A0A5K4F081_SCHMA Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A5K4F081, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 234 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
1M35.8Very low50.1Low222 Ų222138.8 Ų138.8100%1.09472%0.715SS**  0122.70-74.4-116.370.700107.6S3M1-S3 PolarHBondContact O-N 3.15Å
2P44.5Very low50.1Low133 Ų133136.2 Ų136.286%0.86470%0.702SS**  trans-86.1103-179.231.3-26.5000109.7
3S46.2Very low50Low87 Ų87132.1 Ų132.161%0.60868%0.68SS**  trans-115.9-1.9177.250.40000114.5M1M1-S3 PolarHBondContact O-N 3.15Å
4E50.2Low50.4Low176 Ų176132.9 Ų132.982%0.82268%0.677SS**Hα-helixtrans-85.6-16.9-172-73.5178.4163.200115.4
5Q47.5Very low50.3Low167 Ų167132.6 Ų132.678%0.7867%0.671SS**Hα-helixtrans-86.6-20.5-173.2-153.3173.99.100114.3
6K49.2Very low49.9Very low175 Ų175130.7 Ų130.776%0.76166%0.663SS**Hα-helixtrans-79.6-31.8-179.1-80.2-174.3175.6-178.60113.1
7D50.5Low49.9Very low118 Ų118131.8 Ų131.863%0.63166%0.662SS**Hα-helixtrans-71.7-35.5-178.1-66.8-23.1000111.8I9 H10 E11D7-I9 PolarHBondContact O-N 3.4Å; D7-H10 PolarHBondContact O-N 3.18Å; D7-E11 PolarHBondContact O-N 2.98Å; D7-E11 VanDerWaalsContact O-N 3.12Å
8S60.2Low49.3Very low68 Ų68130.6 Ų130.648%0.47666%0.658SS.*Hα-helixtrans-64.6-37.9179.3-175.30000113.2H10 E11 L12S8-H10 VanDerWaalsContact C-N 3.33Å; S8-H10 PolarHBondContact O-N 2.93Å; S8-E11 PolarHBondContact O-N 3.01Å; S8-L12 PolarHBondContact O-N 3.24Å; S8-L12 VanDerWaalsContact O-N 3.13Å
9I56.5Low48.8Very low109 Ų109127.8 Ų127.856%0.55965%0.652SS**Hα-helixtrans-67.3-38.3177.4-61.8177000110.4D7 E11 L12 I13D7-I9 PolarHBondContact O-N 3.4Å; I9-E11 VanDerWaalsContact C-N 3.34Å; I9-E11 PolarHBondContact O-N 3.01Å; I9-L12 PolarHBondContact O-N 3.33Å; I9-I13 HydrophobicContact CG2-CD1 3.96Å; I9-I13 WeakPolarHBondContact O-CG1 3.3Å; I9-I13 PolarHBondContact O-N 2.79Å; I9-I13 VanDerWaalsContact O-N 3.14Å
10H50.6Low48.3Very low145 Ų145126.9 Ų126.967%0.67165%0.653SS**Hα-helixtrans-69-34.2-179.3-126.3-60.4000112.5D7 S8 K14D7-H10 PolarHBondContact O-N 3.18Å; S8-H10 VanDerWaalsContact C-N 3.33Å; S8-H10 PolarHBondContact O-N 2.93Å; H10-K14 PolarHBondContact O-N 3.07Å
11E59.7Low47.6Very low127 Ų127128.3 Ų128.359%0.59366%0.661SS**Hα-helixtrans-71.3-38.5175.8-163.4167.7-167.800112.1D7 S8 I9 K14 Q15D7-E11 PolarHBondContact O-N 2.98Å; D7-E11 VanDerWaalsContact O-N 3.12Å; S8-E11 PolarHBondContact O-N 3.01Å; I9-E11 VanDerWaalsContact C-N 3.34Å; I9-E11 PolarHBondContact O-N 3.01Å; E11-K14 PolarHBondContact O-N 3.04Å; E11-Q15 PolarHBondContact O-N 3.13Å
12L50.7Low47.3Very low107 Ų107126.9 Ų126.956%0.5665%0.648SS**Hα-helixtrans-67.6-38.3178.8-145.9126.9000112.3S8 I9 K14 Q15 L16S8-L12 PolarHBondContact O-N 3.24Å; S8-L12 VanDerWaalsContact O-N 3.13Å; I9-L12 PolarHBondContact O-N 3.33Å; L12-K14 VanDerWaalsContact C-N 3.32Å; L12-Q15 PolarHBondContact O-N 3.36Å; L12-L16 HydrophobicContact CD2-CD1 4.14Å; L12-L16 WeakPolarHBondContact O-CG 3.42Å; L12-L16 PolarHBondContact O-N 2.93Å; L12-L16 VanDerWaalsContact O-N 3.14Å
13I48.3Very low46.7Very low83 Ų83125.3 Ų125.343%0.42664%0.641SS.*Hα-helixtrans-67.3-34.6174.3-66169.1000111.2I9 K17I9-I13 HydrophobicContact CG2-CD1 3.96Å; I9-I13 WeakPolarHBondContact O-CG1 3.3Å; I9-I13 PolarHBondContact O-N 2.79Å; I9-I13 VanDerWaalsContact O-N 3.14Å; I13-K17 PolarHBondContact O-N 3.2Å; I13-K17 VanDerWaalsContact O-N 3.16Å
14K55.9Low45.8Very low144 Ų144126.7 Ų126.763%0.62665%0.65SS**Hα-helixtrans-69-42.7177.5-161.5179.5179.9-170.20111.5H10 E11 L12 L16 K17 D18H10-K14 PolarHBondContact O-N 3.07Å; E11-K14 PolarHBondContact O-N 3.04Å; L12-K14 VanDerWaalsContact C-N 3.32Å; K14-L16 VanDerWaalsContact C-N 3.33Å; K14-L16 PolarHBondContact O-N 3.07Å; K14-K17 PolarHBondContact O-N 2.86Å; K14-D18 PolarHBondContact O-N 3.15Å
15Q48.6Very low45Very low128 Ų128124.8 Ų124.860%0.59864%0.644SS**Hα-helixtrans-63.4-36.6175.6-70.5-171.913.200112.8E11 L12 D18 S19E11-Q15 PolarHBondContact O-N 3.13Å; L12-Q15 PolarHBondContact O-N 3.36Å; Q15-D18 PolarHBondContact O-N 3.42Å; Q15-S19 WeakPolarHBondContact O-CB 2.83Å; Q15-S19 PolarHBondContact O-N 2.8Å; Q15-S19 PolarHBondContact O-OG 3.2Å; Q15-S19 VanDerWaalsContact O-OG 3.13Å
16L44.5Very low44Very low102 Ų102125.2 Ų125.253%0.53465%0.646SS.*Hα-helixtrans-69.2-33.1176.4-76.5166.5000113.1L12 K14 S19 T20L12-L16 HydrophobicContact CD2-CD1 4.14Å; L12-L16 WeakPolarHBondContact O-CG 3.42Å; L12-L16 PolarHBondContact O-N 2.93Å; L12-L16 VanDerWaalsContact O-N 3.14Å; K14-L16 VanDerWaalsContact C-N 3.33Å; K14-L16 PolarHBondContact O-N 3.07Å; L16-S19 PolarHBondContact O-OG 3.14Å; L16-T20 PolarHBondContact O-N 3.27Å; L16-T20 PolarHBondContact O-OG1 3.06Å
17K49.1Very low43.2Very low150 Ų150123.5 Ų123.565%0.65265%0.645SS**Hα-helixtrans-73.2-37.3175.2-77.5-176.1175.3-176.30112.5I13 K14I13-K17 PolarHBondContact O-N 3.2Å; I13-K17 VanDerWaalsContact O-N 3.16Å; K14-K17 PolarHBondContact O-N 2.86Å
18D40Very low42.2Very low110 Ų110124 Ų12459%0.58865%0.653SS**Hα-helixtrans-77.2-30179.3-70.8-18.9000112.6K14 Q15K14-D18 PolarHBondContact O-N 3.15Å; Q15-D18 PolarHBondContact O-N 3.42Å
19S39.4Very low40.6Very low77 Ų77125 Ų12554%0.53866%0.66SS.*Hα-helixtrans-75.8-22.1178.567.70000114Q15 L16 L21Q15-S19 WeakPolarHBondContact O-CB 2.83Å; Q15-S19 PolarHBondContact O-N 2.8Å; Q15-S19 PolarHBondContact O-OG 3.2Å; Q15-S19 VanDerWaalsContact O-OG 3.13Å; L16-S19 PolarHBondContact O-OG 3.14Å; S19-L21 PolarHBondContact O-N 3.11Å
20T37.9Very low39.4Very low110 Ų110128.5 Ų128.568%0.67568%0.676SS**THydrogen-bonded Turntrans-70.8-17.6178.7-540000112.6L16L16-T20 PolarHBondContact O-N 3.27Å; L16-T20 PolarHBondContact O-OG1 3.06Å
21L34.2Very low38.3Very low156 Ų156129.6 Ų129.682%0.81768%0.681SS**THydrogen-bonded Turntrans-1039.3-176.9-77169.1000115.3S19S19-L21 PolarHBondContact O-N 3.11Å
22K30.3Very low36.7Very low192 Ų192132.2 Ų132.284%0.83569%0.691SS**  trans-133.260175.6-84.9-179.7174.51780112.6
23S30.8Very low35.6Very low101 Ų101133.7 Ų133.771%0.70670%0.699SS**  trans-110.987.9143.860.80000107.7I25S23-I25 PolarHBondContact O-N 3.15Å
24S28.3Very low34.7Very low115 Ų115138.3 Ų138.380%0.80472%0.721SS**  trans-61.6108.2162.6-174.10000105.9E26S24-E26 PolarHBondContact O-N 3.24Å
25I32Very low33.2Very low137 Ų137139.1 Ų139.170%0.70373%0.731SS**  trans-63.692.1168.6-65162.9000105.3S23 N27S23-I25 PolarHBondContact O-N 3.15Å; I25-N27 WeakPolarHBondContact CG2-OD1 3.18Å; I25-N27 PolarHBondContact O-N 3.37Å
26E28Very low32.4Very low176 Ų176138.3 Ų138.382%0.82274%0.735SS**  trans-67.892.3165.7-168.8171.4-170.600105.6S24 V28S24-E26 PolarHBondContact O-N 3.24Å; E26-V28 PolarHBondContact O-N 3.15Å
27N32.3Very low31.4Very low138 Ų138141.6 Ų141.674%0.73875%0.745SS**  trans-55.7106.6172.9-76-30.1000107.7I25 S29I25-N27 WeakPolarHBondContact CG2-OD1 3.18Å; I25-N27 PolarHBondContact O-N 3.37Å; N27-S29 PolarHBondContact O-N 3.19Å
28V29.4Very low30.6Very low130 Ų130141.5 Ų141.579%0.78875%0.752SS**  trans-58.7107170.8176.30000107.3E26 M30E26-V28 PolarHBondContact O-N 3.15Å; V28-M30 PolarHBondContact O-N 2.92Å
29S25.3Very low30.1Very low89 Ų89143.7 Ų143.762%0.62276%0.763SS**  trans-58.9104.5175.7-176.20000110N27 E31N27-S29 PolarHBondContact O-N 3.19Å; S29-E31 PolarHBondContact O-N 3Å
30M32.2Very low29.6Very low181 Ų181147.8 Ų147.889%0.89278%0.779SS**  trans-90.668.1162.6-74.6-80.5-8000108.1V28 K32V28-M30 PolarHBondContact O-N 2.92Å; M30-K32 PolarHBondContact O-N 2.92Å
31E26.9Very low29.5Very low168 Ų168150 Ų15079%0.78579%0.785SS**  trans-80.394.5170.3-136.7179.4-176.600108.8S29S29-E31 PolarHBondContact O-N 3Å
32K26.7Very low29.4Very low183 Ų183147.7 Ų147.780%0.79678%0.782SS**  trans-160.795.8148.3-119.6170.8-177.2173.60112.5M30M30-K32 PolarHBondContact O-N 2.92Å
33N28Very low29.5Very low138 Ų138147.8 Ų147.874%0.73878%0.783SS**  trans56.481.3135.1-57.4-9.2000117.6
34M29.6Very low29.5Very low180 Ų180151.7 Ų151.789%0.88779%0.79SS**  trans-119.987.4140.6-76.3-64.3-144.200108.4V36M34-V36 VanDerWaalsContact C-N 3.28Å; M34-V36 PolarHBondContact O-N 3.22Å
35L24.7Very low29.6Very low160 Ų160153.5 Ų153.584%0.83879%0.79SS**  trans-62.687.2166.9179.680.1000108.3
36V31.4Very low29.6Very low112 Ų112153.7 Ų153.768%0.67979%0.793SS**  trans-110.898.1163.1-178.20000106.7M34 N38M34-V36 VanDerWaalsContact C-N 3.28Å; M34-V36 PolarHBondContact O-N 3.22Å; V36-N38 PolarHBondContact O-N 3.41Å
37K24Very low29.9Very low170 Ų170153.6 Ų153.674%0.73980%0.797SS**  trans-50.9120.9164.8-72.5171.8171.8179.20108.1
38N31.3Very low29.9Very low149 Ų149153 Ų15380%0.79780%0.798SS**  trans-138.1124.8151.3-87.9-26.9000107.2V36V36-N38 PolarHBondContact O-N 3.41Å
39D29.8Very low30.1Very low155 Ų155156.5 Ų156.583%0.82980%0.803SS**  trans-64.1142.4-164-66-57.6000113.4I41D39-I41 PolarHBondContact O-N 3.25Å
40N29.3Very low30.5Very low163 Ų163164.1 Ų164.187%0.87282%0.818SS**  trans-52.4116.6164.8-75-38.6000111
41I34.3Very low30.6Very low158 Ų158164.8 Ų164.881%0.8182%0.816SS**  trans-134.9102.3140.6-59.4-178.4000108.3D39D39-I41 PolarHBondContact O-N 3.25Å
42S32.1Very low31Very low107 Ų107162.2 Ų162.275%0.74882%0.817SS**  trans-47.4127.9163.452.30000112.9
43K32.7Very low31.3Very low194 Ų194164.9 Ų164.984%0.84382%0.822SS**  trans-139115.1139.1-74.9-154.7175.1-173.80109D45K43-D45 PolarHBondContact O-N 3.31Å; K43-D45 VanDerWaalsContact O-N 3.07Å
44E30.4Very low31.9Very low182 Ų182167.3 Ų167.385%0.8583%0.826SS**  trans-53.1104.4169.4-74.1168.6126.800110.2N46E44-N46 PolarHBondContact O-N 3.38Å
45D31.5Very low32.3Very low154 Ų154164.2 Ų164.282%0.82482%0.819SS**  trans-75.6101.8162.5-92.3-29.9000108.5K43 L47K43-D45 PolarHBondContact O-N 3.31Å; K43-D45 VanDerWaalsContact O-N 3.07Å; D45-L47 PolarHBondContact O-N 3.04Å
46N32.2Very low32.7Very low140 Ų140164.5 Ų164.575%0.74982%0.821SS**  trans-56.899.8167-80.6-76.4000109.7E44 T48E44-N46 PolarHBondContact O-N 3.38Å; N46-T48 PolarHBondContact O-N 2.85Å; N46-T48 PolarHBondContact O-OG1 3.46Å
47L33.7Very low32.9Very low175 Ų175167.3 Ų167.392%0.91683%0.829SS**  trans-66.170.1170-72.8164.5000110.8D45 K49D45-L47 PolarHBondContact O-N 3.04Å; L47-K49 PolarHBondContact O-N 3.33Å; L47-K49 VanDerWaalsContact O-N 3.17Å
48T32.5Very low33.7Very low125 Ų125168.5 Ų168.577%0.76783%0.834SS**  trans-7799.9165.525.80000108.9N46 R50N46-T48 PolarHBondContact O-N 2.85Å; N46-T48 PolarHBondContact O-OG1 3.46Å; T48-R50 PolarHBondContact O-N 3.07Å
49K34.3Very low33.9Very low203 Ų203170.3 Ų170.388%0.88384%0.837SS**  trans8.373.5155.3-66.6177.9177.8176.10115.1L47 K51L47-K49 PolarHBondContact O-N 3.33Å; L47-K49 VanDerWaalsContact O-N 3.17Å; K49-K51 PolarHBondContact O-N 3.03Å
50R32.1Very low34.3Very low249 Ų249169.1 Ų169.194%0.9483%0.83SS**  trans-77.6106.5169.1-134176.8-176.2173.51.5106.9T48 S52T48-R50 PolarHBondContact O-N 3.07Å; R50-S52 PolarHBondContact O-N 3.41Å
51K35.5Very low34.6Very low195 Ų195165.2 Ų165.285%0.84881%0.814SS**  trans-43.5125.9175.9-70.3177.3176.4178.50109.6K49 R53K49-K51 PolarHBondContact O-N 3.03Å; K51-R53 PolarHBondContact O-N 3.4Å
52S35.6Very low35.3Very low115 Ų115166 Ų16680%0.80481%0.814SS**  trans-57.3103.217551.30000109.2R50 K54R50-S52 PolarHBondContact O-N 3.41Å; S52-K54 PolarHBondContact O-N 3.09Å; S52-K54 VanDerWaalsContact O-N 3.15Å
53R31.8Very low35.6Very low239 Ų239165.8 Ų165.890%0.90281%0.809SS**  trans-71.7106.4163-76.1-176.4173.3-177.4-2.6105.5K51K51-R53 PolarHBondContact O-N 3.4Å
54K40.5Very low35.6Very low188 Ų188163.7 Ų163.782%0.81780%0.803SS**  trans-48.7130.5169-74.8-179.1176.1-178.60107.8S52 L56S52-K54 PolarHBondContact O-N 3.09Å; S52-K54 VanDerWaalsContact O-N 3.15Å; K54-L56 PolarHBondContact O-N 2.87Å
55P39Very low36.1Very low116 Ų116161.5 Ų161.575%0.75380%0.797SS**  trans-59.8125.2179.819.9-27.1000108.7M57P55-M57 VanDerWaalsContact C-N 3.32Å; P55-M57 PolarHBondContact O-N 3.26Å
56L33.4Very low36.3Very low166 Ų166161.5 Ų161.587%0.86979%0.792SS**  trans-6598171-159.184.1000105.8K54 K58K54-L56 PolarHBondContact O-N 2.87Å; L56-K58 PolarHBondContact O-N 2.86Å
57M35.2Very low36.5Very low171 Ų171161.7 Ų161.784%0.84279%0.793SS**  trans-60.5106.8174.5-67.8-155.786.500106.8P55 Q59P55-M57 VanDerWaalsContact C-N 3.32Å; P55-M57 PolarHBondContact O-N 3.26Å; M57-Q59 PolarHBondContact O-N 3.22Å
58K40.8Very low36.7Very low194 Ų194163.1 Ų163.184%0.84379%0.792SS**  trans-60.1110.2165.1-69.3-177.4178.5-1790105.2L56 L60L56-K58 PolarHBondContact O-N 2.86Å; K58-L60 PolarHBondContact O-N 2.92Å; K58-L60 VanDerWaalsContact O-N 3.15Å
59Q35.1Very low36.9Very low187 Ų187166.7 Ų166.787%0.87479%0.791SS**PPolyproline II helixtrans-52.8121.9170.1-80.5177-1600107.1M57M57-Q59 PolarHBondContact O-N 3.22Å
60L38.1Very low37.3Very low130 Ų130163.1 Ų163.168%0.68178%0.781SS**PPolyproline II helixtrans-59133169.4-121.889.2000107K58 E62K58-L60 PolarHBondContact O-N 2.92Å; K58-L60 VanDerWaalsContact O-N 3.15Å; L60-E62 PolarHBondContact O-N 3.15Å; L60-E62 VanDerWaalsContact O-N 3.15Å
61P36Very low37.6Very low82 Ų82158.8 Ų158.853%0.53278%0.776SS.*PPolyproline II helixtrans-58.4123.1175.8-20.831.3000109.7T63 M64P61-T63 PolarHBondContact O-N 3.3Å; P61-M64 PolarHBondContact O-N 3.45Å; P61-M64 VanDerWaalsContact O-N 3.13Å
62E48.6Very low37.9Very low175 Ų175153 Ų15382%0.81877%0.772SS**G310 helixtrans-52.5-15.4177.9-71.6176.8156.900113.3L60 M64 L65L60-E62 PolarHBondContact O-N 3.15Å; L60-E62 VanDerWaalsContact O-N 3.15Å; E62-M64 VanDerWaalsContact C-N 3.29Å; E62-M64 PolarHBondContact O-N 2.91Å; E62-L65 PolarHBondContact O-N 3.41Å
63T38.9Very low38.5Very low102 Ų102149.9 Ų149.963%0.62675%0.75SS**G310 helixtrans-65.9-24.7178.158.50000113.9P61P61-T63 PolarHBondContact O-N 3.3Å
64M32.7Very low39.4Very low149 Ų149140.6 Ų140.673%0.73473%0.728SS**G310 helixtrans-83.8-15-179.8-68.2-167.473.200114.1P61 E62 Q66P61-M64 PolarHBondContact O-N 3.45Å; P61-M64 VanDerWaalsContact O-N 3.13Å; E62-M64 VanDerWaalsContact C-N 3.29Å; E62-M64 PolarHBondContact O-N 2.91Å; M64-Q66 VanDerWaalsContact C-N 3.33Å
65L40.2Very low40.8Very low136 Ų136139.2 Ų139.271%0.71272%0.722SS**G310 helixtrans-93.611.7176.9-71.9171.5000113E62 N67E62-L65 PolarHBondContact O-N 3.41Å; L65-N67 PolarHBondContact O-N 2.97Å
66Q35.6Very low42.8Very low154 Ų154138.4 Ų138.472%0.7271%0.711SS**  trans-77.181.8167.8-64.3-164.77.900108.8M64 K68M64-Q66 VanDerWaalsContact C-N 3.33Å; Q66-K68 PolarHBondContact O-N 3.33Å
67N37.5Very low44.8Very low145 Ų145133.4 Ų133.478%0.77569%0.687SS**  trans-43116.2164.4-71.9-30.7000108.1L65 R69L65-N67 PolarHBondContact O-N 2.97Å; N67-R69 PolarHBondContact O-N 2.89Å
68K37.9Very low46.9Very low204 Ų204130.7 Ų130.789%0.88767%0.671SS**  trans-53.5102177.3-90.6-176.4174.5-179.20108.1Q66 I70Q66-K68 PolarHBondContact O-N 3.33Å; K68-I70 PolarHBondContact O-N 3.48Å
69R35.6Very low48.6Very low201 Ų201123.9 Ų123.976%0.75864%0.644SS**  trans-58.2119.5177-106.5173.6169.7169.6-5.8108.3N67 N71N67-R69 PolarHBondContact O-N 2.89Å; R69-N71 PolarHBondContact O-N 2.72Å
70I43.7Very low51Low128 Ų128122.6 Ų122.666%0.65664%0.643SS**  trans-74.4112.8158.3-20.5177.4000104.6K68 G72 S73K68-I70 PolarHBondContact O-N 3.48Å; I70-G72 PolarHBondContact O-N 2.93Å; I70-S73 PolarHBondContact O-N 3.49Å; I70-S73 PolarHBondContact O-OG 3.32Å; I70-S73 VanDerWaalsContact O-OG 3.07Å
71N38.2Very low52.7Low158 Ų158123.9 Ų123.985%0.84565%0.645SS**THydrogen-bonded Turntrans-53.5118177.3-76.1-20.9000108.7R69R69-N71 PolarHBondContact O-N 2.72Å
72G42.4Very low54.6Low73 Ų73122.3 Ų122.375%0.75365%0.645SS**THydrogen-bonded Turntrans100-12.8178.800000116.1I70 G74I70-G72 PolarHBondContact O-N 2.93Å; G72-G74 PolarHBondContact O-N 3.03Å
73S46.7Very low55.7Low49 Ų49117.9 Ų117.934%0.34363%0.627SS.*  trans-72.7114.6165.966.10000107.6I70I70-S73 PolarHBondContact O-N 3.49Å; I70-S73 PolarHBondContact O-OG 3.32Å; I70-S73 VanDerWaalsContact O-OG 3.07Å
74G52Low57.5Low44 Ų44117.5 Ų117.545%0.45462%0.62SS.*PPolyproline II helixtrans-48.3172.8164.700000112.2G72 P88G72-G74 PolarHBondContact O-N 3.03Å; G74-P88 WeakPolarHBondContact O-CG 3.41Å
75K69.2Low59.6Low160 Ų160115.4 Ų115.470%0.69661%0.611SS**PPolyproline II helixtrans-84.4145174.3-69.5-178.3176.5-1770110
76L80.5Confident61.1Low98 Ų98111.4 Ų111.451%0.51359%0.594SS.*PPolyproline II helixtrans-62.1131.4156.9-62170.2000107.1F78 L84 V87L76-F78 HydrophobicContact CB-CE2 3.71Å; L76-F78 HydrophobicContact CB-CZ 4.1Å; L76-F78 HydrophobicContact CD1-CZ 4.4Å; L76-L84 HydrophobicContact CB-CD1 4.08Å; L76-L84 HydrophobicContact CD2-CD1 3.96Å; L76-V87 HydrophobicContact CD2-CB 4.35Å; L76-V87 HydrophobicContact CD2-CG1 3.93Å
77V75.2Confident62.9Low62 Ų62108.6 Ų108.638%0.37659%0.587SS.*EExtended strand (participates in β ladder)trans-113.2132.7177-168.90000107.9I85 S86V77-I85 HydrophobicContact CB-CD1 4.21Å; V77-I85 HydrophobicContact CB-CG1 3.88Å; V77-I85 HydrophobicContact CG1-CD1 3.56Å; V77-I85 HydrophobicContact CG1-CG1 3.76Å; V77-I85 WeakPolarHBondContact O-CG1 3.3Å; V77-I85 PolarHBondContact O-N 3.05Å; V77-S86 VanDerWaalsContact CB-OG 3.27Å; V77-S86 WeakPolarHBondContact CB-OG 3.27Å; V77-S86 WeakPolarHBondContact CG2-OG 3.44Å; V77-S86 PolarHBondContact N-O 3.41Å; V77-S86 VanDerWaalsContact N-O 3.09Å; V77-S86 PolarHBondContact O-N 3Å
78F79.9Confident64.3Low113 Ų113103.1 Ų103.150%0.49656%0.56SS.*EExtended strand (participates in β ladder)trans-115.1152.3177.9-59.1-93.9000109.5L76 G82 N83 L84L76-F78 HydrophobicContact CB-CE2 3.71Å; L76-F78 HydrophobicContact CB-CZ 4.1Å; L76-F78 HydrophobicContact CD1-CZ 4.4Å; F78-G82 WeakPolarHBondContact CD1-O 3.47Å; F78-N83 CarbonylContact C-O 3.56Å; F78-N83 WeakPolarHBondContact CA-O 3.4Å; F78-L84 HydrophobicContact CD1-CB 4.33Å; F78-L84 HydrophobicContact CD1-CD1 4.37Å; F78-L84 HydrophobicContact CE1-CB 4.19Å; F78-L84 HydrophobicContact CE1-CD1 3.96Å; F78-L84 HydrophobicContact CZ-CD1 4.08Å
79D76.8Confident65.2Low52 Ų52101.4 Ų101.428%0.27855%0.552SS.*  trans-78.2-177.8165.764.417.4000111.3E81 G82 N83 I85D79-E81 PolarHBondContact O-N 3.17Å; D79-E81 WeakPolarHBondContact OD1-CA 3.49Å; D79-E81 PolarHBondContact OD1-N 2.94Å; D79-G82 PolarHBondContact O-N 3.33Å; D79-G82 PolarHBondContact OD1-N 2.88Å; D79-N83 PolarHBondContact N-O 2.75Å; D79-N83 PolarHBondContact OD1-N 2.72Å; D79-N83 PolarHBondContact OD1-ND2 2.99Å; D79-N83 WeakPolarHBondContact OD2-CB 3.19Å; D79-N83 PolarHBondContact OD2-ND2 2.9Å; D79-I85 HydrophobicContact CB-CG2 3.86Å
80D84.5Confident66.1Low160 Ų16099.2 Ų99.286%0.85656%0.555SS**THydrogen-bonded Turntrans-71.6-16.5177.856.8-30.4000113.9
81E74.7Confident66.2Low156 Ų156101.9 Ų101.973%0.72956%0.558SS**THydrogen-bonded Turntrans-88.4-7.5174.2-65.3177.1-179.700112.6D79 N83D79-E81 PolarHBondContact O-N 3.17Å; D79-E81 WeakPolarHBondContact OD1-CA 3.49Å; D79-E81 PolarHBondContact OD1-N 2.94Å; E81-N83 WeakPolarHBondContact CB-ND2 3.13Å; E81-N83 PolarHBondContact OE2-ND2 2.91Å
82G75.4Confident66.5Low50 Ų50100.1 Ų100.152%0.51556%0.555SS.*SBendtrans88.68.7-179.300000114.4F78 D79F78-G82 WeakPolarHBondContact CD1-O 3.47Å; D79-G82 PolarHBondContact O-N 3.33Å; D79-G82 PolarHBondContact OD1-N 2.88Å
83N72Confident66.4Low82 Ų82102.4 Ų102.444%0.43955%0.554SS.*  trans-78.9142.8176.3-48.5-67000110.9F78 D79 E81 I85F78-N83 CarbonylContact C-O 3.56Å; F78-N83 WeakPolarHBondContact CA-O 3.4Å; D79-N83 PolarHBondContact N-O 2.75Å; D79-N83 PolarHBondContact OD1-N 2.72Å; D79-N83 PolarHBondContact OD1-ND2 2.99Å; D79-N83 WeakPolarHBondContact OD2-CB 3.19Å; D79-N83 PolarHBondContact OD2-ND2 2.9Å; E81-N83 WeakPolarHBondContact CB-ND2 3.13Å; E81-N83 PolarHBondContact OE2-ND2 2.91Å; N83-I85 PolarHBondContact O-N 2.94Å
84L76.1Confident65.9Low93 Ų93106.3 Ų106.349%0.48757%0.571SS.*EExtended strand (participates in β ladder)trans-72.8113177.2-178.867.3000110.6L76 F78 S86 V87L76-L84 HydrophobicContact CB-CD1 4.08Å; L76-L84 HydrophobicContact CD2-CD1 3.96Å; F78-L84 HydrophobicContact CD1-CB 4.33Å; F78-L84 HydrophobicContact CD1-CD1 4.37Å; F78-L84 HydrophobicContact CE1-CB 4.19Å; F78-L84 HydrophobicContact CE1-CD1 3.96Å; F78-L84 HydrophobicContact CZ-CD1 4.08Å; L84-S86 WeakPolarHBondContact CD1-O 3.24Å; L84-V87 HydrophobicContact CD1-CG1 4.39Å; L84-V87 HydrophobicContact CD2-CG1 3.7Å; L84-V87 HydrophobicContact CG-CG1 4.31Å
85I77.6Confident65.2Low105 Ų105110.8 Ų110.854%0.53859%0.585SS.*EExtended strand (participates in β ladder)trans-98.8-23.8-179.857.9163.1000113.7V77 D79 N83V77-I85 HydrophobicContact CB-CD1 4.21Å; V77-I85 HydrophobicContact CB-CG1 3.88Å; V77-I85 HydrophobicContact CG1-CD1 3.56Å; V77-I85 HydrophobicContact CG1-CG1 3.76Å; V77-I85 WeakPolarHBondContact O-CG1 3.3Å; V77-I85 PolarHBondContact O-N 3.05Å; D79-I85 HydrophobicContact CB-CG2 3.86Å; N83-I85 PolarHBondContact O-N 2.94Å
86S70.8Confident63.5Low52 Ų52109.1 Ų109.136%0.36458%0.584SS.*EExtended strand (participates in β ladder)trans-154.2145.2171.770.10000113.5V77 L84V77-S86 VanDerWaalsContact CB-OG 3.27Å; V77-S86 WeakPolarHBondContact CB-OG 3.27Å; V77-S86 WeakPolarHBondContact CG2-OG 3.44Å; V77-S86 PolarHBondContact N-O 3.41Å; V77-S86 VanDerWaalsContact N-O 3.09Å; V77-S86 PolarHBondContact O-N 3Å; L84-S86 WeakPolarHBondContact CD1-O 3.24Å
87V74.8Confident61.3Low95 Ų95113.4 Ų113.458%0.57660%0.598SS**  trans-107.2145.9170.6-64.20000110.2L76 L84 K89L76-V87 HydrophobicContact CD2-CB 4.35Å; L76-V87 HydrophobicContact CD2-CG1 3.93Å; L84-V87 HydrophobicContact CD1-CG1 4.39Å; L84-V87 HydrophobicContact CD2-CG1 3.7Å; L84-V87 HydrophobicContact CG-CG1 4.31Å; V87-K89 PolarHBondContact O-N 3.33Å
88P65.4Low59.1Low30 Ų30118.4 Ų118.420%0.19562%0.617CS.*  trans-56.9131.9172.7-26.637.3000111.5G74 L90G74-P88 WeakPolarHBondContact O-CG 3.41Å; P88-L90 PolarHBondContact O-N 2.83Å; P88-L90 VanDerWaalsContact O-N 3.15Å
89K57.7Low56.6Low169 Ų169119.2 Ų119.274%0.73563%0.627SS**  trans-67115.7167.6-77-175.2178.6178.20108.5V87 Y91V87-K89 PolarHBondContact O-N 3.33Å; K89-Y91 HydrophobicContact CB-CE2 4.34Å; K89-Y91 PolarHBondContact O-N 3.2Å
90L54.6Low54.4Low155 Ų155124.8 Ų124.881%0.81265%0.651SS**  trans-73.1108168.6-62.2177.8000107.3P88P88-L90 PolarHBondContact O-N 2.83Å; P88-L90 VanDerWaalsContact O-N 3.15Å
91Y45.3Very low51.8Low184 Ų184122.1 Ų122.172%0.72265%0.645SS**  trans-75.7134.7167.1-67.1-83.9000108.2K89 V93K89-Y91 HydrophobicContact CB-CE2 4.34Å; K89-Y91 PolarHBondContact O-N 3.2Å; Y91-V93 PolarHBondContact O-N 3.24Å; Y91-V93 VanDerWaalsContact O-N 3.11Å
92P44.5Very low49.8Very low121 Ų121124.5 Ų124.579%0.78665%0.653SS**  trans-58.8121.4172.323.5-30.2000108.2N94P92-N94 PolarHBondContact O-N 3.26Å
93V40.1Very low47.4Very low120 Ų120127.6 Ų127.673%0.72766%0.662SS**  trans-62.6108.7169.9176.20000106.2Y91 N95Y91-V93 PolarHBondContact O-N 3.24Å; Y91-V93 VanDerWaalsContact O-N 3.11Å; V93-N95 VanDerWaalsContact CG1-OD1 3.3Å; V93-N95 WeakPolarHBondContact CG1-OD1 3.43Å; V93-N95 PolarHBondContact O-N 3.31Å
94N37.2Very low45.4Very low131 Ų131130.3 Ų130.370%0.70168%0.682SS**  trans-70.498.5172-165.85.7000107P92 N96P92-N94 PolarHBondContact O-N 3.26Å; N94-N96 PolarHBondContact O-N 2.85Å
95N36Very low42.9Very low139 Ų139132.7 Ų132.774%0.74370%0.695SS**  trans-68.412.8-178.1-85.5-5.3000114.1V93 K97V93-N95 VanDerWaalsContact CG1-OD1 3.3Å; V93-N95 WeakPolarHBondContact CG1-OD1 3.43Å; V93-N95 PolarHBondContact O-N 3.31Å; N95-K97 PolarHBondContact O-N 3.01Å
96N35.3Very low40.6Very low125 Ų125132.3 Ų132.367%0.66870%0.702SS**  trans-97.392.3178.5-74.8-22000110.8N94N94-N96 PolarHBondContact O-N 2.85Å
97K32.7Very low38.5Very low187 Ų187138.8 Ų138.881%0.81373%0.726SS**  trans54120.5137.8-66.8-178.3177-179.20118.9N95N95-K97 PolarHBondContact O-N 3.01Å
98Q28.8Very low36.1Very low167 Ų167139.2 Ų139.278%0.7873%0.733SS**  trans71.7114.5146.3-62.1-158.4-75.200118.3
99D28.5Very low34.3Very low131 Ų131145.6 Ų145.670%0.70177%0.766SS**  62128.1127.7-62.7-36.5000119.9
100E30.6Very low32.8Very low168 Ų168141.1 Ų141.179%0.78577%0.767SS**  trans81.4113.8150.6-67.5179177.500119.5
101S29.4Very low31.6Very low104 Ų104140.3 Ų140.373%0.72777%0.769SS**  trans56.3100.3149.359.70000118.2
102F32Very low30.9Very low207 Ų207138 Ų13891%0.90877%0.769SS**  trans-109.890.4156.1-71.5-78000109.3
103T25.6Very low30.3Very low115 Ų115138.9 Ų138.971%0.70677%0.767SS**  trans-68.2129.5154.342.30000108.1D105T103-D105 PolarHBondContact O-N 3.26Å; T103-D105 VanDerWaalsContact O-N 3.15Å
104T30.4Very low30.1Very low138 Ų138140.7 Ų140.785%0.84777%0.773SS**  trans-78.392177.849.80000109.3
105D24.6Very low29.8Very low143 Ų143142.4 Ų142.477%0.76578%0.78SS**  trans-104.3135.5169.3-75.2-38.7000111.7T103T103-D105 PolarHBondContact O-N 3.26Å; T103-D105 VanDerWaalsContact O-N 3.15Å
106S27.4Very low29.5Very low98 Ų98143 Ų14369%0.68578%0.783SS**  trans-53.5168.1-175.4-53.80000115.8
107H27.1Very low29.3Very low187 Ų187139.8 Ų139.887%0.86678%0.779SS**  trans144.8132.3147.7-68.6-43.9000108
108S25.4Very low29.2Very low104 Ų104137.7 Ų137.773%0.72778%0.777SS**  cis-175.5144.38.849.70000109.4
109N28Very low29.2Very low165 Ų165138.6 Ų138.688%0.88278%0.781SS**  trans36.6134.8140.1-67.8-4.1000124.6
110G26.1Very low29.5Very low74 Ų74139 Ų13976%0.76378%0.781SS**  trans92.3124.3149.700000112.8
111T28.3Very low29.5Very low138 Ų138136.5 Ų136.585%0.84778%0.78SS**  cis-166.6152.340.4-39.70000107.9
112D31.6Very low29.6Very low137 Ų137137.3 Ų137.373%0.73378%0.775SS**  trans-49.7137.2-177-59-60.4000115.5
113N31.8Very low29.3Very low139 Ų139134.4 Ų134.474%0.74376%0.764SS**  trans39.296.5134.4-51.3-28.3000117.4
114N34.4Very low29.5Very low158 Ų158138.7 Ų138.785%0.84577%0.767SS**  -161.2128113.2-91.5-28.2000110.9L116N114-L116 VanDerWaalsContact C-N 3.35Å; N114-L116 PolarHBondContact O-N 2.97Å
115I31.4Very low29.4Very low167 Ų167141.5 Ų141.586%0.85676%0.762SS**  trans-56.289.3-179.8-60.8154.4000109.1G117I115-G117 VanDerWaalsContact C-N 3.29Å
116L30.3Very low29.7Very low152 Ų152142.7 Ų142.780%0.79676%0.761SS**  trans-93.981.5149.1-152.672.8000104.4N114 N118N114-L116 VanDerWaalsContact C-N 3.35Å; N114-L116 PolarHBondContact O-N 2.97Å; L116-N118 PolarHBondContact O-N 2.87Å
117G30.6Very low29.7Very low56 Ų56144.5 Ų144.558%0.57777%0.768SS**  trans-50111.7166.500000105.9I115 E119I115-G117 VanDerWaalsContact C-N 3.29Å; G117-E119 PolarHBondContact O-N 3.17Å
118N31.3Very low29.7Very low144 Ų144142.1 Ų142.177%0.7776%0.761SS**  trans-59.596.1176.5-73.2-25000105.7L116 I120L116-N118 PolarHBondContact O-N 2.87Å; N118-I120 VanDerWaalsContact C-N 3.31Å; N118-I120 PolarHBondContact O-N 2.98Å
119E28.2Very low29.8Very low186 Ų186146.7 Ų146.787%0.86977%0.767SS**  trans-62.298.1175.5-159.5172.7-155.900104.9G117 P121G117-E119 PolarHBondContact O-N 3.17Å; E119-P121 WeakPolarHBondContact O-CD 3.27Å
120I36.1Very low29.8Very low139 Ų139142.7 Ų142.771%0.71375%0.753SS**  trans-70.7114.6176-60174.1000104.7N118 I122N118-I120 VanDerWaalsContact C-N 3.31Å; N118-I120 PolarHBondContact O-N 2.98Å; I120-I122 PolarHBondContact O-N 3Å
121P29.3Very low29.9Very low116 Ų116150 Ų15075%0.75376%0.759SS**  trans-65.4107.1179.825.5-31000108.2E119 E123E119-P121 WeakPolarHBondContact O-CD 3.27Å; P121-E123 PolarHBondContact O-N 3.15Å; P121-E123 VanDerWaalsContact O-N 3.1Å
122I31.3Very low30.1Very low121 Ų121148.1 Ų148.162%0.62175%0.751SS**  trans-73.8100.3172.5-59.4175.4000106.5I120 W124I120-I122 PolarHBondContact O-N 3Å; I122-W124 HydrophobicContact CG2-CD2 4.21Å; I122-W124 HydrophobicContact CG2-CG 4.41Å; I122-W124 HydrophobicContact CG2-CZ2 4.18Å; I122-W124 PolarHBondContact O-N 2.85Å
123E25.4Very low30.2Very low145 Ų145149.9 Ų149.968%0.67876%0.761SS**  trans-69.696.3170.8-169.8-170.5-151.800108.8P121 R125P121-E123 PolarHBondContact O-N 3.15Å; P121-E123 VanDerWaalsContact O-N 3.1Å; E123-R125 PolarHBondContact O-N 3.2Å; E123-R125 IonicContact OE2-CZ 3.97Å; E123-R125 IonicContact OE2-NE 3.15Å; E123-R125 IonicContact OE2-NH2 3.81Å; E123-R125 PolarHBondContact OE2-NH2 3.44Å; E123-R125 VanDerWaalsContact OE2-NH2 3.15Å
124W31.2Very low30.3Very low205 Ų205147 Ų14778%0.77775%0.751SS**  trans-71.6118.4172.3-67.294.5000110.2I122I122-W124 HydrophobicContact CG2-CD2 4.21Å; I122-W124 HydrophobicContact CG2-CG 4.41Å; I122-W124 HydrophobicContact CG2-CZ2 4.18Å; I122-W124 PolarHBondContact O-N 2.85Å
125R27Very low30.7Very low197 Ų197146.7 Ų146.774%0.74376%0.755SS**  trans-94.3113.3168.2-62.9-174.9-171.3-161.5-0.5109.4E123 V127E123-R125 PolarHBondContact O-N 3.2Å; E123-R125 IonicContact OE2-CZ 3.97Å; E123-R125 IonicContact OE2-NE 3.15Å; E123-R125 IonicContact OE2-NH2 3.81Å; E123-R125 PolarHBondContact OE2-NH2 3.44Å; E123-R125 VanDerWaalsContact OE2-NH2 3.15Å; R125-V127 PolarHBondContact O-N 3.38Å; R125-V127 VanDerWaalsContact O-N 3.17Å
126F31.1Very low30.8Very low168 Ų168144 Ų14474%0.73775%0.746SS**  trans-74.5102.9169-71.7-84.4000109.4L128F126-L128 PolarHBondContact O-N 3.1Å
127V27.1Very low30.8Very low136 Ų136143.6 Ų143.682%0.82475%0.745SS**  trans-81.491.3166.7-174.90000107.4R125 K129R125-V127 PolarHBondContact O-N 3.38Å; R125-V127 VanDerWaalsContact O-N 3.17Å; V127-K129 PolarHBondContact O-N 2.92Å
128L26.8Very low30.9Very low138 Ų138148.6 Ų148.672%0.72376%0.759SS**  trans-68.6126.4167.1-107.6101.7000108.7F126 S130F126-L128 PolarHBondContact O-N 3.1Å; L128-S130 PolarHBondContact O-N 3.44Å
129K28.5Very low30.8Very low199 Ų199150.6 Ų150.687%0.86576%0.763SS**  trans-65.381.7164.8-97.7179.2174.4174.50108.5V127V127-K129 PolarHBondContact O-N 2.92Å
130S27.9Very low31.3Very low82 Ų82151 Ų15157%0.57376%0.763SS**  trans-109.196.9164.7-59.40000107.1L128 S132L128-S130 PolarHBondContact O-N 3.44Å; S130-S132 PolarHBondContact O-N 3.5Å
131Y28.3Very low30.9Very low228 Ų228147.7 Ų147.789%0.89476%0.763SS**  trans-47.8109.7161.9-84.4-91.2000108.4
132S31.8Very low31.1Very low97 Ų97149.4 Ų149.468%0.67876%0.764SS**  trans-153.396.7163.6-1700000108S130 S134S130-S132 PolarHBondContact O-N 3.5Å; S132-S134 VanDerWaalsContact C-N 3.32Å; S132-S134 PolarHBondContact O-N 2.87Å
133N34.1Very low30.9Very low175 Ų175152.4 Ų152.494%0.93677%0.767SS**  trans-60.195.8166.2-85.8-12.3000108.1
134S34.9Very low31.1Very low79 Ų79152.2 Ų152.255%0.55277%0.77SS**  trans-14496.8170.9170.90000108S132 T136S132-S134 VanDerWaalsContact C-N 3.32Å; S132-S134 PolarHBondContact O-N 2.87Å; S134-T136 PolarHBondContact O-N 2.76Å
135T42Very low30.9Very low150 Ų150148.9 Ų148.992%0.9277%0.767SS**  trans-70.824.1-174.3-15.70000114.1
136T32.8Very low30.9Very low110 Ų110143.7 Ų143.768%0.67576%0.761SS**SBendtrans-123.995.5-178.659.40000110.5S134S134-T136 PolarHBondContact O-N 2.76Å
137N31.4Very low31.1Very low145 Ų145146.1 Ų146.178%0.77577%0.771SS**  trans31.398.3152.6-69.3-17000118.3Q139N137-Q139 VanDerWaalsContact C-N 3.32Å; N137-Q139 PolarHBondContact O-N 3.2Å
138N32Very low31.3Very low160 Ų160144.3 Ų144.386%0.85677%0.765SS**SBend44.333128.7-66.5-10.2000120.2
139Q30.3Very low31.6Very low186 Ų186142.6 Ų142.687%0.86976%0.764SS**  trans-129.889.6163.6-143.5171.91600109.3N137 G141N137-Q139 VanDerWaalsContact C-N 3.32Å; N137-Q139 PolarHBondContact O-N 3.2Å; Q139-G141 VanDerWaalsContact C-N 3.27Å; Q139-G141 PolarHBondContact O-N 2.94Å
140F37.4Very low31.7Very low196 Ų196140.5 Ų140.586%0.8676%0.762SS**  trans-68.381177.8-89.9-90.8000110.7I142F140-I142 PolarHBondContact O-N 3.41Å
141G28Very low32.2Very low69 Ų69146.6 Ų146.671%0.71178%0.779SS**  trans-77.1106.7161.800000109.5Q139 R143Q139-G141 VanDerWaalsContact C-N 3.27Å; Q139-G141 PolarHBondContact O-N 2.94Å; G141-R143 PolarHBondContact O-N 2.77Å; G141-R143 VanDerWaalsContact O-N 3.12Å
142I34.6Very low32.3Very low151 Ų151142.4 Ų142.477%0.77477%0.769SS**  trans-67.4110.4177.1-60.3176.6000108.8F140 I144F140-I142 PolarHBondContact O-N 3.41Å; I142-I144 HydrophobicContact CG2-CG1 4Å; I142-I144 PolarHBondContact O-N 3.17Å
143R25.9Very low32.4Very low184 Ų184148.4 Ų148.469%0.69478%0.777SS**  trans-87.793177-155.9-178.6-167-169.55.6109.1G141 N145 M152G141-R143 PolarHBondContact O-N 2.77Å; G141-R143 VanDerWaalsContact O-N 3.12Å; R143-N145 PolarHBondContact O-N 3.36Å; R143-M152 HydrophobicContact CG-CE 4.03Å
144I30.9Very low32.5Very low142 Ų142145.4 Ų145.473%0.72877%0.765SS**  trans-78.1108172.5-43.9177.2000107.1I142 S146I142-I144 HydrophobicContact CG2-CG1 4Å; I142-I144 PolarHBondContact O-N 3.17Å; I144-S146 PolarHBondContact O-N 3.43Å
145N25.2Very low32.6Very low135 Ų135146.7 Ų146.772%0.72277%0.769SS**  trans-72.576.6172.1-71.3-17.9000109.1R143 K147R143-N145 PolarHBondContact O-N 3.36Å; N145-K147 PolarHBondContact O-N 2.95Å
146S28.5Very low32.2Very low88 Ų88146.7 Ų146.762%0.61576%0.764SS**  trans-74.5120.3161.1470000108I144 S148I144-S146 PolarHBondContact O-N 3.43Å; S146-S148 PolarHBondContact O-N 3.15Å
147K34.2Very low32.4Very low218 Ų218146.5 Ų146.595%0.94877%0.766SS**SBendtrans-67.577.4169.6-71.9176.7176.8175.20109N145N145-K147 PolarHBondContact O-N 2.95Å
148S32.1Very low32.5Very low99 Ų99144.6 Ų144.669%0.69276%0.764SS**  trans-154.4137.5156.765.80000110S146S146-S148 PolarHBondContact O-N 3.15Å
149S32.1Very low33Very low102 Ų102145.9 Ų145.971%0.71376%0.762SS**  trans-63.5154.1-171.547.70000113.4
150N31.4Very low33.5Very low154 Ų154144.6 Ų144.682%0.82476%0.756SS**SBendtrans86.2110160.5-61.5-18.9000118.4
151K37.7Very low34Very low211 Ų211141.1 Ų141.192%0.91775%0.746SS**  trans6780.3154.5-121170.9-179.1175.30115.2R153K151-R153 PolarHBondContact O-N 3.28Å
152M32Very low34.7Very low140 Ų140142.1 Ų142.169%0.6974%0.738SS**  trans-56.588.3175.1-165.5168.4159.700111.6R143R143-M152 HydrophobicContact CG-CE 4.03Å
153R33.7Very low35.3Very low223 Ų223142.9 Ų142.984%0.84274%0.744SS**  trans-86.7112.9165.2-157.2176.9-172.6-177.51.1106.2K151 T155K151-R153 PolarHBondContact O-N 3.28Å; R153-T155 PolarHBondContact O-N 2.74Å
154T35.6Very low35.9Very low111 Ų111138.5 Ų138.568%0.68174%0.738SS**  trans-66.683.8172.450.60000108.4N156T154-N156 PolarHBondContact O-N 3.14Å
155T36Very low36.3Very low106 Ų106138 Ų13865%0.6574%0.741SS**  trans-76107.5166.247.50000106.6R153 C157R153-T155 PolarHBondContact O-N 2.74Å; T155-C157 VanDerWaalsContact C-N 3.25Å; T155-C157 PolarHBondContact O-N 3.48Å
156N35.3Very low37.8Very low150 Ų150137.2 Ų137.280%0.80274%0.736SS**  trans-56.993.2166.5-63.4-29.8000107.4T154 S158T154-N156 PolarHBondContact O-N 3.14Å; N156-S158 PolarHBondContact O-N 3.4Å
157C35.4Very low38.7Very low106 Ų106138.6 Ų138.672%0.71674%0.741SS**  trans-71.488.3164.3-84.10000106.4T155 F159T155-C157 VanDerWaalsContact C-N 3.25Å; T155-C157 PolarHBondContact O-N 3.48Å; C157-F159 VanDerWaalsContact C-N 3.35Å; C157-F159 PolarHBondContact O-N 2.87Å
158S34.9Very low39.9Very low106 Ų106131.9 Ų131.974%0.74172%0.72SS**  trans-59106.715352.50000105.9N156 E160N156-S158 PolarHBondContact O-N 3.4Å; S158-E160 VanDerWaalsContact C-N 3.3Å; S158-E160 PolarHBondContact O-N 3.5Å
159F42.7Very low42Very low186 Ų186131.4 Ų131.482%0.81671%0.709SS**  trans-63104.4161.2-94.6-91.4000105.6C157 L161C157-F159 VanDerWaalsContact C-N 3.35Å; C157-F159 PolarHBondContact O-N 2.87Å; F159-L161 PolarHBondContact O-N 2.91Å
160E40.5Very low44.1Very low160 Ų160131.3 Ų131.375%0.74870%0.704SS**  trans-65.392.3164.3-149.8171.4-152.900104.9S158 T162S158-E160 VanDerWaalsContact C-N 3.3Å; S158-E160 PolarHBondContact O-N 3.5Å; E160-T162 HydrophobicContact CB-CG2 4.17Å; E160-T162 HydrophobicContact CG-CG2 3.89Å; E160-T162 PolarHBondContact O-N 2.89Å
161L48.4Very low46Very low123 Ų123129.5 Ų129.564%0.64469%0.694SS**  trans-67.576.1169.3-82.7148.2000106.3F159 N163 I166F159-L161 PolarHBondContact O-N 2.91Å; L161-N163 VanDerWaalsContact C-N 3.34Å; L161-N163 PolarHBondContact O-N 3.31Å; L161-I166 HydrophobicContact CD2-CD1 4.05Å
162T41.4Very low47.6Very low89 Ų89126.7 Ų126.755%0.54668%0.677SS.*  trans-69.590.3178.644.50000108.2E160 T164E160-T162 HydrophobicContact CB-CG2 4.17Å; E160-T162 HydrophobicContact CG-CG2 3.89Å; E160-T162 PolarHBondContact O-N 2.89Å; T162-T164 WeakPolarHBondContact O-CA 3.44Å; T162-T164 WeakPolarHBondContact O-CB 3.45Å; T162-T164 WeakPolarHBondContact O-CG2 3.35Å; T162-T164 PolarHBondContact O-N 3.13Å; T162-T164 PolarHBondContact O-OG1 3.27Å; T162-T164 VanDerWaalsContact O-OG1 3.06Å
163N47.5Very low49.2Very low168 Ų168124.3 Ų124.390%0.89867%0.667SS**SBendtrans33.732.9167.9-68.8-6.4000116.4L161 T165L161-N163 VanDerWaalsContact C-N 3.34Å; L161-N163 PolarHBondContact O-N 3.31Å; N163-T165 PolarHBondContact O-N 3.3Å
164T38.9Very low50.9Low91 Ų91118 Ų11856%0.55865%0.646SS**  trans-93.1110-173.620.60000105.1T162 I166T162-T164 WeakPolarHBondContact O-CA 3.44Å; T162-T164 WeakPolarHBondContact O-CB 3.45Å; T162-T164 WeakPolarHBondContact O-CG2 3.35Å; T162-T164 PolarHBondContact O-N 3.13Å; T162-T164 PolarHBondContact O-OG1 3.27Å; T162-T164 VanDerWaalsContact O-OG1 3.06Å; T164-I166 PolarHBondContact O-N 3.03Å
165T39Very low52.7Low131 Ų131119.6 Ų119.680%0.80464%0.644SS**  trans-60.3101.7174.4-50.80000108.2N163 T167N163-T165 PolarHBondContact O-N 3.3Å; T165-T167 PolarHBondContact O-N 3.37Å; T165-T167 VanDerWaalsContact O-N 3.1Å
166I57.1Low54.3Low120 Ų120118.6 Ų118.662%0.61563%0.634SS**  trans-74.998.5170.3-60.9172.3000105.8L161 T164 P168L161-I166 HydrophobicContact CD2-CD1 4.05Å; T164-I166 PolarHBondContact O-N 3.03Å; I166-P168 WeakPolarHBondContact O-CD 3.5Å
167T46.9Very low55.8Low117 Ų117117.9 Ų117.972%0.71862%0.624SS**  trans-67.7112.9169.7-50.40000107.6T165 D169T165-T167 PolarHBondContact O-N 3.37Å; T165-T167 VanDerWaalsContact O-N 3.1Å; T167-D169 PolarHBondContact O-N 3.25Å
168P59.5Low57.3Low77 Ų77117 Ų11750%0.561%0.612SS.*  trans-63.2133.6175.826.5-32.5000108.9I166 V170 L173I166-P168 WeakPolarHBondContact O-CD 3.5Å; P168-V170 PolarHBondContact O-N 3.07Å; P168-L173 HydrophobicContact CB-CD1 3.89Å
169D75.9Confident58.8Low88 Ų88115.1 Ų115.147%0.47160%0.603SS.*  trans-6697.1174.2-179.7-12.5000108.9T167 I171 R172 L173T167-D169 PolarHBondContact O-N 3.25Å; D169-I171 PolarHBondContact O-N 3.43Å; D169-I171 WeakPolarHBondContact OD1-CA 3.2Å; D169-I171 VanDerWaalsContact OD1-CB 3.31Å; D169-I171 WeakPolarHBondContact OD1-CB 3.18Å; D169-I171 PolarHBondContact OD1-N 3.16Å; D169-R172 HydrophobicContact CB-CB 3.76Å; D169-R172 WeakPolarHBondContact O-CA 3.48Å; D169-R172 WeakPolarHBondContact O-CB 3.39Å; D169-R172 PolarHBondContact O-N 3.37Å; D169-R172 PolarHBondContact OD1-N 3.32Å; D169-L173 PolarHBondContact O-N 3.36Å
170V75.4Confident59.5Low101 Ų101109.4 Ų109.461%0.61259%0.585SS**Hα-helixtrans-58.9-33.5-178.5-1770000110.8P168 L173 Q174P168-V170 PolarHBondContact O-N 3.07Å; V170-L173 PolarHBondContact O-N 3.17Å; V170-Q174 WeakPolarHBondContact O-CB 3.26Å; V170-Q174 PolarHBondContact O-N 3.4Å
171I72.1Confident60.4Low116 Ų116106.7 Ų106.760%0.59558%0.58SS**Hα-helixtrans-67.5-43.2176.6-58.9173.4000109.5D169 Q174 K175D169-I171 PolarHBondContact O-N 3.43Å; D169-I171 WeakPolarHBondContact OD1-CA 3.2Å; D169-I171 VanDerWaalsContact OD1-CB 3.31Å; D169-I171 WeakPolarHBondContact OD1-CB 3.18Å; D169-I171 PolarHBondContact OD1-N 3.16Å; I171-Q174 PolarHBondContact O-N 2.98Å; I171-K175 HydrophobicContact CG2-CD 4.46Å; I171-K175 WeakPolarHBondContact O-CG 3.32Å; I171-K175 PolarHBondContact O-N 3.27Å
172R70.9Confident60.8Low152 Ų152107.4 Ų107.457%0.57458%0.584SS**Hα-helixtrans-62.6-43.7175.2-163.8178.685.9166.44.8111.6D169 K175 I176D169-R172 HydrophobicContact CB-CB 3.76Å; D169-R172 WeakPolarHBondContact O-CA 3.48Å; D169-R172 WeakPolarHBondContact O-CB 3.39Å; D169-R172 PolarHBondContact O-N 3.37Å; D169-R172 PolarHBondContact OD1-N 3.32Å; R172-K175 PolarHBondContact O-N 2.94Å; R172-I176 HydrophobicContact CG-CD1 4.31Å; R172-I176 VanDerWaalsContact O-CG1 3.3Å; R172-I176 WeakPolarHBondContact O-CG1 3.44Å; R172-I176 PolarHBondContact O-N 3.2Å
173L66.9Low61.6Low90 Ų90108.7 Ų108.747%0.47159%0.587SS.*Hα-helixtrans-62.7-42.9176.4-70.8178000111.9P168 D169 V170 K175 I176 K177P168-L173 HydrophobicContact CB-CD1 3.89Å; D169-L173 PolarHBondContact O-N 3.36Å; V170-L173 PolarHBondContact O-N 3.17Å; L173-K175 PolarHBondContact O-N 2.81Å; L173-I176 PolarHBondContact O-N 3.38Å; L173-K177 PolarHBondContact O-N 2.87Å
174Q69.2Low62.1Low89 Ų89104.3 Ų104.342%0.41657%0.567SS.*Hα-helixtrans-64-40.8176.5-169.966.239.800111.7V170 I171 I176 K177 N178V170-Q174 WeakPolarHBondContact O-CB 3.26Å; V170-Q174 PolarHBondContact O-N 3.4Å; I171-Q174 PolarHBondContact O-N 2.98Å; Q174-I176 VanDerWaalsContact C-N 3.33Å; Q174-I176 PolarHBondContact O-N 3.17Å; Q174-K177 PolarHBondContact O-N 2.78Å; Q174-N178 PolarHBondContact NE2-OD1 2.86Å; Q174-N178 WeakPolarHBondContact O-CB 3.47Å; Q174-N178 PolarHBondContact O-N 3.33Å; Q174-N178 PolarHBondContact O-OD1 2.9Å
175K72Confident63.3Low145 Ų145101.4 Ų101.463%0.6355%0.548SS*.Hα-helixtrans-60.9-41.9173.7-76.8178.5179.4-179.90111.7I171 R172 L173 A179I171-K175 HydrophobicContact CG2-CD 4.46Å; I171-K175 WeakPolarHBondContact O-CG 3.32Å; I171-K175 PolarHBondContact O-N 3.27Å; R172-K175 PolarHBondContact O-N 2.94Å; L173-K175 PolarHBondContact O-N 2.81Å; K175-A179 VanDerWaalsContact O-CB 3.29Å; K175-A179 WeakPolarHBondContact O-CB 3.41Å; K175-A179 PolarHBondContact O-N 3.08Å
176I69.9Low64.4Low86 Ų86100.3 Ų100.344%0.44154%0.542SS..Hα-helixtrans-64-48.4175.6-67.6163.7000110.2R172 L173 Q174 N178 A179 C180R172-I176 HydrophobicContact CG-CD1 4.31Å; R172-I176 VanDerWaalsContact O-CG1 3.3Å; R172-I176 WeakPolarHBondContact O-CG1 3.44Å; R172-I176 PolarHBondContact O-N 3.2Å; L173-I176 PolarHBondContact O-N 3.38Å; Q174-I176 VanDerWaalsContact C-N 3.33Å; Q174-I176 PolarHBondContact O-N 3.17Å; I176-N178 PolarHBondContact O-N 2.95Å; I176-A179 PolarHBondContact O-N 3.47Å; I176-C180 PolarHBondContact O-N 2.88Å; I176-C180 PolarHBondContact O-SG 3.18Å; I176-C180 VanDerWaalsContact O-SG 3.33Å
177K68.3Low64.5Low135 Ų13595.1 Ų95.159%0.58752%0.515SS*.Hα-helixtrans-54-52.3176.5-177.8-176.8176.4-1800110.7L173 Q174 A179 C180 V181L173-K177 PolarHBondContact O-N 2.87Å; Q174-K177 PolarHBondContact O-N 2.78Å; K177-A179 VanDerWaalsContact C-N 3.32Å; K177-A179 PolarHBondContact O-N 2.93Å; K177-C180 WeakPolarHBondContact O-CB 3.48Å; K177-C180 PolarHBondContact O-N 3.42Å; K177-C180 VanDerWaalsContact O-N 3.08Å; K177-V181 WeakPolarHBondContact O-CG2 3.47Å; K177-V181 PolarHBondContact O-N 2.92Å; K177-V181 VanDerWaalsContact O-N 3.17Å
178N66.9Low65.4Low86 Ų8694.3 Ų94.346%0.4651%0.506SS..Hα-helixtrans-63.6-36.4-179.6-66.7-1.8000112.3Q174 I176 C180 V181Q174-N178 PolarHBondContact NE2-OD1 2.86Å; Q174-N178 WeakPolarHBondContact O-CB 3.47Å; Q174-N178 PolarHBondContact O-N 3.33Å; Q174-N178 PolarHBondContact O-OD1 2.9Å; I176-N178 PolarHBondContact O-N 2.95Å; N178-C180 VanDerWaalsContact C-N 3.28Å; N178-C180 PolarHBondContact O-N 3.06Å; N178-V181 PolarHBondContact O-N 3.41Å
179A66.6Low65.8Low67 Ų6796.3 Ų96.355%0.55451%0.512SS*.Hα-helixtrans-66.5-31.5174.500000112.4K175 I176 K177K175-A179 VanDerWaalsContact O-CB 3.29Å; K175-A179 WeakPolarHBondContact O-CB 3.41Å; K175-A179 PolarHBondContact O-N 3.08Å; I176-A179 PolarHBondContact O-N 3.47Å; K177-A179 VanDerWaalsContact C-N 3.32Å; K177-A179 PolarHBondContact O-N 2.93Å
180C56.4Low65.3Low66 Ų6695 Ų9545%0.44651%0.507SS..Hα-helixtrans-77.8-19.6176.7-69.30000114I176 K177 N178 N182 L183I176-C180 PolarHBondContact O-N 2.88Å; I176-C180 PolarHBondContact O-SG 3.18Å; I176-C180 VanDerWaalsContact O-SG 3.33Å; K177-C180 WeakPolarHBondContact O-CB 3.48Å; K177-C180 PolarHBondContact O-N 3.42Å; K177-C180 VanDerWaalsContact O-N 3.08Å; N178-C180 VanDerWaalsContact C-N 3.28Å; N178-C180 PolarHBondContact O-N 3.06Å; C180-N182 PolarHBondContact O-N 2.62Å; C180-L183 HydrophobicContact CB-CD1 3.93Å; C180-L183 WeakPolarHBondContact O-CB 3.36Å; C180-L183 PolarHBondContact O-N 2.87Å; C180-L183 VanDerWaalsContact O-N 3.16Å
181V58.9Low65Low104 Ų10497.7 Ų97.763%0.6352%0.518SS*.Hα-helixtrans-62.1-31.3175.8176.90000111.7K177 N178 L183K177-V181 WeakPolarHBondContact O-CG2 3.47Å; K177-V181 PolarHBondContact O-N 2.92Å; K177-V181 VanDerWaalsContact O-N 3.17Å; N178-V181 PolarHBondContact O-N 3.41Å; V181-L183 VanDerWaalsContact C-N 3.32Å
182N57.8Low64.5Low137 Ų13794 Ų9473%0.73350%0.499SS*.THydrogen-bonded Turntrans-919.7-179.8-62-26.3000113.1C180C180-N182 PolarHBondContact O-N 2.62Å
183L57.9Low64.3Low116 Ų11690.4 Ų90.461%0.60750%0.495SS*.SBendtrans-65.7126.3171.4-73.5166.6000107.6C180 V181 N185C180-L183 HydrophobicContact CB-CD1 3.93Å; C180-L183 WeakPolarHBondContact O-CB 3.36Å; C180-L183 PolarHBondContact O-N 2.87Å; C180-L183 VanDerWaalsContact O-N 3.16Å; V181-L183 VanDerWaalsContact C-N 3.32Å; L183-N185 PolarHBondContact O-N 3.33Å
184P57.5Low64Low76 Ų7687.4 Ų87.449%0.49448%0.483SS..PPolyproline II helixtrans-56.1137.9173.923.9-32000108.5T186 L189P184-T186 PolarHBondContact O-N 2.84Å; P184-L189 HydrophobicContact CB-CD2 4.08Å; P184-L189 HydrophobicContact CB-CG 4.37Å; P184-L189 HydrophobicContact CG-CD1 4.28Å; P184-L189 HydrophobicContact CG-CD2 4.08Å; P184-L189 HydrophobicContact CG-CG 4.43Å
185N63.4Low63.6Low30 Ų3085.3 Ų85.316%0.1649%0.485CS..PPolyproline II helixtrans-57.3135.5173.4-174.4-25.6000107.8L183 I187 D188 L189 D200 H203L183-N185 PolarHBondContact O-N 3.33Å; N185-I187 PolarHBondContact O-N 3.23Å; N185-I187 VanDerWaalsContact O-N 3.13Å; N185-I187 PolarHBondContact OD1-N 2.97Å; N185-D188 WeakPolarHBondContact O-CB 3.3Å; N185-D188 PolarHBondContact O-N 3.34Å; N185-L189 PolarHBondContact O-N 3.33Å; N185-D200 PolarHBondContact ND2-OD2 2.82Å; N185-D200 PolarHBondContact OD1-OD2 3.49Å; N185-H203 VanDerWaalsContact ND2-CB 3.32Å; N185-H203 WeakPolarHBondContact ND2-CB 3.29Å; N185-H203 PolarHBondContact ND2-CE1 3.43Å; N185-H203 PolarHBondContact ND2-ND1 3.26Å
186T62.4Low63.4Low108 Ų10881.6 Ų81.666%0.66347%0.474SS*.THydrogen-bonded Turntrans-53.7-33.3176.2-54.30000111.3P184 D188 L189P184-T186 PolarHBondContact O-N 2.84Å; T186-D188 PolarHBondContact O-N 2.93Å; T186-L189 WeakPolarHBondContact O-CB 3.36Å; T186-L189 PolarHBondContact O-N 3.48Å
187I59.6Low63.3Low12 Ų1281 Ų816%0.06247%0.474CS..THydrogen-bonded Turntrans-63.3-38.3174.7-71.5-173.3000112.8N185 L189 V190 I198 D200 H203 K205N185-I187 PolarHBondContact O-N 3.23Å; N185-I187 VanDerWaalsContact O-N 3.13Å; N185-I187 PolarHBondContact OD1-N 2.97Å; I187-L189 PolarHBondContact O-N 3.49Å; I187-V190 PolarHBondContact O-N 3.39Å; I187-V190 VanDerWaalsContact O-N 3.14Å; I187-I198 HydrophobicContact CB-CD1 4.42Å; I187-I198 HydrophobicContact CG1-CD1 4.31Å; I187-I198 HydrophobicContact CG2-CD1 3.96Å; I187-I198 HydrophobicContact CG2-CG1 4.02Å; I187-D200 HydrophobicContact CD1-CB 3.48Å; I187-D200 VanDerWaalsContact CD1-CB 3.48Å; I187-D200 VanDerWaalsContact CD1-CG 3.41Å; I187-D200 HydrophobicContact CG1-CB 4.17Å; I187-H203 HydrophobicContact CD1-CB 4.36Å; I187-K205 HydrophobicContact CG2-CB 3.35Å; I187-K205 HydrophobicContact CG2-CD 3.92Å; I187-K205 HydrophobicContact CG2-CG 4.24Å; I187-K205 VanDerWaalsContact O-CD 3.26Å; I187-K205 WeakPolarHBondContact O-CD 3.39Å; I187-K205 PolarHBondContact O-NZ 3.48Å
188D65.4Low63.4Low99 Ų9976.8 Ų76.853%0.52946%0.458SS..THydrogen-bonded Turntrans-66.4-27.7179.6-69.7-28.5000111.4N185 T186 V190 K205N185-D188 WeakPolarHBondContact O-CB 3.3Å; N185-D188 PolarHBondContact O-N 3.34Å; T186-D188 PolarHBondContact O-N 2.93Å; D188-V190 VanDerWaalsContact C-N 3.31Å; D188-V190 PolarHBondContact O-N 2.87Å; D188-K205 PolarHBondContact O-NZ 3.02Å
189L68.7Low63.7Low120 Ų12076.3 Ų76.363%0.62846%0.461SS*.THydrogen-bonded Turntrans-77.4-10.8176.6-56.3176.8000114P184 N185 T186 I187P184-L189 HydrophobicContact CB-CD2 4.08Å; P184-L189 HydrophobicContact CB-CG 4.37Å; P184-L189 HydrophobicContact CG-CD1 4.28Å; P184-L189 HydrophobicContact CG-CD2 4.08Å; P184-L189 HydrophobicContact CG-CG 4.43Å; N185-L189 PolarHBondContact O-N 3.33Å; T186-L189 WeakPolarHBondContact O-CB 3.36Å; T186-L189 PolarHBondContact O-N 3.48Å; I187-L189 PolarHBondContact O-N 3.49Å
190V64.4Low63.7Low60 Ų6077 Ų7736%0.36446%0.455SS..SBendtrans-88.9117.3179.1-178.20000110.1I187 D188 L192 I198 K205I187-V190 PolarHBondContact O-N 3.39Å; I187-V190 VanDerWaalsContact O-N 3.14Å; D188-V190 VanDerWaalsContact C-N 3.31Å; D188-V190 PolarHBondContact O-N 2.87Å; V190-L192 HydrophobicContact CG1-CD2 4.24Å; V190-L192 PolarHBondContact O-N 3.4Å; V190-I198 HydrophobicContact CB-CD1 3.73Å; V190-I198 HydrophobicContact CG1-CD1 3.87Å; V190-I198 HydrophobicContact CG2-CD1 4.03Å; V190-K205 PolarHBondContact O-NZ 2.91Å
191D69Low64.1Low157 Ų15777.1 Ų77.184%0.8447%0.468SS*.  trans-69.4115.5165.5-79.6-21.8000109.3
192L62.2Low64.5Low38 Ų3880.3 Ų80.320%0.19948%0.476CS..PPolyproline II helixtrans-86.9132-177.1-75.8176.2000111.7V190 V196 I198 K205 G207V190-L192 HydrophobicContact CG1-CD2 4.24Å; V190-L192 PolarHBondContact O-N 3.4Å; L192-V196 HydrophobicContact CD2-CG1 4.34Å; L192-I198 HydrophobicContact CD1-CG1 4.2Å; L192-I198 HydrophobicContact CD2-CB 4.32Å; L192-I198 HydrophobicContact CD2-CD1 3.7Å; L192-I198 HydrophobicContact CD2-CG1 3.78Å; L192-I198 HydrophobicContact CD2-CG2 3.74Å; L192-I198 HydrophobicContact CG-CD1 4.29Å; L192-I198 HydrophobicContact CG-CG1 4.42Å; L192-K205 HydrophobicContact CD1-CB 3.71Å; L192-K205 HydrophobicContact CD1-CD 3.85Å; L192-K205 HydrophobicContact CD1-CG 3.49Å; L192-K205 VanDerWaalsContact CD1-CG 3.49Å; L192-K205 WeakPolarHBondContact CD1-O 3.39Å; L192-K205 HydrophobicContact CG-CD 4.32Å; L192-K205 HydrophobicContact CG-CG 4.47Å; L192-G207 VanDerWaalsContact CD1-N 3.34Å
193V66.9Low64.8Low78 Ų7878.1 Ų78.147%0.47346%0.461SS..PPolyproline II helixtrans-62.1137.8162.6-178.50000108.6G195 V196 V231V193-G195 PolarHBondContact O-N 3.03Å; V193-V196 HydrophobicContact CB-CB 4.43Å; V193-V196 HydrophobicContact CB-CG2 3.86Å; V193-V196 HydrophobicContact CG1-CG2 4.28Å; V193-V196 WeakPolarHBondContact O-CB 3.48Å; V193-V196 PolarHBondContact O-N 3.35Å; V193-V231 HydrophobicContact CG2-CG1 4.1Å
194A60.4Low65.3Low27 Ų2778 Ų7822%0.22346%0.461CS..THydrogen-bonded Turntrans-57.8127-178.100000111.1V196 L209A194-V196 VanDerWaalsContact C-N 3.34Å; A194-L209 HydrophobicContact CB-CB 4.49Å; A194-L209 HydrophobicContact CB-CD2 3.33Å; A194-L209 HydrophobicContact CB-CG 3.8Å
195G61.2Low65.6Low44 Ų4477 Ų7745%0.45445%0.449SS..THydrogen-bonded Turntrans89.3-9.6-177.500000114.8V193 G207V193-G195 PolarHBondContact O-N 3.03Å; G195-G207 PolarHBondContact N-O 3.26Å
196V67Low65.9Low67 Ų6780.5 Ų80.541%0.40647%0.466SS..  trans-85.9134.4173.8-179.10000109.7L192 V193 A194 I198 G207L192-V196 HydrophobicContact CD2-CG1 4.34Å; V193-V196 HydrophobicContact CB-CB 4.43Å; V193-V196 HydrophobicContact CB-CG2 3.86Å; V193-V196 HydrophobicContact CG1-CG2 4.28Å; V193-V196 WeakPolarHBondContact O-CB 3.48Å; V193-V196 PolarHBondContact O-N 3.35Å; A194-V196 VanDerWaalsContact C-N 3.34Å; V196-I198 HydrophobicContact CG1-CG2 4.31Å; V196-G207 PolarHBondContact O-N 2.87Å
197T69Low66.2Low74 Ų7475.6 Ų75.645%0.45444%0.438SS..EExtended strand (participates in β ladder)trans-115.8129.7176.6-59.20000108.8L204 K205 I206T197-L204 HydrophobicContact CG2-CD1 3.42Å; T197-L204 VanDerWaalsContact CG2-CD1 3.42Å; T197-L204 HydrophobicContact CG2-CD2 4.5Å; T197-L204 HydrophobicContact CG2-CG 4.01Å; T197-K205 WeakPolarHBondContact CA-O 3.44Å; T197-I206 HydrophobicContact CG2-CG1 3.92Å
198I69.5Low66.4Low47 Ų4783.7 Ų83.724%0.24148%0.475CS..EExtended strand (participates in β ladder)trans-121.5147.9174.566.1177.4000110.4I187 V190 L192 V196 K205I187-I198 HydrophobicContact CB-CD1 4.42Å; I187-I198 HydrophobicContact CG1-CD1 4.31Å; I187-I198 HydrophobicContact CG2-CD1 3.96Å; I187-I198 HydrophobicContact CG2-CG1 4.02Å; V190-I198 HydrophobicContact CB-CD1 3.73Å; V190-I198 HydrophobicContact CG1-CD1 3.87Å; V190-I198 HydrophobicContact CG2-CD1 4.03Å; L192-I198 HydrophobicContact CD1-CG1 4.2Å; L192-I198 HydrophobicContact CD2-CB 4.32Å; L192-I198 HydrophobicContact CD2-CD1 3.7Å; L192-I198 HydrophobicContact CD2-CG1 3.78Å; L192-I198 HydrophobicContact CD2-CG2 3.74Å; L192-I198 HydrophobicContact CG-CD1 4.29Å; L192-I198 HydrophobicContact CG-CG1 4.42Å; V196-I198 HydrophobicContact CG1-CG2 4.31Å; I198-K205 HydrophobicContact CG1-CB 4.24Å; I198-K205 PolarHBondContact N-O 3.1Å; I198-K205 PolarHBondContact O-N 3.14Å
199S73.4Confident65.9Low76 Ų7681.2 Ų81.253%0.53146%0.462SS..EExtended strand (participates in β ladder)trans-142.9145178.6176.20000110.7G201 H203S199-G201 PolarHBondContact OG-N 3.13Å; S199-G201 VanDerWaalsContact OG-N 3.17Å; S199-H203 VanDerWaalsContact CA-O 3.27Å; S199-H203 WeakPolarHBondContact CA-O 3.46Å; S199-H203 PolarHBondContact OG-O 3Å
200D66.4Low65.6Low80 Ų8082.7 Ų82.743%0.42846%0.459SS..  trans-107.12.5174.161.77.7000111.5N185 I187 E202 H203N185-D200 PolarHBondContact ND2-OD2 2.82Å; N185-D200 PolarHBondContact OD1-OD2 3.49Å; I187-D200 HydrophobicContact CD1-CB 3.48Å; I187-D200 VanDerWaalsContact CD1-CB 3.48Å; I187-D200 VanDerWaalsContact CD1-CG 3.41Å; I187-D200 HydrophobicContact CG1-CB 4.17Å; D200-E202 PolarHBondContact OD1-N 2.99Å; D200-H203 PolarHBondContact N-O 3.31Å; D200-H203 IonicContact OD1-CG 3.5Å; D200-H203 PolarHBondContact OD1-N 3.07Å; D200-H203 IonicContact OD1-ND1 3.44Å; D200-H203 PolarHBondContact OD1-ND1 3.16Å; D200-H203 IonicContact OD2-ND1 3.7Å; D200-H203 PolarHBondContact OD2-ND1 3.31Å
201G66.1Low65.5Low69 Ų6986.4 Ų86.471%0.71148%0.477SS*.SBendtrans102.5-27.7-175.400000113.9S199S199-G201 PolarHBondContact OG-N 3.13Å; S199-G201 VanDerWaalsContact OG-N 3.17Å
202E66.6Low65.1Low172 Ų17285.2 Ų85.280%0.80447%0.466SS*.SBendtrans-110.5-32.9178.9-69.8-177.9176.500112.1D200D200-E202 PolarHBondContact OD1-N 2.99Å
203H63.2Low64.6Low90 Ų9086.8 Ų86.842%0.41747%0.472SS..  trans-123.7145.4-173.9-5281.2000110.6N185 I187 S199 D200N185-H203 VanDerWaalsContact ND2-CB 3.32Å; N185-H203 WeakPolarHBondContact ND2-CB 3.29Å; N185-H203 PolarHBondContact ND2-CE1 3.43Å; N185-H203 PolarHBondContact ND2-ND1 3.26Å; I187-H203 HydrophobicContact CD1-CB 4.36Å; S199-H203 VanDerWaalsContact CA-O 3.27Å; S199-H203 WeakPolarHBondContact CA-O 3.46Å; S199-H203 PolarHBondContact OG-O 3Å; D200-H203 PolarHBondContact N-O 3.31Å; D200-H203 IonicContact OD1-CG 3.5Å; D200-H203 PolarHBondContact OD1-N 3.07Å; D200-H203 IonicContact OD1-ND1 3.44Å; D200-H203 PolarHBondContact OD1-ND1 3.16Å; D200-H203 IonicContact OD2-ND1 3.7Å; D200-H203 PolarHBondContact OD2-ND1 3.31Å
204L69Low64.2Low114 Ų11488.3 Ų88.360%0.59747%0.473SS*.EExtended strand (participates in β ladder)trans-127.1126-179.8-172.877.4000109.3T197 I206T197-L204 HydrophobicContact CG2-CD1 3.42Å; T197-L204 VanDerWaalsContact CG2-CD1 3.42Å; T197-L204 HydrophobicContact CG2-CD2 4.5Å; T197-L204 HydrophobicContact CG2-CG 4.01Å; L204-I206 HydrophobicContact CD2-CD1 4.29Å; L204-I206 HydrophobicContact CD2-CG1 4.41Å; L204-I206 HydrophobicContact CG-CG1 4.48Å
205K64.5Low64Low56 Ų5690.3 Ų90.324%0.24348%0.483CS..EExtended strand (participates in β ladder)trans-122.7131.1173.7-163.4-173.2179.9-179.20109.5I187 D188 V190 L192 T197 I198I187-K205 HydrophobicContact CG2-CB 3.35Å; I187-K205 HydrophobicContact CG2-CD 3.92Å; I187-K205 HydrophobicContact CG2-CG 4.24Å; I187-K205 VanDerWaalsContact O-CD 3.26Å; I187-K205 WeakPolarHBondContact O-CD 3.39Å; I187-K205 PolarHBondContact O-NZ 3.48Å; D188-K205 PolarHBondContact O-NZ 3.02Å; V190-K205 PolarHBondContact O-NZ 2.91Å; L192-K205 HydrophobicContact CD1-CB 3.71Å; L192-K205 HydrophobicContact CD1-CD 3.85Å; L192-K205 HydrophobicContact CD1-CG 3.49Å; L192-K205 VanDerWaalsContact CD1-CG 3.49Å; L192-K205 WeakPolarHBondContact CD1-O 3.39Å; L192-K205 HydrophobicContact CG-CD 4.32Å; L192-K205 HydrophobicContact CG-CG 4.47Å; T197-K205 WeakPolarHBondContact CA-O 3.44Å; I198-K205 HydrophobicContact CG1-CB 4.24Å; I198-K205 PolarHBondContact N-O 3.1Å; I198-K205 PolarHBondContact O-N 3.14Å
206I69.8Low64Low102 Ų10296.2 Ų96.252%0.52349%0.492SS..EExtended strand (participates in β ladder)trans-116124.6-178.3-56.3172.2000107.9T197 L204 Q208T197-I206 HydrophobicContact CG2-CG1 3.92Å; L204-I206 HydrophobicContact CD2-CD1 4.29Å; L204-I206 HydrophobicContact CD2-CG1 4.41Å; L204-I206 HydrophobicContact CG-CG1 4.48Å; I206-Q208 PolarHBondContact O-N 3.22Å; I206-Q208 VanDerWaalsContact O-N 3.15Å
207G68.8Low63.5Low6 Ų695.9 Ų95.96%0.06249%0.488CS..  trans-65.4112.4172.900000109.8L192 G195 V196 L209L192-G207 VanDerWaalsContact CD1-N 3.34Å; G195-G207 PolarHBondContact N-O 3.26Å; V196-G207 PolarHBondContact O-N 2.87Å; G207-L209 PolarHBondContact O-N 3.26Å; G207-L209 VanDerWaalsContact O-N 3.17Å
208Q62.7Low63.1Low182 Ų18297.7 Ų97.785%0.8549%0.494SS*.PPolyproline II helixtrans-63.3118.1179.6-72.2-173.83.800110.1I206I206-Q208 PolarHBondContact O-N 3.22Å; I206-Q208 VanDerWaalsContact O-N 3.15Å
209L55.2Low63Low47 Ų47101.5 Ų101.525%0.24652%0.515CS..PPolyproline II helixtrans-76.9127.3165.2-76.3158.4000108.6A194 G207 Q213 F214 I217A194-L209 HydrophobicContact CB-CB 4.49Å; A194-L209 HydrophobicContact CB-CD2 3.33Å; A194-L209 HydrophobicContact CB-CG 3.8Å; G207-L209 PolarHBondContact O-N 3.26Å; G207-L209 VanDerWaalsContact O-N 3.17Å; L209-Q213 HydrophobicContact CD2-CB 3.62Å; L209-F214 HydrophobicContact CB-CB 4.17Å; L209-F214 HydrophobicContact CD1-CD2 4Å; L209-I217 HydrophobicContact CD1-CD1 4.11Å; L209-I217 HydrophobicContact CD2-CD1 3.54Å
210R61.6Low62.5Low150 Ų15099.5 Ų99.557%0.56650%0.499SS*.PPolyproline II helixtrans-60.6144.6160.9-64.8-171.8-68.9138.3-0.4107.8E212 Q213 F214R210-E212 IonicContact CZ-OE2 2.95Å; R210-E212 IonicContact NH1-OE2 3.55Å; R210-E212 PolarHBondContact NH1-OE2 3.41Å; R210-E212 PolarHBondContact O-N 3.14Å; R210-Q213 HydrophobicContact CB-CG 4.39Å; R210-Q213 VanDerWaalsContact N-OE1 3.14Å; R210-Q213 WeakPolarHBondContact O-CA 3.17Å; R210-Q213 WeakPolarHBondContact O-CB 3.48Å; R210-Q213 PolarHBondContact O-N 3.13Å; R210-F214 PolarHBondContact O-N 3.49Å
211N62.2Low62Low139 Ų13999.5 Ų99.574%0.74350%0.499SS*.Hα-helixtrans-49.6-35.7179.5-74.6-18.8000112.3F214 T215N211-F214 PolarHBondContact O-N 3.45Å; N211-T215 WeakPolarHBondContact O-CB 3.35Å; N211-T215 PolarHBondContact O-N 3.12Å; N211-T215 PolarHBondContact O-OG1 3.42Å
212E60.5Low61.6Low131 Ų131103.9 Ų103.961%0.61249%0.494SS*.Hα-helixtrans-61-47174.5-63.7161.5-16700112.8R210 T215 Y216R210-E212 IonicContact CZ-OE2 2.95Å; R210-E212 IonicContact NH1-OE2 3.55Å; R210-E212 PolarHBondContact NH1-OE2 3.41Å; R210-E212 PolarHBondContact O-N 3.14Å; E212-T215 PolarHBondContact O-N 3.5Å; E212-Y216 PolarHBondContact O-N 3.43Å
213Q53.1Low61.4Low72 Ų72102.4 Ų102.434%0.33649%0.492SS..Hα-helixtrans-67.7-40.2178.7-67173.4-52.200111.2L209 R210 T215 Y216 I217L209-Q213 HydrophobicContact CD2-CB 3.62Å; R210-Q213 HydrophobicContact CB-CG 4.39Å; R210-Q213 VanDerWaalsContact N-OE1 3.14Å; R210-Q213 WeakPolarHBondContact O-CA 3.17Å; R210-Q213 WeakPolarHBondContact O-CB 3.48Å; R210-Q213 PolarHBondContact O-N 3.13Å; Q213-T215 VanDerWaalsContact C-N 3.32Å; Q213-T215 PolarHBondContact O-N 3.22Å; Q213-Y216 PolarHBondContact O-N 2.93Å; Q213-I217 VanDerWaalsContact O-CG1 3.24Å; Q213-I217 WeakPolarHBondContact O-CG1 3.37Å; Q213-I217 PolarHBondContact O-N 3.42Å
214F57.1Low61Low109 Ų109104 Ų10448%0.47850%0.504SS..Hα-helixtrans-61.1-43173.8-175.5-101.8000111.3L209 R210 N211 I217 L218L209-F214 HydrophobicContact CB-CB 4.17Å; L209-F214 HydrophobicContact CD1-CD2 4Å; R210-F214 PolarHBondContact O-N 3.49Å; N211-F214 PolarHBondContact O-N 3.45Å; F214-I217 PolarHBondContact O-N 3.12Å; F214-L218 HydrophobicContact CD1-CD1 3.79Å; F214-L218 HydrophobicContact CD1-CG 4.35Å; F214-L218 HydrophobicContact CE1-CD1 3.35Å; F214-L218 HydrophobicContact CE1-CG 4.06Å; F214-L218 HydrophobicContact CZ-CD1 3.94Å; F214-L218 HydrophobicContact CZ-CD2 4.42Å; F214-L218 HydrophobicContact CZ-CG 4.27Å; F214-L218 WeakPolarHBondContact O-CG 3.46Å; F214-L218 PolarHBondContact O-N 2.84Å
215T57.7Low60Low70 Ų70101.9 Ų101.943%0.42949%0.493SS..Hα-helixtrans-64.8-41.7176.8-540000111.7N211 E212 Q213 L218 N219N211-T215 WeakPolarHBondContact O-CB 3.35Å; N211-T215 PolarHBondContact O-N 3.12Å; N211-T215 PolarHBondContact O-OG1 3.42Å; E212-T215 PolarHBondContact O-N 3.5Å; Q213-T215 VanDerWaalsContact C-N 3.32Å; Q213-T215 PolarHBondContact O-N 3.22Å; T215-L218 PolarHBondContact O-N 2.99Å; T215-N219 WeakPolarHBondContact O-CB 3.46Å; T215-N219 VanDerWaalsContact O-CG 3.3Å; T215-N219 PolarHBondContact O-N 3.06Å; T215-N219 VanDerWaalsContact O-N 3.07Å; T215-N219 PolarHBondContact O-ND2 3.06Å
216Y61.1Low59.6Low168 Ų168107 Ų10766%0.65952%0.522SS*.Hα-helixtrans-58.4-51.7174.2179.1-97.2000111.2E212 Q213 L218 N219 T220E212-Y216 PolarHBondContact O-N 3.43Å; Q213-Y216 PolarHBondContact O-N 2.93Å; Y216-L218 VanDerWaalsContact C-N 3.31Å; Y216-L218 PolarHBondContact O-N 2.92Å; Y216-N219 CarbonylContact O-C 3.49Å; Y216-N219 PolarHBondContact O-N 2.96Å; Y216-T220 PolarHBondContact O-N 2.97Å; Y216-T220 PolarHBondContact O-OG1 2.83Å
217I56.1Low58.3Low60 Ų60110.1 Ų110.131%0.30854%0.535SS..Hα-helixtrans-58.1-40.6179.1-69.1171.2000112.2L209 Q213 F214 N219 T220 W222L209-I217 HydrophobicContact CD1-CD1 4.11Å; L209-I217 HydrophobicContact CD2-CD1 3.54Å; Q213-I217 VanDerWaalsContact O-CG1 3.24Å; Q213-I217 WeakPolarHBondContact O-CG1 3.37Å; Q213-I217 PolarHBondContact O-N 3.42Å; F214-I217 PolarHBondContact O-N 3.12Å; I217-N219 VanDerWaalsContact C-N 3.32Å; I217-T220 PolarHBondContact O-N 2.93Å; I217-W222 HydrophobicContact CG2-CH2 4.37Å; I217-W222 HydrophobicContact CG2-CZ2 3.74Å; I217-W222 PolarHBondContact O-NE1 3.24Å
218L59.5Low57.2Low111 Ų111117 Ų11758%0.58157%0.569SS**Hα-helixtrans-66-34.5176.2-75.5179.3000112.9F214 T215 Y216F214-L218 HydrophobicContact CD1-CD1 3.79Å; F214-L218 HydrophobicContact CD1-CG 4.35Å; F214-L218 HydrophobicContact CE1-CD1 3.35Å; F214-L218 HydrophobicContact CE1-CG 4.06Å; F214-L218 HydrophobicContact CZ-CD1 3.94Å; F214-L218 HydrophobicContact CZ-CD2 4.42Å; F214-L218 HydrophobicContact CZ-CG 4.27Å; F214-L218 WeakPolarHBondContact O-CG 3.46Å; F214-L218 PolarHBondContact O-N 2.84Å; T215-L218 PolarHBondContact O-N 2.99Å; Y216-L218 VanDerWaalsContact C-N 3.31Å; Y216-L218 PolarHBondContact O-N 2.92Å
219N67.8Low56.2Low128 Ų128112.9 Ų112.968%0.68456%0.558SS**Hα-helixtrans-89.1-10.9-179.2-67.3-17.8000113T215 Y216 I217 N221T215-N219 WeakPolarHBondContact O-CB 3.46Å; T215-N219 VanDerWaalsContact O-CG 3.3Å; T215-N219 PolarHBondContact O-N 3.06Å; T215-N219 VanDerWaalsContact O-N 3.07Å; T215-N219 PolarHBondContact O-ND2 3.06Å; Y216-N219 CarbonylContact O-C 3.49Å; Y216-N219 PolarHBondContact O-N 2.96Å; I217-N219 VanDerWaalsContact C-N 3.32Å; N219-N221 PolarHBondContact O-N 3.05Å
220T63.7Low55.4Low33 Ų33116.6 Ų116.620%0.20259%0.585CS.*SBendtrans-63.1120.6174.3-57.60000109.1Y216 I217 W222 L225Y216-T220 PolarHBondContact O-N 2.97Å; Y216-T220 PolarHBondContact O-OG1 2.83Å; I217-T220 PolarHBondContact O-N 2.93Å; T220-W222 PolarHBondContact O-N 3.5Å; T220-W222 PolarHBondContact O-NE1 2.95Å; T220-L225 HydrophobicContact CG2-CD1 4.39Å
221N55.9Low54.3Low80 Ų80114.9 Ų114.943%0.42859%0.591SS.*  trans-69.6102.6169.4-176.414.6000108.8N219 N223 D224N219-N221 PolarHBondContact O-N 3.05Å; N221-N223 PolarHBondContact O-N 2.82Å; N221-N223 VanDerWaalsContact O-N 3.14Å; N221-N223 WeakPolarHBondContact OD1-CB 3.31Å; N221-N223 PolarHBondContact OD1-N 2.83Å; N221-N223 PolarHBondContact OD1-ND2 3.25Å; N221-D224 PolarHBondContact ND2-OD2 2.97Å; N221-D224 PolarHBondContact O-N 3.33Å
222W58.3Low52.9Low161 Ų161117.3 Ų117.361%0.6160%0.595SS**G310 helixtrans-66.2-12.9-179.3-64.589.1000113.6I217 T220 D224 L225I217-W222 HydrophobicContact CG2-CH2 4.37Å; I217-W222 HydrophobicContact CG2-CZ2 3.74Å; I217-W222 PolarHBondContact O-NE1 3.24Å; T220-W222 PolarHBondContact O-N 3.5Å; T220-W222 PolarHBondContact O-NE1 2.95Å; W222-D224 VanDerWaalsContact C-N 3.3Å; W222-L225 HydrophobicContact CD2-CD1 3.96Å; W222-L225 HydrophobicContact CE3-CD1 3.17Å; W222-L225 HydrophobicContact CZ3-CD1 3.53Å
223N61.8Low51.8Low141 Ų141115.6 Ų115.675%0.75460%0.603SS**G310 helixtrans-77-14.4176.7-59.4-50000113.4N221N221-N223 PolarHBondContact O-N 2.82Å; N221-N223 VanDerWaalsContact O-N 3.14Å; N221-N223 WeakPolarHBondContact OD1-CB 3.31Å; N221-N223 PolarHBondContact OD1-N 2.83Å; N221-N223 PolarHBondContact OD1-ND2 3.25Å
224D54.6Low51Low125 Ų125123.1 Ų123.167%0.66865%0.646SS**G310 helixtrans-101.811.3-179.9-66.4-35.9000113.1N221 W222 D226N221-D224 PolarHBondContact ND2-OD2 2.97Å; N221-D224 PolarHBondContact O-N 3.33Å; W222-D224 VanDerWaalsContact C-N 3.3Å; D224-D226 PolarHBondContact O-N 3.3Å
225L47.9Very low50.7Low69 Ų69123.9 Ų123.936%0.36165%0.654SS.*  trans-90.166178.9-73.4165.9000111.5T220 W222 E227T220-L225 HydrophobicContact CG2-CD1 4.39Å; W222-L225 HydrophobicContact CD2-CD1 3.96Å; W222-L225 HydrophobicContact CE3-CD1 3.17Å; W222-L225 HydrophobicContact CZ3-CD1 3.53Å; L225-E227 PolarHBondContact O-N 3.34Å
226D56.2Low50.3Low162 Ų162126.7 Ų126.787%0.86667%0.666SS**SBendtrans-70.1-16.1168.3-81.6-30.8000112.3D224D224-D226 PolarHBondContact O-N 3.3Å
227E42.5Very low49.7Very low168 Ų168124.4 Ų124.479%0.78567%0.666SS**  trans-138.3113.1174.9-75-176.7161.900111.4L225 P229L225-E227 PolarHBondContact O-N 3.34Å; E227-P229 VanDerWaalsContact O-CD 3.3Å; E227-P229 WeakPolarHBondContact O-CD 3.34Å
228I46Very low49.4Very low151 Ų151128.2 Ų128.277%0.77469%0.687SS**  trans-73.7115.9164.8-58.6173.7000106.9
229P42.2Very low48.7Very low95 Ų95129.3 Ų129.362%0.61769%0.694SS**  trans-67.4140-178.424.9-31.6000110.9E227 V231E227-P229 VanDerWaalsContact O-CD 3.3Å; E227-P229 WeakPolarHBondContact O-CD 3.34Å; P229-V231 PolarHBondContact O-N 2.89Å
230P36.5Very low47.4Very low125 Ų125129.3 Ų129.381%0.81270%0.695SS**  trans-64.5126.4-17824-32.2000111.1K232P230-K232 PolarHBondContact O-N 2.89Å
231V40.2Very low46.3Very low115 Ų115136.2 Ų136.270%0.69773%0.73SS**  trans-70.5113.5174.2-178.70000108.3V193 P229 A233V193-V231 HydrophobicContact CG2-CG1 4.1Å; P229-V231 PolarHBondContact O-N 2.89Å; V231-A233 PolarHBondContact O-N 2.85Å
232K32.6Very low45.5Very low189 Ų189140.5 Ų140.582%0.82275%0.753SS**  trans-72.1118.4168.5-74.2-174.9178.1179.90108.5P230 N234P230-K232 PolarHBondContact O-N 2.89Å; K232-N234 PolarHBondContact O-N 3.45Å
233A37Very low44.5Very low96 Ų96138.8 Ų138.879%0.79377%0.765SS**  trans-65.8123.5164.500000108.1V231V231-A233 PolarHBondContact O-N 2.85Å
234N36.3Very low42.9Very low230 Ų230138.6 Ų138.6100%1.2377%0.766SS**  trans-90.40162-77.6-16.1000108.8K232K232-N234 PolarHBondContact O-N 3.45Å

Retrieved 234 of 234 residues in 111.5 ms (Link to these results)