A0A096MB90_POEFO Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A096MB90, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 248 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
1M39.5Very low34.7Very low240 Ų240150.4 Ų150.4100%1.18282%0.819SS**  0109.70-105.5123.6161.700108.7
2T37.3Very low34.3Very low130 Ų130145.6 Ų145.680%0.79882%0.815SS**  trans-0.7118.6153.442.30000120.8
3N26.3Very low34.6Very low144 Ų144140.2 Ų140.277%0.7781%0.812SS**  trans-7.1127.7131.1-152.4-3.6000117.7
4I38.1Very low34.6Very low159 Ų159142.6 Ų142.682%0.81581%0.812SS**  trans-145109.7151-60.8-176.7000108.5
5S31.9Very low34.7Very low104 Ų104144.5 Ų144.573%0.72782%0.819SS**  trans-74.7142.4153.5-60.40000109.7
6S38.4Very low35Very low115 Ų115143.3 Ų143.380%0.80482%0.815SS**  trans-156.6116141.7-164.40000110.7
7E33.8Very low34.7Very low168 Ų168141.8 Ų141.879%0.78581%0.809SS**  trans-52.6148.2155.8-145144.484.600110.7
8F33.5Very low34.6Very low178 Ų178140.3 Ų140.378%0.78181%0.809SS**  175.2121.3127-111.9-100.2000113.2
9D31.6Very low34.6Very low135 Ų135138.6 Ų138.672%0.72281%0.806SS**  trans54.3120.2143.1-74.2-30.4000124.5
10L31.3Very low34.8Very low160 Ų160138.1 Ų138.184%0.83881%0.805SS**  trans-68.2155.4148.8-81.7145000110.8
11P39.7Very low34.7Very low121 Ų121136.8 Ų136.879%0.78680%0.803SS**  -135.6161.3118.734.9-22.5000114.5
12A30.5Very low34.5Very low93 Ų93133.8 Ų133.877%0.76979%0.788SS**  trans-54.3141.3178.300000114.1
13G37.4Very low34.4Very low76 Ų76136 Ų13678%0.78479%0.79SS**  trans-132.896.3162.900000107.8
14E35Very low35Very low174 Ų174137.9 Ų137.981%0.81380%0.796SS**  trans-76126.6171.4-55.7167.9118.700107.6
15D35.8Very low35.7Very low171 Ų171135.9 Ų135.991%0.91479%0.793SS**  trans-122134.2164.7-92.6-40.8000110.5
16V39.2Very low36.3Very low124 Ų124136.5 Ų136.575%0.75280%0.795SS**  trans-97.7130.3-156.7153.70000110.6
17V30.4Very low36.5Very low118 Ų118138.9 Ų138.972%0.71580%0.799SS**  trans64121141.1179.40000119.8
18S33.8Very low36.7Very low115 Ų115135.5 Ų135.580%0.80480%0.8SS**  -150.9100.5119.9-141.40000111.2
19S33.9Very low37.2Very low109 Ų109132.1 Ų132.176%0.76281%0.805SS**  trans-80.7110170.548.90000109.5
20V37.7Very low37.7Very low127 Ų127136.5 Ų136.577%0.7781%0.811SS**  trans-86.7107.9164.4173.50000107.7
21S33.6Very low38.6Very low111 Ų111135 Ų13578%0.77681%0.814SS**  trans-75123.4166-163.30000108.1
22M34.6Very low39Very low177 Ų177133.4 Ų133.487%0.87281%0.811SS**  trans-124.1106.7170.4-155161.7-174.100108.7
23E34.8Very low40.1Very low178 Ų178137.2 Ų137.283%0.83282%0.818SS**PPolyproline II helixtrans-69.6133.6-179.7-148.1154.9104.700110.1
24M39.5Very low41Very low183 Ų183140.3 Ų140.390%0.90182%0.815SS**PPolyproline II helixtrans-91.9133.3175-94.8158.6166.100110.8
25P52.4Low41.6Very low116 Ų116135.5 Ų135.575%0.75380%0.8SS**PPolyproline II helixtrans-90.1159.9161.632.8-28.1000112
26P44.8Very low42.2Very low117 Ų117138 Ų13876%0.7680%0.796SS**PPolyproline II helixtrans-94.8152.9-156.935-30.3000114.8
27N42.5Very low42.6Very low165 Ų165135.6 Ų135.688%0.88279%0.785SS**  trans26.6108.6150.8-69-25.4000119.5
28A38.1Very low43.5Very low98 Ų98135 Ų13581%0.8178%0.777SS**  trans-145.778.1144.400000110R30A28-R30 PolarHBondContact O-N 3.05Å
29A45.4Very low44.1Very low107 Ų107139.1 Ų139.188%0.88478%0.775SS**  trans-69.396.7164.700000108.7
30R41.3Very low44.8Very low226 Ų226140.1 Ų140.185%0.85377%0.771SS**  trans-131.9109.3165.8-81.1-171.9173-167.7-1.3109.1A28A28-R30 PolarHBondContact O-N 3.05Å
31S51.1Low45.2Very low129 Ų129140.7 Ų140.790%0.90277%0.767SS**  trans28.898.9145.5-52.30000117.9
32A48.2Very low45.7Very low88 Ų88143.1 Ų143.173%0.72776%0.764SS**  trans-157.543.5157.300000112.2L34A32-L34 PolarHBondContact O-N 3.13Å
33L52.2Low46.1Very low173 Ų173138.3 Ų138.391%0.90675%0.752SS**  trans-95.174.2168-72.8172.1000108.5
34L56.3Low46.5Very low140 Ų140136.5 Ų136.573%0.73375%0.748SS**SBendtrans-17039.3172.8-104.4165.5000116A32A32-L34 PolarHBondContact O-N 3.13Å
35P49.1Very low46.9Very low74 Ų74133.4 Ų133.448%0.48174%0.739SS.*SBendtrans-127.1-11.3152.628.6-13000115.5
36W47.6Very low46.4Very low222 Ų222132.2 Ų132.284%0.84173%0.734SS**SBendtrans-89.5-16.2-173.9-67.3-21.3000115.3
37S48.3Very low46.2Very low74 Ų74134 Ų13452%0.51774%0.737SS.*Hα-helixtrans-77.4-20.7176510000113.9
38L49.2Very low45.8Very low105 Ų105131.1 Ų131.155%0.5573%0.729SS.*Hα-helixtrans-77.2-24.1178.4-87.6150000113.2
39W46.3Very low46.2Very low203 Ų203131.3 Ų131.377%0.76971%0.713SS**Hα-helixtrans-74.4-27.3178-85.582.9000113.3M41W39-M41 VanDerWaalsContact C-N 3.34Å
40L47.3Very low46Very low130 Ų130130.3 Ų130.368%0.68170%0.697SS**Hα-helixtrans-74.9-24.3176.5-79.4158.2000112.9
41M46Very low46.2Very low138 Ų138122.2 Ų122.268%0.6867%0.67SS**Hα-helixtrans-81.5-20.3177.5-65-61.6-69.100113.2W39W39-M41 VanDerWaalsContact C-N 3.34Å
42F45.4Very low46.1Very low162 Ų162116.6 Ų116.671%0.71163%0.63SS**Hα-helixtrans-84-15.1175.2-92.4-80.4000113.7L44F42-L44 PolarHBondContact O-N 3.12Å
43A43.3Very low46Very low76 Ų76115.8 Ų115.863%0.62862%0.619SS**THydrogen-bonded Turntrans-77.8-6.1176.700000113.9
44L43.2Very low45.9Very low140 Ų140111.1 Ų111.173%0.73361%0.605SS**THydrogen-bonded Turntrans-102.18.1-173.6-86.4153.1000115.1F42F42-L44 PolarHBondContact O-N 3.12Å
45T46.8Very low45.2Very low118 Ų118111.5 Ų111.572%0.72460%0.602SS**  trans-132.548.6172.858.60000111.4D47T45-D47 PolarHBondContact O-N 3Å
46S42.6Very low45.4Very low92 Ų92110.7 Ų110.764%0.64359%0.593SS**  trans-95.877.4162.8-169.60000108.3C48S46-C48 PolarHBondContact O-N 3.23Å
47D39.8Very low45.7Very low154 Ų154101 Ų10182%0.82456%0.56SS**  trans-67.276.6157.3-99.5-35.8000107.6T45 Q49T45-D47 PolarHBondContact O-N 3Å; D47-Q49 PolarHBondContact O-N 2.79Å
48C35.3Very low46.2Very low105 Ų10599.8 Ų99.871%0.70955%0.549SS*.  trans-73.681.6159.8-92.10000106.5S46 P50S46-C48 PolarHBondContact O-N 3.23Å; C48-P50 VanDerWaalsContact O-CD 3.24Å; C48-P50 WeakPolarHBondContact O-CD 3.44Å
49Q45.4Very low47.1Very low101 Ų101100 Ų10047%0.47255%0.551SS.*  trans-75.5114.5156.3-71-173.3-49.900107.1D47 M51D47-Q49 PolarHBondContact O-N 2.79Å; Q49-M51 HydrophobicContact CB-CG 4.15Å; Q49-M51 PolarHBondContact O-N 3Å
50P41.2Very low48.6Very low86 Ų8691 Ų9156%0.55852%0.519SS*.  trans-73.984.1160.632.1-27.2000105.7C48 N168C48-P50 VanDerWaalsContact O-CD 3.24Å; C48-P50 WeakPolarHBondContact O-CD 3.44Å; P50-N168 HydrophobicContact CG-CB 4.15Å
51M45Very low50.6Low56 Ų5687 Ų8728%0.27650%0.501SS..  trans-71.5152.5164.5-76.5-143.5144.600108.2Q49 S53 P78Q49-M51 HydrophobicContact CB-CG 4.15Å; Q49-M51 PolarHBondContact O-N 3Å; M51-S53 PolarHBondContact O-N 2.89Å; M51-P78 HydrophobicContact SD-CB 4.27Å
52L49.4Very low52.8Low12 Ų1281 Ų816%0.06347%0.471CS..SBendtrans-32.9143.6149.6-88.5105.2000109A54 E56 A57 R133L52-A54 PolarHBondContact O-N 3.46Å; L52-E56 HydrophobicContact CD2-CB 3.91Å; L52-E56 HydrophobicContact CD2-CG 3.82Å; L52-A57 HydrophobicContact CB-CB 4.34Å; L52-R133 HydrophobicContact CD1-CB 3.98Å; L52-R133 HydrophobicContact CD1-CG 4.27Å
53S47.4Very low55.1Low71 Ų7173.6 Ų73.650%0.49744%0.439SS..  trans-42.3126.8173.174.10000108.1M51 H55 E56 A57M51-S53 PolarHBondContact O-N 2.89Å; S53-H55 CarbonylContact O-C 3.57Å; S53-H55 PolarHBondContact O-N 2.84Å; S53-E56 PolarHBondContact O-N 3.04Å; S53-E56 WeakPolarHBondContact OG-CB 3.32Å; S53-A57 PolarHBondContact O-N 3.04Å
54A48.4Very low57.5Low74 Ų7470.4 Ų70.461%0.61241%0.411SS*.Hα-helixtrans-52.4-23.7-166.700000112.6L52 V58L52-A54 PolarHBondContact O-N 3.46Å; A54-V58 VanDerWaalsContact O-CG2 3.26Å; A54-V58 WeakPolarHBondContact O-CG2 3.4Å
55H42.3Very low59.9Low148 Ų14865.2 Ų65.269%0.68538%0.384SS*.Hα-helixtrans-71.3-33.3174.2-163.6-87.2000115.1S53S53-H55 CarbonylContact O-C 3.57Å; S53-H55 PolarHBondContact O-N 2.84Å
56E52.8Low61.9Low58 Ų5862 Ų6227%0.27137%0.367SS..Hα-helixtrans-82.7-28.6-178.2-154.9164.2-155.400111.7L52 S53 N59 A60 T109 H131L52-E56 HydrophobicContact CD2-CB 3.91Å; L52-E56 HydrophobicContact CD2-CG 3.82Å; S53-E56 PolarHBondContact O-N 3.04Å; S53-E56 WeakPolarHBondContact OG-CB 3.32Å; E56-N59 PolarHBondContact O-N 3.15Å; E56-A60 PolarHBondContact O-N 2.9Å; E56-T109 HydrophobicContact CG-CG2 4.34Å; E56-H131 IonicContact OE1-CD2 3.37Å; E56-H131 IonicContact OE1-CE1 3.27Å; E56-H131 IonicContact OE1-CG 3.42Å; E56-H131 IonicContact OE1-ND1 2.72Å; E56-H131 IonicContact OE1-NE2 2.73Å
57A54.2Low64.1Low19 Ų1961 Ų6116%0.15737%0.37CS..Hα-helixtrans-69-31.2171.300000113.4L52 S53 N59 A60 P78L52-A57 HydrophobicContact CB-CB 4.34Å; S53-A57 PolarHBondContact O-N 3.04Å; A57-N59 VanDerWaalsContact C-N 3.29Å; A57-N59 PolarHBondContact O-N 2.64Å; A57-A60 PolarHBondContact O-N 3.14Å; A57-P78 HydrophobicContact CB-CG 4.48Å
58V59.4Low66.3Low48 Ų4857.7 Ų57.729%0.29137%0.365SS..Hα-helixtrans-71.4-23.3178.7170.30000112.4A54 L76A54-V58 VanDerWaalsContact O-CG2 3.26Å; A54-V58 WeakPolarHBondContact O-CG2 3.4Å; V58-L76 WeakPolarHBondContact CG1-O 3.18Å
59N66.9Low68.9Low110 Ų11053 Ų5359%0.58833%0.333SS*.THydrogen-bonded Turntrans-103.96.4179-66.9-25.7000113.2E56 A57E56-N59 PolarHBondContact O-N 3.15Å; A57-N59 VanDerWaalsContact C-N 3.29Å; A57-N59 PolarHBondContact O-N 2.64Å
60A78.6Confident71.2Confident13 Ų1348.4 Ų48.411%0.10731%0.312CS..PPolyproline II helixtrans-79.5139.1179.500000111.1E56 A57 T109E56-A60 PolarHBondContact O-N 2.9Å; A57-A60 PolarHBondContact O-N 3.14Å; A60-T109 WeakPolarHBondContact CA-O 3.4Å; A60-T109 HydrophobicContact CB-CG2 3.8Å
61T89.6Confident73.6Confident47 Ų4746.5 Ų46.529%0.28829%0.294SS..EExtended strand (participates in β ladder)trans-81122.8166.9-57.50000108.7L63 T72 T109 V110 A111T61-L63 HydrophobicContact CG2-CD2 3.95Å; T61-L63 HydrophobicContact CG2-CG 4.34Å; T61-T72 HydrophobicContact CG2-CG2 3.62Å; T61-T109 PolarHBondContact N-O 2.97Å; T61-V110 WeakPolarHBondContact O-CA 3.28Å; T61-A111 PolarHBondContact O-N 2.83Å
62L92.5Very high75.9Confident10 Ų1045.6 Ų45.65%0.05229%0.292CS..EExtended strand (participates in β ladder)trans-89.8128.2176.317264.5000110F64 T72 C73 A87 A111 W113L62-F64 HydrophobicContact CD2-CD1 4.3Å; L62-F64 HydrophobicContact CD2-CE1 4.24Å; L62-F64 HydrophobicContact CG-CD1 4.1Å; L62-F64 HydrophobicContact CG-CE1 4.43Å; L62-T72 WeakPolarHBondContact O-CA 3.4Å; L62-C73 HydrophobicContact CB-CB 4.08Å; L62-C73 HydrophobicContact CD2-CB 4.36Å; L62-C73 HydrophobicContact CG-CB 4.42Å; L62-C73 PolarHBondContact N-O 2.64Å; L62-C73 PolarHBondContact O-N 3.19Å; L62-A87 HydrophobicContact CD2-CB 3.86Å; L62-A111 CarbonylContact C-O 3.5Å; L62-A111 WeakPolarHBondContact CA-O 3.43Å; L62-A111 HydrophobicContact CD1-CB 4.18Å; L62-W113 HydrophobicContact CD1-CD2 3.76Å; L62-W113 HydrophobicContact CD1-CE3 4.4Å; L62-W113 HydrophobicContact CD1-CG 3.97Å; L62-W113 HydrophobicContact CD1-CZ2 4.02Å; L62-W113 HydrophobicContact CD2-CH2 3.88Å; L62-W113 HydrophobicContact CD2-CZ2 3.86Å; L62-W113 HydrophobicContact CD2-CZ3 4.22Å
63L93.8Very high77.9Confident7 Ų745.1 Ų45.14%0.03729%0.289CS..EExtended strand (participates in β ladder)trans-125.2134.1-179.8-57.5177.2000110.7T61 L70 R71 T72 L106 V110 A111 V112 W113 L123T61-L63 HydrophobicContact CG2-CD2 3.95Å; T61-L63 HydrophobicContact CG2-CG 4.34Å; L63-L70 HydrophobicContact CB-CD1 4.41Å; L63-L70 HydrophobicContact CD2-CD2 4.31Å; L63-R71 VanDerWaalsContact CA-O 3.3Å; L63-R71 WeakPolarHBondContact CA-O 3.47Å; L63-T72 HydrophobicContact CD2-CG2 3.61Å; L63-T72 VanDerWaalsContact CD2-OG1 3.23Å; L63-T72 WeakPolarHBondContact CD2-OG1 3.1Å; L63-L106 HydrophobicContact CD1-CD2 3.37Å; L63-V110 HydrophobicContact CD1-CG1 3.5Å; L63-V110 HydrophobicContact CG-CG1 3.97Å; L63-A111 PolarHBondContact N-O 3.05Å; L63-V112 HydrophobicContact CB-CG2 4.28Å; L63-V112 HydrophobicContact CD1-CG2 4.4Å; L63-V112 CarbonylContact O-C 3.57Å; L63-V112 VanDerWaalsContact O-CA 3.32Å; L63-V112 WeakPolarHBondContact O-CA 3.46Å; L63-W113 PolarHBondContact O-N 2.77Å; L63-L123 HydrophobicContact CD1-CD2 4.03Å
64F93.8Very high80Confident10 Ų1045.4 Ų45.44%0.04429%0.291CS..EExtended strand (participates in β ladder)trans-157.6157.117462.6-91000112.1L62 R71 A84 A87 W113L62-F64 HydrophobicContact CD2-CD1 4.3Å; L62-F64 HydrophobicContact CD2-CE1 4.24Å; L62-F64 HydrophobicContact CG-CD1 4.1Å; L62-F64 HydrophobicContact CG-CE1 4.43Å; F64-R71 HydrophobicContact CD1-CB 4.14Å; F64-R71 HydrophobicContact CD2-CB 3.92Å; F64-R71 HydrophobicContact CE1-CB 3.96Å; F64-R71 HydrophobicContact CE1-CG 3.93Å; F64-R71 HydrophobicContact CE2-CB 3.71Å; F64-R71 HydrophobicContact CE2-CG 3.87Å; F64-R71 HydrophobicContact CG-CB 4.13Å; F64-R71 HydrophobicContact CZ-CB 3.75Å; F64-R71 HydrophobicContact CZ-CG 3.53Å; F64-R71 PolarHBondContact N-O 3.47Å; F64-R71 VanDerWaalsContact N-O 3.07Å; F64-R71 WeakPolarHBondContact O-CB 3.29Å; F64-R71 PolarHBondContact O-N 3.41Å; F64-A84 HydrophobicContact CD2-CB 4.46Å; F64-A84 HydrophobicContact CE2-CB 3.75Å; F64-A84 HydrophobicContact CZ-CB 4.07Å; F64-A87 HydrophobicContact CE1-CB 4.06Å; F64-A87 HydrophobicContact CZ-CB 4.34Å; F64-W113 HydrophobicContact CB-CB 3.83Å; F64-W113 HydrophobicContact CB-CE3 4.29Å; F64-W113 HydrophobicContact CD1-CE3 4.03Å; F64-W113 HydrophobicContact CD1-CZ3 4.4Å; F64-W113 HydrophobicContact CE1-CZ3 4.47Å; F64-W113 HydrophobicContact CG-CE3 4.17Å
65D92.6Very high81.8Confident30 Ų3042.4 Ų42.416%0.1627%0.265CS..EExtended strand (participates in β ladder)trans-76.9125.5173.2-172.610.5000110.7G67 W118 V119D65-G67 PolarHBondContact OD1-N 3.31Å; D65-W118 HydrophobicContact CB-CZ2 3.75Å; D65-W118 VanDerWaalsContact CG-CZ2 3.5Å; D65-W118 PolarHBondContact OD2-NE1 2.83Å; D65-V119 HydrophobicContact CB-CG2 4.11Å
66S89.9Confident83.7Confident52 Ų5242.7 Ų42.736%0.36427%0.271SS..  trans-97.31.5175.8610000113.3A68 G69S66-A68 PolarHBondContact O-N 3.14Å; S66-G69 PolarHBondContact N-O 2.7Å; S66-G69 PolarHBondContact OG-O 3.28Å
67G87.3Confident85.2Confident70 Ų7042.5 Ų42.572%0.72228%0.279SS*.SBendtrans81.7-29.2-172.500000113.6D65D65-G67 PolarHBondContact OD1-N 3.31Å
68A86.4Confident86.5Confident85 Ų8544.3 Ų44.370%0.70229%0.289SS*.SBendtrans-89.2-9.3171.500000113.3S66S66-A68 PolarHBondContact O-N 3.14Å
69G89.9Confident87.9Confident5 Ų542.8 Ų42.85%0.05228%0.28CS..SBendtrans147.2-174.7-173.100000111.7S66 R71 V96S66-G69 PolarHBondContact N-O 2.7Å; S66-G69 PolarHBondContact OG-O 3.28Å; G69-R71 PolarHBondContact O-N 2.88Å; G69-V96 CarbonylContact C-O 3.5Å
70L92.8Very high88.9Confident6 Ų640.4 Ų40.43%0.03127%0.271CS..EExtended strand (participates in β ladder)trans-75.7122.5178.2-16870.2000110.1L63 T95 V96 L101 W118 L123L63-L70 HydrophobicContact CB-CD1 4.41Å; L63-L70 HydrophobicContact CD2-CD2 4.31Å; L70-T95 WeakPolarHBondContact O-CA 3.22Å; L70-V96 PolarHBondContact N-O 3.47Å; L70-V96 PolarHBondContact O-N 2.82Å; L70-L101 HydrophobicContact CB-CD2 3.65Å; L70-L101 HydrophobicContact CD2-CD2 3.46Å; L70-L101 VanDerWaalsContact CD2-CD2 3.46Å; L70-L101 HydrophobicContact CG-CD2 4.2Å; L70-W118 HydrophobicContact CB-CH2 4.2Å; L70-W118 HydrophobicContact CD1-CH2 3.99Å; L70-L123 HydrophobicContact CD1-CD2 3.93Å; L70-L123 HydrophobicContact CD2-CD1 3.87Å; L70-L123 HydrophobicContact CD2-CD2 3.75Å; L70-L123 HydrophobicContact CD2-CG 4.43Å
71R93.1Very high89.5Confident46 Ų4641.1 Ų41.117%0.17427%0.273CS..EExtended strand (participates in β ladder)trans-87.5128172.1-153.869.9169.211911.2108.9L63 F64 G69 D88 C93 S94 T95L63-R71 VanDerWaalsContact CA-O 3.3Å; L63-R71 WeakPolarHBondContact CA-O 3.47Å; F64-R71 HydrophobicContact CD1-CB 4.14Å; F64-R71 HydrophobicContact CD2-CB 3.92Å; F64-R71 HydrophobicContact CE1-CB 3.96Å; F64-R71 HydrophobicContact CE1-CG 3.93Å; F64-R71 HydrophobicContact CE2-CB 3.71Å; F64-R71 HydrophobicContact CE2-CG 3.87Å; F64-R71 HydrophobicContact CG-CB 4.13Å; F64-R71 HydrophobicContact CZ-CB 3.75Å; F64-R71 HydrophobicContact CZ-CG 3.53Å; F64-R71 PolarHBondContact N-O 3.47Å; F64-R71 VanDerWaalsContact N-O 3.07Å; F64-R71 WeakPolarHBondContact O-CB 3.29Å; F64-R71 PolarHBondContact O-N 3.41Å; G69-R71 PolarHBondContact O-N 2.88Å; R71-D88 IonicContact CZ-OD1 3.64Å; R71-D88 IonicContact NE-OD1 3.89Å; R71-D88 PolarHBondContact NE-OD1 2.84Å; R71-D88 VanDerWaalsContact NE-OD1 3.16Å; R71-D88 IonicContact NH2-OD1 3.87Å; R71-D88 PolarHBondContact NH2-OD1 3.34Å; R71-C93 HydrophobicContact CG-CB 4.36Å; R71-C93 VanDerWaalsContact CZ-CB 3.44Å; R71-C93 VanDerWaalsContact NH1-C 3.27Å; R71-C93 PolarHBondContact NH1-O 3.42Å; R71-C93 VanDerWaalsContact NH1-O 3.11Å; R71-C93 VanDerWaalsContact NH2-CB 3.26Å; R71-S94 CarbonylContact C-O 3.58Å; R71-S94 WeakPolarHBondContact CA-O 3.17Å; R71-S94 VanDerWaalsContact NH1-CA 3.26Å; R71-S94 PolarHBondContact NH1-O 2.64Å; R71-T95 WeakPolarHBondContact CD-OG1 3.36Å; R71-T95 PolarHBondContact NE-OG1 3.45Å; R71-T95 PolarHBondContact NH1-OG1 2.87Å
72T92.5Very high89.6Confident37 Ų3741.1 Ų41.123%0.22728%0.275CS..EExtended strand (participates in β ladder)trans-120.3116.9178.2-57.90000109.5T61 L62 L63 C93 S94T61-T72 HydrophobicContact CG2-CG2 3.62Å; L62-T72 WeakPolarHBondContact O-CA 3.4Å; L63-T72 HydrophobicContact CD2-CG2 3.61Å; L63-T72 VanDerWaalsContact CD2-OG1 3.23Å; L63-T72 WeakPolarHBondContact CD2-OG1 3.1Å; T72-C93 CarbonylContact O-C 3.52Å; T72-C93 VanDerWaalsContact O-CA 3.3Å; T72-C93 WeakPolarHBondContact O-CA 3.4Å; T72-S94 PolarHBondContact N-O 2.96Å; T72-S94 PolarHBondContact O-N 3Å; T72-S94 PolarHBondContact O-OG 3.31Å
73C91.9Very high89.5Confident1 Ų143.2 Ų43.21%0.00729%0.286CS..EExtended strand (participates in β ladder)trans-120.6135.6-172.8-64.30000111.4L62 C91 R92 C93L62-C73 HydrophobicContact CB-CB 4.08Å; L62-C73 HydrophobicContact CD2-CB 4.36Å; L62-C73 HydrophobicContact CG-CB 4.42Å; L62-C73 PolarHBondContact N-O 2.64Å; L62-C73 PolarHBondContact O-N 3.19Å; C73-C91 HydrophobicContact CB-CB 4.02Å; C73-R92 WeakPolarHBondContact CA-O 3.4Å; C73-C93 HydrophobicContact CB-CB 4.15Å; C73-C93 WeakPolarHBondContact CB-SG 3.41Å; C73-C93 WeakPolarHBondContact SG-CB 3.34Å; C73-C93 CovalentContact SG-SG 2.03Å; C73-C93 PolarHBondContact SG-SG 3.27Å
74S90.3Very high89.5Confident78 Ų7844.8 Ų44.855%0.54530%0.3SS..EExtended strand (participates in β ladder)trans-108.4117.8166.6179.90000108.8C91 R92S74-C91 WeakPolarHBondContact O-CA 3.2Å; S74-C91 WeakPolarHBondContact O-CB 3.49Å; S74-R92 PolarHBondContact N-O 3.25Å; S74-R92 PolarHBondContact O-N 2.83Å
75C87Confident89.4Confident10 Ų1047.9 Ų47.97%0.06833%0.327CS..EExtended strand (participates in β ladder)trans-113138.5-172.8-59.10000110.3A77 V79 C91C75-A77 WeakPolarHBondContact CB-O 3.31Å; C75-V79 HydrophobicContact CB-CG2 4.39Å; C75-C91 VanDerWaalsContact CA-SG 3.56Å; C75-C91 HydrophobicContact CB-CB 3.96Å; C75-C91 WeakPolarHBondContact CB-SG 3.29Å; C75-C91 WeakPolarHBondContact SG-CB 3.35Å; C75-C91 CovalentContact SG-SG 2.02Å; C75-C91 PolarHBondContact SG-SG 2.72Å
76L82.8Confident89.3Confident155 Ų15548.1 Ų48.181%0.81233%0.327SS*.SBendtrans-88-10175.4-64.3174.8000113.1V58V58-L76 WeakPolarHBondContact CG1-O 3.18Å
77A83.2Confident89.4Confident53 Ų5345.7 Ų45.744%0.43831%0.31SS..SBendtrans-143.5156.1179.300000109.5C75C75-A77 WeakPolarHBondContact CB-O 3.31Å
78P82.3Confident89.6Confident57 Ų5745.9 Ų45.937%0.3730%0.295SS..  trans-56.9138.9173.8-23.333.8000111.7M51 A57M51-P78 HydrophobicContact SD-CB 4.27Å; A57-P78 HydrophobicContact CB-CG 4.48Å
79V88.1Confident89.9Confident16 Ų1646.2 Ų46.210%0.09729%0.292CS..  trans-110.4138172.6-175.70000107.9C75 D81 Q86 A87 C91 W113C75-V79 HydrophobicContact CB-CG2 4.39Å; V79-D81 PolarHBondContact O-N 3.43Å; V79-Q86 HydrophobicContact CG1-CB 4.12Å; V79-Q86 HydrophobicContact CG1-CG 4.2Å; V79-A87 HydrophobicContact CG1-CB 4.15Å; V79-C91 VanDerWaalsContact CG2-SG 3.54Å; V79-W113 HydrophobicContact CB-CH2 4.48Å; V79-W113 HydrophobicContact CB-CZ2 4.48Å; V79-W113 HydrophobicContact CG1-CH2 3.85Å; V79-W113 HydrophobicContact CG1-CZ2 4.27Å
80P89.6Confident90Very high60 Ų6053.5 Ų53.539%0.3932%0.318SS..  trans-52.8135.1171.6-25.535.4000110.7D83 Q86 W113P80-D83 HydrophobicContact CB-CB 4.34Å; P80-D83 PolarHBondContact O-N 3.1Å; P80-Q86 VanDerWaalsContact CD-CD 3.44Å; P80-Q86 VanDerWaalsContact CG-OE1 3.28Å; P80-W113 WeakPolarHBondContact O-CH2 3.43Å; P80-W113 WeakPolarHBondContact O-CZ2 3.23Å
81D90.3Very high89.9Confident28 Ų2854 Ų5415%0.1532%0.321CS..THydrogen-bonded Turntrans-58.1142.3177.8-73.5-51.8000110.7V79 D83 W113 R133 S135 H158V79-D81 PolarHBondContact O-N 3.43Å; D81-D83 PolarHBondContact O-N 2.89Å; D81-W113 PolarHBondContact OD1-NE1 3.45Å; D81-R133 IonicContact OD1-NE 2.69Å; D81-R133 IonicContact OD2-CZ 3.94Å; D81-R133 IonicContact OD2-NE 3.16Å; D81-R133 PolarHBondContact OD2-NE 2.92Å; D81-R133 IonicContact OD2-NH2 3.67Å; D81-R133 PolarHBondContact OD2-NH2 3.46Å; D81-S135 WeakPolarHBondContact OD1-CB 3.41Å; D81-S135 PolarHBondContact OD1-OG 3.11Å; D81-S135 PolarHBondContact OD2-OG 3.17Å; D81-H158 IonicContact OD2-CD2 3.53Å; D81-H158 IonicContact OD2-CG 3.45Å
82C90.8Very high89.9Confident48 Ų4862.2 Ų62.232%0.32435%0.352SS..THydrogen-bonded Turntrans6516.3177.4-48.40000116C137C82-C137 WeakPolarHBondContact CA-SG 3.26Å; C82-C137 HydrophobicContact CB-CB 3.65Å; C82-C137 WeakPolarHBondContact CB-SG 3.39Å; C82-C137 WeakPolarHBondContact SG-CA 3.47Å; C82-C137 WeakPolarHBondContact SG-CB 3.29Å; C82-C137 CovalentContact SG-SG 2.03Å; C82-C137 PolarHBondContact SG-SG 2.78Å
83D92Very high89.9Confident53 Ų5361.8 Ų61.828%0.28335%0.351SS..  trans-107.482.7174.1-171-14.1000111.5P80 D81 A85 Q86 A87 W113P80-D83 HydrophobicContact CB-CB 4.34Å; P80-D83 PolarHBondContact O-N 3.1Å; D81-D83 PolarHBondContact O-N 2.89Å; D83-A85 VanDerWaalsContact C-N 3.33Å; D83-A85 PolarHBondContact O-N 3.31Å; D83-A85 PolarHBondContact OD1-N 2.85Å; D83-Q86 HydrophobicContact CB-CB 4Å; D83-Q86 PolarHBondContact O-N 3.37Å; D83-Q86 VanDerWaalsContact OD1-CB 3.32Å; D83-Q86 WeakPolarHBondContact OD1-CB 3.4Å; D83-Q86 PolarHBondContact OD1-N 2.77Å; D83-Q86 WeakPolarHBondContact OD2-CB 3.47Å; D83-Q86 PolarHBondContact OD2-NE2 3.23Å; D83-A87 PolarHBondContact O-N 2.96Å; D83-W113 VanDerWaalsContact C-CZ3 3.48Å; D83-W113 WeakPolarHBondContact O-CH2 3.29Å
84A92.1Very high89.9Confident40 Ų4064.8 Ų64.833%0.33137%0.372SS..Hα-helixtrans-62.3-37-178.900000113F64 Q86 A87 D88F64-A84 HydrophobicContact CD2-CB 4.46Å; F64-A84 HydrophobicContact CE2-CB 3.75Å; F64-A84 HydrophobicContact CZ-CB 4.07Å; A84-Q86 VanDerWaalsContact C-N 3.3Å; A84-Q86 PolarHBondContact O-N 2.73Å; A84-A87 PolarHBondContact O-N 3.37Å; A84-D88 PolarHBondContact O-N 3.1Å
85A92.1Very high90Very high75 Ų7564.1 Ų64.162%0.6237%0.365SS*.Hα-helixtrans-65.1-37.6178.900000111.4D83 S89D83-A85 VanDerWaalsContact C-N 3.33Å; D83-A85 PolarHBondContact O-N 3.31Å; D83-A85 PolarHBondContact OD1-N 2.85Å; A85-S89 WeakPolarHBondContact O-CB 3.44Å; A85-S89 PolarHBondContact O-N 2.82Å; A85-S89 PolarHBondContact O-OG 3.34Å
86Q92.1Very high90.2Very high36 Ų3666 Ų6617%0.16838%0.376CS..Hα-helixtrans-72.9-35.4175.2-163.8173.8139.600112.5V79 P80 D83 A84 S89 R90V79-Q86 HydrophobicContact CG1-CB 4.12Å; V79-Q86 HydrophobicContact CG1-CG 4.2Å; P80-Q86 VanDerWaalsContact CD-CD 3.44Å; P80-Q86 VanDerWaalsContact CG-OE1 3.28Å; D83-Q86 HydrophobicContact CB-CB 4Å; D83-Q86 PolarHBondContact O-N 3.37Å; D83-Q86 VanDerWaalsContact OD1-CB 3.32Å; D83-Q86 WeakPolarHBondContact OD1-CB 3.4Å; D83-Q86 PolarHBondContact OD1-N 2.77Å; D83-Q86 WeakPolarHBondContact OD2-CB 3.47Å; D83-Q86 PolarHBondContact OD2-NE2 3.23Å; A84-Q86 VanDerWaalsContact C-N 3.3Å; A84-Q86 PolarHBondContact O-N 2.73Å; Q86-S89 WeakPolarHBondContact CA-OG 3.46Å; Q86-S89 PolarHBondContact O-N 3.35Å; Q86-S89 PolarHBondContact O-OG 3.16Å; Q86-S89 VanDerWaalsContact O-OG 3.12Å; Q86-R90 HydrophobicContact CG-CG 4.33Å; Q86-R90 WeakPolarHBondContact O-CB 3.25Å; Q86-R90 WeakPolarHBondContact O-CG 3.44Å; Q86-R90 PolarHBondContact O-N 3.27Å; Q86-R90 VanDerWaalsContact O-N 3.09Å
87A92Very high90.5Very high0 Ų061.8 Ų61.80%036%0.358CS..Hα-helixtrans-61.5-49.4172.500000111.6L62 F64 V79 D83 A84 S89 R90 C91 W113L62-A87 HydrophobicContact CD2-CB 3.86Å; F64-A87 HydrophobicContact CE1-CB 4.06Å; F64-A87 HydrophobicContact CZ-CB 4.34Å; V79-A87 HydrophobicContact CG1-CB 4.15Å; D83-A87 PolarHBondContact O-N 2.96Å; A84-A87 PolarHBondContact O-N 3.37Å; A87-S89 VanDerWaalsContact C-N 3.27Å; A87-S89 PolarHBondContact O-N 2.66Å; A87-R90 PolarHBondContact O-N 2.89Å; A87-C91 WeakPolarHBondContact O-CB 3.3Å; A87-C91 PolarHBondContact O-N 3.34Å; A87-C91 PolarHBondContact O-SG 2.92Å; A87-C91 VanDerWaalsContact O-SG 3.41Å; A87-W113 HydrophobicContact CB-CH2 4.09Å; A87-W113 HydrophobicContact CB-CZ3 4.16Å
88D91.4Very high90.7Very high75 Ų7564.3 Ų64.340%0.40136%0.356SS..Hα-helixtrans-64.2-30.6-179-82.1-43.8000113.1R71 A84R71-D88 IonicContact CZ-OD1 3.64Å; R71-D88 IonicContact NE-OD1 3.89Å; R71-D88 PolarHBondContact NE-OD1 2.84Å; R71-D88 VanDerWaalsContact NE-OD1 3.16Å; R71-D88 IonicContact NH2-OD1 3.87Å; R71-D88 PolarHBondContact NH2-OD1 3.34Å; A84-D88 PolarHBondContact O-N 3.1Å
89S91.8Very high90.8Very high92 Ų9267.3 Ų67.364%0.64338%0.378SS*.Hα-helixtrans-84-26179.857.80000114.1A85 Q86 A87A85-S89 WeakPolarHBondContact O-CB 3.44Å; A85-S89 PolarHBondContact O-N 2.82Å; A85-S89 PolarHBondContact O-OG 3.34Å; Q86-S89 WeakPolarHBondContact CA-OG 3.46Å; Q86-S89 PolarHBondContact O-N 3.35Å; Q86-S89 PolarHBondContact O-OG 3.16Å; Q86-S89 VanDerWaalsContact O-OG 3.12Å; A87-S89 VanDerWaalsContact C-N 3.27Å; A87-S89 PolarHBondContact O-N 2.66Å
90R91Very high90.6Very high157 Ų15769.4 Ų69.459%0.59240%0.397SS*.Hα-helixtrans-106.4-16-175.4-63.1-173-178.9-178.34.4114.2Q86 A87Q86-R90 HydrophobicContact CG-CG 4.33Å; Q86-R90 WeakPolarHBondContact O-CB 3.25Å; Q86-R90 WeakPolarHBondContact O-CG 3.44Å; Q86-R90 PolarHBondContact O-N 3.27Å; Q86-R90 VanDerWaalsContact O-N 3.09Å; A87-R90 PolarHBondContact O-N 2.89Å
91C91.8Very high90.1Very high16 Ų1668.7 Ų68.711%0.10839%0.39CS..EExtended strand (participates in β ladder)trans-120.1161-172.9-49.60000112.1C73 S74 C75 V79 A87 C93C73-C91 HydrophobicContact CB-CB 4.02Å; S74-C91 WeakPolarHBondContact O-CA 3.2Å; S74-C91 WeakPolarHBondContact O-CB 3.49Å; C75-C91 VanDerWaalsContact CA-SG 3.56Å; C75-C91 HydrophobicContact CB-CB 3.96Å; C75-C91 WeakPolarHBondContact CB-SG 3.29Å; C75-C91 WeakPolarHBondContact SG-CB 3.35Å; C75-C91 CovalentContact SG-SG 2.02Å; C75-C91 PolarHBondContact SG-SG 2.72Å; V79-C91 VanDerWaalsContact CG2-SG 3.54Å; A87-C91 WeakPolarHBondContact O-CB 3.3Å; A87-C91 PolarHBondContact O-N 3.34Å; A87-C91 PolarHBondContact O-SG 2.92Å; A87-C91 VanDerWaalsContact O-SG 3.41Å; C91-C93 PolarHBondContact O-N 2.76Å
92R92.6Very high89.5Confident219 Ų21971.8 Ų71.883%0.82641%0.406SS*.EExtended strand (participates in β ladder)trans-87.2105.6169.3-68.3-177.8177.5-179-0.2108.4C73 S74C73-R92 WeakPolarHBondContact CA-O 3.4Å; S74-R92 PolarHBondContact N-O 3.25Å; S74-R92 PolarHBondContact O-N 2.83Å
93C93.1Very high88.6Confident28 Ų2874.9 Ų74.919%0.18941%0.411CS..EExtended strand (participates in β ladder)trans-113136-173.9-61.60000112.6R71 T72 C73 C91R71-C93 HydrophobicContact CG-CB 4.36Å; R71-C93 VanDerWaalsContact CZ-CB 3.44Å; R71-C93 VanDerWaalsContact NH1-C 3.27Å; R71-C93 PolarHBondContact NH1-O 3.42Å; R71-C93 VanDerWaalsContact NH1-O 3.11Å; R71-C93 VanDerWaalsContact NH2-CB 3.26Å; T72-C93 CarbonylContact O-C 3.52Å; T72-C93 VanDerWaalsContact O-CA 3.3Å; T72-C93 WeakPolarHBondContact O-CA 3.4Å; C73-C93 HydrophobicContact CB-CB 4.15Å; C73-C93 WeakPolarHBondContact CB-SG 3.41Å; C73-C93 WeakPolarHBondContact SG-CB 3.34Å; C73-C93 CovalentContact SG-SG 2.03Å; C73-C93 PolarHBondContact SG-SG 3.27Å; C91-C93 PolarHBondContact O-N 2.76Å
94S92.3Very high87.2Confident65 Ų6576.4 Ų76.446%0.45543%0.431SS..EExtended strand (participates in β ladder)trans-120.8153.9172.462.70000109.8R71 T72R71-S94 CarbonylContact C-O 3.58Å; R71-S94 WeakPolarHBondContact CA-O 3.17Å; R71-S94 VanDerWaalsContact NH1-CA 3.26Å; R71-S94 PolarHBondContact NH1-O 2.64Å; T72-S94 PolarHBondContact N-O 2.96Å; T72-S94 PolarHBondContact O-N 3Å; T72-S94 PolarHBondContact O-OG 3.31Å
95T92.8Very high85.9Confident64 Ų6478.7 Ų78.739%0.39344%0.444SS..EExtended strand (participates in β ladder)trans-117.3128.6177.9-50.90000109L70 R71L70-T95 WeakPolarHBondContact O-CA 3.22Å; R71-T95 WeakPolarHBondContact CD-OG1 3.36Å; R71-T95 PolarHBondContact NE-OG1 3.45Å; R71-T95 PolarHBondContact NH1-OG1 2.87Å
96V90.2Very high85.2Confident49 Ų4976.1 Ų76.130%0.29742%0.42SS..EExtended strand (participates in β ladder)trans-114.8128.9176.1-177.70000108.1G69 L70 A100 L101G69-V96 CarbonylContact C-O 3.5Å; L70-V96 PolarHBondContact N-O 3.47Å; L70-V96 PolarHBondContact O-N 2.82Å; V96-A100 HydrophobicContact CG1-CB 4.05Å; V96-L101 HydrophobicContact CB-CD2 4.49Å; V96-L101 HydrophobicContact CG1-CD2 4.26Å
97P89.4Confident84.5Confident67 Ų6775.8 Ų75.844%0.43543%0.426SS..  trans-63.9146.1177.526.4-32.5000110.3S99 A100P97-S99 PolarHBondContact O-N 3.45Å; P97-S99 VanDerWaalsContact O-N 3.1Å; P97-A100 HydrophobicContact CG-CB 3.88Å; P97-A100 PolarHBondContact O-N 3.31Å
98R87.9Confident84.2Confident106 Ų10683.7 Ų83.740%0.446%0.456SS..G310 helixtrans-54-33.6-177.8-178.7170.3168.5179.8-6.8113.6A100 L101 W118 E122R98-A100 PolarHBondContact O-N 3.22Å; R98-L101 HydrophobicContact CB-CD1 4.36Å; R98-L101 HydrophobicContact CG-CD1 4.07Å; R98-L101 VanDerWaalsContact O-CG 3.29Å; R98-L101 WeakPolarHBondContact O-CG 3.4Å; R98-L101 PolarHBondContact O-N 3.32Å; R98-W118 HydrophobicContact CG-CE3 4.2Å; R98-W118 HydrophobicContact CG-CH2 4.43Å; R98-W118 HydrophobicContact CG-CZ3 4.06Å; R98-W118 VanDerWaalsContact CZ-CB 3.49Å; R98-E122 IonicContact CZ-OE1 3.71Å; R98-E122 IonicContact CZ-OE2 3.47Å; R98-E122 IonicContact NE-OE1 3.68Å; R98-E122 IonicContact NE-OE2 3.45Å; R98-E122 PolarHBondContact NE-OE2 3.08Å; R98-E122 IonicContact NH2-OE1 3.85Å; R98-E122 PolarHBondContact NH2-OE1 2.82Å; R98-E122 IonicContact NH2-OE2 2.83Å; R98-E122 PolarHBondContact NH2-OE2 2.9Å
99S83.8Confident84.1Confident119 Ų11981 Ų8183%0.83244%0.443SS*.G310 helixtrans-69.4-17177.554.80000114.7P97P97-S99 PolarHBondContact O-N 3.45Å; P97-S99 VanDerWaalsContact O-N 3.1Å
100A83.3Confident84.1Confident61 Ų6176.8 Ų76.850%0.50441%0.413SS..G310 helixtrans-107.917.1-178.900000112.7V96 P97 R98V96-A100 HydrophobicContact CG1-CB 4.05Å; P97-A100 HydrophobicContact CG-CB 3.88Å; P97-A100 PolarHBondContact O-N 3.31Å; R98-A100 PolarHBondContact O-N 3.22Å
101L80.3Confident84.2Confident45 Ų4569.9 Ų69.924%0.23639%0.389CS..  trans-73.2128.1-179.1-68.3176.6000111.7L70 V96 R98 W118L70-L101 HydrophobicContact CB-CD2 3.65Å; L70-L101 HydrophobicContact CD2-CD2 3.46Å; L70-L101 VanDerWaalsContact CD2-CD2 3.46Å; L70-L101 HydrophobicContact CG-CD2 4.2Å; V96-L101 HydrophobicContact CB-CD2 4.49Å; V96-L101 HydrophobicContact CG1-CD2 4.26Å; R98-L101 HydrophobicContact CB-CD1 4.36Å; R98-L101 HydrophobicContact CG-CD1 4.07Å; R98-L101 VanDerWaalsContact O-CG 3.29Å; R98-L101 WeakPolarHBondContact O-CG 3.4Å; R98-L101 PolarHBondContact O-N 3.32Å; L101-W118 HydrophobicContact CD1-CH2 4Å; L101-W118 HydrophobicContact CD1-CZ3 3.49Å; L101-W118 VanDerWaalsContact CD1-CZ3 3.49Å
102D76.6Confident84.4Confident93 Ų9369.1 Ų69.150%0.49738%0.384SS..  trans-109.7111.4172.7-177.910.8000110.8A104 S105D102-A104 PolarHBondContact O-N 3.39Å; D102-A104 WeakPolarHBondContact OD1-CB 3.47Å; D102-A104 PolarHBondContact OD1-N 3.11Å; D102-S105 PolarHBondContact O-N 2.97Å; D102-S105 PolarHBondContact O-OG 2.8Å
103R72.1Confident84.5Confident113 Ų11359.1 Ų59.143%0.42635%0.346SS..G310 helixtrans-64.4-26.8177.1-67.5-175.4-73-129.91112.8S105 E122R103-S105 PolarHBondContact O-N 3.15Å; R103-E122 WeakPolarHBondContact CD-O 3.22Å
104A62.2Low84.5Confident84 Ų8457.8 Ų57.869%0.69434%0.337SS*.G310 helixtrans-74.1-16.8-178.900000112.6D102D102-A104 PolarHBondContact O-N 3.39Å; D102-A104 WeakPolarHBondContact OD1-CB 3.47Å; D102-A104 PolarHBondContact OD1-N 3.11Å
105S65.4Low84.4Confident88 Ų8857.1 Ų57.162%0.61533%0.333SS*.G310 helixtrans-88.82.5-178.5730000114.7D102 R103 G107D102-S105 PolarHBondContact O-N 2.97Å; D102-S105 PolarHBondContact O-OG 2.8Å; R103-S105 PolarHBondContact O-N 3.15Å; S105-G107 PolarHBondContact O-N 2.85Å
106L77.5Confident84.2Confident21 Ų2159.1 Ų59.111%0.1134%0.338CS..  trans-63.4122.7177-79.3159.8000109.3L63 V110 L123 L124L63-L106 HydrophobicContact CD1-CD2 3.37Å; L106-V110 HydrophobicContact CD2-CG1 4.26Å; L106-V110 HydrophobicContact CD2-CG2 4.33Å; L106-L123 HydrophobicContact CD1-CD1 4.16Å; L106-L123 HydrophobicContact CD1-CG 4.35Å; L106-L123 WeakPolarHBondContact CD1-O 3.34Å; L106-L123 HydrophobicContact CD2-CD1 4.16Å; L106-L123 HydrophobicContact CD2-CG 4.4Å; L106-L123 HydrophobicContact CG-CD1 4.35Å; L106-L124 HydrophobicContact CD1-CD2 4.24Å
107G77.1Confident84.1Confident29 Ų2959.4 Ų59.430%0.29934%0.337SS..  trans-62.3170.3-179.900000112.4S105 T109 V110S105-G107 PolarHBondContact O-N 2.85Å; G107-T109 VanDerWaalsContact C-N 3.32Å; G107-T109 PolarHBondContact O-N 2.84Å; G107-V110 VanDerWaalsContact O-CG2 3.22Å; G107-V110 WeakPolarHBondContact O-CG2 3.37Å
108R84.9Confident84.1Confident167 Ų16757.2 Ų57.263%0.6332%0.32SS*.SBendtrans-66.1-35.1-179.1-159.3-17893.8166.17113.1A130 H131R108-A130 HydrophobicContact CG-CB 3.65Å; R108-A130 PolarHBondContact O-N 3.26Å; R108-A130 VanDerWaalsContact O-N 3.1Å; R108-H131 PolarHBondContact O-N 2.88Å
109T89.9Confident84.3Confident19 Ų1952.2 Ų52.212%0.11730%0.301CS..EExtended strand (participates in β ladder)trans-123.3115.5180-57.20000108.8E56 A60 T61 G107 H131E56-T109 HydrophobicContact CG-CG2 4.34Å; A60-T109 WeakPolarHBondContact CA-O 3.4Å; A60-T109 HydrophobicContact CB-CG2 3.8Å; T61-T109 PolarHBondContact N-O 2.97Å; G107-T109 VanDerWaalsContact C-N 3.32Å; G107-T109 PolarHBondContact O-N 2.84Å; T109-H131 WeakPolarHBondContact CA-O 3.5Å; T109-H131 HydrophobicContact CG2-CB 4.01Å
110V92Very high84.7Confident2 Ų246.6 Ų46.61%0.01226%0.262CS..EExtended strand (participates in β ladder)trans-131.7134.5-172.5-173.90000109.7T61 L63 L106 G107 V112 V129 H131 L132 R133T61-V110 WeakPolarHBondContact O-CA 3.28Å; L63-V110 HydrophobicContact CD1-CG1 3.5Å; L63-V110 HydrophobicContact CG-CG1 3.97Å; L106-V110 HydrophobicContact CD2-CG1 4.26Å; L106-V110 HydrophobicContact CD2-CG2 4.33Å; G107-V110 VanDerWaalsContact O-CG2 3.22Å; G107-V110 WeakPolarHBondContact O-CG2 3.37Å; V110-V112 HydrophobicContact CG1-CG2 3.6Å; V110-V129 HydrophobicContact CB-CG2 4.12Å; V110-V129 HydrophobicContact CG2-CG2 3.94Å; V110-H131 PolarHBondContact N-O 3.28Å; V110-L132 HydrophobicContact CB-CD1 4.35Å; V110-L132 WeakPolarHBondContact O-CA 3.44Å; V110-R133 PolarHBondContact O-N 2.91Å
111A94Very high84.9Confident12 Ų1247.9 Ų47.910%0.09926%0.258CS..EExtended strand (participates in β ladder)trans-107.3129165.300000108.4T61 L62 L63 R133T61-A111 PolarHBondContact O-N 2.83Å; L62-A111 CarbonylContact C-O 3.5Å; L62-A111 WeakPolarHBondContact CA-O 3.43Å; L62-A111 HydrophobicContact CD1-CB 4.18Å; L63-A111 PolarHBondContact N-O 3.05Å; A111-R133 CarbonylContact C-O 3.45Å; A111-R133 WeakPolarHBondContact CA-O 3.46Å; A111-R133 HydrophobicContact CB-CB 4.16Å
112V94.6Very high85.3Confident0 Ų049.7 Ų49.70%027%0.265CS..EExtended strand (participates in β ladder)trans-123.9123.1-178.7-174.30000109.3L63 V110 V114 V119 L124 L132 R133 L134 S135L63-V112 HydrophobicContact CB-CG2 4.28Å; L63-V112 HydrophobicContact CD1-CG2 4.4Å; L63-V112 CarbonylContact O-C 3.57Å; L63-V112 VanDerWaalsContact O-CA 3.32Å; L63-V112 WeakPolarHBondContact O-CA 3.46Å; V110-V112 HydrophobicContact CG1-CG2 3.6Å; V112-V114 HydrophobicContact CG1-CG2 4.18Å; V112-V119 HydrophobicContact CG1-CG1 3.42Å; V112-V119 VanDerWaalsContact CG1-CG1 3.42Å; V112-L124 HydrophobicContact CB-CD1 4.37Å; V112-L124 HydrophobicContact CG1-CD1 4.31Å; V112-L124 HydrophobicContact CG2-CD1 4.11Å; V112-L124 HydrophobicContact CG2-CD2 4.17Å; V112-L132 HydrophobicContact CG2-CD1 3.95Å; V112-R133 PolarHBondContact N-O 3.01Å; V112-L134 HydrophobicContact CB-CD2 3.9Å; V112-L134 HydrophobicContact CG2-CD2 4.43Å; V112-L134 WeakPolarHBondContact O-CA 3.3Å; V112-S135 PolarHBondContact O-N 3.46Å
113W95Very high85.9Confident9 Ų945.5 Ų45.53%0.03424%0.242CC..EExtended strand (participates in β ladder)trans-94.4124.3169.5-60.5-13000109.7L62 L63 F64 V79 P80 D81 D83 A87 S135L62-W113 HydrophobicContact CD1-CD2 3.76Å; L62-W113 HydrophobicContact CD1-CE3 4.4Å; L62-W113 HydrophobicContact CD1-CG 3.97Å; L62-W113 HydrophobicContact CD1-CZ2 4.02Å; L62-W113 HydrophobicContact CD2-CH2 3.88Å; L62-W113 HydrophobicContact CD2-CZ2 3.86Å; L62-W113 HydrophobicContact CD2-CZ3 4.22Å; L63-W113 PolarHBondContact O-N 2.77Å; F64-W113 HydrophobicContact CB-CB 3.83Å; F64-W113 HydrophobicContact CB-CE3 4.29Å; F64-W113 HydrophobicContact CD1-CE3 4.03Å; F64-W113 HydrophobicContact CD1-CZ3 4.4Å; F64-W113 HydrophobicContact CE1-CZ3 4.47Å; F64-W113 HydrophobicContact CG-CE3 4.17Å; V79-W113 HydrophobicContact CB-CH2 4.48Å; V79-W113 HydrophobicContact CB-CZ2 4.48Å; V79-W113 HydrophobicContact CG1-CH2 3.85Å; V79-W113 HydrophobicContact CG1-CZ2 4.27Å; P80-W113 WeakPolarHBondContact O-CH2 3.43Å; P80-W113 WeakPolarHBondContact O-CZ2 3.23Å; D81-W113 PolarHBondContact OD1-NE1 3.45Å; D83-W113 VanDerWaalsContact C-CZ3 3.48Å; D83-W113 WeakPolarHBondContact O-CH2 3.29Å; A87-W113 HydrophobicContact CB-CH2 4.09Å; A87-W113 HydrophobicContact CB-CZ3 4.16Å; W113-S135 CarbonylContact C-O 3.51Å; W113-S135 WeakPolarHBondContact CA-O 3.44Å
114V93.9Very high86.8Confident0 Ų040.1 Ų40.10%022%0.222CC..EExtended strand (participates in β ladder)trans-107.196.6-171.8-174.60000108.1V112 L120 S135 F136 C137 G138V112-V114 HydrophobicContact CG1-CG2 4.18Å; V114-L120 HydrophobicContact CG1-CD1 3.99Å; V114-L120 HydrophobicContact CG1-CD2 4.31Å; V114-L120 HydrophobicContact CG1-CG 3.88Å; V114-L120 HydrophobicContact CG2-CD2 3.66Å; V114-L120 HydrophobicContact CG2-CG 4.17Å; V114-S135 PolarHBondContact N-O 3.24Å; V114-F136 HydrophobicContact CB-CD2 4.26Å; V114-F136 HydrophobicContact CG1-CD2 4.27Å; V114-F136 WeakPolarHBondContact O-CD2 3.47Å; V114-C137 PolarHBondContact O-N 3.12Å; V114-G138 PolarHBondContact O-N 3.48Å
115S89.7Confident88.2Confident51 Ų5138.2 Ų38.236%0.35720%0.2SC..SBendtrans-90.3-34.8165.647.20000111.4
116E88.5Confident89.1Confident107 Ų10734.3 Ų34.350%0.517%0.173SC..SBendtrans-126.7141.7-175.2-69.5-72.9-175.700111.3W118 V119E116-W118 HydrophobicContact CB-CG 4.39Å; E116-W118 PolarHBondContact O-N 2.77Å; E116-V119 PolarHBondContact O-N 3.25Å
117L88.9Confident89.6Confident54 Ų5433.4 Ų33.428%0.28317%0.169SC..THydrogen-bonded Turntrans-63.2-27.6-175.5-85.4175.2000113.8V119 L120 E121 L142 I196L117-V119 PolarHBondContact O-N 2.79Å; L117-V119 VanDerWaalsContact O-N 3.15Å; L117-L120 HydrophobicContact CD2-CD1 4.29Å; L117-L120 WeakPolarHBondContact O-CB 3.5Å; L117-L120 PolarHBondContact O-N 2.8Å; L117-E121 PolarHBondContact O-N 2.86Å; L117-E121 VanDerWaalsContact O-N 3.11Å; L117-L142 HydrophobicContact CD2-CD1 4.36Å; L117-L142 HydrophobicContact CD2-CD2 3.67Å; L117-L142 HydrophobicContact CG-CD2 4.06Å; L117-I196 HydrophobicContact CD2-CD1 3.76Å
118W89.4Confident90.1Very high22 Ų2234.8 Ų34.88%0.08318%0.177CC..Hα-helixtrans-60-28.6-179.175.8-101.1000112.4D65 L70 R98 L101 E116 L120 E121 E122D65-W118 HydrophobicContact CB-CZ2 3.75Å; D65-W118 VanDerWaalsContact CG-CZ2 3.5Å; D65-W118 PolarHBondContact OD2-NE1 2.83Å; L70-W118 HydrophobicContact CB-CH2 4.2Å; L70-W118 HydrophobicContact CD1-CH2 3.99Å; R98-W118 HydrophobicContact CG-CE3 4.2Å; R98-W118 HydrophobicContact CG-CH2 4.43Å; R98-W118 HydrophobicContact CG-CZ3 4.06Å; R98-W118 VanDerWaalsContact CZ-CB 3.49Å; L101-W118 HydrophobicContact CD1-CH2 4Å; L101-W118 HydrophobicContact CD1-CZ3 3.49Å; L101-W118 VanDerWaalsContact CD1-CZ3 3.49Å; E116-W118 HydrophobicContact CB-CG 4.39Å; E116-W118 PolarHBondContact O-N 2.77Å; W118-L120 VanDerWaalsContact C-N 3.25Å; W118-L120 PolarHBondContact O-N 2.79Å; W118-E121 PolarHBondContact O-N 3.36Å; W118-E122 HydrophobicContact CE3-CB 4.45Å; W118-E122 WeakPolarHBondContact O-CB 3.16Å; W118-E122 PolarHBondContact O-N 2.98Å
119V91.4Very high90.2Very high0 Ų027 Ų270%015%0.148CC..Iπ-helixtrans-64.2-33.7177.1-177.30000110.8D65 V112 E116 L117 L123 L124D65-V119 HydrophobicContact CB-CG2 4.11Å; V112-V119 HydrophobicContact CG1-CG1 3.42Å; V112-V119 VanDerWaalsContact CG1-CG1 3.42Å; E116-V119 PolarHBondContact O-N 3.25Å; L117-V119 PolarHBondContact O-N 2.79Å; L117-V119 VanDerWaalsContact O-N 3.15Å; V119-L123 HydrophobicContact CG1-CD2 3.9Å; V119-L123 VanDerWaalsContact O-CB 3.3Å; V119-L123 WeakPolarHBondContact O-CB 3.41Å; V119-L124 PolarHBondContact O-N 2.8Å
120L91.9Very high90.2Very high2 Ų226.6 Ų26.61%0.0115%0.147CC..Iπ-helixtrans-76.6-47.6174-60.7-178.7000110.7V114 L117 W118 L124 N125 L134 L142 L147 I196 L199V114-L120 HydrophobicContact CG1-CD1 3.99Å; V114-L120 HydrophobicContact CG1-CD2 4.31Å; V114-L120 HydrophobicContact CG1-CG 3.88Å; V114-L120 HydrophobicContact CG2-CD2 3.66Å; V114-L120 HydrophobicContact CG2-CG 4.17Å; L117-L120 HydrophobicContact CD2-CD1 4.29Å; L117-L120 WeakPolarHBondContact O-CB 3.5Å; L117-L120 PolarHBondContact O-N 2.8Å; W118-L120 VanDerWaalsContact C-N 3.25Å; W118-L120 PolarHBondContact O-N 2.79Å; L120-L124 HydrophobicContact CD2-CD1 3.81Å; L120-L124 PolarHBondContact O-N 3.45Å; L120-N125 PolarHBondContact O-N 3.28Å; L120-L134 HydrophobicContact CD2-CD2 4.29Å; L120-L142 HydrophobicContact CD1-CD1 4.27Å; L120-L147 HydrophobicContact CD2-CD2 4.45Å; L120-L147 VanDerWaalsContact O-CD1 3.22Å; L120-L147 WeakPolarHBondContact O-CD1 3.3Å; L120-I196 HydrophobicContact CD1-CB 4Å; L120-I196 HydrophobicContact CD1-CD1 4.13Å; L120-I196 HydrophobicContact CD1-CG2 3.85Å; L120-L199 HydrophobicContact CD1-CD1 3.92Å
121E88.4Confident90.2Very high87 Ų8727.2 Ų27.241%0.40715%0.149SC..Iπ-helixtrans-74.5-37.4-169.7-66.1-179.4167.500113.9L117 W118 N125 R145L117-E121 PolarHBondContact O-N 2.86Å; L117-E121 VanDerWaalsContact O-N 3.11Å; W118-E121 PolarHBondContact O-N 3.36Å; E121-N125 WeakPolarHBondContact O-CB 3.44Å; E121-R145 IonicContact OE1-CZ 3.53Å; E121-R145 IonicContact OE1-NH1 2.64Å; E121-R145 PolarHBondContact OE1-NH1 3.42Å
122E87.9Confident90.2Very high83 Ų8326.8 Ų26.839%0.38815%0.145SC..Iπ-helixtrans-101.4-38.3-174.9-64.8-173.4-175.900113.5R98 R103 W118R98-E122 IonicContact CZ-OE1 3.71Å; R98-E122 IonicContact CZ-OE2 3.47Å; R98-E122 IonicContact NE-OE1 3.68Å; R98-E122 IonicContact NE-OE2 3.45Å; R98-E122 PolarHBondContact NE-OE2 3.08Å; R98-E122 IonicContact NH2-OE1 3.85Å; R98-E122 PolarHBondContact NH2-OE1 2.82Å; R98-E122 IonicContact NH2-OE2 2.83Å; R98-E122 PolarHBondContact NH2-OE2 2.9Å; R103-E122 WeakPolarHBondContact CD-O 3.22Å; W118-E122 HydrophobicContact CE3-CB 4.45Å; W118-E122 WeakPolarHBondContact O-CB 3.16Å; W118-E122 PolarHBondContact O-N 2.98Å
123L89.3Confident90.2Very high5 Ų527.8 Ų27.83%0.02615%0.149CC..Iπ-helixtrans-86.5-51.1-177171.574.5000111.4L63 L70 L106 V119L63-L123 HydrophobicContact CD1-CD2 4.03Å; L70-L123 HydrophobicContact CD1-CD2 3.93Å; L70-L123 HydrophobicContact CD2-CD1 3.87Å; L70-L123 HydrophobicContact CD2-CD2 3.75Å; L70-L123 HydrophobicContact CD2-CG 4.43Å; L106-L123 HydrophobicContact CD1-CD1 4.16Å; L106-L123 HydrophobicContact CD1-CG 4.35Å; L106-L123 WeakPolarHBondContact CD1-O 3.34Å; L106-L123 HydrophobicContact CD2-CD1 4.16Å; L106-L123 HydrophobicContact CD2-CG 4.4Å; L106-L123 HydrophobicContact CG-CD1 4.35Å; V119-L123 HydrophobicContact CG1-CD2 3.9Å; V119-L123 VanDerWaalsContact O-CB 3.3Å; V119-L123 WeakPolarHBondContact O-CB 3.41Å
124L91.1Very high90.2Very high0 Ų027.5 Ų27.50%015%0.148CC..Iπ-helixtrans-89-30.2-172.6-70.9179.9000114.1L106 V112 V119 L120 S126 S127 L132 L134 L147 L149L106-L124 HydrophobicContact CD1-CD2 4.24Å; V112-L124 HydrophobicContact CB-CD1 4.37Å; V112-L124 HydrophobicContact CG1-CD1 4.31Å; V112-L124 HydrophobicContact CG2-CD1 4.11Å; V112-L124 HydrophobicContact CG2-CD2 4.17Å; V119-L124 PolarHBondContact O-N 2.8Å; L120-L124 HydrophobicContact CD2-CD1 3.81Å; L120-L124 PolarHBondContact O-N 3.45Å; L124-S126 PolarHBondContact O-N 3.03Å; L124-S127 WeakPolarHBondContact CA-OG 3.43Å; L124-S127 WeakPolarHBondContact O-CB 3.15Å; L124-S127 PolarHBondContact O-N 2.73Å; L124-S127 PolarHBondContact O-OG 3.41Å; L124-L132 HydrophobicContact CD1-CD1 4.41Å; L124-L132 HydrophobicContact CD1-CD2 4.36Å; L124-L132 HydrophobicContact CD2-CD1 4.22Å; L124-L134 HydrophobicContact CD1-CD2 3.56Å; L124-L147 HydrophobicContact CB-CD1 3.98Å; L124-L147 HydrophobicContact CB-CD2 4.23Å; L124-L147 HydrophobicContact CD1-CD2 4.43Å; L124-L149 HydrophobicContact CB-CD2 4.28Å; L124-L149 WeakPolarHBondContact O-CD2 3.34Å
125N90.3Very high90.3Very high44 Ų4427.5 Ų27.524%0.23515%0.148CC..THydrogen-bonded Turntrans-63.6127.3-174.5-164.819000111.8L120 E121 S127 L147 V148L120-N125 PolarHBondContact O-N 3.28Å; E121-N125 WeakPolarHBondContact O-CB 3.44Å; N125-S127 PolarHBondContact O-N 2.85Å; N125-L147 HydrophobicContact CB-CD1 3.81Å; N125-V148 WeakPolarHBondContact OD1-CB 3.49Å; N125-V148 PolarHBondContact OD1-N 2.83Å; N125-V148 VanDerWaalsContact OD1-N 3.1Å
126S86.2Confident90.4Very high7 Ų725.3 Ų25.35%0.04913%0.132CC..THydrogen-bonded Turntrans60.318.8-173.2-49.50000114.7L124 V148 V226L124-S126 PolarHBondContact O-N 3.03Å; S126-V148 PolarHBondContact N-O 3.3Å; S126-V226 VanDerWaalsContact CB-O 3.29Å; S126-V226 WeakPolarHBondContact CB-O 3.46Å
127S87.2Confident90.5Very high2 Ų222 Ų221%0.01412%0.121CC..EExtended strand (participates in β ladder)trans-81.8158.6173.371.20000112.4L124 N125 L150L124-S127 WeakPolarHBondContact CA-OG 3.43Å; L124-S127 WeakPolarHBondContact O-CB 3.15Å; L124-S127 PolarHBondContact O-N 2.73Å; L124-S127 PolarHBondContact O-OG 3.41Å; N125-S127 PolarHBondContact O-N 2.85Å; S127-L150 PolarHBondContact O-N 3.31Å
128A86.9Confident90.3Very high57 Ų5720.3 Ų20.347%0.47112%0.116SC..EExtended strand (participates in β ladder)trans-98.6116.4173.400000110.2L150A128-L150 WeakPolarHBondContact CA-O 3.3Å; A128-L150 HydrophobicContact CB-CB 4.34Å
129V87.8Confident89.8Confident3 Ų326.3 Ų26.32%0.01816%0.155CC..  trans-148.3131.9178.260.80000109.3V110 L132 L149 L150 G151 L152V110-V129 HydrophobicContact CB-CG2 4.12Å; V110-V129 HydrophobicContact CG2-CG2 3.94Å; V129-L132 HydrophobicContact CG1-CB 4.17Å; V129-L132 HydrophobicContact CG1-CD2 4.26Å; V129-L132 HydrophobicContact CG2-CB 4.19Å; V129-L132 HydrophobicContact CG2-CD1 4.43Å; V129-L149 HydrophobicContact CG1-CD2 3.99Å; V129-L150 PolarHBondContact N-O 3.3Å; V129-G151 CarbonylContact O-C 3.51Å; V129-L152 HydrophobicContact CG1-CD1 4.35Å; V129-L152 WeakPolarHBondContact O-CA 3.48Å; V129-L152 PolarHBondContact O-N 3.36Å
130A89.1Confident89.6Confident11 Ų1133.5 Ų33.59%0.09119%0.189CC..SBendtrans-89.6-39.4-177.400000112.4R108 G151 R153 T154R108-A130 HydrophobicContact CG-CB 3.65Å; R108-A130 PolarHBondContact O-N 3.26Å; R108-A130 VanDerWaalsContact O-N 3.1Å; A130-G151 WeakPolarHBondContact CA-O 3.02Å; A130-R153 HydrophobicContact CB-CG 4.36Å; A130-R153 WeakPolarHBondContact O-CA 3.39Å; A130-R153 WeakPolarHBondContact O-CB 3.44Å; A130-R153 PolarHBondContact O-N 2.78Å; A130-T154 PolarHBondContact O-N 2.88Å; A130-T154 VanDerWaalsContact O-N 3.12Å
131H91.8Very high89.4Confident16 Ų1638.3 Ų38.37%0.07422%0.22CC..EExtended strand (participates in β ladder)trans-128.5113.4-179.9-53.4-78.7000108.2E56 R108 T109 V110 T154E56-H131 IonicContact OE1-CD2 3.37Å; E56-H131 IonicContact OE1-CE1 3.27Å; E56-H131 IonicContact OE1-CG 3.42Å; E56-H131 IonicContact OE1-ND1 2.72Å; E56-H131 IonicContact OE1-NE2 2.73Å; R108-H131 PolarHBondContact O-N 2.88Å; T109-H131 WeakPolarHBondContact CA-O 3.5Å; T109-H131 HydrophobicContact CG2-CB 4.01Å; V110-H131 PolarHBondContact N-O 3.28Å; H131-T154 PolarHBondContact ND1-OG1 2.86Å
132L94.3Very high89.4Confident2 Ų235.1 Ų35.11%0.0121%0.205CC..EExtended strand (participates in β ladder)trans-119.9126.2-175.5-177.863.2000109.8V110 V112 L124 V129 L134 L149 L152 T154 L155 S156V110-L132 HydrophobicContact CB-CD1 4.35Å; V110-L132 WeakPolarHBondContact O-CA 3.44Å; V112-L132 HydrophobicContact CG2-CD1 3.95Å; L124-L132 HydrophobicContact CD1-CD1 4.41Å; L124-L132 HydrophobicContact CD1-CD2 4.36Å; L124-L132 HydrophobicContact CD2-CD1 4.22Å; V129-L132 HydrophobicContact CG1-CB 4.17Å; V129-L132 HydrophobicContact CG1-CD2 4.26Å; V129-L132 HydrophobicContact CG2-CB 4.19Å; V129-L132 HydrophobicContact CG2-CD1 4.43Å; L132-L134 HydrophobicContact CD1-CD2 3.89Å; L132-L134 HydrophobicContact CD1-CG 4.47Å; L132-L134 HydrophobicContact CD2-CD1 4.14Å; L132-L134 HydrophobicContact CD2-CD2 3.87Å; L132-L134 HydrophobicContact CD2-CG 3.92Å; L132-L134 HydrophobicContact CG-CD2 3.88Å; L132-L134 HydrophobicContact CG-CG 3.94Å; L132-L149 HydrophobicContact CD2-CD1 3.45Å; L132-L149 VanDerWaalsContact CD2-CD1 3.45Å; L132-L149 HydrophobicContact CD2-CD2 4.29Å; L132-L152 HydrophobicContact CB-CD1 3.72Å; L132-T154 PolarHBondContact N-O 2.73Å; L132-L155 HydrophobicContact CB-CD1 4.19Å; L132-L155 HydrophobicContact CD2-CD1 4.01Å; L132-L155 HydrophobicContact CG-CD1 4.15Å; L132-L155 WeakPolarHBondContact O-CA 3.22Å; L132-S156 PolarHBondContact O-N 2.91Å
133R94.8Very high89.5Confident22 Ų2237.9 Ų37.98%0.08322%0.218CC..EExtended strand (participates in β ladder)trans-106.5123.2163.9-177.7177.3-177.4139.81.2108.8L52 D81 V110 A111 V112 S156L52-R133 HydrophobicContact CD1-CB 3.98Å; L52-R133 HydrophobicContact CD1-CG 4.27Å; D81-R133 IonicContact OD1-NE 2.69Å; D81-R133 IonicContact OD2-CZ 3.94Å; D81-R133 IonicContact OD2-NE 3.16Å; D81-R133 PolarHBondContact OD2-NE 2.92Å; D81-R133 IonicContact OD2-NH2 3.67Å; D81-R133 PolarHBondContact OD2-NH2 3.46Å; V110-R133 PolarHBondContact O-N 2.91Å; A111-R133 CarbonylContact C-O 3.45Å; A111-R133 WeakPolarHBondContact CA-O 3.46Å; A111-R133 HydrophobicContact CB-CB 4.16Å; V112-R133 PolarHBondContact N-O 3.01Å; R133-S156 CarbonylContact C-O 3.58Å; R133-S156 VanDerWaalsContact CA-O 3.27Å; R133-S156 WeakPolarHBondContact CA-O 3.34Å
134L95.4Very high89.4Confident2 Ų241.7 Ų41.71%0.0125%0.245CC..EExtended strand (participates in β ladder)trans-109.6124.1173.3-63.6-179.9000109.3V112 L120 L124 L132 L155 S156 V157 H158 L199V112-L134 HydrophobicContact CB-CD2 3.9Å; V112-L134 HydrophobicContact CG2-CD2 4.43Å; V112-L134 WeakPolarHBondContact O-CA 3.3Å; L120-L134 HydrophobicContact CD2-CD2 4.29Å; L124-L134 HydrophobicContact CD1-CD2 3.56Å; L132-L134 HydrophobicContact CD1-CD2 3.89Å; L132-L134 HydrophobicContact CD1-CG 4.47Å; L132-L134 HydrophobicContact CD2-CD1 4.14Å; L132-L134 HydrophobicContact CD2-CD2 3.87Å; L132-L134 HydrophobicContact CD2-CG 3.92Å; L132-L134 HydrophobicContact CG-CD2 3.88Å; L132-L134 HydrophobicContact CG-CG 3.94Å; L134-L155 HydrophobicContact CD1-CD1 4.15Å; L134-L155 HydrophobicContact CG-CD1 4.25Å; L134-S156 PolarHBondContact N-O 2.79Å; L134-V157 HydrophobicContact CB-CG1 4.48Å; L134-V157 CarbonylContact O-C 3.57Å; L134-V157 VanDerWaalsContact O-CA 3.3Å; L134-V157 WeakPolarHBondContact O-CA 3.46Å; L134-H158 PolarHBondContact O-N 3.11Å; L134-L199 HydrophobicContact CB-CD2 3.55Å; L134-L199 HydrophobicContact CD1-CD1 4.46Å; L134-L199 HydrophobicContact CD1-CD2 4.21Å
135S95.1Very high89.3Confident0 Ų047 Ų470%027%0.265CS..EExtended strand (participates in β ladder)trans-117.6119.3175.2-47.20000109.1D81 V112 W113 V114 H158D81-S135 WeakPolarHBondContact OD1-CB 3.41Å; D81-S135 PolarHBondContact OD1-OG 3.11Å; D81-S135 PolarHBondContact OD2-OG 3.17Å; V112-S135 PolarHBondContact O-N 3.46Å; W113-S135 CarbonylContact C-O 3.51Å; W113-S135 WeakPolarHBondContact CA-O 3.44Å; V114-S135 PolarHBondContact N-O 3.24Å; S135-H158 CarbonylContact C-O 3.54Å; S135-H158 VanDerWaalsContact CA-O 3.32Å; S135-H158 WeakPolarHBondContact CA-O 3.1Å
136F93.6Very high89.3Confident5 Ų549.8 Ų49.82%0.02228%0.277CS..EExtended strand (participates in β ladder)trans-86.5118.8179.5-175.9-118.9000111.1V114 G138 E140 L142 H158 A160 L199V114-F136 HydrophobicContact CB-CD2 4.26Å; V114-F136 HydrophobicContact CG1-CD2 4.27Å; V114-F136 WeakPolarHBondContact O-CD2 3.47Å; F136-G138 WeakPolarHBondContact CE1-O 3.4Å; F136-G138 VanDerWaalsContact CZ-CA 3.45Å; F136-E140 WeakPolarHBondContact CE1-O 3.23Å; F136-E140 WeakPolarHBondContact CZ-O 3.35Å; F136-L142 HydrophobicContact CD2-CD1 3.79Å; F136-L142 HydrophobicContact CD2-CD2 4.39Å; F136-L142 HydrophobicContact CD2-CG 4.05Å; F136-L142 HydrophobicContact CE1-CG 4.4Å; F136-L142 HydrophobicContact CE2-CD1 3.78Å; F136-L142 HydrophobicContact CE2-CD2 3.53Å; F136-L142 HydrophobicContact CE2-CG 3.58Å; F136-L142 HydrophobicContact CG-CD1 4.48Å; F136-L142 HydrophobicContact CZ-CD1 4.42Å; F136-L142 HydrophobicContact CZ-CD2 3.78Å; F136-L142 HydrophobicContact CZ-CG 3.78Å; F136-H158 PolarHBondContact N-O 2.99Å; F136-A160 VanDerWaalsContact O-CB 3.3Å; F136-A160 WeakPolarHBondContact O-CB 3.27Å; F136-A160 PolarHBondContact O-N 3.17Å; F136-L199 HydrophobicContact CB-CB 3.95Å; F136-L199 HydrophobicContact CG-CB 4.32Å
137C90.4Very high89.6Confident38 Ų3849.6 Ų49.626%0.25728%0.276SS..  trans-114.14.6-174.8-540000112.7C82 V114C82-C137 WeakPolarHBondContact CA-SG 3.26Å; C82-C137 HydrophobicContact CB-CB 3.65Å; C82-C137 WeakPolarHBondContact CB-SG 3.39Å; C82-C137 WeakPolarHBondContact SG-CA 3.47Å; C82-C137 WeakPolarHBondContact SG-CB 3.29Å; C82-C137 CovalentContact SG-SG 2.03Å; C82-C137 PolarHBondContact SG-SG 2.78Å; V114-C137 PolarHBondContact O-N 3.12Å
138G83.5Confident89.8Confident19 Ų1949.7 Ų49.720%0.19628%0.276CS..  trans-78.7164.1175.600000112.5V114 F136V114-G138 PolarHBondContact O-N 3.48Å; F136-G138 WeakPolarHBondContact CE1-O 3.4Å; F136-G138 VanDerWaalsContact CZ-CA 3.45Å
139V80.5Confident90Very high147 Ų14747 Ų4789%0.89125%0.254SS*.SBendtrans-95.8-26.6179.1-65.40000113
140E86.5Confident90Very high152 Ų15247.7 Ų47.771%0.7126%0.257SS*.SBendtrans-95.6140.1179.9-67.8-172.4171.700110.9F136 L142F136-E140 WeakPolarHBondContact CE1-O 3.23Å; F136-E140 WeakPolarHBondContact CZ-O 3.35Å; E140-L142 PolarHBondContact O-N 2.85Å
141P86.4Confident89.9Confident102 Ų10248.8 Ų48.866%0.66227%0.269SS*.PPolyproline II helixtrans-64.1137.7177.527.4-33.8000110.9N200P141-N200 VanDerWaalsContact CA-OD1 3.26Å; P141-N200 WeakPolarHBondContact CA-OD1 3.3Å
142L88.9Confident89.9Confident20 Ų2048 Ų4811%0.10527%0.266CS..PPolyproline II helixtrans-72.5134.6175.2-61.5-173.6000110.5L117 L120 F136 E140 L199 N200L117-L142 HydrophobicContact CD2-CD1 4.36Å; L117-L142 HydrophobicContact CD2-CD2 3.67Å; L117-L142 HydrophobicContact CG-CD2 4.06Å; L120-L142 HydrophobicContact CD1-CD1 4.27Å; F136-L142 HydrophobicContact CD2-CD1 3.79Å; F136-L142 HydrophobicContact CD2-CD2 4.39Å; F136-L142 HydrophobicContact CD2-CG 4.05Å; F136-L142 HydrophobicContact CE1-CG 4.4Å; F136-L142 HydrophobicContact CE2-CD1 3.78Å; F136-L142 HydrophobicContact CE2-CD2 3.53Å; F136-L142 HydrophobicContact CE2-CG 3.58Å; F136-L142 HydrophobicContact CG-CD1 4.48Å; F136-L142 HydrophobicContact CZ-CD1 4.42Å; F136-L142 HydrophobicContact CZ-CD2 3.78Å; F136-L142 HydrophobicContact CZ-CG 3.78Å; E140-L142 PolarHBondContact O-N 2.85Å; L142-L199 HydrophobicContact CD1-CB 4.01Å; L142-L199 HydrophobicContact CD1-CD1 3.73Å; L142-L199 HydrophobicContact CD1-CG 4.48Å; L142-N200 PolarHBondContact N-OD1 2.85Å; L142-N200 PolarHBondContact O-ND2 3.21Å
143Q89.4Confident89.7Confident141 Ų14154.3 Ų54.366%0.65929%0.289SS*.PPolyproline II helixtrans-70.9143.4167.5-66.6-174.6-17.500109.9R145 I196Q143-R145 PolarHBondContact O-N 2.81Å; Q143-I196 WeakPolarHBondContact O-CG1 3.38Å
144S88.4Confident89.6Confident85 Ų8553.9 Ų53.959%0.59429%0.289SS*.PPolyproline II helixtrans-58.2123.1175171.20000110.1D195S144-D195 VanDerWaalsContact CA-OD1 3.3Å; S144-D195 WeakPolarHBondContact CA-OD1 3.43Å; S144-D195 WeakPolarHBondContact CB-OD1 3.34Å; S144-D195 PolarHBondContact OG-OD1 3.18Å; S144-D195 PolarHBondContact OG-OD2 2.86Å
145R89.5Confident89.6Confident112 Ų11253.8 Ų53.842%0.42329%0.289SS..  trans-150.9152.7177.5-61.2-176.1178.2-174.90.3108.6E121 Q143 D195 I196E121-R145 IonicContact OE1-CZ 3.53Å; E121-R145 IonicContact OE1-NH1 2.64Å; E121-R145 PolarHBondContact OE1-NH1 3.42Å; Q143-R145 PolarHBondContact O-N 2.81Å; R145-D195 PolarHBondContact N-OD1 2.99Å; R145-D195 WeakPolarHBondContact O-CA 3.47Å; R145-I196 HydrophobicContact CB-CD1 3.72Å; R145-I196 HydrophobicContact CB-CG1 3.9Å; R145-I196 HydrophobicContact CG-CD1 4.2Å; R145-I196 WeakPolarHBondContact O-CG1 3.37Å; R145-I196 PolarHBondContact O-N 2.85Å
146Q90.1Very high89.6Confident102 Ų10254.2 Ų54.248%0.47729%0.292SS..EExtended strand (participates in β ladder)trans-91.3122.4-177-15881.17500111.2F193 V194Q146-F193 HydrophobicContact CG-CB 4.02Å; Q146-F193 HydrophobicContact CG-CD1 3.68Å; Q146-F193 HydrophobicContact CG-CG 4.34Å; Q146-F193 PolarHBondContact NE2-O 2.76Å; Q146-V194 PolarHBondContact NE2-O 3.07Å
147L92.4Very high89.7Confident4 Ų454.3 Ų54.32%0.02129%0.292CS..EExtended strand (participates in β ladder)trans-98.2132.8166.617869.2000109.3L120 L124 N125 L149 V194 I196L120-L147 HydrophobicContact CD2-CD2 4.45Å; L120-L147 VanDerWaalsContact O-CD1 3.22Å; L120-L147 WeakPolarHBondContact O-CD1 3.3Å; L124-L147 HydrophobicContact CB-CD1 3.98Å; L124-L147 HydrophobicContact CB-CD2 4.23Å; L124-L147 HydrophobicContact CD1-CD2 4.43Å; N125-L147 HydrophobicContact CB-CD1 3.81Å; L147-L149 HydrophobicContact CD2-CD1 4.12Å; L147-L149 HydrophobicContact CD2-CD2 4.2Å; L147-L149 HydrophobicContact CD2-CG 4.17Å; L147-L149 HydrophobicContact CG-CD2 4.34Å; L147-L149 HydrophobicContact CG-CG 4.2Å; L147-V194 HydrophobicContact CB-CB 4.38Å; L147-V194 PolarHBondContact N-O 2.94Å; L147-V194 PolarHBondContact O-N 3.16Å; L147-I196 HydrophobicContact CB-CG2 3.73Å
148V91.4Very high89.8Confident4 Ų453.8 Ų53.82%0.02429%0.286CS..EExtended strand (participates in β ladder)trans-102.4131.2175.8178.60000110.1N125 S126 M191 S192 F193 L225N125-V148 WeakPolarHBondContact OD1-CB 3.49Å; N125-V148 PolarHBondContact OD1-N 2.83Å; N125-V148 VanDerWaalsContact OD1-N 3.1Å; S126-V148 PolarHBondContact N-O 3.3Å; V148-M191 HydrophobicContact CG1-CE 3.43Å; V148-M191 VanDerWaalsContact CG1-CE 3.43Å; V148-M191 HydrophobicContact CG1-CG 4.25Å; V148-M191 HydrophobicContact CG2-CE 4.36Å; V148-S192 CarbonylContact C-O 3.53Å; V148-S192 WeakPolarHBondContact CA-O 3.34Å; V148-F193 HydrophobicContact CG2-CD1 3.7Å; V148-F193 HydrophobicContact CG2-CE1 3.72Å; V148-L225 HydrophobicContact CB-CD2 4.04Å; V148-L225 HydrophobicContact CG1-CD1 4.32Å; V148-L225 HydrophobicContact CG1-CD2 4.41Å; V148-L225 HydrophobicContact CG2-CD1 3.96Å; V148-L225 HydrophobicContact CG2-CD2 3.57Å; V148-L225 HydrophobicContact CG2-CG 4.45Å
149L91.2Very high90.2Very high0 Ų053.2 Ų53.20%028%0.279CS..EExtended strand (participates in β ladder)trans-130.4145.7177.9-63.4170.5000110.3L124 V129 L132 L147 L152 S192 V194L124-L149 HydrophobicContact CB-CD2 4.28Å; L124-L149 WeakPolarHBondContact O-CD2 3.34Å; V129-L149 HydrophobicContact CG1-CD2 3.99Å; L132-L149 HydrophobicContact CD2-CD1 3.45Å; L132-L149 VanDerWaalsContact CD2-CD1 3.45Å; L132-L149 HydrophobicContact CD2-CD2 4.29Å; L147-L149 HydrophobicContact CD2-CD1 4.12Å; L147-L149 HydrophobicContact CD2-CD2 4.2Å; L147-L149 HydrophobicContact CD2-CG 4.17Å; L147-L149 HydrophobicContact CG-CD2 4.34Å; L147-L149 HydrophobicContact CG-CG 4.2Å; L149-L152 HydrophobicContact CB-CB 4.34Å; L149-L152 HydrophobicContact CB-CD2 4.45Å; L149-L152 HydrophobicContact CD1-CD1 4.28Å; L149-L152 HydrophobicContact CD1-CD2 3.83Å; L149-S192 PolarHBondContact N-O 2.82Å; L149-S192 PolarHBondContact O-N 2.8Å; L149-V194 HydrophobicContact CD1-CG2 3.96Å
150L87.7Confident90.4Very high18 Ų1848.6 Ų48.69%0.09426%0.256CS..EExtended strand (participates in β ladder)trans-110.7137.4178.4-56.4173.2000110.2S127 A128 V129 L152 H190 M191 L215 F227 P228S127-L150 PolarHBondContact O-N 3.31Å; A128-L150 WeakPolarHBondContact CA-O 3.3Å; A128-L150 HydrophobicContact CB-CB 4.34Å; V129-L150 PolarHBondContact N-O 3.3Å; L150-L152 VanDerWaalsContact C-N 3.26Å; L150-L152 PolarHBondContact O-N 3.4Å; L150-H190 WeakPolarHBondContact CA-O 3.22Å; L150-M191 HydrophobicContact CD2-CB 4.4Å; L150-M191 HydrophobicContact CD2-CG 4.22Å; L150-L215 HydrophobicContact CD2-CD1 4.37Å; L150-F227 HydrophobicContact CD1-CD1 4.14Å; L150-F227 HydrophobicContact CD2-CD1 3.99Å; L150-F227 HydrophobicContact CD2-CE1 4.06Å; L150-P228 HydrophobicContact CD1-CG 4.17Å
151G86.9Confident90.1Very high33 Ų3342.6 Ų42.634%0.3423%0.233SC..SBendtrans72.810.917500000115.7V129 A130 R153 H190V129-G151 CarbonylContact O-C 3.51Å; A130-G151 WeakPolarHBondContact CA-O 3.02Å; G151-R153 PolarHBondContact O-N 2.98Å; G151-H190 PolarHBondContact N-O 3.1Å
152L91.1Very high89.9Confident0 Ų044.1 Ų44.10%024%0.243CC..  trans-65.9116.8-174.6-17572.1000112.4V129 L132 L149 L150 T154 L155 V173 H190 V194V129-L152 HydrophobicContact CG1-CD1 4.35Å; V129-L152 WeakPolarHBondContact O-CA 3.48Å; V129-L152 PolarHBondContact O-N 3.36Å; L132-L152 HydrophobicContact CB-CD1 3.72Å; L149-L152 HydrophobicContact CB-CB 4.34Å; L149-L152 HydrophobicContact CB-CD2 4.45Å; L149-L152 HydrophobicContact CD1-CD1 4.28Å; L149-L152 HydrophobicContact CD1-CD2 3.83Å; L150-L152 VanDerWaalsContact C-N 3.26Å; L150-L152 PolarHBondContact O-N 3.4Å; L152-T154 WeakPolarHBondContact CD1-O 3.48Å; L152-L155 HydrophobicContact CD2-CB 4.19Å; L152-V173 HydrophobicContact CD2-CG2 4.16Å; L152-V173 HydrophobicContact CG-CG2 4.17Å; L152-V173 WeakPolarHBondContact O-CB 3.35Å; L152-H190 PolarHBondContact O-CE1 2.87Å; L152-H190 PolarHBondContact O-ND1 2.87Å; L152-V194 HydrophobicContact CD2-CG2 4.24Å
153R90.6Very high89.6Confident135 Ų13546.8 Ų46.851%0.50928%0.276SS..  trans-100.7-39178.2-57.8-177.8178.6-162.3-4.8112.5A130 G151 R172 V173A130-R153 HydrophobicContact CB-CG 4.36Å; A130-R153 WeakPolarHBondContact O-CA 3.39Å; A130-R153 WeakPolarHBondContact O-CB 3.44Å; A130-R153 PolarHBondContact O-N 2.78Å; G151-R153 PolarHBondContact O-N 2.98Å; R153-R172 WeakPolarHBondContact O-CA 3.39Å; R153-V173 PolarHBondContact O-N 2.75Å
154T92.8Very high89.4Confident13 Ų1340.9 Ų40.98%0.0825%0.251CS..EExtended strand (participates in β ladder)trans-133.5131.8179.6-490000109.6A130 H131 L132 L152 E170A130-T154 PolarHBondContact O-N 2.88Å; A130-T154 VanDerWaalsContact O-N 3.12Å; H131-T154 PolarHBondContact ND1-OG1 2.86Å; L132-T154 PolarHBondContact N-O 2.73Å; L152-T154 WeakPolarHBondContact CD1-O 3.48Å; T154-E170 HydrophobicContact CG2-CG 3.74Å
155L95.1Very high89.6Confident0 Ų040.5 Ų40.50%025%0.246CC..EExtended strand (participates in β ladder)trans-119119.7168.4179.967.8000109.1L132 L134 L152 V157 E170 I171 V194 I198 V247L132-L155 HydrophobicContact CB-CD1 4.19Å; L132-L155 HydrophobicContact CD2-CD1 4.01Å; L132-L155 HydrophobicContact CG-CD1 4.15Å; L132-L155 WeakPolarHBondContact O-CA 3.22Å; L134-L155 HydrophobicContact CD1-CD1 4.15Å; L134-L155 HydrophobicContact CG-CD1 4.25Å; L152-L155 HydrophobicContact CD2-CB 4.19Å; L155-V157 HydrophobicContact CD1-CG1 4.36Å; L155-V157 HydrophobicContact CD2-CG1 4.23Å; L155-V157 HydrophobicContact CG-CG1 4.07Å; L155-E170 CarbonylContact O-C 3.57Å; L155-E170 WeakPolarHBondContact O-CA 3.32Å; L155-I171 HydrophobicContact CB-CG2 4.13Å; L155-I171 PolarHBondContact N-O 3.31Å; L155-I171 PolarHBondContact O-N 2.97Å; L155-V194 HydrophobicContact CD2-CG1 3.83Å; L155-V194 HydrophobicContact CD2-CG2 4.3Å; L155-I198 HydrophobicContact CD2-CD1 3.92Å; L155-V247 HydrophobicContact CD2-CG1 3.87Å
156S95Very high89.7Confident9 Ų940.4 Ų40.46%0.06325%0.247CC..EExtended strand (participates in β ladder)trans-109135.7169.3-39.10000108.2L132 R133 L134 Q169 E170L132-S156 PolarHBondContact O-N 2.91Å; R133-S156 CarbonylContact C-O 3.58Å; R133-S156 VanDerWaalsContact CA-O 3.27Å; R133-S156 WeakPolarHBondContact CA-O 3.34Å; L134-S156 PolarHBondContact N-O 2.79Å; S156-Q169 CarbonylContact C-O 3.51Å; S156-Q169 WeakPolarHBondContact CA-O 3.37Å; S156-E170 PolarHBondContact OG-OE2 3.23Å
157V95Very high89.7Confident6 Ų638 Ų384%0.03624%0.24CC..EExtended strand (participates in β ladder)trans-123.6135.2177.9-62.20000110.2L134 L155 N168 Q169 I198 L199 L205L134-V157 HydrophobicContact CB-CG1 4.48Å; L134-V157 CarbonylContact O-C 3.57Å; L134-V157 VanDerWaalsContact O-CA 3.3Å; L134-V157 WeakPolarHBondContact O-CA 3.46Å; L155-V157 HydrophobicContact CD1-CG1 4.36Å; L155-V157 HydrophobicContact CD2-CG1 4.23Å; L155-V157 HydrophobicContact CG-CG1 4.07Å; V157-N168 WeakPolarHBondContact O-CA 3.01Å; V157-Q169 HydrophobicContact CG2-CB 3.72Å; V157-Q169 HydrophobicContact CG2-CG 4.3Å; V157-Q169 PolarHBondContact N-O 3.12Å; V157-Q169 PolarHBondContact O-N 3.43Å; V157-I198 HydrophobicContact CG1-CD1 3.85Å; V157-I198 HydrophobicContact CG1-CG1 4.17Å; V157-L199 HydrophobicContact CB-CD2 4.24Å; V157-L199 HydrophobicContact CG1-CD2 4.08Å; V157-L205 HydrophobicContact CG2-CD2 4.19Å
158H94.3Very high89.7Confident28 Ų2839.9 Ų39.913%0.1325%0.25CS..EExtended strand (participates in β ladder)trans-120.2128.1171.2-18069.2000109.5D81 L134 S135 F136 P167 N168D81-H158 IonicContact OD2-CD2 3.53Å; D81-H158 IonicContact OD2-CG 3.45Å; L134-H158 PolarHBondContact O-N 3.11Å; S135-H158 CarbonylContact C-O 3.54Å; S135-H158 VanDerWaalsContact CA-O 3.32Å; S135-H158 WeakPolarHBondContact CA-O 3.1Å; F136-H158 PolarHBondContact N-O 2.99Å; H158-P167 CarbonylContact C-O 3.52Å; H158-P167 WeakPolarHBondContact CA-O 3.39Å; H158-P167 PolarHBondContact ND1-O 3.44Å; H158-N168 PolarHBondContact ND1-OD1 2.86Å
159S90.4Very high89.9Confident6 Ų641 Ų414%0.04226%0.255CS..EExtended strand (participates in β ladder)trans-109.9119.8171.4179.30000109.2A161 P167 L199 N200S159-A161 VanDerWaalsContact C-N 3.26Å; S159-A161 WeakPolarHBondContact OG-CB 3.27Å; S159-A161 PolarHBondContact OG-N 2.8Å; S159-P167 PolarHBondContact N-O 2.85Å; S159-L199 WeakPolarHBondContact CB-O 3.03Å; S159-L199 PolarHBondContact OG-O 3.47Å; S159-L199 VanDerWaalsContact OG-O 3.12Å; S159-N200 PolarHBondContact OG-O 2.75Å
160A85.1Confident90Very high50 Ų5044.8 Ų44.841%0.41327%0.273SS..  trans-86.63.416900000112.4F136F136-A160 VanDerWaalsContact O-CB 3.3Å; F136-A160 WeakPolarHBondContact O-CB 3.27Å; F136-A160 PolarHBondContact O-N 3.17Å
161A81.2Confident90.3Very high27 Ų2745.6 Ų45.622%0.22328%0.277CS..SBendtrans-65.3130-177.300000111S159 G163 A164S159-A161 VanDerWaalsContact C-N 3.26Å; S159-A161 WeakPolarHBondContact OG-CB 3.27Å; S159-A161 PolarHBondContact OG-N 2.8Å; A161-G163 PolarHBondContact O-N 2.78Å; A161-A164 WeakPolarHBondContact O-CB 3.4Å; A161-A164 PolarHBondContact O-N 2.84Å
162P80.8Confident90.5Very high133 Ų13352.7 Ų52.786%0.86429%0.293SS*.THydrogen-bonded Turntrans-57.4128.8178.4-25.434.1000112
163G82.4Confident90Very high77 Ų7753 Ų5379%0.79430%0.295SS*.THydrogen-bonded Turntrans80.110.6177.800000115.2A161 P165A161-G163 PolarHBondContact O-N 2.78Å; G163-P165 WeakPolarHBondContact O-CD 3.39Å
164A86.6Confident89.1Confident17 Ų1749.2 Ų49.214%0.1429%0.29CS..  trans-61115.817200000110.8A161 Y166A161-A164 WeakPolarHBondContact O-CB 3.4Å; A161-A164 PolarHBondContact O-N 2.84Å; A164-Y166 PolarHBondContact O-N 2.86Å
165P91Very high87.4Confident77 Ų7753.2 Ų53.250%0.532%0.315SS..SBendtrans-66.5-24.517924.3-34000113.1G163 P167 G201G163-P165 WeakPolarHBondContact O-CD 3.39Å; P165-P167 WeakPolarHBondContact O-CD 3.42Å; P165-G201 WeakPolarHBondContact CD-O 3.49Å; P165-G201 WeakPolarHBondContact CG-O 3.3Å
166Y91.9Very high84.9Confident109 Ų10958.2 Ų58.243%0.42735%0.35SS..  trans-126.674.2-179.5-54.2-78.8000111A164 N168 Q169 G201 S203 A204A164-Y166 PolarHBondContact O-N 2.86Å; Y166-N168 PolarHBondContact O-N 2.96Å; Y166-Q169 VanDerWaalsContact CB-NE2 3.26Å; Y166-Q169 PolarHBondContact O-NE2 2.81Å; Y166-G201 PolarHBondContact N-O 3.28Å; Y166-G201 VanDerWaalsContact N-O 3.11Å; Y166-S203 VanDerWaalsContact CD2-C 3.44Å; Y166-A204 HydrophobicContact CD1-CB 4.45Å; Y166-A204 HydrophobicContact CE1-CB 4.22Å; Y166-A204 HydrophobicContact CE2-CB 4.33Å
167P89.9Confident82.4Confident52 Ų5262.6 Ų62.634%0.33839%0.388SS..SBendtrans-76.2-22.8-17230.4-35.9000113.4H158 S159 P165H158-P167 CarbonylContact C-O 3.52Å; H158-P167 WeakPolarHBondContact CA-O 3.39Å; H158-P167 PolarHBondContact ND1-O 3.44Å; S159-P167 PolarHBondContact N-O 2.85Å; P165-P167 WeakPolarHBondContact O-CD 3.42Å
168N93.6Very high79.8Confident44 Ų4466 Ų6624%0.23542%0.424CS..EExtended strand (participates in β ladder)trans-133.8119.7178.9-65.1-70.1000108.9P50 V157 H158 Y166P50-N168 HydrophobicContact CG-CB 4.15Å; V157-N168 WeakPolarHBondContact O-CA 3.01Å; H158-N168 PolarHBondContact ND1-OD1 2.86Å; Y166-N168 PolarHBondContact O-N 2.96Å
169Q94.3Very high77.4Confident28 Ų2868 Ų6813%0.13145%0.445CS..EExtended strand (participates in β ladder)trans-142150.9-179.9-46.5-172.57400110.1S156 V157 Y166 S203 A204 L205S156-Q169 CarbonylContact C-O 3.51Å; S156-Q169 WeakPolarHBondContact CA-O 3.37Å; V157-Q169 HydrophobicContact CG2-CB 3.72Å; V157-Q169 HydrophobicContact CG2-CG 4.3Å; V157-Q169 PolarHBondContact N-O 3.12Å; V157-Q169 PolarHBondContact O-N 3.43Å; Y166-Q169 VanDerWaalsContact CB-NE2 3.26Å; Y166-Q169 PolarHBondContact O-NE2 2.81Å; Q169-S203 PolarHBondContact NE2-O 3.32Å; Q169-A204 VanDerWaalsContact OE1-CA 3.23Å; Q169-L205 HydrophobicContact CB-CB 4.04Å; Q169-L205 HydrophobicContact CB-CD2 4.24Å
170E94.6Very high74.6Confident79 Ų7971.5 Ų71.537%0.36948%0.475SS..EExtended strand (participates in β ladder)trans-141.8141.5175.4179.4174.1113.100109.6T154 L155 S156T154-E170 HydrophobicContact CG2-CG 3.74Å; L155-E170 CarbonylContact O-C 3.57Å; L155-E170 WeakPolarHBondContact O-CA 3.32Å; S156-E170 PolarHBondContact OG-OE2 3.23Å
171I92.8Very high72.4Confident35 Ų3574.6 Ų74.618%0.17949%0.49CS..EExtended strand (participates in β ladder)trans-133.2139.5171.2-163.9156.4000110.6L155 V173 L205 A207 V247L155-I171 HydrophobicContact CB-CG2 4.13Å; L155-I171 PolarHBondContact N-O 3.31Å; L155-I171 PolarHBondContact O-N 2.97Å; I171-V173 HydrophobicContact CG2-CG2 4.37Å; I171-L205 HydrophobicContact CB-CD2 3.81Å; I171-L205 HydrophobicContact CB-CG 4.3Å; I171-L205 HydrophobicContact CG2-CD2 3.55Å; I171-L205 HydrophobicContact CG2-CG 4.09Å; I171-A207 HydrophobicContact CD1-CB 3.45Å; I171-A207 VanDerWaalsContact CD1-CB 3.45Å; I171-A207 HydrophobicContact CG1-CB 4.34Å; I171-V247 HydrophobicContact CG2-CG1 4.39Å
172R91.2Very high70.1Confident182 Ų18280.8 Ų80.869%0.68752%0.515SS*.EExtended strand (participates in β ladder)trans-93125.9167.4-68-176.2-177.1137.44.5108.5R153R153-R172 WeakPolarHBondContact O-CA 3.39Å
173V82.3Confident68Low6 Ų678.8 Ų78.84%0.03650%0.501CS..  trans-97.3-18.5-171.1-157.70000110.7L152 R153 I171 H190 T245L152-V173 HydrophobicContact CD2-CG2 4.16Å; L152-V173 HydrophobicContact CG-CG2 4.17Å; L152-V173 WeakPolarHBondContact O-CB 3.35Å; R153-V173 PolarHBondContact O-N 2.75Å; I171-V173 HydrophobicContact CG2-CG2 4.37Å; V173-H190 VanDerWaalsContact CG1-CE1 3.46Å; V173-H190 WeakPolarHBondContact CG1-CE1 3.32Å; V173-T245 VanDerWaalsContact CG1-CB 3.44Å; V173-T245 HydrophobicContact CG1-CG2 3.23Å; V173-T245 WeakPolarHBondContact CG1-OG1 3.39Å
174S70.1Confident65.7Low56 Ų5682.3 Ų82.339%0.39250%0.502SS..SBendtrans-71.9147.9175.659.10000112.3S176S174-S176 PolarHBondContact O-N 3.12Å
175P57.6Low63.5Low96 Ų9684.7 Ų84.762%0.62352%0.518SS*.PPolyproline II helixtrans-57.6137.217821.9-30.4000111.5
176S43.3Very low61.2Low105 Ų10586.6 Ų86.673%0.73453%0.533SS*.PPolyproline II helixtrans-61.2144.9179.1-179.10000111.3S174 G178 A179S174-S176 PolarHBondContact O-N 3.12Å; S176-G178 PolarHBondContact O-N 3.41Å; S176-A179 PolarHBondContact O-N 3.26Å
177A42.3Very low59.1Low102 Ų10283.6 Ų83.684%0.84353%0.526SS*.THydrogen-bonded Turntrans-60.814.8-17600000116.4
178G39.7Very low57.3Low78 Ų7884.8 Ų84.880%0.80454%0.535SS*.THydrogen-bonded Turntrans-94.8-12.8173.100000114.3S176S176-G178 PolarHBondContact O-N 3.41Å
179A44.8Very low56.5Low69 Ų6986.4 Ų86.457%0.5754%0.542SS*.SBendtrans-86.1128.7158.100000106.5S176S176-A179 PolarHBondContact O-N 3.26Å
180A31.7Very low56.1Low80 Ų8086.3 Ų86.366%0.66154%0.541SS*.  trans-43.7137.4-176.300000111.2E182A180-E182 VanDerWaalsContact C-N 3.33Å; A180-E182 PolarHBondContact O-N 2.78Å
181P37.3Very low55.8Low114 Ų11482.6 Ų82.674%0.7452%0.523SS*.  trans-67.4102.9168.629.3-27.3000104.9P183P181-P183 WeakPolarHBondContact O-CD 3.32Å
182E33.2Very low55.8Low158 Ų15880.9 Ų80.974%0.73852%0.515SS*.  trans-76.2102.3151.6-80.8-65125.900104.8A180 D184A180-E182 VanDerWaalsContact C-N 3.33Å; A180-E182 PolarHBondContact O-N 2.78Å; E182-D184 PolarHBondContact O-N 3.22Å
183P37Very low55.8Low90 Ų9072.7 Ų72.758%0.58448%0.484SS*.THydrogen-bonded Turntrans-62.4130.6161.533.2-30.6000104.6P181P181-P183 WeakPolarHBondContact O-CD 3.32Å
184D33.8Very low56.5Low152 Ų15272.5 Ų72.581%0.81348%0.483SS*.THydrogen-bonded Turntrans102.214.2171.4-43-24.8000118.6E182 S186E182-D184 PolarHBondContact O-N 3.22Å; D184-S186 PolarHBondContact O-N 3.32Å
185S41.1Very low57.6Low66 Ų6671.4 Ų71.446%0.46247%0.473SS..  trans-76.674.1159.3-175.40000111T187 S188S185-T187 PolarHBondContact O-N 3.23Å; S185-T187 VanDerWaalsContact O-N 3.16Å; S185-T187 PolarHBondContact OG-OG1 3.11Å; S185-S188 PolarHBondContact OG-OG 3.49Å
186S43Very low59.3Low117 Ų11767.1 Ų67.182%0.81845%0.445SS*.THydrogen-bonded Turntrans-69.310.9164.352.20000113.2D184D184-S186 PolarHBondContact O-N 3.32Å
187T46.9Very low61.7Low46 Ų4662.9 Ų62.928%0.28242%0.417SS..THydrogen-bonded Turntrans-123.3-10.6-165.954.90000114.8S185 H189 Q240S185-T187 PolarHBondContact O-N 3.23Å; S185-T187 VanDerWaalsContact O-N 3.16Å; S185-T187 PolarHBondContact OG-OG1 3.11Å; T187-H189 PolarHBondContact O-N 3.37Å; T187-H189 PolarHBondContact O-ND1 2.97Å; T187-Q240 PolarHBondContact O-OE1 2.89Å
188S53.6Low64.1Low77 Ų7758.1 Ų58.154%0.53838%0.377SS..  trans-86.3112.9174.355.30000110.6S185S185-S188 PolarHBondContact OG-OG 3.49Å
189H75.5Confident66.7Low79 Ų7954.4 Ų54.437%0.36634%0.339SS..EExtended strand (participates in β ladder)trans-77.9133.3174.3-67.673.7000108.5T187 L215 Q240 T242 L243T187-H189 PolarHBondContact O-N 3.37Å; T187-H189 PolarHBondContact O-ND1 2.97Å; H189-L215 HydrophobicContact CB-CB 3.96Å; H189-L215 HydrophobicContact CB-CD2 4Å; H189-L215 HydrophobicContact CB-CG 4.43Å; H189-L215 VanDerWaalsContact CD2-CD2 3.4Å; H189-L215 WeakPolarHBondContact CD2-CD2 3.48Å; H189-Q240 PolarHBondContact CE1-OE1 3.45Å; H189-T242 HydrophobicContact CB-CG2 4.24Å; H189-T242 CarbonylContact O-C 3.54Å; H189-T242 VanDerWaalsContact O-CA 3.3Å; H189-T242 WeakPolarHBondContact O-CA 3.32Å; H189-T242 VanDerWaalsContact O-CG2 3.25Å; H189-T242 WeakPolarHBondContact O-CG2 3.47Å; H189-L243 PolarHBondContact O-N 3.09Å
190H85.6Confident68.9Low26 Ų2651.8 Ų51.812%0.1232%0.316CS..EExtended strand (participates in β ladder)trans-108.9124.4176.3-170178.9000109.1L150 G151 L152 V173 S192 L243 T245L150-H190 WeakPolarHBondContact CA-O 3.22Å; G151-H190 PolarHBondContact N-O 3.1Å; L152-H190 PolarHBondContact O-CE1 2.87Å; L152-H190 PolarHBondContact O-ND1 2.87Å; V173-H190 VanDerWaalsContact CG1-CE1 3.46Å; V173-H190 WeakPolarHBondContact CG1-CE1 3.32Å; H190-S192 PolarHBondContact NE2-OG 2.86Å; H190-L243 WeakPolarHBondContact CA-O 3.05Å; H190-L243 PolarHBondContact CD2-O 3.12Å; H190-L243 VanDerWaalsContact CD2-O 3.28Å; H190-T245 PolarHBondContact NE2-OG1 3.44Å
191M88.9Confident71.8Confident0 Ų048 Ų480%028%0.284CS..EExtended strand (participates in β ladder)trans-119.6131175.2-175.6178.8-178.400109.2V148 L150 F193 L215 F218 L225 F227 T242 L243 V244 T245V148-M191 HydrophobicContact CG1-CE 3.43Å; V148-M191 VanDerWaalsContact CG1-CE 3.43Å; V148-M191 HydrophobicContact CG1-CG 4.25Å; V148-M191 HydrophobicContact CG2-CE 4.36Å; L150-M191 HydrophobicContact CD2-CB 4.4Å; L150-M191 HydrophobicContact CD2-CG 4.22Å; M191-F193 HydrophobicContact CE-CE1 3.72Å; M191-F193 HydrophobicContact CE-CE2 3.71Å; M191-F193 HydrophobicContact CE-CZ 3.21Å; M191-F193 HydrophobicContact CG-CE2 4.29Å; M191-F193 HydrophobicContact SD-CE2 3.97Å; M191-F193 HydrophobicContact SD-CZ 4.03Å; M191-L215 HydrophobicContact CB-CD1 4.46Å; M191-L215 HydrophobicContact SD-CD1 4.25Å; M191-F218 HydrophobicContact CE-CD1 4.21Å; M191-F218 HydrophobicContact SD-CD1 3.57Å; M191-F218 VanDerWaalsContact SD-CD1 3.57Å; M191-F218 HydrophobicContact SD-CE1 3.72Å; M191-F218 HydrophobicContact SD-CG 4.11Å; M191-F218 HydrophobicContact SD-CZ 4.34Å; M191-L225 HydrophobicContact CE-CD1 3.45Å; M191-L225 VanDerWaalsContact CE-CD1 3.45Å; M191-F227 HydrophobicContact CE-CE1 3.74Å; M191-F227 HydrophobicContact CE-CZ 3.68Å; M191-F227 HydrophobicContact SD-CE1 4.08Å; M191-F227 HydrophobicContact SD-CZ 4.2Å; M191-T242 HydrophobicContact CB-CG2 3.92Å; M191-L243 PolarHBondContact N-O 3.48Å; M191-V244 CarbonylContact O-C 3.57Å; M191-V244 VanDerWaalsContact O-CA 3.28Å; M191-V244 WeakPolarHBondContact O-CA 3.3Å; M191-T245 PolarHBondContact O-N 3.38Å
192S91.9Very high74.4Confident0 Ų048.3 Ų48.30%028%0.279CS..EExtended strand (participates in β ladder)trans-121.1125.4-179.2-69.20000110.5V148 L149 H190 T245V148-S192 CarbonylContact C-O 3.53Å; V148-S192 WeakPolarHBondContact CA-O 3.34Å; L149-S192 PolarHBondContact N-O 2.82Å; L149-S192 PolarHBondContact O-N 2.8Å; H190-S192 PolarHBondContact NE2-OG 2.86Å; S192-T245 CarbonylContact C-O 3.55Å; S192-T245 VanDerWaalsContact CA-O 3.3Å; S192-T245 WeakPolarHBondContact CA-O 3.24Å
193F93.1Very high77.1Confident10 Ų1043.2 Ų43.24%0.04426%0.261CS..EExtended strand (participates in β ladder)trans-98.4108.1170.1-70.5-81.3000107.8Q146 V148 M191 F222 L225 V244 T245 F246 V247Q146-F193 HydrophobicContact CG-CB 4.02Å; Q146-F193 HydrophobicContact CG-CD1 3.68Å; Q146-F193 HydrophobicContact CG-CG 4.34Å; Q146-F193 PolarHBondContact NE2-O 2.76Å; V148-F193 HydrophobicContact CG2-CD1 3.7Å; V148-F193 HydrophobicContact CG2-CE1 3.72Å; M191-F193 HydrophobicContact CE-CE1 3.72Å; M191-F193 HydrophobicContact CE-CE2 3.71Å; M191-F193 HydrophobicContact CE-CZ 3.21Å; M191-F193 HydrophobicContact CG-CE2 4.29Å; M191-F193 HydrophobicContact SD-CE2 3.97Å; M191-F193 HydrophobicContact SD-CZ 4.03Å; F193-F222 HydrophobicContact CE1-CE1 4.21Å; F193-F222 HydrophobicContact CE1-CZ 4.41Å; F193-F222 HydrophobicContact CZ-CE1 4.06Å; F193-F222 HydrophobicContact CZ-CE2 4.11Å; F193-F222 AromaticContact CZ-CZ 3.81Å; F193-F222 HydrophobicContact CZ-CZ 3.81Å; F193-L225 HydrophobicContact CE1-CD1 4.34Å; F193-V244 HydrophobicContact CD2-CG1 3.59Å; F193-V244 HydrophobicContact CE2-CG1 3.57Å; F193-T245 PolarHBondContact N-O 3.02Å; F193-F246 HydrophobicContact CB-CD1 3.71Å; F193-F246 HydrophobicContact CB-CE1 4.03Å; F193-F246 HydrophobicContact CB-CG 4.47Å; F193-F246 HydrophobicContact CD2-CD1 4.14Å; F193-F246 AromaticContact CD2-CE1 3.68Å; F193-F246 HydrophobicContact CD2-CE1 3.68Å; F193-F246 HydrophobicContact CD2-CZ 4.01Å; F193-F246 HydrophobicContact CE2-CE1 4.31Å; F193-F246 HydrophobicContact CE2-CZ 4.37Å; F193-F246 HydrophobicContact CG-CD1 4.17Å; F193-F246 AromaticContact CG-CE1 3.96Å; F193-F246 HydrophobicContact CG-CE1 3.96Å; F193-F246 CarbonylContact O-C 3.52Å; F193-F246 WeakPolarHBondContact O-CA 3.33Å; F193-V247 PolarHBondContact O-N 3.11Å
194V95.1Very high79.8Confident1 Ų140.6 Ų40.61%0.00625%0.247CC..EExtended strand (participates in β ladder)trans-106.7122.8-177.5-176.40000109.2Q146 L147 L149 L152 L155 I196 I198 V247Q146-V194 PolarHBondContact NE2-O 3.07Å; L147-V194 HydrophobicContact CB-CB 4.38Å; L147-V194 PolarHBondContact N-O 2.94Å; L147-V194 PolarHBondContact O-N 3.16Å; L149-V194 HydrophobicContact CD1-CG2 3.96Å; L152-V194 HydrophobicContact CD2-CG2 4.24Å; L155-V194 HydrophobicContact CD2-CG1 3.83Å; L155-V194 HydrophobicContact CD2-CG2 4.3Å; V194-I196 PolarHBondContact O-N 2.81Å; V194-I198 HydrophobicContact CG1-CD1 3.51Å; V194-V247 HydrophobicContact CB-CB 4.43Å; V194-V247 HydrophobicContact CG1-CB 4.32Å; V194-V247 HydrophobicContact CG1-CG1 4.49Å; V194-V247 HydrophobicContact CG2-CB 4.15Å; V194-V247 HydrophobicContact CG2-CG2 4.2Å
195D95Very high82.7Confident33 Ų3334.4 Ų34.418%0.17621%0.213CC..EExtended strand (participates in β ladder)trans-73.3119.6168.8-175.3-9.8000108.8S144 R145 G197 I198 V247S144-D195 VanDerWaalsContact CA-OD1 3.3Å; S144-D195 WeakPolarHBondContact CA-OD1 3.43Å; S144-D195 WeakPolarHBondContact CB-OD1 3.34Å; S144-D195 PolarHBondContact OG-OD1 3.18Å; S144-D195 PolarHBondContact OG-OD2 2.86Å; R145-D195 PolarHBondContact N-OD1 2.99Å; R145-D195 WeakPolarHBondContact O-CA 3.47Å; D195-G197 PolarHBondContact O-N 3.06Å; D195-G197 PolarHBondContact OD1-N 2.9Å; D195-I198 WeakPolarHBondContact O-CD1 3.3Å; D195-I198 WeakPolarHBondContact O-CG1 3.43Å; D195-I198 WeakPolarHBondContact O-CG2 3.19Å; D195-I198 PolarHBondContact O-N 2.81Å; D195-V247 PolarHBondContact N-O 3.39Å
196I93.4Very high85.3Confident7 Ų736.8 Ų36.84%0.03622%0.216CC..G310 helixtrans-69.6-14.8179.971.3173.8000112.7L117 L120 Q143 R145 L147 V194 I198 L199L117-I196 HydrophobicContact CD2-CD1 3.76Å; L120-I196 HydrophobicContact CD1-CB 4Å; L120-I196 HydrophobicContact CD1-CD1 4.13Å; L120-I196 HydrophobicContact CD1-CG2 3.85Å; Q143-I196 WeakPolarHBondContact O-CG1 3.38Å; R145-I196 HydrophobicContact CB-CD1 3.72Å; R145-I196 HydrophobicContact CB-CG1 3.9Å; R145-I196 HydrophobicContact CG-CD1 4.2Å; R145-I196 WeakPolarHBondContact O-CG1 3.37Å; R145-I196 PolarHBondContact O-N 2.85Å; L147-I196 HydrophobicContact CB-CG2 3.73Å; V194-I196 PolarHBondContact O-N 2.81Å; I196-I198 PolarHBondContact O-N 2.89Å; I196-L199 VanDerWaalsContact O-CB 3.27Å; I196-L199 WeakPolarHBondContact O-CB 3.21Å; I196-L199 WeakPolarHBondContact O-CG 3.43Å; I196-L199 PolarHBondContact O-N 2.65Å; I196-L199 VanDerWaalsContact O-N 3.11Å
197G92.4Very high87.7Confident15 Ų1532.9 Ų32.916%0.15519%0.191CC..G310 helixtrans-60.1-22174.600000113.6D195 L199 N200D195-G197 PolarHBondContact O-N 3.06Å; D195-G197 PolarHBondContact OD1-N 2.9Å; G197-L199 PolarHBondContact O-N 3.48Å; G197-N200 WeakPolarHBondContact O-CB 3.39Å; G197-N200 PolarHBondContact O-N 2.86Å; G197-N200 VanDerWaalsContact O-N 3.11Å; G197-N200 PolarHBondContact O-ND2 3.19Å; G197-N200 VanDerWaalsContact O-ND2 3.12Å
198I93.6Very high89.9Confident2 Ų236.2 Ų36.21%0.0120%0.199CC..G310 helixtrans-58.9-26.4174.669.1-172.5000112.7L155 V157 V194 D195 I196 N200 G201 L205 V247 Y248L155-I198 HydrophobicContact CD2-CD1 3.92Å; V157-I198 HydrophobicContact CG1-CD1 3.85Å; V157-I198 HydrophobicContact CG1-CG1 4.17Å; V194-I198 HydrophobicContact CG1-CD1 3.51Å; D195-I198 WeakPolarHBondContact O-CD1 3.3Å; D195-I198 WeakPolarHBondContact O-CG1 3.43Å; D195-I198 WeakPolarHBondContact O-CG2 3.19Å; D195-I198 PolarHBondContact O-N 2.81Å; I196-I198 PolarHBondContact O-N 2.89Å; I198-N200 PolarHBondContact O-N 3.22Å; I198-G201 PolarHBondContact O-N 2.03Å; I198-L205 HydrophobicContact CB-CD1 4.11Å; I198-L205 HydrophobicContact CD1-CD1 3.7Å; I198-L205 HydrophobicContact CG1-CD1 4.41Å; I198-L205 HydrophobicContact CG2-CD1 3.96Å; I198-V247 HydrophobicContact CD1-CG1 4.42Å; I198-Y248 VanDerWaalsContact CG2-OXT 3.29Å; I198-Y248 WeakPolarHBondContact CG2-OXT 3.13Å
199L93.4Very high91.7Very high0 Ų035.3 Ų35.30%019%0.192CC..G310 helixtrans-67.8-16.8180-69.5178.9000113.1L120 L134 F136 L142 V157 S159 I196 G197 G201L120-L199 HydrophobicContact CD1-CD1 3.92Å; L134-L199 HydrophobicContact CB-CD2 3.55Å; L134-L199 HydrophobicContact CD1-CD1 4.46Å; L134-L199 HydrophobicContact CD1-CD2 4.21Å; F136-L199 HydrophobicContact CB-CB 3.95Å; F136-L199 HydrophobicContact CG-CB 4.32Å; L142-L199 HydrophobicContact CD1-CB 4.01Å; L142-L199 HydrophobicContact CD1-CD1 3.73Å; L142-L199 HydrophobicContact CD1-CG 4.48Å; V157-L199 HydrophobicContact CB-CD2 4.24Å; V157-L199 HydrophobicContact CG1-CD2 4.08Å; S159-L199 WeakPolarHBondContact CB-O 3.03Å; S159-L199 PolarHBondContact OG-O 3.47Å; S159-L199 VanDerWaalsContact OG-O 3.12Å; I196-L199 VanDerWaalsContact O-CB 3.27Å; I196-L199 WeakPolarHBondContact O-CB 3.21Å; I196-L199 WeakPolarHBondContact O-CG 3.43Å; I196-L199 PolarHBondContact O-N 2.65Å; I196-L199 VanDerWaalsContact O-N 3.11Å; G197-L199 PolarHBondContact O-N 3.48Å; L199-G201 PolarHBondContact O-N 2.77Å
200N92.3Very high92.4Very high14 Ų1435.6 Ų35.68%0.07520%0.196CC..G310 helixtrans-72.1-17.7171.8-60.1-44.7000112.1P141 L142 S159 G197 I198 L202P141-N200 VanDerWaalsContact CA-OD1 3.26Å; P141-N200 WeakPolarHBondContact CA-OD1 3.3Å; L142-N200 PolarHBondContact N-OD1 2.85Å; L142-N200 PolarHBondContact O-ND2 3.21Å; S159-N200 PolarHBondContact OG-O 2.75Å; G197-N200 WeakPolarHBondContact O-CB 3.39Å; G197-N200 PolarHBondContact O-N 2.86Å; G197-N200 VanDerWaalsContact O-N 3.11Å; G197-N200 PolarHBondContact O-ND2 3.19Å; G197-N200 VanDerWaalsContact O-ND2 3.12Å; I198-N200 PolarHBondContact O-N 3.22Å; N200-L202 HydrophobicContact CB-CD1 4.02Å; N200-L202 HydrophobicContact CB-CG 3.82Å; N200-L202 PolarHBondContact O-N 2.96Å
201G92.2Very high92.5Very high0 Ų040 Ų400%022%0.219CC..  trans68.418.2-179.900000114.5P165 Y166 I198 L199P165-G201 WeakPolarHBondContact CD-O 3.49Å; P165-G201 WeakPolarHBondContact CG-O 3.3Å; Y166-G201 PolarHBondContact N-O 3.28Å; Y166-G201 VanDerWaalsContact N-O 3.11Å; I198-G201 PolarHBondContact O-N 2.03Å; L199-G201 PolarHBondContact O-N 2.77Å
202L91.4Very high92.1Very high121 Ų12140.7 Ų40.763%0.63423%0.226SC*.  trans-78.3-22.6-177.7-61.2177.9000113.3N200N200-L202 HydrophobicContact CB-CD1 4.02Å; N200-L202 HydrophobicContact CB-CG 3.82Å; N200-L202 PolarHBondContact O-N 2.96Å
203S90.4Very high91.6Very high51 Ų5143.3 Ų43.336%0.35724%0.243SC..SBendtrans-129.2154.418050.70000111.4Y166 Q169Y166-S203 VanDerWaalsContact CD2-C 3.44Å; Q169-S203 PolarHBondContact NE2-O 3.32Å
204A93.4Very high91Very high35 Ų3544 Ų4429%0.28925%0.249SC..  trans-68.7134169.700000110.1Y166 Q169 K206Y166-A204 HydrophobicContact CD1-CB 4.45Å; Y166-A204 HydrophobicContact CE1-CB 4.22Å; Y166-A204 HydrophobicContact CE2-CB 4.33Å; Q169-A204 VanDerWaalsContact OE1-CA 3.23Å; A204-K206 PolarHBondContact O-N 2.03Å
205L94.4Very high90.1Very high22 Ų2244.7 Ų44.712%0.11525%0.252CS..  trans-65.3127.8-178.5-170.864000110.6V157 Q169 I171 I198 V247V157-L205 HydrophobicContact CG2-CD2 4.19Å; Q169-L205 HydrophobicContact CB-CB 4.04Å; Q169-L205 HydrophobicContact CB-CD2 4.24Å; I171-L205 HydrophobicContact CB-CD2 3.81Å; I171-L205 HydrophobicContact CB-CG 4.3Å; I171-L205 HydrophobicContact CG2-CD2 3.55Å; I171-L205 HydrophobicContact CG2-CG 4.09Å; I198-L205 HydrophobicContact CB-CD1 4.11Å; I198-L205 HydrophobicContact CD1-CD1 3.7Å; I198-L205 HydrophobicContact CG1-CD1 4.41Å; I198-L205 HydrophobicContact CG2-CD1 3.96Å; L205-V247 HydrophobicContact CD1-CG1 3.54Å; L205-V247 HydrophobicContact CG-CG1 4.24Å
206K94.8Very high89.1Confident116 Ų11649 Ų4950%0.50427%0.271SS..  trans-129.9151.2179.9-68.7172.8-173.5175.80109.8A204 V247 Y248A204-K206 PolarHBondContact O-N 2.03Å; K206-V247 WeakPolarHBondContact O-CA 3.19Å; K206-Y248 HydrophobicContact CB-CD2 4.32Å; K206-Y248 HydrophobicContact CB-CE1 4.04Å; K206-Y248 HydrophobicContact CB-CE2 3.82Å; K206-Y248 HydrophobicContact CD-CE2 3.81Å; K206-Y248 HydrophobicContact CG-CE2 4.44Å; K206-Y248 PolarHBondContact N-O 3.05Å; K206-Y248 PolarHBondContact O-N 3.48Å
207A94.8Very high88.4Confident36 Ų3649.8 Ų49.830%0.29828%0.276SS..EExtended strand (participates in β ladder)trans-143.4151.1169.300000111.6I171 T245 F246 V247I171-A207 HydrophobicContact CD1-CB 3.45Å; I171-A207 VanDerWaalsContact CD1-CB 3.45Å; I171-A207 HydrophobicContact CG1-CB 4.34Å; A207-T245 HydrophobicContact CB-CG2 3.92Å; A207-F246 WeakPolarHBondContact CA-O 3.46Å; A207-F246 WeakPolarHBondContact CB-O 3.37Å; A207-V247 HydrophobicContact CB-CG2 4.05Å
208Y93.3Very high87.7Confident116 Ų11649.4 Ų49.446%0.45527%0.27SS..EExtended strand (participates in β ladder)trans-138150164.469.3-86.6000109.7I210 T245 F246 Y248Y208-I210 HydrophobicContact CD2-CG2 4.19Å; Y208-I210 HydrophobicContact CE2-CG2 4.27Å; Y208-T245 WeakPolarHBondContact O-CA 3.4Å; Y208-F246 HydrophobicContact CD1-CB 4.12Å; Y208-F246 HydrophobicContact CD2-CD2 4.19Å; Y208-F246 HydrophobicContact CE1-CB 3.54Å; Y208-F246 HydrophobicContact CE1-CD2 4.31Å; Y208-F246 HydrophobicContact CE1-CG 4.14Å; Y208-F246 HydrophobicContact CE2-CB 4.21Å; Y208-F246 AromaticContact CE2-CD2 3.42Å; Y208-F246 HydrophobicContact CE2-CD2 3.42Å; Y208-F246 VanDerWaalsContact CE2-CD2 3.42Å; Y208-F246 HydrophobicContact CE2-CE2 4.1Å; Y208-F246 HydrophobicContact CE2-CG 4.07Å; Y208-F246 AromaticContact CZ-CD2 3.48Å; Y208-F246 VanDerWaalsContact CZ-CD2 3.48Å; Y208-F246 AromaticContact CZ-CG 3.63Å; Y208-F246 PolarHBondContact N-O 3.48Å; Y208-F246 VanDerWaalsContact N-O 3.08Å; Y208-F246 PolarHBondContact O-N 2.81Å; Y208-F246 WeakPolarHBondContact OH-CD2 3.26Å; Y208-F246 WeakPolarHBondContact OH-CG 3.45Å; Y208-Y248 AromaticContact CD1-CE1 3.81Å; Y208-Y248 HydrophobicContact CD1-CE1 3.81Å; Y208-Y248 HydrophobicContact CE1-CD1 4.49Å; Y208-Y248 AromaticContact CE1-CE1 3.93Å; Y208-Y248 HydrophobicContact CE1-CE1 3.93Å
209S91Very high86.7Confident57 Ų5752 Ų5240%0.39929%0.288SS..EExtended strand (participates in β ladder)trans-120.2144.1-177.7-570000111.1V244 T245S209-V244 CarbonylContact C-O 3.51Å; S209-V244 VanDerWaalsContact CA-O 3.23Å; S209-V244 WeakPolarHBondContact CA-O 3.18Å; S209-T245 WeakPolarHBondContact OG-CG2 3.5Å; S209-T245 PolarHBondContact OG-OG1 3Å
210I89.3Confident85.9Confident85 Ų8559.1 Ų59.144%0.43632%0.321SS..EExtended strand (participates in β ladder)trans-129.2158173.565.6173.6000109.7Y208 V244 F246Y208-I210 HydrophobicContact CD2-CG2 4.19Å; Y208-I210 HydrophobicContact CE2-CG2 4.27Å; I210-V244 HydrophobicContact CG1-CB 3.87Å; I210-V244 HydrophobicContact CG1-CG1 4.47Å; I210-V244 PolarHBondContact N-O 3.45Å; I210-V244 PolarHBondContact O-N 2.89Å; I210-F246 HydrophobicContact CD1-CE2 3.89Å; I210-F246 HydrophobicContact CG1-CE2 4.15Å
211I87.4Confident85.1Confident120 Ų12064.7 Ų64.762%0.61535%0.345SS*.EExtended strand (participates in β ladder)trans-88.5114.8170.9-62.8173.5000107.4Q241I211-Q241 HydrophobicContact CG2-CB 3.77Å; I211-Q241 HydrophobicContact CG2-CG 4.01Å
212G82.1Confident84.2Confident13 Ų1368.4 Ų68.413%0.13436%0.362CS..EExtended strand (participates in β ladder)trans-99177.717800000113.1T242G212-T242 PolarHBondContact N-O 2.98Å; G212-T242 PolarHBondContact O-N 2.83Å
213P80.7Confident82.9Confident56 Ų5667.5 Ų67.536%0.36436%0.363SS..SBendtrans-66.5178175.433.4-37.9000111.1T217 F218 F221 T242P213-T217 WeakPolarHBondContact CB-OG1 3.04Å; P213-F218 HydrophobicContact CG-CD2 4.29Å; P213-F218 HydrophobicContact CG-CE2 3.79Å; P213-F218 HydrophobicContact CG-CZ 4.09Å; P213-F218 VanDerWaalsContact O-CE2 3.31Å; P213-F218 WeakPolarHBondContact O-CE2 3.49Å; P213-F221 HydrophobicContact CG-CE2 4.3Å; P213-T242 WeakPolarHBondContact O-CB 3.33Å; P213-T242 PolarHBondContact O-N 2.92Å; P213-T242 PolarHBondContact O-OG1 2.9Å
214P80.3Confident81.7Confident25 Ų2573.4 Ų73.416%0.16238%0.384CS..  trans-62.9143.7175.5-24.435.4000113.8H216 T217 Q240P214-H216 VanDerWaalsContact C-N 3.26Å; P214-H216 WeakPolarHBondContact CB-CE1 3.21Å; P214-H216 PolarHBondContact O-N 3.3Å; P214-H216 VanDerWaalsContact O-N 3.14Å; P214-T217 HydrophobicContact CB-CG2 4.37Å; P214-T217 WeakPolarHBondContact O-CB 3.49Å; P214-T217 PolarHBondContact O-N 2.91Å; P214-T217 PolarHBondContact O-OG1 3.43Å; P214-Q240 WeakPolarHBondContact CA-O 3.47Å; P214-Q240 WeakPolarHBondContact CB-O 3.35Å; P214-Q240 WeakPolarHBondContact CG-O 3Å
215L75.9Confident80.4Confident15 Ų1573 Ų738%0.07938%0.377CS..G310 helixtrans-54.8-39.6-171.2-172.568.4000113L150 H189 M191 T217 F218 F227 L229 T242L150-L215 HydrophobicContact CD2-CD1 4.37Å; H189-L215 HydrophobicContact CB-CB 3.96Å; H189-L215 HydrophobicContact CB-CD2 4Å; H189-L215 HydrophobicContact CB-CG 4.43Å; H189-L215 VanDerWaalsContact CD2-CD2 3.4Å; H189-L215 WeakPolarHBondContact CD2-CD2 3.48Å; M191-L215 HydrophobicContact CB-CD1 4.46Å; M191-L215 HydrophobicContact SD-CD1 4.25Å; L215-T217 PolarHBondContact O-N 3.34Å; L215-T217 VanDerWaalsContact O-N 3.15Å; L215-F218 HydrophobicContact CD1-CD2 4.34Å; L215-F218 WeakPolarHBondContact O-CB 3.45Å; L215-F218 PolarHBondContact O-N 3.23Å; L215-F227 HydrophobicContact CD1-CD1 4.37Å; L215-F227 HydrophobicContact CD1-CE1 4.19Å; L215-L229 HydrophobicContact CD2-CD2 4.38Å; L215-T242 WeakPolarHBondContact CA-OG1 3.43Å; L215-T242 HydrophobicContact CD1-CG2 4.11Å; L215-T242 PolarHBondContact N-OG1 2.93Å
216H75.1Confident78.8Confident123 Ų12376.6 Ų76.657%0.56940%0.4SS*.G310 helixtrans-60.7-25.2178.763.2-95.3000113.6P214 S219 L229P214-H216 VanDerWaalsContact C-N 3.26Å; P214-H216 WeakPolarHBondContact CB-CE1 3.21Å; P214-H216 PolarHBondContact O-N 3.3Å; P214-H216 VanDerWaalsContact O-N 3.14Å; H216-S219 PolarHBondContact O-OG 2.02Å; H216-S219 VanDerWaalsContact O-OG 3.12Å; H216-L229 HydrophobicContact CB-CD2 4.45Å
217T79.1Confident77.3Confident23 Ų2372 Ų7214%0.14138%0.38CS..G310 helixtrans-80.3-15.6177.969.30000113.3P213 P214 L215 S219 Q220 F221P213-T217 WeakPolarHBondContact CB-OG1 3.04Å; P214-T217 HydrophobicContact CB-CG2 4.37Å; P214-T217 WeakPolarHBondContact O-CB 3.49Å; P214-T217 PolarHBondContact O-N 2.91Å; P214-T217 PolarHBondContact O-OG1 3.43Å; L215-T217 PolarHBondContact O-N 3.34Å; L215-T217 VanDerWaalsContact O-N 3.15Å; T217-S219 PolarHBondContact O-N 3.41Å; T217-Q220 WeakPolarHBondContact O-CB 3.38Å; T217-Q220 PolarHBondContact O-N 3.45Å; T217-F221 WeakPolarHBondContact O-CD2 3.04Å
218F77.6Confident75.4Confident8 Ų874.4 Ų74.44%0.03539%0.393CS..Hα-helixtrans-63.4-28.9-178.3-84-103.2000113M191 P213 L215 Q220 F221 F222 F227 T242 V244M191-F218 HydrophobicContact CE-CD1 4.21Å; M191-F218 HydrophobicContact SD-CD1 3.57Å; M191-F218 VanDerWaalsContact SD-CD1 3.57Å; M191-F218 HydrophobicContact SD-CE1 3.72Å; M191-F218 HydrophobicContact SD-CG 4.11Å; M191-F218 HydrophobicContact SD-CZ 4.34Å; P213-F218 HydrophobicContact CG-CD2 4.29Å; P213-F218 HydrophobicContact CG-CE2 3.79Å; P213-F218 HydrophobicContact CG-CZ 4.09Å; P213-F218 VanDerWaalsContact O-CE2 3.31Å; P213-F218 WeakPolarHBondContact O-CE2 3.49Å; L215-F218 HydrophobicContact CD1-CD2 4.34Å; L215-F218 WeakPolarHBondContact O-CB 3.45Å; L215-F218 PolarHBondContact O-N 3.23Å; F218-Q220 PolarHBondContact O-N 3.44Å; F218-Q220 VanDerWaalsContact O-N 3.13Å; F218-F221 PolarHBondContact O-N 3.46Å; F218-F222 HydrophobicContact CB-CD2 4.32Å; F218-F222 AromaticContact CD1-CD2 3.69Å; F218-F222 HydrophobicContact CD1-CD2 3.69Å; F218-F222 AromaticContact CD1-CE2 3.6Å; F218-F222 HydrophobicContact CD1-CE2 3.6Å; F218-F222 HydrophobicContact CE1-CE2 4.04Å; F218-F222 HydrophobicContact CG-CD2 4.46Å; F218-F222 WeakPolarHBondContact O-CD2 3.15Å; F218-F222 PolarHBondContact O-N 3.5Å; F218-F227 HydrophobicContact CB-CE2 3.84Å; F218-F227 HydrophobicContact CB-CZ 3.81Å; F218-T242 HydrophobicContact CE2-CG2 4.05Å; F218-T242 HydrophobicContact CZ-CG2 4.31Å; F218-V244 HydrophobicContact CE1-CG2 3.96Å; F218-V244 HydrophobicContact CZ-CG2 3.48Å; F218-V244 VanDerWaalsContact CZ-CG2 3.48Å
219S72.8Confident73.5Confident55 Ų5573 Ų7339%0.38539%0.392SS..Hα-helixtrans-56-28.1174.3590000113.1H216 T217 F222 P223H216-S219 PolarHBondContact O-OG 2.02Å; H216-S219 VanDerWaalsContact O-OG 3.12Å; T217-S219 PolarHBondContact O-N 3.41Å; S219-F222 CarbonylContact O-C 3.56Å; S219-P223 WeakPolarHBondContact O-CA 2.99Å
220Q75.8Confident71.5Confident150 Ų15079 Ų7970%0.70141%0.414SS*.Hα-helixtrans-74.2-32.6177.4-57.1178.5-2.500112.4T217 F218T217-Q220 WeakPolarHBondContact O-CB 3.38Å; T217-Q220 PolarHBondContact O-N 3.45Å; F218-Q220 PolarHBondContact O-N 3.44Å; F218-Q220 VanDerWaalsContact O-N 3.13Å
221F74.4Confident69.1Low132 Ų13280.5 Ų80.558%0.57943%0.432SS*.Hα-helixtrans-92.4-23.7179.9-57.6-73.5000112.3P213 T217 F218P213-F221 HydrophobicContact CG-CE2 4.3Å; T217-F221 WeakPolarHBondContact O-CD2 3.04Å; F218-F221 PolarHBondContact O-N 3.46Å
222F73.7Confident66.9Low78 Ų7883.7 Ų83.734%0.34244%0.441SS..  trans-134.974.2-175.2-57.8-82.7000110.3F193 F218 S219 H224 L225F193-F222 HydrophobicContact CE1-CE1 4.21Å; F193-F222 HydrophobicContact CE1-CZ 4.41Å; F193-F222 HydrophobicContact CZ-CE1 4.06Å; F193-F222 HydrophobicContact CZ-CE2 4.11Å; F193-F222 AromaticContact CZ-CZ 3.81Å; F193-F222 HydrophobicContact CZ-CZ 3.81Å; F218-F222 HydrophobicContact CB-CD2 4.32Å; F218-F222 AromaticContact CD1-CD2 3.69Å; F218-F222 HydrophobicContact CD1-CD2 3.69Å; F218-F222 AromaticContact CD1-CE2 3.6Å; F218-F222 HydrophobicContact CD1-CE2 3.6Å; F218-F222 HydrophobicContact CE1-CE2 4.04Å; F218-F222 HydrophobicContact CG-CD2 4.46Å; F218-F222 WeakPolarHBondContact O-CD2 3.15Å; F218-F222 PolarHBondContact O-N 3.5Å; S219-F222 CarbonylContact O-C 3.56Å; F222-H224 PolarHBondContact O-N 3.41Å; F222-L225 HydrophobicContact CB-CB 4.23Å; F222-L225 HydrophobicContact CB-CD1 3.45Å; F222-L225 VanDerWaalsContact CB-CD1 3.45Å; F222-L225 HydrophobicContact CB-CG 3.76Å; F222-L225 HydrophobicContact CD1-CD1 4.23Å; F222-L225 HydrophobicContact CD2-CD1 4.43Å; F222-L225 HydrophobicContact CG-CD1 3.81Å; F222-L225 PolarHBondContact O-N 3.42Å
223P65.2Low65Low102 Ų10291.6 Ų91.666%0.66248%0.475SS*.THydrogen-bonded Turntrans-64.5-13.3-171.925.7-35.5000114.4S219S219-P223 WeakPolarHBondContact O-CA 2.99Å
224H65.4Low63Low174 Ų17496.1 Ų96.181%0.80650%0.496SS*.THydrogen-bonded Turntrans-94.3-5.5178.8-58.2-58.1000113.8F222F222-H224 PolarHBondContact O-N 3.41Å
225L64.7Low61Low26 Ų2698.7 Ų98.714%0.13652%0.515CS..  trans-88.5113.6178.3-63.4-179.5000110.1V148 M191 F193 F222 F227V148-L225 HydrophobicContact CB-CD2 4.04Å; V148-L225 HydrophobicContact CG1-CD1 4.32Å; V148-L225 HydrophobicContact CG1-CD2 4.41Å; V148-L225 HydrophobicContact CG2-CD1 3.96Å; V148-L225 HydrophobicContact CG2-CD2 3.57Å; V148-L225 HydrophobicContact CG2-CG 4.45Å; M191-L225 HydrophobicContact CE-CD1 3.45Å; M191-L225 VanDerWaalsContact CE-CD1 3.45Å; F193-L225 HydrophobicContact CE1-CD1 4.34Å; F222-L225 HydrophobicContact CB-CB 4.23Å; F222-L225 HydrophobicContact CB-CD1 3.45Å; F222-L225 VanDerWaalsContact CB-CD1 3.45Å; F222-L225 HydrophobicContact CB-CG 3.76Å; F222-L225 HydrophobicContact CD1-CD1 4.23Å; F222-L225 HydrophobicContact CD2-CD1 4.43Å; F222-L225 HydrophobicContact CG-CD1 3.81Å; F222-L225 PolarHBondContact O-N 3.42Å; L225-F227 HydrophobicContact CB-CD2 4.23Å; L225-F227 HydrophobicContact CB-CE1 4.26Å; L225-F227 HydrophobicContact CB-CE2 3.52Å; L225-F227 HydrophobicContact CB-CZ 3.55Å; L225-F227 HydrophobicContact CD1-CE1 4.4Å; L225-F227 HydrophobicContact CD1-CE2 4.37Å; L225-F227 HydrophobicContact CD1-CZ 3.68Å; L225-F227 HydrophobicContact CG-CZ 4.27Å; L225-F227 WeakPolarHBondContact O-CD2 3.03Å; L225-F227 PolarHBondContact O-N 3.01Å
226V61.3Low59.3Low98 Ų98104.5 Ų104.559%0.59456%0.556SS**  trans-91.896.4175.9-176.30000107.8S126S126-V226 VanDerWaalsContact CB-O 3.29Å; S126-V226 WeakPolarHBondContact CB-O 3.46Å
227F64.4Low57.9Low20 Ų20104.5 Ų104.59%0.08856%0.557CS.*  trans-81.5134.5176.1-59.7-77.6000110.1L150 M191 L215 F218 L225 L229L150-F227 HydrophobicContact CD1-CD1 4.14Å; L150-F227 HydrophobicContact CD2-CD1 3.99Å; L150-F227 HydrophobicContact CD2-CE1 4.06Å; M191-F227 HydrophobicContact CE-CE1 3.74Å; M191-F227 HydrophobicContact CE-CZ 3.68Å; M191-F227 HydrophobicContact SD-CE1 4.08Å; M191-F227 HydrophobicContact SD-CZ 4.2Å; L215-F227 HydrophobicContact CD1-CD1 4.37Å; L215-F227 HydrophobicContact CD1-CE1 4.19Å; F218-F227 HydrophobicContact CB-CE2 3.84Å; F218-F227 HydrophobicContact CB-CZ 3.81Å; L225-F227 HydrophobicContact CB-CD2 4.23Å; L225-F227 HydrophobicContact CB-CE1 4.26Å; L225-F227 HydrophobicContact CB-CE2 3.52Å; L225-F227 HydrophobicContact CB-CZ 3.55Å; L225-F227 HydrophobicContact CD1-CE1 4.4Å; L225-F227 HydrophobicContact CD1-CE2 4.37Å; L225-F227 HydrophobicContact CD1-CZ 3.68Å; L225-F227 HydrophobicContact CG-CZ 4.27Å; L225-F227 WeakPolarHBondContact O-CD2 3.03Å; L225-F227 PolarHBondContact O-N 3.01Å; F227-L229 HydrophobicContact CB-CD1 4.2Å; F227-L229 HydrophobicContact CB-CD2 4.44Å; F227-L229 HydrophobicContact CB-CG 3.8Å; F227-L229 PolarHBondContact O-N 2.94Å
228P54.9Low56.3Low87 Ų87107.6 Ų107.657%0.56559%0.585SS**  trans-70.479.9162.125.5-23.3000108L150 E230L150-P228 HydrophobicContact CD1-CG 4.17Å; P228-E230 PolarHBondContact O-N 3.28Å
229L53.2Low55.3Low85 Ų85112 Ų11245%0.44562%0.616SS.*  trans-81.7108.7174-73.4163.8000107.7L215 H216 F227 S231L215-L229 HydrophobicContact CD2-CD2 4.38Å; H216-L229 HydrophobicContact CB-CD2 4.45Å; F227-L229 HydrophobicContact CB-CD1 4.2Å; F227-L229 HydrophobicContact CB-CD2 4.44Å; F227-L229 HydrophobicContact CB-CG 3.8Å; F227-L229 PolarHBondContact O-N 2.94Å; L229-S231 PolarHBondContact O-N 3.42Å; L229-S231 VanDerWaalsContact O-N 3.14Å
230E47.7Very low55.1Low185 Ų185112.2 Ų112.286%0.86461%0.611SS**  trans-64.3112.1160.1-71-167.5166.100107.8P228 K232P228-E230 PolarHBondContact O-N 3.28Å; E230-K232 VanDerWaalsContact C-N 3.26Å; E230-K232 PolarHBondContact O-N 3.41Å
231S39.9Very low55.2Low116 Ų116110.7 Ų110.781%0.81160%0.604SS**  trans-6887169.259.20000108.8L229L229-S231 PolarHBondContact O-N 3.42Å; L229-S231 VanDerWaalsContact O-N 3.14Å
232K40.7Very low55.6Low186 Ų186104.4 Ų104.481%0.80958%0.577SS**  trans-100.574.1160.1-129.4177.1-174.2176.30109.1E230 N234E230-K232 VanDerWaalsContact C-N 3.26Å; E230-K232 PolarHBondContact O-N 3.41Å; K232-N234 PolarHBondContact O-N 2.72Å
233E41.5Very low56.2Low179 Ų179102.5 Ų102.584%0.83657%0.57SS**  trans-66.578.3160-166.9173.8-161.700107.3
234N40.1Very low57.4Low152 Ų15297.9 Ų97.981%0.81354%0.54SS*.  trans171.975.6160.1-89.7-20.7000110.5K232K232-N234 PolarHBondContact O-N 2.72Å
235S36.8Very low58.7Low78 Ų7889.6 Ų89.655%0.54550%0.501SS..  trans-156.4132.7136.162.90000108.6E237S235-E237 PolarHBondContact O-N 2.79Å; S235-E237 PolarHBondContact OG-OE2 3.42Å
236S40.2Very low60.1Low137 Ų13790.6 Ų90.696%0.95851%0.505SS*.  trans-6955.3167.854.30000110.4
237E45.9Very low61.7Low124 Ų12486 Ų8658%0.57948%0.477SS*.  trans-105.8131.9180-80.2-169.8143.500111S235 S239S235-E237 PolarHBondContact O-N 2.79Å; S235-E237 PolarHBondContact OG-OE2 3.42Å; E237-S239 PolarHBondContact O-N 3.25Å
238A45.8Very low63.1Low88 Ų8890.4 Ų90.473%0.72749%0.494SS*.  trans-49133.4-176.800000112.5Q240A238-Q240 PolarHBondContact O-N 3.45Å
239S56.1Low63.5Low100 Ų10090.6 Ų90.670%0.69949%0.49SS*.  trans2.975.3158.1-48.70000115.6E237 Q241E237-S239 PolarHBondContact O-N 3.25Å; S239-Q241 PolarHBondContact O-N 2.69Å
240Q69.6Low64.1Low59 Ų5990.8 Ų90.828%0.27649%0.493SS..  trans-64.3112.6179-69.3-177.9-0.900108.6T187 H189 P214 A238T187-Q240 PolarHBondContact O-OE1 2.89Å; H189-Q240 PolarHBondContact CE1-OE1 3.45Å; P214-Q240 WeakPolarHBondContact CA-O 3.47Å; P214-Q240 WeakPolarHBondContact CB-O 3.35Å; P214-Q240 WeakPolarHBondContact CG-O 3Å; A238-Q240 PolarHBondContact O-N 3.45Å
241Q77.1Confident65Low118 Ų11885.6 Ų85.655%0.55147%0.472SS*.PPolyproline II helixtrans-76148.6178.8-66.5173.7-11.700110.3I211 S239I211-Q241 HydrophobicContact CG2-CB 3.77Å; I211-Q241 HydrophobicContact CG2-CG 4.01Å; S239-Q241 PolarHBondContact O-N 2.69Å
242T83.1Confident66.5Low1 Ų183.8 Ų83.81%0.00645%0.452CS..EExtended strand (participates in β ladder)trans-101.2128.1177.6-51.80000109.1H189 M191 G212 P213 L215 F218 V244H189-T242 HydrophobicContact CB-CG2 4.24Å; H189-T242 CarbonylContact O-C 3.54Å; H189-T242 VanDerWaalsContact O-CA 3.3Å; H189-T242 WeakPolarHBondContact O-CA 3.32Å; H189-T242 VanDerWaalsContact O-CG2 3.25Å; H189-T242 WeakPolarHBondContact O-CG2 3.47Å; M191-T242 HydrophobicContact CB-CG2 3.92Å; G212-T242 PolarHBondContact N-O 2.98Å; G212-T242 PolarHBondContact O-N 2.83Å; P213-T242 WeakPolarHBondContact O-CB 3.33Å; P213-T242 PolarHBondContact O-N 2.92Å; P213-T242 PolarHBondContact O-OG1 2.9Å; L215-T242 WeakPolarHBondContact CA-OG1 3.43Å; L215-T242 HydrophobicContact CD1-CG2 4.11Å; L215-T242 PolarHBondContact N-OG1 2.93Å; F218-T242 HydrophobicContact CE2-CG2 4.05Å; F218-T242 HydrophobicContact CZ-CG2 4.31Å; T242-V244 HydrophobicContact CG2-CG2 4.25Å; T242-V244 PolarHBondContact O-N 3.2Å
243L87.3Confident68.1Low38 Ų3877.4 Ų77.420%0.19943%0.43CS..EExtended strand (participates in β ladder)trans-75.2118166-174.867.8000107.6H189 H190 M191H189-L243 PolarHBondContact O-N 3.09Å; H190-L243 WeakPolarHBondContact CA-O 3.05Å; H190-L243 PolarHBondContact CD2-O 3.12Å; H190-L243 VanDerWaalsContact CD2-O 3.28Å; M191-L243 PolarHBondContact N-O 3.48Å
244V89.8Confident69.8Low4 Ų470.7 Ų70.72%0.02440%0.402CS..EExtended strand (participates in β ladder)trans-106.9121.9177.6-176.10000108.6M191 F193 S209 I210 F218 T242 F246M191-V244 CarbonylContact O-C 3.57Å; M191-V244 VanDerWaalsContact O-CA 3.28Å; M191-V244 WeakPolarHBondContact O-CA 3.3Å; F193-V244 HydrophobicContact CD2-CG1 3.59Å; F193-V244 HydrophobicContact CE2-CG1 3.57Å; S209-V244 CarbonylContact C-O 3.51Å; S209-V244 VanDerWaalsContact CA-O 3.23Å; S209-V244 WeakPolarHBondContact CA-O 3.18Å; I210-V244 HydrophobicContact CG1-CB 3.87Å; I210-V244 HydrophobicContact CG1-CG1 4.47Å; I210-V244 PolarHBondContact N-O 3.45Å; I210-V244 PolarHBondContact O-N 2.89Å; F218-V244 HydrophobicContact CE1-CG2 3.96Å; F218-V244 HydrophobicContact CZ-CG2 3.48Å; F218-V244 VanDerWaalsContact CZ-CG2 3.48Å; T242-V244 HydrophobicContact CG2-CG2 4.25Å; T242-V244 PolarHBondContact O-N 3.2Å; V244-F246 HydrophobicContact CG1-CD2 4.33Å; V244-F246 HydrophobicContact CG1-CE2 3.65Å; V244-F246 HydrophobicContact CG1-CZ 3.85Å
245T92.8Very high72Confident0 Ų064.9 Ų64.90%037%0.373CS..EExtended strand (participates in β ladder)trans-114.2133.3176.8-54.30000111V173 H190 M191 S192 F193 A207 Y208 S209 V247V173-T245 VanDerWaalsContact CG1-CB 3.44Å; V173-T245 HydrophobicContact CG1-CG2 3.23Å; V173-T245 WeakPolarHBondContact CG1-OG1 3.39Å; H190-T245 PolarHBondContact NE2-OG1 3.44Å; M191-T245 PolarHBondContact O-N 3.38Å; S192-T245 CarbonylContact C-O 3.55Å; S192-T245 VanDerWaalsContact CA-O 3.3Å; S192-T245 WeakPolarHBondContact CA-O 3.24Å; F193-T245 PolarHBondContact N-O 3.02Å; A207-T245 HydrophobicContact CB-CG2 3.92Å; Y208-T245 WeakPolarHBondContact O-CA 3.4Å; S209-T245 WeakPolarHBondContact OG-CG2 3.5Å; S209-T245 PolarHBondContact OG-OG1 3Å; T245-V247 HydrophobicContact CG2-CG2 4.05Å
246F94.3Very high74.7Confident48 Ų4863.8 Ų63.821%0.21136%0.36CS..EExtended strand (participates in β ladder)trans-105.4127.2171.6-62.2-92.2000108.4F193 A207 Y208 I210 V244F193-F246 HydrophobicContact CB-CD1 3.71Å; F193-F246 HydrophobicContact CB-CE1 4.03Å; F193-F246 HydrophobicContact CB-CG 4.47Å; F193-F246 HydrophobicContact CD2-CD1 4.14Å; F193-F246 AromaticContact CD2-CE1 3.68Å; F193-F246 HydrophobicContact CD2-CE1 3.68Å; F193-F246 HydrophobicContact CD2-CZ 4.01Å; F193-F246 HydrophobicContact CE2-CE1 4.31Å; F193-F246 HydrophobicContact CE2-CZ 4.37Å; F193-F246 HydrophobicContact CG-CD1 4.17Å; F193-F246 AromaticContact CG-CE1 3.96Å; F193-F246 HydrophobicContact CG-CE1 3.96Å; F193-F246 CarbonylContact O-C 3.52Å; F193-F246 WeakPolarHBondContact O-CA 3.33Å; A207-F246 WeakPolarHBondContact CA-O 3.46Å; A207-F246 WeakPolarHBondContact CB-O 3.37Å; Y208-F246 HydrophobicContact CD1-CB 4.12Å; Y208-F246 HydrophobicContact CD2-CD2 4.19Å; Y208-F246 HydrophobicContact CE1-CB 3.54Å; Y208-F246 HydrophobicContact CE1-CD2 4.31Å; Y208-F246 HydrophobicContact CE1-CG 4.14Å; Y208-F246 HydrophobicContact CE2-CB 4.21Å; Y208-F246 AromaticContact CE2-CD2 3.42Å; Y208-F246 HydrophobicContact CE2-CD2 3.42Å; Y208-F246 VanDerWaalsContact CE2-CD2 3.42Å; Y208-F246 HydrophobicContact CE2-CE2 4.1Å; Y208-F246 HydrophobicContact CE2-CG 4.07Å; Y208-F246 AromaticContact CZ-CD2 3.48Å; Y208-F246 VanDerWaalsContact CZ-CD2 3.48Å; Y208-F246 AromaticContact CZ-CG 3.63Å; Y208-F246 PolarHBondContact N-O 3.48Å; Y208-F246 VanDerWaalsContact N-O 3.08Å; Y208-F246 PolarHBondContact O-N 2.81Å; Y208-F246 WeakPolarHBondContact OH-CD2 3.26Å; Y208-F246 WeakPolarHBondContact OH-CG 3.45Å; I210-F246 HydrophobicContact CD1-CE2 3.89Å; I210-F246 HydrophobicContact CG1-CE2 4.15Å; V244-F246 HydrophobicContact CG1-CD2 4.33Å; V244-F246 HydrophobicContact CG1-CE2 3.65Å; V244-F246 HydrophobicContact CG1-CZ 3.85Å
247V95.5Very high77.5Confident2 Ų257.8 Ų57.81%0.01231%0.31CS..EExtended strand (participates in β ladder)trans-120.2130.1-178.9-172.20000108.9L155 I171 F193 V194 D195 I198 L205 K206 A207 T245L155-V247 HydrophobicContact CD2-CG1 3.87Å; I171-V247 HydrophobicContact CG2-CG1 4.39Å; F193-V247 PolarHBondContact O-N 3.11Å; V194-V247 HydrophobicContact CB-CB 4.43Å; V194-V247 HydrophobicContact CG1-CB 4.32Å; V194-V247 HydrophobicContact CG1-CG1 4.49Å; V194-V247 HydrophobicContact CG2-CB 4.15Å; V194-V247 HydrophobicContact CG2-CG2 4.2Å; D195-V247 PolarHBondContact N-O 3.39Å; I198-V247 HydrophobicContact CD1-CG1 4.42Å; L205-V247 HydrophobicContact CD1-CG1 3.54Å; L205-V247 HydrophobicContact CG-CG1 4.24Å; K206-V247 WeakPolarHBondContact O-CA 3.19Å; A207-V247 HydrophobicContact CB-CG2 4.05Å; T245-V247 HydrophobicContact CG2-CG2 4.05Å
248Y93.4Very high80.4Confident111 Ų11151.7 Ų51.744%0.43529%0.286SS..  trans-157.90-174.565.1-84.8000112.6I198 K206 Y208I198-Y248 VanDerWaalsContact CG2-OXT 3.29Å; I198-Y248 WeakPolarHBondContact CG2-OXT 3.13Å; K206-Y248 HydrophobicContact CB-CD2 4.32Å; K206-Y248 HydrophobicContact CB-CE1 4.04Å; K206-Y248 HydrophobicContact CB-CE2 3.82Å; K206-Y248 HydrophobicContact CD-CE2 3.81Å; K206-Y248 HydrophobicContact CG-CE2 4.44Å; K206-Y248 PolarHBondContact N-O 3.05Å; K206-Y248 PolarHBondContact O-N 3.48Å; Y208-Y248 AromaticContact CD1-CE1 3.81Å; Y208-Y248 HydrophobicContact CD1-CE1 3.81Å; Y208-Y248 HydrophobicContact CE1-CD1 4.49Å; Y208-Y248 AromaticContact CE1-CE1 3.93Å; Y208-Y248 HydrophobicContact CE1-CE1 3.93Å

Retrieved 248 of 248 residues in 238.5 ms (Link to these results)