 3.84Å; F265-F283 HydrophobicContact CG-CG 4.39Å; F265-F283 HydrophobicContact CG-CZ 4.24Å; F265-F283 HydrophobicContact CZ-CE1 4.45Å; F269-F283 AromaticContact CE2-CE2 3.73Å; F269-F283 HydrophobicContact CE2-CE2 3.73Å; F269-F283 AromaticContact CE2-CZ 3.95Å; F269-F283 HydrophobicContact CE2-CZ 3.95Å; F269-F283 HydrophobicContact CZ-CE2 4.25Å; F269-F283 HydrophobicContact CZ-CZ 4.38Å; F283-I290 HydrophobicContact CB-CG2 4.03Å; F283-I290 HydrophobicContact CD1-CG2 4.07Å; F283-F292 AromaticContact CD1-CD2 3.82Å; F283-F292 HydrophobicContact CD1-CD2 3.82Å; F283-F292 HydrophobicContact CD2-CD2 4.33Å; F283-F292 AromaticContact CE1-CD2 3.42Å; F283-F292 HydrophobicContact CE1-CD2 3.42Å; F283-F292 VanDerWaalsContact CE1-CD2 3.42Å; F283-F292 AromaticContact CE1-CE2 3.94Å; F283-F292 HydrophobicContact CE1-CE2 3.94Å; F283-F292 HydrophobicContact CE1-CG 4.42Å; F283-F292 AromaticContact CE2-CD2 3.98Å; F283-F292 HydrophobicContact CE2-CD2 3.98Å; F283-F292 AromaticContact CE2-CE2 3.83Å; F283-F292 HydrophobicContact CE2-CE2 3.83Å; F283-F292 HydrophobicContact CG-CD2 4.26Å; F283-F292 AromaticContact CZ-CD2 3.51Å; F283-F292 HydrophobicContact CZ-CD2 3.51Å; F283-F292 AromaticContact CZ-CE2 3.51Å; F283-F292 HydrophobicContact CZ-CE2 3.51Å
284H97.6Very high95.4Very high59 Ų5944.2 Ų44.227%0.27320%0.202SC..EExtended strand (participates in β ladder)trans-106.8112.7179.7177.568000110.2N251 N252 I290 F291N251-H284 HydrophobicContact CB-CB 4.45Å; N251-H284 WeakPolarHBondContact CB-ND1 3.32Å; N252-H284 PolarHBondContact ND2-CE1 3.19Å; N252-H284 VanDerWaalsContact ND2-CE1 3.35Å; H284-I290 CarbonylContact O-C 3.6Å; H284-I290 WeakPolarHBondContact O-CA 3.49Å; H284-F291 HydrophobicContact CB-CB 4.39Å; H284-F291 PolarHBondContact N-O 2.81Å; H284-F291 PolarHBondContact O-N 2.77Å
285N96.5Very high95.4Very high4 Ų441.3 Ų41.32%0.02119%0.189CC..EExtended strand (participates in β ladder)trans-81126.7172.7-178.629.4000110.5N251 N252 F253 D288 L351N251-N285 WeakPolarHBondContact O-CB 3.38Å; N251-N285 PolarHBondContact O-N 3.45Å; N252-N285 HydrophobicContact CB-CB 4.25Å; N252-N285 WeakPolarHBondContact CB-O 3.21Å; N252-N285 PolarHBondContact ND2-O 2.68Å; N252-N285 WeakPolarHBondContact O-CB 3.4Å; N252-N285 PolarHBondContact O-ND2 3Å; F253-N285 HydrophobicContact CD1-CB 4.43Å; F253-N285 HydrophobicContact CD2-CB 4.49Å; F253-N285 HydrophobicContact CE1-CB 4.2Å; F253-N285 HydrophobicContact CE2-CB 4.27Å; F253-N285 HydrophobicContact CZ-CB 4.13Å; N285-D288 WeakPolarHBondContact OD1-CA 3.38Å; N285-D288 PolarHBondContact OD1-N 3.47Å; N285-L351 VanDerWaalsContact ND2-C 3.27Å; N285-L351 WeakPolarHBondContact ND2-CB 3.38Å; N285-L351 PolarHBondContact ND2-O 3.1Å; N285-L351 PolarHBondContact ND2-OXT 2.74Å
286Q94.4Very high95.5Very high78 Ų7839.3 Ų39.336%0.36418%0.177SC..EExtended strand (participates in β ladder)trans-143.4111.6170.8179.8177.424.900109D288 F289 F291Q286-D288 PolarHBondContact O-N 2.82Å; Q286-F289 PolarHBondContact N-O 3.27Å; Q286-F289 WeakPolarHBondContact O-CB 3.4Å; Q286-F289 PolarHBondContact O-N 2.85Å; Q286-F289 VanDerWaalsContact O-N 3.09Å; Q286-F291 HydrophobicContact CB-CD2 4.32Å; Q286-F291 HydrophobicContact CB-CE2 3.99Å
287R91.7Very high95.6Very high93 Ų9334.9 Ų34.935%0.35115%0.148SC..THydrogen-bonded Turntrans57.245.9178.2-53.2-176.7-171.5156.76.7113.2E108 F289 F349E108-R287 IonicContact OE1-CZ 3.99Å; E108-R287 IonicContact OE1-NE 2.63Å; E108-R287 PolarHBondContact OE1-NE 3.45Å; E108-R287 IonicContact OE1-NH2 3.05Å; E108-R287 PolarHBondContact OE1-NH2 2.99Å; R287-F289 WeakPolarHBondContact O-CD2 3.43Å; R287-F289 PolarHBondContact O-N 2.83Å; R287-F289 VanDerWaalsContact O-N 3.13Å; R287-F349 HydrophobicContact CB-CD1 3.79Å; R287-F349 HydrophobicContact CB-CE1 3.45Å; R287-F349 VanDerWaalsContact CB-CE1 3.45Å; R287-F349 HydrophobicContact CB-CE2 4.48Å; R287-F349 HydrophobicContact CB-CG 4.45Å; R287-F349 HydrophobicContact CB-CZ 3.85Å; R287-F349 HydrophobicContact CG-CD1 4.3Å; R287-F349 HydrophobicContact CG-CE1 3.7Å; R287-F349 HydrophobicContact CG-CE2 3.96Å; R287-F349 HydrophobicContact CG-CZ 3.51Å
288D93.1Very high95.8Very high12 Ų1239.1 Ų39.16%0.06417%0.17CC..THydrogen-bonded Turntrans6213.2-175.1-45.6-51.9000115.1N285 Q286 F349 Q350 L351N285-D288 WeakPolarHBondContact OD1-CA 3.38Å; N285-D288 PolarHBondContact OD1-N 3.47Å; Q286-D288 PolarHBondContact O-N 2.82Å; D288-F349 VanDerWaalsContact OD2-CA 3.28Å; D288-F349 WeakPolarHBondContact OD2-CA 3.5Å; D288-F349 WeakPolarHBondContact OD2-CB 2.95Å; D288-F349 WeakPolarHBondContact OD2-CD1 3.04Å; D288-Q350 PolarHBondContact OD1-N 3.28Å; D288-Q350 PolarHBondContact OD2-N 2.92Å; D288-Q350 PolarHBondContact OD2-OE1 2.89Å; D288-L351 HydrophobicContact CB-CD1 4.2Å; D288-L351 PolarHBondContact OD1-N 3.05Å
289F96.1Very high95.8Very high77 Ų7739.6 Ų39.634%0.33818%0.175SC..EExtended strand (participates in β ladder)trans-101.9117.9166.7-66.6-86.3000108.9Q286 R287 F291 K317Q286-F289 PolarHBondContact N-O 3.27Å; Q286-F289 WeakPolarHBondContact O-CB 3.4Å; Q286-F289 PolarHBondContact O-N 2.85Å; Q286-F289 VanDerWaalsContact O-N 3.09Å; R287-F289 WeakPolarHBondContact O-CD2 3.43Å; R287-F289 PolarHBondContact O-N 2.83Å; R287-F289 VanDerWaalsContact O-N 3.13Å; F289-F291 HydrophobicContact CB-CD2 4.34Å; F289-F291 HydrophobicContact CB-CE2 3.63Å; F289-F291 HydrophobicContact CB-CZ 4.01Å; F289-F291 VanDerWaalsContact O-CD2 3.31Å; F289-F291 WeakPolarHBondContact O-CD2 3.38Å; F289-F291 WeakPolarHBondContact O-CE2 3.4Å; F289-K317 HydrophobicContact CD1-CB 4.35Å; F289-K317 HydrophobicContact CE1-CB 4.4Å; F289-K317 HydrophobicContact CE1-CD 3.99Å; F289-K317 HydrophobicContact CZ-CD 4.09Å
290I97.9Very high95.7Very high0 Ų046.7 Ų46.70%021%0.206CC..EExtended strand (participates in β ladder)trans-93.4109.1177-53.2172.3000107.5F223 F253 I261 F265 F283 H284 T315 L316 L351F223-I290 HydrophobicContact CE1-CD1 4.22Å; F253-I290 HydrophobicContact CE1-CD1 3.77Å; F253-I290 HydrophobicContact CE1-CG1 4.16Å; F253-I290 HydrophobicContact CZ-CD1 4Å; F253-I290 HydrophobicContact CZ-CG1 4.14Å; F253-I290 HydrophobicContact CZ-CG2 3.97Å; I261-I290 HydrophobicContact CG2-CD1 4.08Å; F265-I290 HydrophobicContact CE2-CD1 3.75Å; F265-I290 HydrophobicContact CE2-CG2 4.44Å; F265-I290 HydrophobicContact CZ-CD1 4.41Å; F283-I290 HydrophobicContact CB-CG2 4.03Å; F283-I290 HydrophobicContact CD1-CG2 4.07Å; H284-I290 CarbonylContact O-C 3.6Å; H284-I290 WeakPolarHBondContact O-CA 3.49Å; I290-T315 CarbonylContact O-C 3.56Å; I290-T315 WeakPolarHBondContact O-CA 3.41Å; I290-L316 HydrophobicContact CB-CB 4.21Å; I290-L316 PolarHBondContact N-O 3.03Å; I290-L316 PolarHBondContact O-N 3.33Å; I290-L351 HydrophobicContact CD1-CD1 3.94Å; I290-L351 HydrophobicContact CG1-CD1 4.09Å
291F98.1Very high95.6Very high56 Ų5651.6 Ų51.625%0.24623%0.232CC..EExtended strand (participates in β ladder)trans-86.8111.7177.4-65.4-93.4000109.2H284 Q286 F289 T315H284-F291 HydrophobicContact CB-CB 4.39Å; H284-F291 PolarHBondContact N-O 2.81Å; H284-F291 PolarHBondContact O-N 2.77Å; Q286-F291 HydrophobicContact CB-CD2 4.32Å; Q286-F291 HydrophobicContact CB-CE2 3.99Å; F289-F291 HydrophobicContact CB-CD2 4.34Å; F289-F291 HydrophobicContact CB-CE2 3.63Å; F289-F291 HydrophobicContact CB-CZ 4.01Å; F289-F291 VanDerWaalsContact O-CD2 3.31Å; F289-F291 WeakPolarHBondContact O-CD2 3.38Å; F289-F291 WeakPolarHBondContact O-CE2 3.4Å; F291-T315 HydrophobicContact CD1-CG2 3.2Å; F291-T315 HydrophobicContact CE1-CG2 3.32Å; F291-T315 HydrophobicContact CG-CG2 3.99Å; F291-T315 HydrophobicContact CZ-CG2 4.18Å
292F98Very high95.4Very high4 Ų461 Ų612%0.01828%0.276CS..EExtended strand (participates in β ladder)trans-88.1131.3171.4-178.8-98.9000110.7V168 A281 T282 F283 F294 F314V168-F292 HydrophobicContact CG1-CE1 4.45Å; V168-F292 HydrophobicContact CG1-CZ 3.75Å; A281-F292 HydrophobicContact CB-CE2 4.17Å; A281-F292 HydrophobicContact CB-CZ 4.48Å; T282-F292 WeakPolarHBondContact O-CA 3.4Å; F283-F292 AromaticContact CD1-CD2 3.82Å; F283-F292 HydrophobicContact CD1-CD2 3.82Å; F283-F292 HydrophobicContact CD2-CD2 4.33Å; F283-F292 AromaticContact CE1-CD2 3.42Å; F283-F292 HydrophobicContact CE1-CD2 3.42Å; F283-F292 VanDerWaalsContact CE1-CD2 3.42Å; F283-F292 AromaticContact CE1-CE2 3.94Å; F283-F292 HydrophobicContact CE1-CE2 3.94Å; F283-F292 HydrophobicContact CE1-CG 4.42Å; F283-F292 AromaticContact CE2-CD2 3.98Å; F283-F292 HydrophobicContact CE2-CD2 3.98Å; F283-F292 AromaticContact CE2-CE2 3.83Å; F283-F292 HydrophobicContact CE2-CE2 3.83Å; F283-F292 HydrophobicContact CG-CD2 4.26Å; F283-F292 AromaticContact CZ-CD2 3.51Å; F283-F292 HydrophobicContact CZ-CD2 3.51Å; F283-F292 AromaticContact CZ-CE2 3.51Å; F283-F292 HydrophobicContact CZ-CE2 3.51Å; F292-F294 HydrophobicContact CE1-CB 4.2Å; F292-F294 HydrophobicContact CZ-CB 4.33Å; F292-F314 HydrophobicContact CB-CD1 4.29Å; F292-F314 HydrophobicContact CB-CD2 3.96Å; F292-F314 HydrophobicContact CB-CE1 3.95Å; F292-F314 HydrophobicContact CB-CE2 3.56Å; F292-F314 HydrophobicContact CB-CG 4.31Å; F292-F314 HydrophobicContact CB-CZ 3.56Å; F292-F314 AromaticContact CD1-CD1 3.82Å; F292-F314 HydrophobicContact CD1-CD1 3.82Å; F292-F314 AromaticContact CD1-CE1 3.1Å; F292-F314 HydrophobicContact CD1-CE1 3.1Å; F292-F314 HydrophobicContact CD1-CE2 4.24Å; F292-F314 AromaticContact CD1-CZ 3.36Å; F292-F314 HydrophobicContact CD1-CZ 3.36Å; F292-F314 HydrophobicContact CD2-CZ 4.23Å; F292-F314 AromaticContact CE1-CE1 3.72Å; F292-F314 HydrophobicContact CE1-CE1 3.72Å; F292-F314 HydrophobicContact CE1-CZ 4.05Å; F292-F314 HydrophobicContact CG-CD1 4.41Å; F292-F314 AromaticContact CG-CE1 3.69Å; F292-F314 HydrophobicContact CG-CE1 3.69Å; F292-F314 AromaticContact CG-CE2 3.97Å; F292-F314 HydrophobicContact CG-CE2 3.97Å; F292-F314 AromaticContact CG-CZ 3.42Å; F292-F314 HydrophobicContact CG-CZ 3.42Å; F292-F314 VanDerWaalsContact CG-CZ 3.42Å; F292-F314 PolarHBondContact N-O 2.91Å; F292-F314 VanDerWaalsContact N-O 3.1Å
293R96.3Very high95.2Very high53 Ų5369.4 Ų69.420%0.231%0.31CS..EExtended strand (participates in β ladder)trans-142149169.4-54.1-74.1-179.4-89.1-2.3110T282 H295 F314T282-R293 PolarHBondContact N-O 3.19Å; T282-R293 PolarHBondContact O-N 2.9Å; T282-R293 WeakPolarHBondContact OG1-CB 3.41Å; T282-R293 PolarHBondContact OG1-O 2.89Å; T282-R293 VanDerWaalsContact OG1-O 3.1Å; R293-H295 WeakPolarHBondContact CB-CE1 3.28Å; R293-F314 PolarHBondContact NH1-O 3.43Å
294F96.3Very high95Very high2 Ų275.9 Ų75.91%0.00934%0.338CS..EExtended strand (participates in β ladder)trans-124.2117.7176.1-172.9-116.4000109.9V168 P241 P246 Q279 V280 A281 F292 L310 G311V168-F294 HydrophobicContact CG1-CB 4.3Å; V168-F294 HydrophobicContact CG1-CD1 4.31Å; V168-F294 HydrophobicContact CG1-CD2 3.53Å; V168-F294 HydrophobicContact CG1-CE2 3.78Å; V168-F294 HydrophobicContact CG1-CG 3.81Å; V168-F294 HydrophobicContact CG1-CZ 4.25Å; V168-F294 HydrophobicContact CG2-CB 4.33Å; V168-F294 HydrophobicContact CG2-CD1 3.74Å; V168-F294 HydrophobicContact CG2-CD2 4.44Å; V168-F294 HydrophobicContact CG2-CE1 4.09Å; V168-F294 HydrophobicContact CG2-CG 3.93Å; P241-F294 HydrophobicContact CB-CE1 3.99Å; P241-F294 HydrophobicContact CG-CE1 4.02Å; P246-F294 HydrophobicContact CB-CE2 3.65Å; P246-F294 HydrophobicContact CB-CZ 4.25Å; P246-F294 HydrophobicContact CG-CE2 4.02Å; Q279-F294 HydrophobicContact CB-CE2 4.31Å; Q279-F294 HydrophobicContact CB-CZ 4.05Å; Q279-F294 HydrophobicContact CG-CZ 4.38Å; Q279-F294 VanDerWaalsContact OE1-CZ 3.3Å; V280-F294 WeakPolarHBondContact O-CA 3.3Å; V280-F294 WeakPolarHBondContact O-CD2 3.29Å; A281-F294 HydrophobicContact CB-CD2 4.02Å; A281-F294 HydrophobicContact CB-CE2 4.43Å; F292-F294 HydrophobicContact CE1-CB 4.2Å; F292-F294 HydrophobicContact CZ-CB 4.33Å; F294-L310 HydrophobicContact CD1-CB 3.5Å; F294-L310 HydrophobicContact CD1-CD1 4.38Å; F294-L310 HydrophobicContact CE1-CB 3.77Å; F294-L310 HydrophobicContact CE1-CD1 3.92Å; F294-L310 PolarHBondContact O-N 3.06Å; F294-G311 PolarHBondContact O-N 3.23Å
295H95.3Very high94.9Very high21 Ų2176.7 Ų76.710%0.09735%0.347CS..EExtended strand (participates in β ladder)trans-125.5152.9-171-55.9101.5000111.7Q279 V280 R293 Q308 E309Q279-H295 CarbonylContact C-O 3.59Å; Q279-H295 WeakPolarHBondContact CA-O 3.3Å; V280-H295 HydrophobicContact CG1-CB 3.89Å; V280-H295 PolarHBondContact N-O 2.78Å; V280-H295 PolarHBondContact O-N 2.78Å; R293-H295 WeakPolarHBondContact CB-CE1 3.28Å; H295-Q308 CarbonylContact C-O 3.55Å; H295-Q308 VanDerWaalsContact CA-O 3.28Å; H295-Q308 WeakPolarHBondContact CA-O 3.34Å; H295-E309 WeakPolarHBondContact CD2-CG 3.46Å; H295-E309 IonicContact NE2-OE1 3.9Å
296R94.9Very high94.7Very high86 Ų8677.2 Ų77.233%0.32535%0.353SS..EExtended strand (participates in β ladder)trans-97.8138.6155.2-155.6176.3-176.4179.3-2.8108.8G277 R278 I307 Q308 L310G277-R296 PolarHBondContact O-NE 3.1Å; R278-R296 HydrophobicContact CB-CG 4.41Å; R278-R296 CarbonylContact O-C 3.6Å; R278-R296 VanDerWaalsContact O-CA 3.24Å; R278-R296 WeakPolarHBondContact O-CA 3.44Å; R278-R296 WeakPolarHBondContact O-CG 3.42Å; R296-I307 WeakPolarHBondContact O-CA 3.43Å; R296-Q308 PolarHBondContact N-O 2.8Å; R296-Q308 PolarHBondContact O-N 3.1Å; R296-L310 HydrophobicContact CB-CD1 3.68Å; R296-L310 HydrophobicContact CB-CD2 4.46Å; R296-L310 HydrophobicContact CB-CG 3.97Å; R296-L310 HydrophobicContact CG-CD1 4.31Å
297Y94.3Very high94.7Very high26 Ų2679.1 Ų79.110%0.10237%0.365CS..EExtended strand (participates in β ladder)trans-112.5151174.768.1-96.9000112E247 R278 V280 F299 V305 G306E247-Y297 WeakPolarHBondContact OE1-CE1 3.35Å; E247-Y297 VanDerWaalsContact OE1-CZ 3.26Å; E247-Y297 PolarHBondContact OE1-OH 2.9Å; R278-Y297 HydrophobicContact CB-CD1 4.29Å; R278-Y297 HydrophobicContact CB-CD2 4.2Å; R278-Y297 HydrophobicContact CB-CE1 4.1Å; R278-Y297 HydrophobicContact CB-CE2 3.96Å; R278-Y297 HydrophobicContact CB-CG 4.35Å; R278-Y297 WeakPolarHBondContact CB-O 3.1Å; R278-Y297 WeakPolarHBondContact CD-O 3.22Å; R278-Y297 HydrophobicContact CG-CE2 4.1Å; R278-Y297 WeakPolarHBondContact O-CD1 3.4Å; R278-Y297 PolarHBondContact O-N 3.03Å; V280-Y297 HydrophobicContact CB-CD1 4.38Å; V280-Y297 HydrophobicContact CG1-CD1 4.21Å; Y297-F299 HydrophobicContact CD2-CE1 4.49Å; Y297-F299 HydrophobicContact CD2-CE2 4.04Å; Y297-F299 AromaticContact CD2-CZ 3.98Å; Y297-F299 HydrophobicContact CD2-CZ 3.98Å; Y297-F299 HydrophobicContact CE2-CD2 4.37Å; Y297-F299 HydrophobicContact CE2-CE1 4.49Å; Y297-F299 AromaticContact CE2-CE2 3.53Å; Y297-F299 HydrophobicContact CE2-CE2 3.53Å; Y297-F299 AromaticContact CE2-CZ 3.58Å; Y297-F299 HydrophobicContact CE2-CZ 3.58Å; Y297-V305 HydrophobicContact CD2-CG1 4.44Å; Y297-V305 HydrophobicContact CG-CG1 4.42Å; Y297-G306 CarbonylContact C-O 3.46Å; Y297-G306 WeakPolarHBondContact CA-O 3.46Å
298I94Very high94.9Very high90 Ų9078.5 Ų78.546%0.46237%0.366SS..EExtended strand (participates in β ladder)trans-138123.7174.2-60.6175.5000107.1K300 G306I298-K300 PolarHBondContact O-N 3.29Å; I298-G306 PolarHBondContact N-O 2.94Å; I298-G306 PolarHBondContact O-N 2.91Å
299F94.1Very high94.9Very high125 Ų12579.3 Ų79.355%0.54837%0.369SS..EExtended strand (participates in β ladder)trans-67.3117171.3-60.6-69.8000108.8Y297 V305Y297-F299 HydrophobicContact CD2-CE1 4.49Å; Y297-F299 HydrophobicContact CD2-CE2 4.04Å; Y297-F299 AromaticContact CD2-CZ 3.98Å; Y297-F299 HydrophobicContact CD2-CZ 3.98Å; Y297-F299 HydrophobicContact CE2-CD2 4.37Å; Y297-F299 HydrophobicContact CE2-CE1 4.49Å; Y297-F299 AromaticContact CE2-CE2 3.53Å; Y297-F299 HydrophobicContact CE2-CE2 3.53Å; Y297-F299 AromaticContact CE2-CZ 3.58Å; Y297-F299 HydrophobicContact CE2-CZ 3.58Å; F299-V305 HydrophobicContact CD1-CG2 3.75Å; F299-V305 HydrophobicContact CE1-CG2 3.82Å
300K93.2Very high94.8Very high155 Ų15575.8 Ų75.867%0.67435%0.354SS*.EExtended strand (participates in β ladder)trans-82.4-49.7171.1-65.4-174.4176.5-175.90108.9I298 K304I298-K300 PolarHBondContact O-N 3.29Å; K300-K304 PolarHBondContact N-O 3.17Å
301N93.4Very high94.5Very high113 Ų11376 Ų7660%0.60436%0.356SS*.EExtended strand (participates in β ladder)trans-139.8170.6175.9-57.519.1000107.9K303 K304N301-K303 PolarHBondContact O-N 3.35Å; N301-K303 VanDerWaalsContact O-N 3.1Å; N301-K304 PolarHBondContact N-O 3.05Å; N301-K304 PolarHBondContact O-N 3.48Å; N301-K304 VanDerWaalsContact O-N 3.1Å; N301-K304 VanDerWaalsContact O-O 3.08Å
302E92.1Very high94.4Very high197 Ų19773.3 Ų73.392%0.92134%0.344SS*.THydrogen-bonded Turntrans-52.7-33.8175.5-64.8175.7174.600113.6
303K93Very high94.3Very high199 Ų19977.3 Ų77.387%0.86536%0.359SS*.THydrogen-bonded Turntrans-95.5-12.2-177.9-61.6-176.4-179.6179.90114.6N301N301-K303 PolarHBondContact O-N 3.35Å; N301-K303 VanDerWaalsContact O-N 3.1Å
304K94.3Very high94.4Very high144 Ų14475 Ų7563%0.62635%0.351SS*.EExtended strand (participates in β ladder)trans-134.8124.2-167.9-70.6-173.3-178.2175.80111.9K300 N301K300-K304 PolarHBondContact N-O 3.17Å; N301-K304 PolarHBondContact N-O 3.05Å; N301-K304 PolarHBondContact O-N 3.48Å; N301-K304 VanDerWaalsContact O-N 3.1Å; N301-K304 VanDerWaalsContact O-O 3.08Å
305V95.1Very high94.5Very high75 Ų7575.3 Ų75.346%0.45535%0.352SS..EExtended strand (participates in β ladder)trans-106.2129.7177-175.80000109.8Y297 F299 I307Y297-V305 HydrophobicContact CD2-CG1 4.44Å; Y297-V305 HydrophobicContact CG-CG1 4.42Å; F299-V305 HydrophobicContact CD1-CG2 3.75Å; F299-V305 HydrophobicContact CE1-CG2 3.82Å; V305-I307 HydrophobicContact CG1-CG2 4.34Å
306G94.2Very high94.6Very high15 Ų1574.3 Ų74.316%0.15535%0.348CS..EExtended strand (participates in β ladder)trans-86132.6165.800000110.1Y297 I298Y297-G306 CarbonylContact C-O 3.46Å; Y297-G306 WeakPolarHBondContact CA-O 3.46Å; I298-G306 PolarHBondContact N-O 2.94Å; I298-G306 PolarHBondContact O-N 2.91Å
307I94.5Very high94.7Very high119 Ų11971.9 Ų71.961%0.6134%0.34SS*.EExtended strand (participates in β ladder)trans-114.9141.8178.657.5174.7000110.8R296 V305R296-I307 WeakPolarHBondContact O-CA 3.43Å; V305-I307 HydrophobicContact CG1-CG2 4.34Å
308Q94Very high94.8Very high79 Ų7970.8 Ų70.837%0.36934%0.336SS..EExtended strand (participates in β ladder)trans-133.2132.9173.3-175.6171.539.300109.7R236 R237 H295 R296R236-Q308 PolarHBondContact O-NE2 2.78Å; R237-Q308 PolarHBondContact O-NE2 2.95Å; H295-Q308 CarbonylContact C-O 3.55Å; H295-Q308 VanDerWaalsContact CA-O 3.28Å; H295-Q308 WeakPolarHBondContact CA-O 3.34Å; R296-Q308 PolarHBondContact N-O 2.8Å; R296-Q308 PolarHBondContact O-N 3.1Å
309E93.7Very high94.8Very high29 Ų2970.2 Ų70.214%0.13633%0.328CS..EExtended strand (participates in β ladder)trans-79.2133.8-179-72.5179.7-17900112.6I234 G238 H295 R313I234-E309 HydrophobicContact CG2-CB 4.33Å; I234-E309 WeakPolarHBondContact CG2-OE2 3.26Å; G238-E309 PolarHBondContact N-O 2.99Å; H295-E309 WeakPolarHBondContact CD2-CG 3.46Å; H295-E309 IonicContact NE2-OE1 3.9Å; E309-R313 IonicContact OE1-CZ 3.79Å; E309-R313 IonicContact OE1-NE 2.89Å; E309-R313 PolarHBondContact OE1-NE 3.25Å; E309-R313 IonicContact OE1-NH1 3.89Å; E309-R313 IonicContact OE1-NH2 3.66Å; E309-R313 PolarHBondContact OE1-NH2 2.94Å; E309-R313 IonicContact OE2-CZ 3.77Å; E309-R313 IonicContact OE2-NE 3.33Å; E309-R313 PolarHBondContact OE2-NE 3.45Å; E309-R313 IonicContact OE2-NH2 2.79Å; E309-R313 PolarHBondContact OE2-NH2 3.08Å
310L93.6Very high94.9Very high4 Ų465 Ų652%0.02131%0.306CS..  trans-109.7-38.5179.9-72.4178000112.2R231 K239 P241 Q279 F294 R296R231-L310 WeakPolarHBondContact CD-O 3.31Å; R231-L310 WeakPolarHBondContact CG-O 3.49Å; R231-L310 PolarHBondContact NE-O 2.94Å; K239-L310 WeakPolarHBondContact O-CD2 3.48Å; P241-L310 HydrophobicContact CG-CB 4.46Å; Q279-L310 HydrophobicContact CG-CD1 4.04Å; F294-L310 HydrophobicContact CD1-CB 3.5Å; F294-L310 HydrophobicContact CD1-CD1 4.38Å; F294-L310 HydrophobicContact CE1-CB 3.77Å; F294-L310 HydrophobicContact CE1-CD1 3.92Å; F294-L310 PolarHBondContact O-N 3.06Å; R296-L310 HydrophobicContact CB-CD1 3.68Å; R296-L310 HydrophobicContact CB-CD2 4.46Å; R296-L310 HydrophobicContact CB-CG 3.97Å; R296-L310 HydrophobicContact CG-CD1 4.31Å
311G93.1Very high95Very high3 Ų357.8 Ų57.83%0.03128%0.275CS..SBendtrans-110.4-173.8-170.300000114.6I234 F294I234-G311 VanDerWaalsContact CD1-O 3.29Å; I234-G311 WeakPolarHBondContact CD1-O 3.44Å; F294-G311 PolarHBondContact O-N 3.23Å
312P95.5Very high95.1Very high0 Ų052.7 Ų52.70%025%0.248CC..  trans-68153.8176.129-32.5000111.1F161 Q164 R229 F314F161-P312 HydrophobicContact CD2-CB 4.2Å; F161-P312 HydrophobicContact CD2-CG 4.41Å; F161-P312 HydrophobicContact CE2-CB 4.03Å; F161-P312 HydrophobicContact CE2-CG 4.1Å; Q164-P312 HydrophobicContact CB-CG 4.05Å; R229-P312 CarbonylContact O-C 3.6Å; R229-P312 VanDerWaalsContact O-CA 3.3Å; R229-P312 WeakPolarHBondContact O-CA 3.4Å; R229-P312 WeakPolarHBondContact O-CB 3.48Å; P312-F314 HydrophobicContact CB-CD1 4.47Å; P312-F314 HydrophobicContact CG-CD1 4.45Å; P312-F314 HydrophobicContact CG-CE1 4.31Å
313R96.1Very high95.2Very high88 Ų8849.5 Ų49.533%0.33223%0.231SC..EExtended strand (participates in β ladder)trans-103.8135166.7-53.1-178.3-173.8-170.1-3.1108.8V228 R229 I234 E309V228-R313 CarbonylContact C-O 3.58Å; V228-R313 WeakPolarHBondContact CA-O 3.33Å; R229-R313 HydrophobicContact CB-CB 4.18Å; R229-R313 PolarHBondContact N-O 3.19Å; R229-R313 PolarHBondContact O-N 2.97Å; I234-R313 HydrophobicContact CD1-CG 3.85Å; E309-R313 IonicContact OE1-CZ 3.79Å; E309-R313 IonicContact OE1-NE 2.89Å; E309-R313 PolarHBondContact OE1-NE 3.25Å; E309-R313 IonicContact OE1-NH1 3.89Å; E309-R313 IonicContact OE1-NH2 3.66Å; E309-R313 PolarHBondContact OE1-NH2 2.94Å; E309-R313 IonicContact OE2-CZ 3.77Å; E309-R313 IonicContact OE2-NE 3.33Å; E309-R313 PolarHBondContact OE2-NE 3.45Å; E309-R313 IonicContact OE2-NH2 2.79Å; E309-R313 PolarHBondContact OE2-NH2 3.08Å
314F97.5Very high95.1Very high6 Ų640.8 Ų40.83%0.02620%0.198CC..EExtended strand (participates in β ladder)trans-152.617016855.1-87.6000109.7F161 L165 V225 V228 F292 R293 P312 L316F161-F314 AromaticContact CE2-CD1 3.58Å; F161-F314 HydrophobicContact CE2-CD1 3.58Å; F161-F314 AromaticContact CE2-CE1 3.9Å; F161-F314 HydrophobicContact CE2-CE1 3.9Å; F161-F314 HydrophobicContact CE2-CG 4.27Å; F161-F314 AromaticContact CZ-CD1 3.66Å; F161-F314 HydrophobicContact CZ-CD1 3.66Å; F161-F314 AromaticContact CZ-CE1 3.85Å; F161-F314 HydrophobicContact CZ-CE1 3.85Å; F161-F314 HydrophobicContact CZ-CG 4.03Å; F161-F314 HydrophobicContact CZ-CZ 4.38Å; L165-F314 HydrophobicContact CD2-CE1 3.7Å; L165-F314 HydrophobicContact CD2-CZ 3.87Å; V225-F314 HydrophobicContact CG1-CB 4.09Å; V225-F314 HydrophobicContact CG1-CD2 4.28Å; V225-F314 HydrophobicContact CG1-CG 4.46Å; V228-F314 HydrophobicContact CG2-CB 3.99Å; F292-F314 HydrophobicContact CB-CD1 4.29Å; F292-F314 HydrophobicContact CB-CD2 3.96Å; F292-F314 HydrophobicContact CB-CE1 3.95Å; F292-F314 HydrophobicContact CB-CE2 3.56Å; F292-F314 HydrophobicContact CB-CG 4.31Å; F292-F314 HydrophobicContact CB-CZ 3.56Å; F292-F314 AromaticContact CD1-CD1 3.82Å; F292-F314 HydrophobicContact CD1-CD1 3.82Å; F292-F314 AromaticContact CD1-CE1 3.1Å; F292-F314 HydrophobicContact CD1-CE1 3.1Å; F292-F314 HydrophobicContact CD1-CE2 4.24Å; F292-F314 AromaticContact CD1-CZ 3.36Å; F292-F314 HydrophobicContact CD1-CZ 3.36Å; F292-F314 HydrophobicContact CD2-CZ 4.23Å; F292-F314 AromaticContact CE1-CE1 3.72Å; F292-F314 HydrophobicContact CE1-CE1 3.72Å; F292-F314 HydrophobicContact CE1-CZ 4.05Å; F292-F314 HydrophobicContact CG-CD1 4.41Å; F292-F314 AromaticContact CG-CE1 3.69Å; F292-F314 HydrophobicContact CG-CE1 3.69Å; F292-F314 AromaticContact CG-CE2 3.97Å; F292-F314 HydrophobicContact CG-CE2 3.97Å; F292-F314 AromaticContact CG-CZ 3.42Å; F292-F314 HydrophobicContact CG-CZ 3.42Å; F292-F314 VanDerWaalsContact CG-CZ 3.42Å; F292-F314 PolarHBondContact N-O 2.91Å; F292-F314 VanDerWaalsContact N-O 3.1Å; R293-F314 PolarHBondContact NH1-O 3.43Å; P312-F314 HydrophobicContact CB-CD1 4.47Å; P312-F314 HydrophobicContact CG-CD1 4.45Å; P312-F314 HydrophobicContact CG-CE1 4.31Å; F314-L316 HydrophobicContact CD2-CD2 3.7Å; F314-L316 HydrophobicContact CD2-CG 3.91Å; F314-L316 HydrophobicContact CE2-CD1 4.01Å; F314-L316 HydrophobicContact CE2-CD2 3.77Å; F314-L316 HydrophobicContact CE2-CG 3.83Å
315T98Very high94.9Very high7 Ų735.7 Ų35.74%0.04318%0.179CC..EExtended strand (participates in β ladder)trans-125.6132176.343.70000108.9V225 S226 I290 F291V225-T315 CarbonylContact C-O 3.58Å; V225-T315 WeakPolarHBondContact CA-O 3.24Å; S226-T315 VanDerWaalsContact C-OG1 3.31Å; S226-T315 PolarHBondContact N-O 3.5Å; S226-T315 PolarHBondContact O-N 2.66Å; S226-T315 PolarHBondContact O-OG1 3.03Å; S226-T315 PolarHBondContact OG-O 2.98Å; S226-T315 PolarHBondContact OG-OG1 2.85Å; I290-T315 CarbonylContact O-C 3.56Å; I290-T315 WeakPolarHBondContact O-CA 3.41Å; F291-T315 HydrophobicContact CD1-CG2 3.2Å; F291-T315 HydrophobicContact CE1-CG2 3.32Å; F291-T315 HydrophobicContact CG-CG2 3.99Å; F291-T315 HydrophobicContact CZ-CG2 4.18Å
316L97.9Very high94.7Very high1 Ų134.9 Ų34.91%0.00517%0.169CC..EExtended strand (participates in β ladder)trans-104.7144.2174.5-54.3176.8000108.8L210 F223 K224 V225 F265 I290 F314L210-L316 HydrophobicContact CD1-CD2 4.41Å; F223-L316 HydrophobicContact CB-CB 4.23Å; F223-L316 HydrophobicContact CB-CD2 4.18Å; F223-L316 HydrophobicContact CD1-CB 4.02Å; F223-L316 HydrophobicContact CD1-CD1 4.49Å; F223-L316 HydrophobicContact CG-CB 4.33Å; F223-L316 HydrophobicContact CG-CD1 4.44Å; K224-L316 CarbonylContact O-C 3.43Å; K224-L316 WeakPolarHBondContact O-CA 3.39Å; V225-L316 HydrophobicContact CB-CD2 4.3Å; V225-L316 HydrophobicContact CG1-CD2 4.22Å; V225-L316 HydrophobicContact CG2-CD2 3.72Å; F265-L316 HydrophobicContact CE1-CD1 3.97Å; F265-L316 HydrophobicContact CZ-CD1 3.65Å; I290-L316 HydrophobicContact CB-CB 4.21Å; I290-L316 PolarHBondContact N-O 3.03Å; I290-L316 PolarHBondContact O-N 3.33Å; F314-L316 HydrophobicContact CD2-CD2 3.7Å; F314-L316 HydrophobicContact CD2-CG 3.91Å; F314-L316 HydrophobicContact CE2-CD1 4.01Å; F314-L316 HydrophobicContact CE2-CD2 3.77Å; F314-L316 HydrophobicContact CE2-CG 3.83Å
317K96.3Very high94.4Very high34 Ų3435.6 Ų35.615%0.14817%0.17CC..EExtended strand (participates in β ladder)trans-129.5123.9165.1-179.2166.4-174.5171.40107.8F223 K224 F289 R319 D343F223-K317 WeakPolarHBondContact CA-O 3.35Å; K224-K317 PolarHBondContact N-O 3.05Å; K224-K317 PolarHBondContact O-N 3.26Å; F289-K317 HydrophobicContact CD1-CB 4.35Å; F289-K317 HydrophobicContact CE1-CB 4.4Å; F289-K317 HydrophobicContact CE1-CD 3.99Å; F289-K317 HydrophobicContact CZ-CD 4.09Å; K317-R319 PolarHBondContact O-N 3.11Å; K317-D343 IonicContact NZ-OD1 2.85Å
318L96.7Very high93.9Very high3 Ų334 Ų342%0.01617%0.169CC..EExtended strand (participates in β ladder)trans-61.3135.1178.7-171.369000109.8A221 F223 L257 I261 W335 L351A221-L318 HydrophobicContact CB-CD1 4.23Å; F223-L318 HydrophobicContact CD1-CB 4.19Å; F223-L318 HydrophobicContact CD1-CD1 3.9Å; F223-L318 HydrophobicContact CE1-CB 4.13Å; F223-L318 HydrophobicContact CE1-CD1 3.48Å; F223-L318 VanDerWaalsContact CE1-CD1 3.48Å; F223-L318 HydrophobicContact CE1-CG 4.4Å; F223-L318 HydrophobicContact CZ-CD1 3.85Å; L257-L318 HydrophobicContact CD1-CD2 4.43Å; L257-L318 HydrophobicContact CD2-CD2 3.68Å; L257-L318 HydrophobicContact CG-CD2 4.45Å; I261-L318 HydrophobicContact CD1-CD1 3.85Å; I261-L318 HydrophobicContact CD1-CD2 4.17Å; I261-L318 HydrophobicContact CG1-CD2 4.16Å; L318-W335 HydrophobicContact CB-CH2 4.47Å; L318-W335 HydrophobicContact CB-CZ3 4.02Å; L318-W335 HydrophobicContact CD2-CD2 4.37Å; L318-W335 HydrophobicContact CD2-CE3 3.59Å; L318-W335 HydrophobicContact CD2-CH2 4.29Å; L318-W335 HydrophobicContact CD2-CZ3 3.57Å; L318-W335 HydrophobicContact CG-CE3 3.96Å; L318-W335 HydrophobicContact CG-CH2 4.43Å; L318-W335 HydrophobicContact CG-CZ3 3.57Å; L318-L351 HydrophobicContact CB-CD1 4.43Å; L318-L351 HydrophobicContact CD2-CD2 4.47Å
319R95.3Very high93.5Very high78 Ų7838.3 Ų38.329%0.29419%0.187SC..EExtended strand (participates in β ladder)trans-110.5-41176.6-70.9-60.5-156.4160.39.2111.6H222 K224 K317 L337H222-R319 WeakPolarHBondContact O-CA 3.49Å; H222-R319 WeakPolarHBondContact O-CB 3.4Å; H222-R319 PolarHBondContact O-N 2.88Å; K224-R319 HydrophobicContact CB-CG 4.02Å; K317-R319 PolarHBondContact O-N 3.11Å; R319-L337 WeakPolarHBondContact O-CB 3.31Å; R319-L337 PolarHBondContact O-N 3.38Å
320S95.4Very high93.1Very high15 Ų1545.9 Ų45.911%0.10522%0.215CC..EExtended strand (participates in β ladder)trans-159151.4175.956.70000110H222 W335H222-S320 WeakPolarHBondContact CB-OG 3.47Å; H222-S320 PolarHBondContact N-O 3.37Å; H222-S320 PolarHBondContact O-N 2.77Å; S320-W335 CarbonylContact C-O 3.56Å; S320-W335 WeakPolarHBondContact CA-O 3.48Å
321L96.1Very high92.8Very high4 Ų446.5 Ų46.52%0.02122%0.222CC..EExtended strand (participates in β ladder)trans-121.4124.3168.8-176.460.7000106.9P219 A221 I261 E334 W335P219-L321 HydrophobicContact CB-CD1 4.3Å; A221-L321 HydrophobicContact CB-CD1 3.98Å; I261-L321 HydrophobicContact CD1-CD1 3.98Å; I261-L321 HydrophobicContact CD1-CD2 4.34Å; L321-E334 VanDerWaalsContact CD2-OE2 3.24Å; L321-E334 WeakPolarHBondContact CD2-OE2 3.07Å; L321-E334 HydrophobicContact CG-CB 4.47Å; L321-E334 PolarHBondContact O-N 2.91Å; L321-W335 HydrophobicContact CB-CB 4.26Å; L321-W335 PolarHBondContact N-O 2.97Å; L321-W335 PolarHBondContact O-N 3.16Å; L321-W335 VanDerWaalsContact O-N 3.14Å
322Q94.9Very high92.8Very high7 Ų753 Ų533%0.03325%0.252CS..EExtended strand (participates in β ladder)trans-114.8138.7-178.6-179-172.3-13.900108.9P219 T220 T325 D327 E332 Y333P219-Q322 CarbonylContact C-O 3.54Å; P219-Q322 WeakPolarHBondContact CA-O 3.13Å; P219-Q322 WeakPolarHBondContact CB-O 3.38Å; T220-Q322 PolarHBondContact N-O 3.15Å; T220-Q322 PolarHBondContact O-N 2.83Å; Q322-T325 PolarHBondContact NE2-O 3.39Å; Q322-D327 PolarHBondContact NE2-O 3.4Å; Q322-D327 PolarHBondContact OE1-O 2.95Å; Q322-E332 CarbonylContact C-O 3.55Å; Q322-E332 WeakPolarHBondContact CA-O 3.42Å; Q322-E332 VanDerWaalsContact CG-O 3.23Å; Q322-E332 WeakPolarHBondContact CG-O 3.29Å; Q322-Y333 HydrophobicContact CB-CD1 4.05Å; Q322-Y333 HydrophobicContact CB-CE1 4.16Å
323K93.2Very high92.7Very high129 Ų12958.1 Ų58.156%0.56127%0.272SS*.SBendtrans-76.5130.5170.6-168.7173.7-175.9175.50109.4E332K323-E332 PolarHBondContact N-O 2.93Å
324G91.7Very high92.5Very high16 Ų1659.5 Ų59.517%0.16528%0.282CS..SBendtrans76.5-173.9-175.700000114.9G218 P219 T220G218-G324 CarbonylContact O-C 3.6Å; G218-G324 WeakPolarHBondContact O-CA 3.29Å; P219-G324 CarbonylContact C-O 3.57Å; T220-G324 PolarHBondContact N-O 3.13Å; T220-G324 PolarHBondContact OG1-O 2.89Å
325T90.8Very high92.3Very high37 Ų3761.3 Ų61.323%0.22729%0.289CS..SBendtrans-68.8168.1-174.1640000113.2I186 L215 P216 G218 T220 Q322 D327I186-T325 HydrophobicContact CG2-CG2 4.34Å; L215-T325 HydrophobicContact CD2-CG2 3.87Å; P216-T325 WeakPolarHBondContact O-CG2 3.5Å; G218-T325 PolarHBondContact O-N 2.86Å; T220-T325 VanDerWaalsContact OG1-C 3.25Å; T220-T325 WeakPolarHBondContact OG1-CA 3.47Å; Q322-T325 PolarHBondContact NE2-O 3.39Å; T325-D327 PolarHBondContact O-N 2.87Å
326F89.4Confident92.2Very high59 Ų5964.1 Ų64.126%0.25931%0.306SS..  trans-55.4106.2-177.2179.6-95.6000112.6L182 I186 V211 T220L182-F326 HydrophobicContact CB-CD1 3.93Å; L182-F326 HydrophobicContact CB-CE1 4.29Å; L182-F326 HydrophobicContact CD1-CD1 3.66Å; L182-F326 HydrophobicContact CD1-CD2 4.39Å; L182-F326 HydrophobicContact CD1-CE1 3.64Å; L182-F326 HydrophobicContact CD1-CE2 4.36Å; L182-F326 HydrophobicContact CD1-CG 4.06Å; L182-F326 HydrophobicContact CD1-CZ 4Å; L182-F326 HydrophobicContact CG-CD1 4.44Å; I186-F326 HydrophobicContact CD1-CB 4.12Å; V211-F326 HydrophobicContact CG1-CD2 4.05Å; T220-F326 HydrophobicContact CG2-CB 4.3Å; T220-F326 HydrophobicContact CG2-CD2 4.29Å; T220-F326 PolarHBondContact OG1-N 3.4Å; T220-F326 VanDerWaalsContact OG1-N 3.15Å
327D88.9Confident91.9Very high30 Ų3065 Ų6516%0.1631%0.31CS..  trans-136.2110.6168.4-171.322000112.3K183 Q322 T325 K329 Y330 G331K183-D327 VanDerWaalsContact CE-OD1 3.29Å; K183-D327 WeakPolarHBondContact CE-OD1 3.22Å; K183-D327 IonicContact NZ-OD1 2.74Å; K183-D327 PolarHBondContact NZ-OD1 3.34Å; K183-D327 IonicContact NZ-OD2 3.98Å; Q322-D327 PolarHBondContact NE2-O 3.4Å; Q322-D327 PolarHBondContact OE1-O 2.95Å; T325-D327 PolarHBondContact O-N 2.87Å; D327-K329 VanDerWaalsContact C-N 3.33Å; D327-K329 PolarHBondContact O-N 3.47Å; D327-K329 PolarHBondContact OD1-N 3.12Å; D327-Y330 WeakPolarHBondContact OD2-CA 3.43Å; D327-Y330 WeakPolarHBondContact OD2-CB 3.48Å; D327-Y330 PolarHBondContact OD2-N 3.08Å; D327-Y330 VanDerWaalsContact OD2-N 3.1Å; D327-G331 WeakPolarHBondContact O-CA 3.41Å; D327-G331 PolarHBondContact O-N 2.99Å
328S83.6Confident91.6Very high86 Ų8669 Ų6960%0.60133%0.328SS*.THydrogen-bonded Turntrans-76.2-17.7-178.3-177.20000114.1
329K84.9Confident91Very high169 Ų16976.1 Ų76.174%0.73536%0.355SS*.THydrogen-bonded Turntrans-101.4-50.8-171.5-70.9-171.6178.9-173.40113.1D327D327-K329 VanDerWaalsContact C-N 3.33Å; D327-K329 PolarHBondContact O-N 3.47Å; D327-K329 PolarHBondContact OD1-N 3.12Å
330Y86.7Confident90.4Very high188 Ų18881 Ų8174%0.73738%0.38SS*.THydrogen-bonded Turntrans-116.812.6-174.6-50.7-76.2000112D327D327-Y330 WeakPolarHBondContact OD2-CA 3.43Å; D327-Y330 WeakPolarHBondContact OD2-CB 3.48Å; D327-Y330 PolarHBondContact OD2-N 3.08Å; D327-Y330 VanDerWaalsContact OD2-N 3.1Å
331G86.8Confident89.9Confident16 Ų1686.4 Ų86.417%0.16540%0.404CS..PPolyproline II helixtrans-64.8130.7178.400000113D327 Y333D327-G331 WeakPolarHBondContact O-CA 3.41Å; D327-G331 PolarHBondContact O-N 2.99Å; G331-Y333 WeakPolarHBondContact O-CD2 3.23Å
332E92.5Very high89.1Confident141 Ų14188.1 Ų88.166%0.65941%0.412SS*.PPolyproline II helixtrans-80.4118.3172-66.5-176.1174.100110Q322 K323Q322-E332 CarbonylContact C-O 3.55Å; Q322-E332 WeakPolarHBondContact CA-O 3.42Å; Q322-E332 VanDerWaalsContact CG-O 3.23Å; Q322-E332 WeakPolarHBondContact CG-O 3.29Å; K323-E332 PolarHBondContact N-O 2.93Å
333Y93.3Very high88.4Confident106 Ų10691.2 Ų91.242%0.41643%0.429SS..EExtended strand (participates in β ladder)trans-93.6116.6177.8-68.5-88.2000110.4Q322 G331 W335 V336Q322-Y333 HydrophobicContact CB-CD1 4.05Å; Q322-Y333 HydrophobicContact CB-CE1 4.16Å; G331-Y333 WeakPolarHBondContact O-CD2 3.23Å; Y333-W335 VanDerWaalsContact C-N 3.34Å; Y333-V336 HydrophobicContact CD1-CG2 3.81Å; Y333-V336 HydrophobicContact CG-CG2 3.75Å
334E92.4Very high87.9Confident117 Ų11788.9 Ų88.955%0.54743%0.434SS..EExtended strand (participates in β ladder)trans-67-40.7169.5-171.8-170.6159.100110.3L321L321-E334 VanDerWaalsContact CD2-OE2 3.24Å; L321-E334 WeakPolarHBondContact CD2-OE2 3.07Å; L321-E334 HydrophobicContact CG-CB 4.47Å; L321-E334 PolarHBondContact O-N 2.91Å
335W94.3Very high87.5Confident44 Ų4490.8 Ų90.817%0.16744%0.444CS..EExtended strand (participates in β ladder)trans-147.7141.9-179.7-175.292.9000112.8L257 L318 S320 L321 Y333 L337 M342 Q350L257-W335 HydrophobicContact CD1-CB 3.5Å; L257-W335 VanDerWaalsContact CD1-CB 3.5Å; L257-W335 HydrophobicContact CD1-CD2 3.65Å; L257-W335 HydrophobicContact CD1-CE3 4.4Å; L257-W335 HydrophobicContact CD1-CG 3.21Å; L318-W335 HydrophobicContact CB-CH2 4.47Å; L318-W335 HydrophobicContact CB-CZ3 4.02Å; L318-W335 HydrophobicContact CD2-CD2 4.37Å; L318-W335 HydrophobicContact CD2-CE3 3.59Å; L318-W335 HydrophobicContact CD2-CH2 4.29Å; L318-W335 HydrophobicContact CD2-CZ3 3.57Å; L318-W335 HydrophobicContact CG-CE3 3.96Å; L318-W335 HydrophobicContact CG-CH2 4.43Å; L318-W335 HydrophobicContact CG-CZ3 3.57Å; S320-W335 CarbonylContact C-O 3.56Å; S320-W335 WeakPolarHBondContact CA-O 3.48Å; L321-W335 HydrophobicContact CB-CB 4.26Å; L321-W335 PolarHBondContact N-O 2.97Å; L321-W335 PolarHBondContact O-N 3.16Å; L321-W335 VanDerWaalsContact O-N 3.14Å; Y333-W335 VanDerWaalsContact C-N 3.34Å; W335-L337 HydrophobicContact CH2-CB 3.66Å; W335-L337 HydrophobicContact CH2-CD1 3.7Å; W335-L337 HydrophobicContact CH2-CG 4.24Å; W335-L337 HydrophobicContact CZ2-CB 4.49Å; W335-L337 HydrophobicContact CZ2-CD1 4.13Å; W335-L337 HydrophobicContact CZ3-CB 3.87Å; W335-M342 HydrophobicContact CH2-CE 4.36Å; W335-M342 HydrophobicContact CZ2-CE 3.65Å; W335-M342 HydrophobicContact CZ2-SD 3.87Å; W335-Q350 HydrophobicContact CZ2-CB 4.16Å; W335-Q350 HydrophobicContact CZ2-CG 4.08Å
336V94.4Very high87.2Confident67 Ų6799.4 Ų99.441%0.40647%0.473SS..EExtended strand (participates in β ladder)trans-137.8136.2176.4-177.90000110.8Y333 K338 M342Y333-V336 HydrophobicContact CD1-CG2 3.81Å; Y333-V336 HydrophobicContact CG-CG2 3.75Å; V336-K338 PolarHBondContact O-N 3.33Å; V336-M342 WeakPolarHBondContact O-CE 3.5Å
337L91.8Very high87.2Confident18 Ų18102.1 Ų102.19%0.09448%0.481CS..  trans-71.588.7175.7-17372.3000112R319 W335 R339 M342R319-L337 WeakPolarHBondContact O-CB 3.31Å; R319-L337 PolarHBondContact O-N 3.38Å; W335-L337 HydrophobicContact CH2-CB 3.66Å; W335-L337 HydrophobicContact CH2-CD1 3.7Å; W335-L337 HydrophobicContact CH2-CG 4.24Å; W335-L337 HydrophobicContact CZ2-CB 4.49Å; W335-L337 HydrophobicContact CZ2-CD1 4.13Å; W335-L337 HydrophobicContact CZ3-CB 3.87Å; L337-R339 PolarHBondContact O-N 3.08Å; L337-R339 VanDerWaalsContact O-N 3.15Å; L337-M342 VanDerWaalsContact CA-CE 3.42Å; L337-M342 HydrophobicContact CB-CE 4.43Å; L337-M342 HydrophobicContact CD1-CE 3.87Å; L337-M342 HydrophobicContact CD1-SD 4.45Å; L337-M342 HydrophobicContact CG-CE 4.47Å
338K89.9Confident87.2Confident118 Ų118105.1 Ų105.151%0.51349%0.493SS..  trans-74.990.9166.7-62-176.1-177.8-179.20111.4V336 H340 E341 M342V336-K338 PolarHBondContact O-N 3.33Å; K338-H340 PolarHBondContact O-N 2.97Å; K338-E341 HydrophobicContact CB-CB 4.25Å; K338-E341 WeakPolarHBondContact CD-OE2 3.3Å; K338-E341 IonicContact NZ-OE2 3.55Å; K338-E341 PolarHBondContact O-N 3.26Å; K338-M342 HydrophobicContact CB-CE 4.12Å; K338-M342 WeakPolarHBondContact O-CB 3.28Å; K338-M342 PolarHBondContact O-N 3.02Å
339R83.9Confident87.5Confident154 Ų154101.8 Ų101.858%0.58147%0.467SS*.Hα-helixtrans-55.4-44-171-165.5-179.7-173.2-179.6-3.5114.4L337 D343L337-R339 PolarHBondContact O-N 3.08Å; L337-R339 VanDerWaalsContact O-N 3.15Å; R339-D343 WeakPolarHBondContact CG-OD2 3.41Å; R339-D343 IonicContact NE-OD2 2.91Å; R339-D343 WeakPolarHBondContact O-CB 3.47Å; R339-D343 PolarHBondContact O-N 2.98Å
340H84.1Confident87.8Confident179 Ų17994.8 Ų94.883%0.82944%0.437SS*.Hα-helixtrans-71.8-34.4-175-67.7-74.9000112.8K338K338-H340 PolarHBondContact O-N 2.97Å
341E84.1Confident87.9Confident130 Ų13086 Ų8661%0.60740%0.403SS*.Hα-helixtrans-78.8-47.1178.7-66.3170.2-155.200110.9K338 A344K338-E341 HydrophobicContact CB-CB 4.25Å; K338-E341 WeakPolarHBondContact CD-OE2 3.3Å; K338-E341 IonicContact NZ-OE2 3.55Å; K338-E341 PolarHBondContact O-N 3.26Å; E341-A344 WeakPolarHBondContact O-CB 3.21Å
342M80.1Confident88Confident39 Ų3989.5 Ų89.519%0.19242%0.415CS..Hα-helixtrans-81.9-31.2-172.3-70.8-162.7-93.700114.4W335 V336 L337 K338 A344 Q350W335-M342 HydrophobicContact CH2-CE 4.36Å; W335-M342 HydrophobicContact CZ2-CE 3.65Å; W335-M342 HydrophobicContact CZ2-SD 3.87Å; V336-M342 WeakPolarHBondContact O-CE 3.5Å; L337-M342 VanDerWaalsContact CA-CE 3.42Å; L337-M342 HydrophobicContact CB-CE 4.43Å; L337-M342 HydrophobicContact CD1-CE 3.87Å; L337-M342 HydrophobicContact CD1-SD 4.45Å; L337-M342 HydrophobicContact CG-CE 4.47Å; K338-M342 HydrophobicContact CB-CE 4.12Å; K338-M342 WeakPolarHBondContact O-CB 3.28Å; K338-M342 PolarHBondContact O-N 3.02Å; M342-A344 PolarHBondContact O-N 3.46Å; M342-Q350 HydrophobicContact SD-CG 3.82Å
343D78.9Confident87.7Confident72 Ų7286.8 Ų86.839%0.38540%0.402SS..THydrogen-bonded Turntrans-77.8-2.7175.7-69.6-20.3000112.2K317 R339K317-D343 IonicContact NZ-OD1 2.85Å; R339-D343 WeakPolarHBondContact CG-OD2 3.41Å; R339-D343 IonicContact NE-OD2 2.91Å; R339-D343 WeakPolarHBondContact O-CB 3.47Å; R339-D343 PolarHBondContact O-N 2.98Å
344A83.2Confident87.4Confident81 Ų8185.7 Ų85.767%0.66940%0.401SS*.SBendtrans-66.4-45.417800000111.8E341 M342E341-A344 WeakPolarHBondContact O-CB 3.21Å; M342-A344 PolarHBondContact O-N 3.46Å
345C83.8Confident87.1Confident56 Ų5683.9 Ų83.938%0.37839%0.393SS..SBendtrans-96.299.2174.4-172.50000110.8R347 K348C345-R347 PolarHBondContact O-N 3.18Å; C345-K348 HydrophobicContact CB-CB 4.21Å; C345-K348 PolarHBondContact O-N 3.13Å
346R85Confident86.7Confident218 Ų21886.4 Ų86.482%0.82341%0.407SS*.THydrogen-bonded Turntrans-70.411179.9-61.5-173.6177.7178.61115.4
347R88.9Confident86.2Confident116 Ų11687.7 Ų87.744%0.43841%0.407SS..THydrogen-bonded Turntrans-125.7-2.4-179.4-62.9-176.4-172.8168.62.1113Q110 V112 C345Q110-R347 WeakPolarHBondContact O-CD 3.16Å; Q110-R347 VanDerWaalsContact OE1-CZ 3.3Å; V112-R347 HydrophobicContact CG2-CB 3.94Å; V112-R347 PolarHBondContact N-O 2.89Å; C345-R347 PolarHBondContact O-N 3.18Å
348K88.5Confident85.8Confident93 Ų9392.6 Ų92.640%0.40443%0.429SS..  trans-99.6131.1171.2-173.2171.4-176.7171.20108.2D114 C345D114-K348 VanDerWaalsContact OD2-CE 3.26Å; D114-K348 WeakPolarHBondContact OD2-CE 3.48Å; C345-K348 HydrophobicContact CB-CB 4.21Å; C345-K348 PolarHBondContact O-N 3.13Å
349F90.8Very high85.4Confident16 Ų1690.7 Ų90.77%0.0742%0.423CS..  trans-132.9138.7-180-52.6-63.3000108.1I107 R111 R287 D288I107-F349 HydrophobicContact CG2-CE2 3.99Å; I107-F349 HydrophobicContact CG2-CZ 3.76Å; R111-F349 HydrophobicContact CG-CD2 4.01Å; R111-F349 HydrophobicContact CG-CE2 4.42Å; R111-F349 PolarHBondContact NH2-O 3.49Å; R287-F349 HydrophobicContact CB-CD1 3.79Å; R287-F349 HydrophobicContact CB-CE1 3.45Å; R287-F349 VanDerWaalsContact CB-CE1 3.45Å; R287-F349 HydrophobicContact CB-CE2 4.48Å; R287-F349 HydrophobicContact CB-CG 4.45Å; R287-F349 HydrophobicContact CB-CZ 3.85Å; R287-F349 HydrophobicContact CG-CD1 4.3Å; R287-F349 HydrophobicContact CG-CE1 3.7Å; R287-F349 HydrophobicContact CG-CE2 3.96Å; R287-F349 HydrophobicContact CG-CZ 3.51Å; D288-F349 VanDerWaalsContact OD2-CA 3.28Å; D288-F349 WeakPolarHBondContact OD2-CA 3.5Å; D288-F349 WeakPolarHBondContact OD2-CB 2.95Å; D288-F349 WeakPolarHBondContact OD2-CD1 3.04Å
350Q90.1Very high85.6Confident22 Ų2285.4 Ų85.410%0.10341%0.41CS..  trans-96.2-17.8-166.1-60.179.135.800114.1T255 D288 W335 M342T255-Q350 WeakPolarHBondContact CB-O 3.46Å; T255-Q350 PolarHBondContact OG1-O 3.26Å; D288-Q350 PolarHBondContact OD1-N 3.28Å; D288-Q350 PolarHBondContact OD2-N 2.92Å; D288-Q350 PolarHBondContact OD2-OE1 2.89Å; W335-Q350 HydrophobicContact CZ2-CB 4.16Å; W335-Q350 HydrophobicContact CZ2-CG 4.08Å; M342-Q350 HydrophobicContact SD-CG 3.82Å
351L89.2Confident85.7Confident3 Ų376.9 Ų76.92%0.01637%0.371CS..  trans-97.10178.7-72.1164.7000113.1R111 F253 T254 T255 L257 G258 I261 N285 D288 I290 L318R111-L351 PolarHBondContact NH2-O 3.02Å; F253-L351 WeakPolarHBondContact CA-OXT 3.41Å; T254-L351 PolarHBondContact N-OXT 2.93Å; T255-L351 WeakPolarHBondContact OG1-CA 3.11Å; T255-L351 PolarHBondContact OG1-OXT 3.31Å; L257-L351 HydrophobicContact CD2-CD2 3.26Å; L257-L351 HydrophobicContact CD2-CG 3.96Å; G258-L351 WeakPolarHBondContact CA-OXT 3.34Å; I261-L351 HydrophobicContact CB-CD2 4.15Å; I261-L351 HydrophobicContact CG1-CD2 4.04Å; I261-L351 HydrophobicContact CG2-CD2 4.33Å; N285-L351 VanDerWaalsContact ND2-C 3.27Å; N285-L351 WeakPolarHBondContact ND2-CB 3.38Å; N285-L351 PolarHBondContact ND2-O 3.1Å; N285-L351 PolarHBondContact ND2-OXT 2.74Å; D288-L351 HydrophobicContact CB-CD1 4.2Å; D288-L351 PolarHBondContact OD1-N 3.05Å; I290-L351 HydrophobicContact CD1-CD1 3.94Å; I290-L351 HydrophobicContact CG1-CD1 4.09Å; L318-L351 HydrophobicContact CB-CD1 4.43Å; L318-L351 HydrophobicContact CD2-CD2 4.47Å

Retrieved 351 of 351 residues in 1968.2 ms (Link to these results)