A0A077ZDS5_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077ZDS5, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 249 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
1M30.1Very low33.5Very low241 Ų241149.1 Ų149.1100%1.18776%0.764SS**  088.90-155.5173.8-171.200106.4
2V29Very low33.6Very low145 Ų145154.3 Ų154.388%0.87977%0.767SS**  trans-117.6127.4-177.4179.80000108
3M31.4Very low33.9Very low145 Ų145151.5 Ų151.571%0.71476%0.755SS**  trans-72.4131.1-156.1-64.8-86.8-84.500112.5T5M3-T5 PolarHBondContact O-N 3.35Å; M3-T5 VanDerWaalsContact O-N 3.09Å
4L34.9Very low34.3Very low174 Ų174147.5 Ų147.591%0.91175%0.748SS**SBendtrans-81.935.5-177.9-144.798.6000112.6
5T34.5Very low34.7Very low84 Ų84151.4 Ų151.452%0.51575%0.75SS.*  trans-111.4-8.8-160.5460000117M3M3-T5 PolarHBondContact O-N 3.35Å; M3-T5 VanDerWaalsContact O-N 3.09Å
6D34.2Very low34.7Very low151 Ų151154.9 Ų154.981%0.80775%0.752SS**G310 helixtrans-96.54-172.7-69.8-35.7000116.1L8D6-L8 PolarHBondContact O-N 3.25Å
7L34.8Very low34.7Very low151 Ų151153.6 Ų153.679%0.79174%0.742SS**G310 helixtrans-88.68.4-177.1-69.7173.1000115.2
8L34.5Very low34.9Very low139 Ų139156.1 Ų156.173%0.72874%0.742SS**G310 helixtrans-93.92.5-173.2-90157.2000115.8D6D6-L8 PolarHBondContact O-N 3.25Å
9M28.7Very low34.9Very low154 Ų154154.7 Ų154.776%0.75974%0.74SS**  trans-125.472.8-174.1-76-79.2168.100115.3
10P38.6Very low34.8Very low54 Ų54158.2 Ų158.235%0.35175%0.745SS.*  trans-130.45.2149.921.5-1.8000114.8R12 L13P10-R12 PolarHBondContact O-N 2.98Å; P10-R12 VanDerWaalsContact O-N 3.16Å; P10-L13 PolarHBondContact O-N 3.05Å
11W37.4Very low34.9Very low202 Ų202156.4 Ų156.477%0.76574%0.74SS**THydrogen-bonded Turntrans-69.6-13.6-175.2-67.786.8000114.7
12R34.6Very low34.8Very low212 Ų212150.8 Ų150.880%0.871%0.714SS**THydrogen-bonded Turntrans-90.9-17.8179.2-66.7-171.4178.7-168.10.9114.2P10P10-R12 PolarHBondContact O-N 2.98Å; P10-R12 VanDerWaalsContact O-N 3.16Å
13L37.8Very low34.7Very low117 Ų117149.3 Ų149.361%0.61371%0.707SS**Hα-helixtrans-85.4-25.1-178.8-86.5131.6000113.5P10 R15P10-L13 PolarHBondContact O-N 3.05Å; L13-R15 VanDerWaalsContact C-N 3.31Å; L13-R15 PolarHBondContact O-N 2.78Å
14C40Very low34.9Very low96 Ų96152.6 Ų152.665%0.64971%0.712SS**Hα-helixtrans-72.2-17-178.8-68.40000114.8
15R39.6Very low34.6Very low206 Ų206149.3 Ų149.378%0.77770%0.703SS**Hα-helixtrans-75.2-41.6176.1-101.8-176.9176.1172.5-1.2112.1L13 F17 R18L13-R15 VanDerWaalsContact C-N 3.31Å; L13-R15 PolarHBondContact O-N 2.78Å; R15-F17 PolarHBondContact O-N 3.05Å; R15-R18 PolarHBondContact O-N 3.15Å
16R34.6Very low34.2Very low208 Ų208154 Ų15479%0.78572%0.724SS**Hα-helixtrans-69.9-27.8-179.1-86.6-177.6173.9172-2.1114.1
17F34.9Very low33.8Very low133 Ų133151 Ų15158%0.58372%0.715SS**Hα-helixtrans-78.5-22.9175.4-85.7-80.8000113.5R15 L21R15-F17 PolarHBondContact O-N 3.05Å; F17-L21 WeakPolarHBondContact O-CD1 3.32Å
18R38.3Very low33.3Very low197 Ų197151 Ų15174%0.74372%0.716SS**Hα-helixtrans-73.7-30.9179.6-161.4172.5-179171.9-2.5112.4R15R15-R18 PolarHBondContact O-N 3.15Å
19D35Very low33Very low130 Ų130151 Ų15170%0.69572%0.722SS**Hα-helixtrans-89.4-13.7-177.6-62.6-27.4000113.7
20R33.5Very low32.8Very low225 Ų225154.9 Ų154.985%0.84973%0.728SS**SBendtrans-102.7-2179.4-72.1-172.5174.9-172.3-2.4114.7
21L35.7Very low32.2Very low121 Ų121157.5 Ų157.563%0.63475%0.746SS**SBendtrans-110.813.7-178.9-73.5171.8000113.7F17F17-L21 WeakPolarHBondContact O-CD1 3.32Å
22L28.7Very low31.6Very low123 Ų123153 Ų15364%0.64475%0.745SS**  trans-117.9108.9172.8-70.6166.2000108.9
23P27.5Very low31.2Very low114 Ų114149.5 Ų149.574%0.7475%0.748SS**  trans-140.266.3130.237.4-22.4000110.2
24W36.2Very low30.6Very low214 Ų214155.3 Ų155.381%0.81176%0.762SS**SBendtrans-127.2106.8158.7-15.5-53000106.8L26W24-L26 PolarHBondContact O-N 3.02Å
25S27.8Very low29.9Very low105 Ų105155.5 Ų155.573%0.73476%0.764SS**  trans-52.1123.6-178.149.60000111.5S27S25-S27 PolarHBondContact O-N 3.45Å
26L26.2Very low29.6Very low182 Ų182153.4 Ų153.495%0.95377%0.768SS**  trans-54.5102.7148.6-88.9144.3000107.9W24W24-L26 PolarHBondContact O-N 3.02Å
27S26.5Very low29.1Very low89 Ų89153.4 Ų153.462%0.62277%0.773SS**  trans-141.2104164.9-520000107.6S25S25-S27 PolarHBondContact O-N 3.45Å
28D23.6Very low28.7Very low149 Ų149151.1 Ų151.180%0.79778%0.78SS**  trans33.3106.4153.1-72.2-55.2000119.8
29V28.4Very low28.4Very low141 Ų141150.8 Ų150.886%0.85579%0.786SS**  -150.190.6125-172.70000108.7C31V29-C31 PolarHBondContact O-N 3.32Å
30R24.2Very low28Very low234 Ų234149.6 Ų149.688%0.88379%0.788SS**  trans-65.5121149.9-77.5-177.1172.2179.8-0.6106.6
31C25.5Very low27.7Very low110 Ų110144.1 Ų144.174%0.74379%0.791SS**  trans-177.4126.2138-103.90000113.1V29V29-C31 PolarHBondContact O-N 3.32Å
32S25.8Very low27.5Very low106 Ų106141 Ų14174%0.74179%0.789SS**  trans7678.3140.3-61.40000119.2R34S32-R34 PolarHBondContact O-N 3.32Å
33T25.3Very low27.5Very low139 Ų139143.2 Ų143.285%0.85380%0.801SS**  trans-49.8117.1132.743.30000111.1
34R26Very low27.9Very low239 Ų239146.8 Ų146.890%0.90281%0.805SS**  trans-171.1119.7148.5-114.7173.1165.9-166.6-5.6111.6S32S32-R34 PolarHBondContact O-N 3.32Å
35S24.7Very low27.6Very low100 Ų100141.2 Ų141.270%0.69980%0.799SS**  trans61.1121.2141-1660000118.2
36L33Very low28.1Very low163 Ų163142.1 Ų142.185%0.85380%0.802SS**  178.6103106.8-86.1169.7000109.1
37F24.2Very low28.7Very low207 Ų207140.6 Ų140.691%0.90880%0.795SS**  trans-65159.7154.4-105.8-103.6000109.3
38A25.9Very low29.2Very low86 Ų86142 Ų14271%0.71179%0.792SS**  trans90.2105.6166.500000117
39Q32.7Very low29.7Very low189 Ų189142.4 Ų142.488%0.88379%0.793SS**  -162.987.8126.2-102.9162.383.600110.4
40S25.9Very low30.1Very low106 Ų106139.2 Ų139.274%0.74177%0.774SS**  trans23.7119.8131.3470000120.7
41A28.5Very low30.6Very low109 Ų109133.4 Ų133.490%0.90175%0.753SS**  39.9109.4123.600000118.8
42G30.2Very low31.1Very low57 Ų57133 Ų13359%0.58874%0.744SS**  trans-174.1106.4164.500000111.9F44G42-F44 VanDerWaalsContact O-CD2 3.29Å; G42-F44 WeakPolarHBondContact O-CD2 3.49Å
43N30.2Very low32.1Very low168 Ų168131.5 Ų131.590%0.89874%0.744SS**  trans1.4109.3161-56.3-16.2000117.7
44F34.1Very low32.7Very low189 Ų189133.3 Ų133.383%0.82974%0.736SS**  trans-130122.8161.2-85-84.1000111.2G42G42-F44 VanDerWaalsContact O-CD2 3.29Å; G42-F44 WeakPolarHBondContact O-CD2 3.49Å
45S31Very low33.7Very low98 Ų98126.7 Ų126.769%0.68572%0.717SS**  trans-68.4146.9177.3-1700000111.2D47S45-D47 PolarHBondContact O-N 3.48Å
46P37.7Very low34.6Very low124 Ų124126.5 Ų126.581%0.80571%0.711SS**THydrogen-bonded Turntrans-71.24.3-166.627-34.5000117.3
47D38.8Very low35.3Very low150 Ų150123.3 Ų123.380%0.80270%0.699SS**THydrogen-bonded Turntrans-114.617.5-169-78-21.3000116.3S45S45-D47 PolarHBondContact O-N 3.48Å
48Q37.5Very low36.3Very low119 Ų119118.3 Ų118.356%0.55670%0.696SS**  trans-122.4108.6173.8-82.4-176.415.500112.8T50Q48-T50 PolarHBondContact O-N 3.36Å
49L33.6Very low37.2Very low157 Ų157119.2 Ų119.282%0.82269%0.689SS**  trans-83.7100.1165.9-79.1164.2000109.2V56L49-V56 PolarHBondContact O-N 3.05Å
50T37.6Very low37.9Very low73 Ų73117 Ų11745%0.44868%0.683SS.*EExtended strand (participates in β ladder)trans-94.5122.6174.3-45.70000109.4Q48 R54Q48-T50 PolarHBondContact O-N 3.36Å; T50-R54 CarbonylContact C-O 3.59Å; T50-R54 WeakPolarHBondContact CA-O 3.43Å; T50-R54 WeakPolarHBondContact CG2-O 3.5Å
51Y35.3Very low39.3Very low112 Ų112117.5 Ų117.544%0.43968%0.677SS.*EExtended strand (participates in β ladder)trans-115.9126.7172.7-171.4-96.8000109.5G53 R54Y51-G53 VanDerWaalsContact C-N 3.26Å; Y51-G53 PolarHBondContact O-N 3.49Å; Y51-R54 PolarHBondContact N-O 2.87Å; Y51-R54 PolarHBondContact O-N 3.24Å
52D35.7Very low40.5Very low103 Ų103116.3 Ų116.355%0.55166%0.659SS**THydrogen-bonded Turntrans57.534.2180-144.916000114.1R54 R102D52-R54 PolarHBondContact O-N 3.41Å; D52-R102 IonicContact OD2-CZ 3.99Å; D52-R102 VanDerWaalsContact OD2-CZ 3.24Å; D52-R102 IonicContact OD2-NE 3.04Å; D52-R102 PolarHBondContact OD2-NE 3.17Å; D52-R102 IonicContact OD2-NH2 2.87Å; D52-R102 PolarHBondContact OD2-NH2 3.1Å
53G45.9Very low41.6Very low73 Ų73120.5 Ų120.575%0.75366%0.663SS**THydrogen-bonded Turntrans73.78.8-176.300000114.7Y51Y51-G53 VanDerWaalsContact C-N 3.26Å; Y51-G53 PolarHBondContact O-N 3.49Å
54R37.2Very low43.2Very low178 Ų178118 Ų11867%0.67265%0.646SS**EExtended strand (participates in β ladder)trans-113.1135.2177.2-62.4-178179.9169.6-0.4110.6T50 Y51 D52 V56T50-R54 CarbonylContact C-O 3.59Å; T50-R54 WeakPolarHBondContact CA-O 3.43Å; T50-R54 WeakPolarHBondContact CG2-O 3.5Å; Y51-R54 PolarHBondContact N-O 2.87Å; Y51-R54 PolarHBondContact O-N 3.24Å; D52-R54 PolarHBondContact O-N 3.41Å; R54-V56 PolarHBondContact O-N 2.92Å
55I48.5Very low44.1Very low99 Ų99114.8 Ų114.851%0.50863%0.634SS.*EExtended strand (participates in β ladder)trans-72.9115.6173.1-58.9169.1000106.4T57I55-T57 PolarHBondContact O-N 3.49Å
56V42.1Very low45.2Very low96 Ų96114.5 Ų114.558%0.58262%0.624SS**  trans-86.1101.6176.5-179.70000107.4L49 R54L49-V56 PolarHBondContact O-N 3.05Å; R54-V56 PolarHBondContact O-N 2.92Å
57T47.9Very low46.6Very low97 Ų97113.4 Ų113.460%0.59561%0.611SS**  trans-77.2133.6165.947.80000108.4I55 D59I55-T57 PolarHBondContact O-N 3.49Å; T57-D59 VanDerWaalsContact C-N 3.3Å; T57-D59 PolarHBondContact O-N 3.28Å
58A46.3Very low47.9Very low102 Ų102114 Ų11484%0.84360%0.602SS**  trans-71.887.3176.500000108.9
59D45.1Very low48.9Very low105 Ų105113.2 Ų113.256%0.56160%0.6SS**  trans-102.6145.6167.8-79.6-41.9000109.5T57 N61T57-D59 VanDerWaalsContact C-N 3.3Å; T57-D59 PolarHBondContact O-N 3.28Å; D59-N61 PolarHBondContact O-N 3.44Å
60D47.8Very low49.7Very low142 Ų142111.8 Ų111.876%0.75959%0.589SS**THydrogen-bonded Turntrans-55.119.1-163.8-58.1-61.6000118.3
61N53.6Low50.9Low116 Ų116112.2 Ų112.262%0.6260%0.595SS**THydrogen-bonded Turntrans-88.2-8.4-178.9-65.9-33.4000114.1D59 E63 E65D59-N61 PolarHBondContact O-N 3.44Å; N61-E63 VanDerWaalsContact C-N 3.34Å; N61-E63 PolarHBondContact O-N 3.09Å; N61-E65 PolarHBondContact O-N 2.98Å
62T55.4Low52.2Low85 Ų85110.2 Ų110.252%0.52160%0.597SS.*Hα-helixtrans-69-31.8-176.355.90000112.6E65 L66T62-E65 PolarHBondContact O-N 3.29Å; T62-L66 WeakPolarHBondContact O-CB 3.46Å; T62-L66 VanDerWaalsContact O-CG 3.28Å; T62-L66 WeakPolarHBondContact O-CG 3.49Å; T62-L66 PolarHBondContact O-N 3.06Å
63E53.1Low53.1Low144 Ų144108.8 Ų108.867%0.67359%0.592SS**Hα-helixtrans-70.6-39.8-178.9-50-163.1151.200111.9N61 E65 L66 N67N61-E63 VanDerWaalsContact C-N 3.34Å; N61-E63 PolarHBondContact O-N 3.09Å; E63-E65 VanDerWaalsContact C-N 3.35Å; E63-L66 PolarHBondContact O-N 3.49Å; E63-N67 PolarHBondContact O-N 3.48Å
64E63.2Low53.4Low115 Ų115107.7 Ų107.754%0.53758%0.576SS.*Hα-helixtrans-71.7-32.8178.2-145.8-176.2-146.600111.6R68E64-R68 VanDerWaalsContact O-CG 3.32Å; E64-R68 WeakPolarHBondContact O-CG 3.38Å; E64-R68 PolarHBondContact O-N 3.36Å; E64-R68 VanDerWaalsContact O-N 3.09Å; E64-R68 IonicContact OE2-CZ 3.24Å; E64-R68 IonicContact OE2-NH2 2.71Å; E64-R68 PolarHBondContact OE2-NH2 2.95Å
65E53.1Low53.9Low123 Ų123102.6 Ų102.658%0.57557%0.567SS**Hα-helixtrans-69.9-37.9173.5-144.9172.4-177.200111.4N61 T62 E63 R68 M69N61-E65 PolarHBondContact O-N 2.98Å; T62-E65 PolarHBondContact O-N 3.29Å; E63-E65 VanDerWaalsContact C-N 3.35Å; E65-R68 PolarHBondContact O-N 2.93Å; E65-M69 WeakPolarHBondContact O-CE 3.41Å; E65-M69 WeakPolarHBondContact O-CG 3.4Å; E65-M69 PolarHBondContact O-N 3.21Å
66L54.5Low53.8Low91 Ų91102.1 Ų102.148%0.47656%0.563SS.*Hα-helixtrans-63.4-44.8171.3-77.2165.4000112.3T62 E63 R68 M69 Q70T62-L66 WeakPolarHBondContact O-CB 3.46Å; T62-L66 VanDerWaalsContact O-CG 3.28Å; T62-L66 WeakPolarHBondContact O-CG 3.49Å; T62-L66 PolarHBondContact O-N 3.06Å; E63-L66 PolarHBondContact O-N 3.49Å; L66-R68 VanDerWaalsContact C-N 3.32Å; L66-R68 PolarHBondContact O-N 3.11Å; L66-M69 HydrophobicContact CD2-CE 3.9Å; L66-M69 HydrophobicContact CG-CE 4.24Å; L66-M69 PolarHBondContact O-N 3.41Å; L66-M69 VanDerWaalsContact O-N 3.17Å; L66-Q70 WeakPolarHBondContact O-CG 3.39Å; L66-Q70 PolarHBondContact O-N 3.42Å
67N67.1Low54Low101 Ų101102 Ų10254%0.5456%0.559SS.*Hα-helixtrans-62.2-37.9176.4-90.2-5.6000112.5E63 S71E63-N67 PolarHBondContact O-N 3.48Å; N67-S71 WeakPolarHBondContact O-CB 3.29Å; N67-S71 PolarHBondContact O-N 3.23Å; N67-S71 PolarHBondContact O-OG 3.09Å
68R64.7Low53.9Low164 Ų164103.2 Ų103.262%0.61956%0.562SS**Hα-helixtrans-65-42.8172.8-71.4176.7-142.7-136.15.9111.6E64 E65 L66 S71 S72E64-R68 VanDerWaalsContact O-CG 3.32Å; E64-R68 WeakPolarHBondContact O-CG 3.38Å; E64-R68 PolarHBondContact O-N 3.36Å; E64-R68 VanDerWaalsContact O-N 3.09Å; E64-R68 IonicContact OE2-CZ 3.24Å; E64-R68 IonicContact OE2-NH2 2.71Å; E64-R68 PolarHBondContact OE2-NH2 2.95Å; E65-R68 PolarHBondContact O-N 2.93Å; L66-R68 VanDerWaalsContact C-N 3.32Å; L66-R68 PolarHBondContact O-N 3.11Å; R68-S71 PolarHBondContact O-N 3.17Å; R68-S72 WeakPolarHBondContact O-CB 3.46Å; R68-S72 PolarHBondContact O-N 2.97Å
69M59Low53.9Low102 Ų102108.3 Ų108.350%0.50256%0.559SS.*Hα-helixtrans-64.4-44.3177.2-74.9-172.4-76.700112E65 L66 S71 S72 V73E65-M69 WeakPolarHBondContact O-CE 3.41Å; E65-M69 WeakPolarHBondContact O-CG 3.4Å; E65-M69 PolarHBondContact O-N 3.21Å; L66-M69 HydrophobicContact CD2-CE 3.9Å; L66-M69 HydrophobicContact CG-CE 4.24Å; L66-M69 PolarHBondContact O-N 3.41Å; L66-M69 VanDerWaalsContact O-N 3.17Å; M69-S71 PolarHBondContact O-N 3.42Å; M69-S72 PolarHBondContact O-N 3.39Å; M69-V73 VanDerWaalsContact O-CG2 3.32Å; M69-V73 WeakPolarHBondContact O-CG2 3.33Å; M69-V73 PolarHBondContact O-N 3.24Å
70Q50.7Low54Low127 Ų127109.6 Ų109.659%0.59357%0.565SS**Hα-helixtrans-61.9-43.2177-74-176.7-0.200112.1L66 S72 V73 A74L66-Q70 WeakPolarHBondContact O-CG 3.39Å; L66-Q70 PolarHBondContact O-N 3.42Å; Q70-S72 VanDerWaalsContact C-N 3.34Å; Q70-S72 PolarHBondContact O-N 2.87Å; Q70-V73 PolarHBondContact O-N 2.83Å; Q70-A74 WeakPolarHBondContact O-CB 3.32Å; Q70-A74 PolarHBondContact O-N 3.43Å
71S62.8Low54Low81 Ų81107.5 Ų107.557%0.56656%0.561SS**Hα-helixtrans-62.9-39.5176.8-60.30000112.3N67 R68 M69 A74 C75N67-S71 WeakPolarHBondContact O-CB 3.29Å; N67-S71 PolarHBondContact O-N 3.23Å; N67-S71 PolarHBondContact O-OG 3.09Å; R68-S71 PolarHBondContact O-N 3.17Å; M69-S71 PolarHBondContact O-N 3.42Å; S71-A74 PolarHBondContact O-N 3.34Å; S71-C75 WeakPolarHBondContact O-CB 3.32Å; S71-C75 PolarHBondContact O-N 3.42Å; S71-C75 VanDerWaalsContact O-N 3.09Å
72S63Low53.1Low71 Ų71104.3 Ų104.350%0.49756%0.556SS.*Hα-helixtrans-66.1-40.9175.9-173.70000112.2R68 M69 Q70 C75 M76R68-S72 WeakPolarHBondContact O-CB 3.46Å; R68-S72 PolarHBondContact O-N 2.97Å; M69-S72 PolarHBondContact O-N 3.39Å; Q70-S72 VanDerWaalsContact C-N 3.34Å; Q70-S72 PolarHBondContact O-N 2.87Å; S72-C75 PolarHBondContact O-N 3.48Å; S72-M76 PolarHBondContact O-N 2.71Å; S72-M76 VanDerWaalsContact O-N 3.11Å
73V54.7Low52.3Low73 Ų73104.8 Ų104.844%0.44256%0.563SS.*Hα-helixtrans-66-43.4175.9173.60000111.4M69 Q70 C75 M76 L77M69-V73 VanDerWaalsContact O-CG2 3.32Å; M69-V73 WeakPolarHBondContact O-CG2 3.33Å; M69-V73 PolarHBondContact O-N 3.24Å; Q70-V73 PolarHBondContact O-N 2.83Å; V73-C75 VanDerWaalsContact C-N 3.32Å; V73-C75 PolarHBondContact O-N 2.96Å; V73-M76 HydrophobicContact CG2-CE 4.27Å; V73-M76 PolarHBondContact O-N 3.49Å; V73-L77 HydrophobicContact CG1-CD1 3.96Å; V73-L77 HydrophobicContact CG1-CG 4.37Å; V73-L77 WeakPolarHBondContact O-CG 3.28Å; V73-L77 PolarHBondContact O-N 2.91Å
74A51.7Low52Low50 Ų50103.3 Ų103.341%0.41357%0.566SS.*Hα-helixtrans-59.9-41.2175.900000112.2Q70 S71 M76 L77 N78Q70-A74 WeakPolarHBondContact O-CB 3.32Å; Q70-A74 PolarHBondContact O-N 3.43Å; S71-A74 PolarHBondContact O-N 3.34Å; A74-M76 PolarHBondContact O-N 3.15Å; A74-L77 PolarHBondContact O-N 3.47Å; A74-N78 PolarHBondContact O-N 3.33Å
75C47.2Very low50.9Low71 Ų71104.1 Ų104.148%0.4857%0.574SS.*Hα-helixtrans-64.6-38.7176.8-162.30000112.3S71 S72 V73 R79S71-C75 WeakPolarHBondContact O-CB 3.32Å; S71-C75 PolarHBondContact O-N 3.42Å; S71-C75 VanDerWaalsContact O-N 3.09Å; S72-C75 PolarHBondContact O-N 3.48Å; V73-C75 VanDerWaalsContact C-N 3.32Å; V73-C75 PolarHBondContact O-N 2.96Å; C75-R79 PolarHBondContact O-N 3.29Å
76M46.5Very low50.2Low88 Ų88105.6 Ų105.643%0.43359%0.586SS.*Hα-helixtrans-68.1-39.6174.2-71.9-169.3-65.700112.8S72 V73 A74 R79 I80S72-M76 PolarHBondContact O-N 2.71Å; S72-M76 VanDerWaalsContact O-N 3.11Å; V73-M76 HydrophobicContact CG2-CE 4.27Å; V73-M76 PolarHBondContact O-N 3.49Å; A74-M76 PolarHBondContact O-N 3.15Å; M76-R79 PolarHBondContact O-N 3.28Å; M76-I80 WeakPolarHBondContact O-CD1 3.49Å; M76-I80 VanDerWaalsContact O-CG1 3.29Å; M76-I80 WeakPolarHBondContact O-CG1 3.44Å; M76-I80 PolarHBondContact O-N 3.43Å; M76-I80 VanDerWaalsContact O-N 3.17Å
77L45.9Very low49.4Very low93 Ų93107.4 Ų107.449%0.48760%0.6SS.*Hα-helixtrans-68-35178.8-70.3173000112.3V73 A74 R79 I80 S81V73-L77 HydrophobicContact CG1-CD1 3.96Å; V73-L77 HydrophobicContact CG1-CG 4.37Å; V73-L77 WeakPolarHBondContact O-CG 3.28Å; V73-L77 PolarHBondContact O-N 2.91Å; A74-L77 PolarHBondContact O-N 3.47Å; L77-R79 VanDerWaalsContact C-N 3.31Å; L77-R79 PolarHBondContact O-N 3.02Å; L77-I80 HydrophobicContact CD2-CD1 4.45Å; L77-I80 PolarHBondContact O-N 3.36Å; L77-I80 VanDerWaalsContact O-N 3.15Å; L77-S81 WeakPolarHBondContact O-CB 3.46Å; L77-S81 PolarHBondContact O-N 3.44Å; L77-S81 PolarHBondContact O-OG 3.33Å
78N46.5Very low48.2Very low124 Ų124108 Ų10866%0.66361%0.609SS**Hα-helixtrans-64.3-34.4172.3-79.9-14.5000112.5A74 I80 S81 G82A74-N78 PolarHBondContact O-N 3.33Å; N78-I80 VanDerWaalsContact C-N 3.33Å; N78-S81 PolarHBondContact O-N 3.35Å; N78-G82 PolarHBondContact O-N 2.94Å
79R46Very low46.6Very low208 Ų208105.6 Ų105.679%0.78562%0.618SS**Hα-helixtrans-70.6-26.4172.6-70.6-177.8177-176.4-1.1113.7C75 M76 L77C75-R79 PolarHBondContact O-N 3.29Å; M76-R79 PolarHBondContact O-N 3.28Å; L77-R79 VanDerWaalsContact C-N 3.31Å; L77-R79 PolarHBondContact O-N 3.02Å
80I48.1Very low45.2Very low132 Ų132106.4 Ų106.468%0.67763%0.632SS**Hα-helixtrans-84.1-21.5179.3-65161.7000111.5M76 L77 N78M76-I80 WeakPolarHBondContact O-CD1 3.49Å; M76-I80 VanDerWaalsContact O-CG1 3.29Å; M76-I80 WeakPolarHBondContact O-CG1 3.44Å; M76-I80 PolarHBondContact O-N 3.43Å; M76-I80 VanDerWaalsContact O-N 3.17Å; L77-I80 HydrophobicContact CD2-CD1 4.45Å; L77-I80 PolarHBondContact O-N 3.36Å; L77-I80 VanDerWaalsContact O-N 3.15Å; N78-I80 VanDerWaalsContact C-N 3.33Å
81S46.7Very low44.3Very low98 Ų98105.2 Ų105.269%0.68564%0.636SS**SBendtrans-97-4.7-178.3-47.30000113.4L77 N78L77-S81 WeakPolarHBondContact O-CB 3.46Å; L77-S81 PolarHBondContact O-N 3.44Å; L77-S81 PolarHBondContact O-OG 3.33Å; N78-S81 PolarHBondContact O-N 3.35Å
82G35.7Very low42.7Very low50 Ų50110.7 Ų110.752%0.51565%0.652SS.*SBendtrans-80.9127179.800000112.6N78N78-G82 PolarHBondContact O-N 2.94Å
83S37.4Very low41.4Very low95 Ų95115.8 Ų115.866%0.66467%0.668SS**  trans-50.6136.9171.4-172.10000111.5D85S83-D85 PolarHBondContact O-N 3.01Å
84P48Very low40.2Very low112 Ų112121.2 Ų121.273%0.72769%0.689SS**THydrogen-bonded Turntrans-73.916.2-169.531-36.7000116.2
85D38.9Very low39Very low133 Ų133128 Ų12871%0.71171%0.709SS**THydrogen-bonded Turntrans-111.64.8-164.9-74.6-56.3000116.5S83S83-D85 PolarHBondContact O-N 3.01Å
86D39.2Very low38.1Very low154 Ų154130 Ų13082%0.82472%0.72SS**  trans-123.394.5171.5-81.4-69.5000110P88D86-P88 WeakPolarHBondContact O-CD 3.15Å
87V38.5Very low37.4Very low128 Ų128130.4 Ų130.478%0.77673%0.729SS**  trans-98.2101.5165.7178.70000107.3S89V87-S89 PolarHBondContact O-N 3.14Å
88P40.9Very low36.5Very low113 Ų113131.9 Ų131.973%0.73474%0.744SS**  trans-75.2115.7164.8-4.522.2000107.9D86 C90D86-P88 WeakPolarHBondContact O-CD 3.15Å; P88-C90 PolarHBondContact O-N 2.73Å
89S30.4Very low35.7Very low115 Ų115133.7 Ų133.780%0.80475%0.752SS**  trans-50.7118.8171-53.80000111V87V87-S89 PolarHBondContact O-N 3.14Å
90C30.2Very low34.9Very low118 Ų118133 Ų13380%0.79776%0.757SS**  trans-147.1143.3166.1-89.90000110.5P88P88-C90 PolarHBondContact O-N 2.73Å
91P31.9Very low33.8Very low103 Ų103130 Ų13067%0.66976%0.759SS**  trans-86.8157.6-146.734.4-33.5000113.5E93P91-E93 PolarHBondContact O-N 3.16Å
92E28.8Very low32.9Very low195 Ų195132.4 Ų132.491%0.91175%0.753SS**  trans-48.197167.453.1-150.679.300113.4
93E36.8Very low32.3Very low178 Ų178138.8 Ų138.883%0.83277%0.769SS**  trans-124124.5162.6-70.4-167.8119.800111P91 F95P91-E93 PolarHBondContact O-N 3.16Å; E93-F95 PolarHBondContact O-N 2.73Å
94E28.6Very low31.9Very low187 Ų187139.3 Ų139.387%0.87477%0.768SS**  trans-59.9114.1-176.5-172168.4145.200111.8
95F27.5Very low30.7Very low192 Ų192138.2 Ų138.284%0.84277%0.769SS**  trans-118.1101175.3-148.1-90.8000110.4E93 P97E93-F95 PolarHBondContact O-N 2.73Å; F95-P97 WeakPolarHBondContact O-CD 2.9Å
96T27.2Very low30.1Very low115 Ų115135.1 Ų135.171%0.70676%0.757SS**PPolyproline II helixtrans-77.5116.8173.8-20.50000109.3
97P31.4Very low29.4Very low95 Ų95131.8 Ų131.862%0.61775%0.751SS**PPolyproline II helixtrans-80.6137.4174.130.5-31.2000110.8F95 I99F95-P97 WeakPolarHBondContact O-CD 2.9Å; P97-I99 PolarHBondContact O-N 3.45Å
98P28.6Very low28.8Very low125 Ų125130.4 Ų130.481%0.81275%0.753SS**PPolyproline II helixtrans-71.7129178.329.3-32.1000110.5H100P98-H100 PolarHBondContact O-N 3.34Å
99I28.7Very low28Very low161 Ų161131.1 Ų131.183%0.82676%0.755SS**  trans-81.8103.4176.6-52.9168.6000107.5P97P97-I99 PolarHBondContact O-N 3.45Å
100H29.5Very low27.7Very low193 Ų193134.4 Ų134.489%0.89476%0.758SS**  trans-130.7114.2162.5-10636.5000110.5P98P98-H100 PolarHBondContact O-N 3.34Å
101G24.9Very low27.5Very low70 Ų70135.1 Ų135.172%0.72276%0.759SS**  trans-76.6150.4-175.700000112.8
102R27.1Very low27Very low149 Ų149136.1 Ų136.156%0.56277%0.768SS**  trans-153.3128156.1-110.3167.9174.5170.10.4109.9D52D52-R102 IonicContact OD2-CZ 3.99Å; D52-R102 VanDerWaalsContact OD2-CZ 3.24Å; D52-R102 IonicContact OD2-NE 3.04Å; D52-R102 PolarHBondContact OD2-NE 3.17Å; D52-R102 IonicContact OD2-NH2 2.87Å; D52-R102 PolarHBondContact OD2-NH2 3.1Å
103H24.6Very low26.9Very low184 Ų184131.4 Ų131.485%0.85276%0.762SS**  trans-82.7135.7175-82.5-109.3000109.1
104V27.4Very low26.3Very low106 Ų106132.2 Ų132.264%0.64277%0.768SS**  trans-117.4119.1172.5-1740000108.8
105A23.9Very low26.1Very low89 Ų89129.8 Ų129.874%0.73677%0.766SS**  trans-69.1151.1177.400000112R214A105-R214 PolarHBondContact O-NH2 3.06Å
106S26.2Very low26Very low68 Ų68126.3 Ų126.348%0.47677%0.766SS.*  trans-125.1119.8168.865.20000114.5R214S106-R214 VanDerWaalsContact CA-NH2 3.31Å
107A24.4Very low25.9Very low84 Ų84129 Ų12969%0.69477%0.77SS**  trans-63.6136.7165.600000111.2
108A26Very low25.6Very low98 Ų98136.1 Ų136.181%0.8178%0.784SS**  trans-101.6128.516800000108
109V25Very low25.5Very low128 Ų128135.8 Ų135.878%0.77678%0.782SS**  trans-95.3115.8169.7166.90000107.3T111V109-T111 HydrophobicContact CG1-CG2 4.29Å
110E23.6Very low25.4Very low185 Ų185131.9 Ų131.986%0.86477%0.774SS**  trans-80.3125164.4-78.5179.4144.400108.5
111T26.3Very low25.2Very low133 Ų133130.2 Ų130.282%0.81677%0.772SS**  trans-115.1106.4166.926.40000108.2V109V109-T111 HydrophobicContact CG1-CG2 4.29Å
112S21.6Very low25.2Very low123 Ų123131.5 Ų131.586%0.8678%0.776SS**  trans-76.2126.9170.1-65.30000109.6
113A25.7Very low24.9Very low97 Ų97129.3 Ų129.380%0.80279%0.79SS**  trans-111.3122.5166.500000109.5
114M23.9Very low24.8Very low194 Ų194123.8 Ų123.896%0.95678%0.776SS**  trans-66.3136.6-177.9-68.4171.2164.500112.1
115V24.4Very low24.6Very low137 Ų137123.5 Ų123.583%0.8377%0.774SS**  trans-89.6124.7170.2171.40000108.4
116S24.7Very low24.7Very low118 Ų118127 Ų12783%0.82577%0.768SS**  trans-120.3128.3168.7-170.20000110.5
117H25.5Very low24.5Very low173 Ų173129.4 Ų129.480%0.80177%0.767SS**  trans-66.3136-179-86.4-102000112.5
118R26.4Very low24.6Very low243 Ų243127.2 Ų127.292%0.91775%0.746SS**  -173.1153117.2-101.3175-170.7-166.93.9112.7
119P26.4Very low24.9Very low118 Ų118129.3 Ų129.377%0.76673%0.733SS**  trans-102.2178.6-16440.9-32.4000112.6
120A25.9Very low25.1Very low80 Ų80126.9 Ų126.966%0.66171%0.71SS**  trans98.4119.816000000116.4
121D24.7Very low25.4Very low157 Ų157119.7 Ų119.784%0.8468%0.675SS**SBendtrans80.8121.4150.3-50.9-28.3000118.3
122A24.9Very low25.6Very low97 Ų97113.5 Ų113.580%0.80264%0.638SS**  trans80.383.7-177.100000116A124A122-A124 PolarHBondContact O-N 3.29Å
123A21.9Very low26Very low104 Ų104110.6 Ų110.686%0.8661%0.609SS**  trans-69.372.1171.100000112.4
124A22.2Very low26.3Very low67 Ų67107.7 Ų107.755%0.55458%0.579SS**  trans-85.8102.7154.700000107.1A122 W126A122-A124 PolarHBondContact O-N 3.29Å; A124-W126 PolarHBondContact O-N 3.29Å; A124-W126 VanDerWaalsContact O-N 3.15Å
125V23.1Very low26.6Very low101 Ų10199.4 Ų99.461%0.61254%0.54SS*.  trans-79.996.7179.7-175.60000108.4W127V125-W127 HydrophobicContact CG1-CD2 4.42Å; V125-W127 HydrophobicContact CG1-CZ2 3.7Å; V125-W127 VanDerWaalsContact O-CD1 3.28Å; V125-W127 PolarHBondContact O-NE1 3.22Å
126W25.8Very low26.8Very low162 Ų16299.9 Ų99.961%0.61454%0.537SS*.PPolyproline II helixtrans-88.7127.3175.4-69.781.7000110.2A124 P224A124-W126 PolarHBondContact O-N 3.29Å; A124-W126 VanDerWaalsContact O-N 3.15Å; W126-P224 HydrophobicContact CE3-CB 4.4Å; W126-P224 HydrophobicContact CH2-CB 3.34Å; W126-P224 HydrophobicContact CZ2-CB 3.52Å; W126-P224 HydrophobicContact CZ3-CB 3.79Å
127W22.7Very low26.9Very low118 Ų11897.5 Ų97.545%0.44752%0.52SS..PPolyproline II helixtrans-102.5127.6-174.7-60.681000111V125 E189 R190V125-W127 HydrophobicContact CG1-CD2 4.42Å; V125-W127 HydrophobicContact CG1-CZ2 3.7Å; V125-W127 VanDerWaalsContact O-CD1 3.28Å; V125-W127 PolarHBondContact O-NE1 3.22Å; W127-E189 HydrophobicContact CE3-CB 3.89Å; W127-E189 HydrophobicContact CZ3-CB 4.37Å; W127-R190 HydrophobicContact CZ3-CG 4.31Å
128P26.9Very low26.9Very low38 Ų38100.5 Ų100.525%0.24753%0.525CS..PPolyproline II helixtrans-72.8132.5178.929.9-34000111.2E189P128-E189 VanDerWaalsContact CD-OE2 3.26Å; P128-E189 WeakPolarHBondContact CD-OE2 3.26Å; P128-E189 HydrophobicContact CG-CG 3.95Å; P128-E189 VanDerWaalsContact CG-OE1 3.25Å; P128-E189 WeakPolarHBondContact CG-OE1 3.09Å
129R30.6Very low26.9Very low142 Ų14294.6 Ų94.654%0.53651%0.511SS..EExtended strand (participates in β ladder)trans-87.1130.2174.5-78.9-179.9165.1-176.9-1.3110.5F131 L187 Q220R129-F131 HydrophobicContact CB-CE2 4.41Å; R129-L187 VanDerWaalsContact CA-O 3.31Å; R129-L187 WeakPolarHBondContact CA-O 3.25Å; R129-Q220 PolarHBondContact O-N 3.22Å
130R29.7Very low26.9Very low78 Ų78100.3 Ų100.329%0.29452%0.517SS..EExtended strand (participates in β ladder)trans-101.4138.3177-53.5-170.8-176.8-175.71.9110.5L187 E189 V217 H218 T219R130-L187 HydrophobicContact CB-CB 4.19Å; R130-L187 HydrophobicContact CB-CD1 4.31Å; R130-L187 PolarHBondContact N-O 2.79Å; R130-L187 VanDerWaalsContact N-O 3.07Å; R130-L187 WeakPolarHBondContact O-CB 3.22Å; R130-L187 WeakPolarHBondContact O-CG 3.21Å; R130-L187 PolarHBondContact O-N 2.9Å; R130-E189 IonicContact CZ-OE1 3.78Å; R130-E189 IonicContact NE-OE1 3.79Å; R130-E189 IonicContact NH2-OE1 2.93Å; R130-E189 PolarHBondContact NH2-OE1 3.11Å; R130-V217 HydrophobicContact CB-CG1 3.99Å; R130-V217 HydrophobicContact CG-CG1 4.48Å; R130-H218 CarbonylContact C-O 3.41Å; R130-H218 WeakPolarHBondContact CA-O 3.26Å; R130-T219 HydrophobicContact CG-CG2 4.1Å
131F30.5Very low26.8Very low33 Ų33107.5 Ų107.515%0.14553%0.527CS..EExtended strand (participates in β ladder)trans-112.8141.9177.7-66.5-88.5000110.9R129 F184 V185 A186 V217 H218 Q220 F222R129-F131 HydrophobicContact CB-CE2 4.41Å; F131-F184 HydrophobicContact CD1-CB 4.38Å; F131-V185 VanDerWaalsContact CA-O 3.26Å; F131-V185 WeakPolarHBondContact CA-O 2.96Å; F131-A186 HydrophobicContact CE1-CB 3.86Å; F131-A186 HydrophobicContact CZ-CB 4.19Å; F131-V217 CarbonylContact O-C 3.49Å; F131-V217 WeakPolarHBondContact O-CA 3.1Å; F131-H218 HydrophobicContact CB-CB 4.06Å; F131-H218 PolarHBondContact N-O 3.25Å; F131-H218 PolarHBondContact O-N 3.09Å; F131-Q220 HydrophobicContact CD2-CB 4.42Å; F131-Q220 HydrophobicContact CD2-CG 4.22Å; F131-Q220 HydrophobicContact CE2-CB 4Å; F131-Q220 HydrophobicContact CE2-CG 4.09Å; F131-F222 HydrophobicContact CE2-CE2 4.18Å; F131-F222 HydrophobicContact CZ-CE2 4.27Å
132V30.7Very low26.8Very low4 Ų4106.5 Ų106.52%0.02453%0.526CS..EExtended strand (participates in β ladder)trans-116.7120.4177.5-179.60000110.9F134 L187 I215 V216V132-F134 HydrophobicContact CB-CE2 4.23Å; V132-F134 HydrophobicContact CG1-CD2 4.19Å; V132-F134 HydrophobicContact CG1-CE2 3.62Å; V132-F134 HydrophobicContact CG1-CZ 3.88Å; V132-L187 HydrophobicContact CG2-CD1 3.63Å; V132-I215 HydrophobicContact CG1-CG2 3.79Å; V132-V216 CarbonylContact C-O 3.09Å; V132-V216 VanDerWaalsContact CA-O 3.27Å; V132-V216 WeakPolarHBondContact CA-O 3.37Å
133F29.1Very low26.7Very low61 Ų61106.1 Ų106.127%0.26852%0.518SS..EExtended strand (participates in β ladder)trans-85.6141.7174.6-166.7-103.2000111.7P135 A182 V216F133-P135 HydrophobicContact CD1-CB 4.42Å; F133-P135 HydrophobicContact CD1-CG 3.98Å; F133-P135 HydrophobicContact CE1-CB 3.85Å; F133-P135 HydrophobicContact CE1-CG 3.87Å; F133-A182 HydrophobicContact CD2-CB 4.31Å; F133-A182 HydrophobicContact CE2-CB 3.81Å; F133-V216 HydrophobicContact CB-CB 3.67Å; F133-V216 HydrophobicContact CB-CG2 4.07Å; F133-V216 HydrophobicContact CD1-CG2 4.2Å; F133-V216 PolarHBondContact N-O 3.36Å
134F31.9Very low26.8Very low37 Ų37108 Ų10816%0.16251%0.513CS..  trans-129.4101.8173.5-69.7-89.1000110.5V132 L183V132-F134 HydrophobicContact CB-CE2 4.23Å; V132-F134 HydrophobicContact CG1-CD2 4.19Å; V132-F134 HydrophobicContact CG1-CE2 3.62Å; V132-F134 HydrophobicContact CG1-CZ 3.88Å; F134-L183 HydrophobicContact CD2-CB 4.26Å; F134-L183 HydrophobicContact CD2-CD2 3.82Å; F134-L183 HydrophobicContact CE2-CD2 3.94Å
135P29.8Very low27Very low20 Ų20113.5 Ų113.513%0.1353%0.527CS..SBendtrans-81.2140.8167.323.5-13.5000109.9F133 R214F133-P135 HydrophobicContact CD1-CB 4.42Å; F133-P135 HydrophobicContact CD1-CG 3.98Å; F133-P135 HydrophobicContact CE1-CB 3.85Å; F133-P135 HydrophobicContact CE1-CG 3.87Å; P135-R214 VanDerWaalsContact CD-O 3.26Å; P135-R214 WeakPolarHBondContact CD-O 3.37Å; P135-R214 HydrophobicContact CG-CB 4.07Å
136N29.1Very low27.1Very low146 Ų146117.6 Ų117.678%0.78154%0.54SS*.SBendtrans82.824.3174.3-75.5-45.7000120.5
137C28.4Very low26.9Very low69 Ų69115.2 Ų115.247%0.46655%0.548SS..  trans-90.8106.6168.5-70.40000112.3L139C137-L139 PolarHBondContact O-N 3.06Å
138R25.2Very low26.9Very low236 Ų236117 Ų11789%0.89157%0.565SS**  trans-64.499.1158.2-85.5-172.6176.3-179.4-1.2108.4R140R138-R140 PolarHBondContact O-N 3.42Å
139L26.6Very low26.6Very low119 Ų119119.8 Ų119.862%0.62359%0.591SS**  trans-76.5107.2171.1-77.6158.6000108.8C137C137-L139 PolarHBondContact O-N 3.06Å
140R24.4Very low26.3Very low237 Ų237119 Ų11989%0.89460%0.602SS**  trans-72.3126.6164.7-97.7-176.1171.9-179.1-2.5108.4R138 V142R138-R140 PolarHBondContact O-N 3.42Å; R140-V142 PolarHBondContact O-N 3.16Å; R140-V142 VanDerWaalsContact O-N 3.15Å
141R24.8Very low26Very low232 Ų232123.4 Ų123.488%0.87563%0.631SS**  trans-56.5116164.3-115.4-177-171.9167.12.1107.5S143R141-S143 VanDerWaalsContact C-N 3.27Å; R141-S143 PolarHBondContact O-N 2.71Å
142V25.4Very low25.8Very low135 Ų135127 Ų12782%0.81866%0.656SS**  trans-82.786.2160.3-178.50000104.9R140 D144R140-V142 PolarHBondContact O-N 3.16Å; R140-V142 VanDerWaalsContact O-N 3.15Å; V142-D144 PolarHBondContact O-N 3.37Å
143S23.1Very low25.4Very low90 Ų90131.5 Ų131.563%0.62969%0.688SS**  trans-72.8107157.3-77.90000105.8R141R141-S143 VanDerWaalsContact C-N 3.27Å; R141-S143 PolarHBondContact O-N 2.71Å
144D23.9Very low25.3Very low143 Ų143134 Ų13477%0.76571%0.707SS**  trans174133.7131.8-82.3-24.9000109V142V142-D144 PolarHBondContact O-N 3.37Å
145Q26.4Very low24.9Very low182 Ų182143.1 Ų143.185%0.8574%0.741SS**  trans87.782.2172.2-60.6175.35.400117.6
146Q23.4Very low24.7Very low187 Ų187147.1 Ų147.187%0.87477%0.767SS**  34.8101.1124-75.5166.6-15.400117.4
147S22.4Very low24.5Very low112 Ų112149.6 Ų149.678%0.78377%0.773SS**  162.7143.5114.551.80000110.9
148I23.2Very low24.4Very low156 Ų156149.4 Ų149.480%0.878%0.783SS**  trans80.781179.1-42.9174.2000113.7T150I148-T150 PolarHBondContact O-N 3.04Å
149A20.9Very low24.5Very low97 Ų97144.2 Ų144.280%0.80278%0.78SS**  trans-46.1127.1162.200000111.6
150T24.6Very low24.7Very low124 Ų124144.8 Ų144.876%0.76179%0.788SS**  trans-138.8113.21497.50000106.7I148 V152I148-T150 PolarHBondContact O-N 3.04Å; T150-V152 PolarHBondContact O-N 3.06Å
151D23.1Very low25Very low171 Ų171138.2 Ų138.291%0.91478%0.776SS**  trans-56.2113.5-178-142.1-11000109.7
152V25.3Very low25.2Very low109 Ų109135.8 Ų135.866%0.66177%0.774SS**  trans-98.294.3179.3-177.80000107.8T150 V154T150-V152 PolarHBondContact O-N 3.06Å; V152-V154 PolarHBondContact O-N 3.08Å
153S23.6Very low25.3Very low99 Ų99137.7 Ų137.769%0.69278%0.777SS**  trans-76.2112.2173-171.20000109.8
154V25.3Very low25.5Very low113 Ų113141.3 Ų141.369%0.68579%0.788SS**  trans-89.1110.5171.4-179.10000107.2V152V152-V154 PolarHBondContact O-N 3.08Å
155R24Very low25.8Very low229 Ų229144.3 Ų144.386%0.86479%0.789SS**  trans-103.5118.9169.5-81.3-166.8179.2-169.8-0.3109.9
156P25.3Very low26.1Very low104 Ų104145 Ų14568%0.67579%0.789SS**  trans-80.9142.6171.732.5-29.1000110.1
157H26.5Very low26.3Very low197 Ų197144.3 Ų144.391%0.91279%0.791SS**  trans53.6104.3162.6-67.1-78000118.3
158G26.3Very low26.9Very low65 Ų65141.7 Ų141.767%0.6778%0.782SS**  trans-177.1146.7162.600000111.1V160G158-V160 PolarHBondContact O-N 3.41Å
159P26.9Very low27.5Very low128 Ų128141 Ų14183%0.83179%0.788SS**SBendtrans-63137.3-173.728.6-33.5000110.2
160V30.3Very low28.1Very low131 Ų131139.6 Ų139.679%0.79478%0.782SS**  trans11.3100.2167-174.50000113.7G158 Q162G158-V160 PolarHBondContact O-N 3.41Å; V160-Q162 PolarHBondContact O-N 3.41Å
161P31.4Very low28.7Very low98 Ų98141.3 Ų141.364%0.63678%0.779SS**  trans-68.9113.5176.728.2-30.7000108M163P161-M163 PolarHBondContact O-N 2.06Å; P161-M163 VanDerWaalsContact O-N 3.16Å
162Q27.8Very low29.1Very low181 Ų181139 Ų13985%0.84677%0.766SS**  trans-44.9123.8160.5-65.2179.517.300107.4V160 L164V160-Q162 PolarHBondContact O-N 3.41Å; Q162-L164 VanDerWaalsContact C-N 3.33Å; Q162-L164 PolarHBondContact O-N 3.08Å
163M27.6Very low29.7Very low175 Ų175139 Ų13986%0.86276%0.758SS**  trans-49.192.2-178.1-86.4171.247.800111P161 R165P161-M163 PolarHBondContact O-N 2.06Å; P161-M163 VanDerWaalsContact O-N 3.16Å; M163-R165 PolarHBondContact O-N 2.74Å; M163-R165 VanDerWaalsContact O-N 3.14Å
164L28.4Very low30.3Very low166 Ų166138.9 Ų138.987%0.86975%0.749SS**  trans-79.1101.5169.4-147.683.5000106.5Q162 K166Q162-L164 VanDerWaalsContact C-N 3.33Å; Q162-L164 PolarHBondContact O-N 3.08Å; L164-K166 PolarHBondContact O-N 3.47Å; L164-K166 VanDerWaalsContact O-N 3.1Å
165R29Very low30.9Very low206 Ų206139 Ų13978%0.77775%0.745SS**  trans-45.6114.6171.6-73.3178.5167.7170.8-3.9109.4M163M163-R165 PolarHBondContact O-N 2.74Å; M163-R165 VanDerWaalsContact O-N 3.14Å
166K32.3Very low31.5Very low196 Ų196131.7 Ų131.785%0.85272%0.723SS**  trans-137.4113.8162.3-148.7173.6-175.5-179.10108.1L164 G168L164-K166 PolarHBondContact O-N 3.47Å; L164-K166 VanDerWaalsContact O-N 3.1Å; K166-G168 PolarHBondContact O-N 3.1Å
167D29.1Very low32.2Very low174 Ų174136.4 Ų136.493%0.9374%0.736SS**  trans-53.5115.3-178.8-66.7-64.6000111.6
168G33.4Very low32.6Very low56 Ų56137.1 Ų137.158%0.57773%0.731SS**SBendtrans152.1153172.800000113.2K166 G170K166-G168 PolarHBondContact O-N 3.1Å; G168-G170 PolarHBondContact O-N 2.75Å
169P35.9Very low32.8Very low143 Ų143137.1 Ų137.193%0.92973%0.731SS**  trans-7472.9176.232.9-33.7000109.8
170G33Very low33Very low67 Ų67132.2 Ų132.269%0.69170%0.699SS**  trans-79.6120.3174.100000110.6G168 L172G168-G170 PolarHBondContact O-N 2.75Å; G170-L172 PolarHBondContact O-N 3.36Å
171K38.5Very low33Very low159 Ų159128.5 Ų128.569%0.69168%0.682SS**  trans-74.7103.3166.1-68.1176.6-177.1171.90107.6F173K171-F173 HydrophobicContact CB-CD2 4.49Å; K171-F173 HydrophobicContact CB-CE2 3.88Å; K171-F173 HydrophobicContact CB-CZ 4.46Å
172L31.9Very low32.9Very low124 Ų124124 Ų12465%0.64965%0.653SS**  trans-79130.5167.6-137.376.9000107.8G170 F184G170-L172 PolarHBondContact O-N 3.36Å; L172-F184 WeakPolarHBondContact O-CD2 3.26Å; L172-F184 WeakPolarHBondContact O-CE2 3.44Å
173F37.8Very low33.3Very low109 Ų109117.9 Ų117.948%0.47863%0.626SS.*  trans-108.5126.3168.8-67.9-95.7000106.5K171 A182 L183K171-F173 HydrophobicContact CB-CD2 4.49Å; K171-F173 HydrophobicContact CB-CE2 3.88Å; K171-F173 HydrophobicContact CB-CZ 4.46Å; F173-A182 WeakPolarHBondContact CD1-O 3.15Å; F173-L183 HydrophobicContact CE1-CD1 4.26Å
174D36.3Very low33.6Very low95 Ų95113.8 Ų113.851%0.50860%0.604SS.*  trans-106.9133.7173.3-140.8-34.3000107.2A182 F184D174-A182 WeakPolarHBondContact O-CB 3.27Å; D174-A182 PolarHBondContact O-N 3.01Å; D174-F184 HydrophobicContact CB-CE2 4.03Å; D174-F184 HydrophobicContact CB-CZ 4.04Å
175L36.3Very low34Very low116 Ų116107.5 Ų107.561%0.60757%0.572SS**EExtended strand (participates in β ladder)trans-97105.4175.5-90.5142.7000106
176D37.5Very low34.2Very low76 Ų76100.2 Ų100.241%0.40656%0.556SS.*EExtended strand (participates in β ladder)trans-58.2146.6169-173.522.3000108.7R178 G179 C180D176-R178 PolarHBondContact O-N 2.94Å; D176-G179 PolarHBondContact O-N 3.34Å; D176-C180 HydrophobicContact CB-CB 4.3Å; D176-C180 PolarHBondContact N-O 3.44Å
177E39.7Very low34.3Very low203 Ų20391.6 Ų91.695%0.94952%0.519SS*.THydrogen-bonded Turntrans-58.1-1.2-176.4-63.8-172.6145.600113.5
178R34.1Very low34.4Very low212 Ų21286.8 Ų86.880%0.849%0.493SS*.THydrogen-bonded Turntrans-10011.6175.6-58.5179.4-175.6-159.6-0.4114.1D176 C180D176-R178 PolarHBondContact O-N 2.94Å; R178-C180 PolarHBondContact O-N 3.39Å
179G32.2Very low34.5Very low64 Ų6486.8 Ų86.866%0.6648%0.478SS*.THydrogen-bonded Turntrans68.423-178.300000113.8D176D176-G179 PolarHBondContact O-N 3.34Å
180C29.7Very low34.4Very low26 Ų2688.5 Ų88.518%0.17647%0.466CS..EExtended strand (participates in β ladder)trans-90.6116.9179.7-64.90000110D176 R178 A182D176-C180 HydrophobicContact CB-CB 4.3Å; D176-C180 PolarHBondContact N-O 3.44Å; R178-C180 PolarHBondContact O-N 3.39Å; C180-A182 PolarHBondContact O-N 3.34Å
181A31.5Very low34.6Very low52 Ų5291.1 Ų91.143%0.4346%0.461SS..EExtended strand (participates in β ladder)trans-69.2115.4170.300000110.1
182A29.9Very low34.6Very low4 Ų488.5 Ų88.53%0.03345%0.453CS..  trans-85.4118.8177.100000111.4F133 F173 D174 C180 F184F133-A182 HydrophobicContact CD2-CB 4.31Å; F133-A182 HydrophobicContact CE2-CB 3.81Å; F173-A182 WeakPolarHBondContact CD1-O 3.15Å; D174-A182 WeakPolarHBondContact O-CB 3.27Å; D174-A182 PolarHBondContact O-N 3.01Å; C180-A182 PolarHBondContact O-N 3.34Å; A182-F184 HydrophobicContact CB-CD2 4.21Å; A182-F184 HydrophobicContact CB-CE2 3.58Å; A182-F184 HydrophobicContact CB-CZ 4.09Å
183L34.2Very low35.3Very low52 Ų5285 Ų8527%0.27244%0.438SS..  trans-88.7114.5167.9-168.499000109F134 F173 V185F134-L183 HydrophobicContact CD2-CB 4.26Å; F134-L183 HydrophobicContact CD2-CD2 3.82Å; F134-L183 HydrophobicContact CE2-CD2 3.94Å; F173-L183 HydrophobicContact CE1-CD1 4.26Å; L183-V185 HydrophobicContact CD2-CG2 3.41Å; L183-V185 VanDerWaalsContact CD2-CG2 3.41Å; L183-V185 HydrophobicContact CG-CG2 4.06Å
184F35.6Very low35.7Very low90 Ų9081.6 Ų81.640%0.39543%0.425SS..  trans-92.6124.4172.5-64.4-97.1000110.1F131 L172 D174 A182F131-F184 HydrophobicContact CD1-CB 4.38Å; L172-F184 WeakPolarHBondContact O-CD2 3.26Å; L172-F184 WeakPolarHBondContact O-CE2 3.44Å; D174-F184 HydrophobicContact CB-CE2 4.03Å; D174-F184 HydrophobicContact CB-CZ 4.04Å; A182-F184 HydrophobicContact CB-CD2 4.21Å; A182-F184 HydrophobicContact CB-CE2 3.58Å; A182-F184 HydrophobicContact CB-CZ 4.09Å
185V36.4Very low36Very low34 Ų3484.5 Ų84.521%0.20643%0.429CS..  trans-126.3105.3177.4-174.70000109.5F131 L183 L187F131-V185 VanDerWaalsContact CA-O 3.26Å; F131-V185 WeakPolarHBondContact CA-O 2.96Å; L183-V185 HydrophobicContact CD2-CG2 3.41Å; L183-V185 VanDerWaalsContact CD2-CG2 3.41Å; L183-V185 HydrophobicContact CG-CG2 4.06Å; V185-L187 HydrophobicContact CG1-CD2 4.04Å; V185-L187 HydrophobicContact CG1-CG 4.19Å; V185-L187 PolarHBondContact O-N 3.28Å
186A32.3Very low36.3Very low53 Ų5379.7 Ų79.744%0.43841%0.405SS..  trans-69.5122171.200000110.3F131F131-A186 HydrophobicContact CE1-CB 3.86Å; F131-A186 HydrophobicContact CZ-CB 4.19Å
187L34.7Very low36.8Very low14 Ų1482.5 Ų82.57%0.07342%0.418CS..BIsolated β-bridgetrans-114.5135.7179.3-63.4159.7000111R129 R130 V132 V185 L194R129-L187 VanDerWaalsContact CA-O 3.31Å; R129-L187 WeakPolarHBondContact CA-O 3.25Å; R130-L187 HydrophobicContact CB-CB 4.19Å; R130-L187 HydrophobicContact CB-CD1 4.31Å; R130-L187 PolarHBondContact N-O 2.79Å; R130-L187 VanDerWaalsContact N-O 3.07Å; R130-L187 WeakPolarHBondContact O-CB 3.22Å; R130-L187 WeakPolarHBondContact O-CG 3.21Å; R130-L187 PolarHBondContact O-N 2.9Å; V132-L187 HydrophobicContact CG2-CD1 3.63Å; V185-L187 HydrophobicContact CG1-CD2 4.04Å; V185-L187 HydrophobicContact CG1-CG 4.19Å; V185-L187 PolarHBondContact O-N 3.28Å; L187-L194 HydrophobicContact CD1-CD2 3.44Å; L187-L194 VanDerWaalsContact CD1-CD2 3.44Å; L187-L194 HydrophobicContact CD2-CD2 4.32Å; L187-L194 HydrophobicContact CG-CD2 4.38Å
188D32.4Very low37Very low73 Ų7379.8 Ų79.839%0.3941%0.409SS..  trans-84.9136.6170.1-170.66.9000109.8R190 Q191D188-R190 PolarHBondContact O-N 2.87Å; D188-Q191 HydrophobicContact CB-CG 4.48Å; D188-Q191 PolarHBondContact O-N 3.27Å
189E34.4Very low37.4Very low57 Ų5772.9 Ų72.927%0.26639%0.392SS..G310 helixtrans-60.4-21.2-174.1-88.5-163.5143.600113.8W127 P128 R130 Q191W127-E189 HydrophobicContact CE3-CB 3.89Å; W127-E189 HydrophobicContact CZ3-CB 4.37Å; P128-E189 VanDerWaalsContact CD-OE2 3.26Å; P128-E189 WeakPolarHBondContact CD-OE2 3.26Å; P128-E189 HydrophobicContact CG-CG 3.95Å; P128-E189 VanDerWaalsContact CG-OE1 3.25Å; P128-E189 WeakPolarHBondContact CG-OE1 3.09Å; R130-E189 IonicContact CZ-OE1 3.78Å; R130-E189 IonicContact NE-OE1 3.79Å; R130-E189 IonicContact NH2-OE1 2.93Å; R130-E189 PolarHBondContact NH2-OE1 3.11Å; E189-Q191 PolarHBondContact O-N 2.73Å
190R34.1Very low38.3Very low179 Ų17976.6 Ų76.668%0.67539%0.386SS*.G310 helixtrans-74.9-6.4177.5-60.4-175.2177.6-162.40.8114W127 D188W127-R190 HydrophobicContact CZ3-CG 4.31Å; D188-R190 PolarHBondContact O-N 2.87Å
191Q38Very low39Very low122 Ų12276.9 Ų76.957%0.5739%0.388SS*.G310 helixtrans-98.521.7-176.1-61.1-172.11100114D188 E189 P193 L194D188-Q191 HydrophobicContact CB-CG 4.48Å; D188-Q191 PolarHBondContact O-N 3.27Å; E189-Q191 PolarHBondContact O-N 2.73Å; Q191-P193 CarbonylContact O-C 3.45Å; Q191-L194 PolarHBondContact O-N 2.88Å
192L38.1Very low39.8Very low103 Ų10380.9 Ų80.954%0.53939%0.392SS..  trans-72.3126.2164.6-76.9155.7000109.4L194L192-L194 HydrophobicContact CD2-CG 4.37Å
193P46.8Very low40.7Very low51 Ų5181.3 Ų81.333%0.33139%0.394SS..SBendcis-83.7127.17.931.2-31.2000112Q191 R195 R202Q191-P193 CarbonylContact O-C 3.45Å; P193-R195 WeakPolarHBondContact O-CG 3.5Å; P193-R195 PolarHBondContact O-N 2.8Å; P193-R202 HydrophobicContact CB-CG 4.23Å; P193-R202 HydrophobicContact CG-CG 4Å
194L44.5Very low41.1Very low38 Ų3884 Ų8420%0.19941%0.412CS..  trans-35.2126.1175.8-64.3170.8000111.5L187 Q191 L192 R202 I203L187-L194 HydrophobicContact CD1-CD2 3.44Å; L187-L194 VanDerWaalsContact CD1-CD2 3.44Å; L187-L194 HydrophobicContact CD2-CD2 4.32Å; L187-L194 HydrophobicContact CG-CD2 4.38Å; Q191-L194 PolarHBondContact O-N 2.88Å; L192-L194 HydrophobicContact CD2-CG 4.37Å; L194-R202 CarbonylContact O-C 3.54Å; L194-R202 VanDerWaalsContact O-CA 3.27Å; L194-R202 WeakPolarHBondContact O-CA 3.47Å; L194-I203 HydrophobicContact CB-CB 3.78Å; L194-I203 HydrophobicContact CB-CD1 3.58Å; L194-I203 HydrophobicContact CB-CG1 3.68Å; L194-I203 HydrophobicContact CD1-CB 4.5Å; L194-I203 HydrophobicContact CD1-CD1 4.33Å; L194-I203 HydrophobicContact CG-CD1 4.43Å; L194-I203 WeakPolarHBondContact O-CG1 3.31Å; L194-I203 PolarHBondContact O-N 3.31Å
195R44.1Very low41.5Very low156 Ų15687.8 Ų87.859%0.58942%0.424SS*.BIsolated β-bridgetrans-112.5138.1176.7-61.8-171.4-175.9-143.98.8110.4P193 I197 S201P193-R195 WeakPolarHBondContact O-CG 3.5Å; P193-R195 PolarHBondContact O-N 2.8Å; R195-I197 PolarHBondContact O-N 3.32Å; R195-S201 WeakPolarHBondContact CA-O 3.48Å
196C42.6Very low41.9Very low15 Ų1587.2 Ų87.210%0.10142%0.419CS..  trans-58.3126.3166.7174.90000110.2I198 C199 R200 S201 L206C196-I198 VanDerWaalsContact C-N 3.26Å; C196-I198 PolarHBondContact O-N 3.14Å; C196-C199 HydrophobicContact CB-CB 4.17Å; C196-C199 WeakPolarHBondContact CB-SG 3.39Å; C196-C199 PolarHBondContact O-N 2.79Å; C196-C199 WeakPolarHBondContact SG-CB 3.37Å; C196-C199 PolarHBondContact SG-N 3.33Å; C196-C199 CovalentContact SG-SG 2.06Å; C196-C199 PolarHBondContact SG-SG 2.75Å; C196-R200 WeakPolarHBondContact O-CA 3.41Å; C196-R200 PolarHBondContact O-N 2.88Å; C196-S201 PolarHBondContact N-O 3.4Å; C196-L206 HydrophobicContact CB-CD1 3.55Å
197I46.9Very low42.5Very low134 Ų13491.7 Ų91.769%0.68743%0.429SS*.THydrogen-bonded Turntrans-67.3-30.7177.1-165.6164.9000112.1R195R195-I197 PolarHBondContact O-N 3.32Å
198I44.3Very low43.1Very low147 Ų14798.6 Ų98.675%0.75446%0.461SS*.THydrogen-bonded Turntrans-75.3-39.8-179.9-56.4174.5000110.8C196C196-I198 VanDerWaalsContact C-N 3.26Å; C196-I198 PolarHBondContact O-N 3.14Å
199C43.7Very low43.8Very low66 Ų66101.1 Ų101.145%0.44647%0.47SS..THydrogen-bonded Turntrans-125.3-1.5-162.855.40000114.7C196 S201C196-C199 HydrophobicContact CB-CB 4.17Å; C196-C199 WeakPolarHBondContact CB-SG 3.39Å; C196-C199 PolarHBondContact O-N 2.79Å; C196-C199 WeakPolarHBondContact SG-CB 3.37Å; C196-C199 PolarHBondContact SG-N 3.33Å; C196-C199 CovalentContact SG-SG 2.06Å; C196-C199 PolarHBondContact SG-SG 2.75Å; C199-S201 PolarHBondContact O-N 2.88Å; C199-S201 PolarHBondContact SG-OG 3.18Å
200R49.7Very low44.2Very low143 Ų143103.9 Ų103.954%0.5448%0.479SS..  trans49.54.4-176.5-64.4-174.6178.1176.9-1.2115.6C196C196-R200 WeakPolarHBondContact O-CA 3.41Å; C196-R200 PolarHBondContact O-N 2.88Å
201S45.6Very low44.6Very low31 Ų31100.8 Ų100.822%0.21748%0.482CS..  trans-73.5144.5177.655.30000109.1R195 C196 C199 I203 L206R195-S201 WeakPolarHBondContact CA-O 3.48Å; C196-S201 PolarHBondContact N-O 3.4Å; C199-S201 PolarHBondContact O-N 2.88Å; C199-S201 PolarHBondContact SG-OG 3.18Å; S201-I203 PolarHBondContact O-N 2.95Å; S201-L206 WeakPolarHBondContact OG-CD1 3.29Å
202R48.1Very low44.6Very low137 Ų137104.4 Ų104.452%0.51749%0.491SS..BIsolated β-bridgetrans-57.3130.6174.6-65.7-179.5179.2179.4-1.8107.9P193 L194 V204 R205 L206P193-R202 HydrophobicContact CB-CG 4.23Å; P193-R202 HydrophobicContact CG-CG 4Å; L194-R202 CarbonylContact O-C 3.54Å; L194-R202 VanDerWaalsContact O-CA 3.27Å; L194-R202 WeakPolarHBondContact O-CA 3.47Å; R202-V204 PolarHBondContact O-N 3.1Å; R202-V204 VanDerWaalsContact O-N 3.09Å; R202-R205 WeakPolarHBondContact O-CA 3.34Å; R202-R205 WeakPolarHBondContact O-CB 3.43Å; R202-R205 PolarHBondContact O-N 3.38Å; R202-L206 PolarHBondContact O-N 3.02Å
203I47.6Very low44.6Very low13 Ų13101.1 Ų101.17%0.06748%0.476CS..Hα-helixtrans-58.9-25.2-179.8-64.6-170.6000111.1L194 S201 R205 L206 K207 I215L194-I203 HydrophobicContact CB-CB 3.78Å; L194-I203 HydrophobicContact CB-CD1 3.58Å; L194-I203 HydrophobicContact CB-CG1 3.68Å; L194-I203 HydrophobicContact CD1-CB 4.5Å; L194-I203 HydrophobicContact CD1-CD1 4.33Å; L194-I203 HydrophobicContact CG-CD1 4.43Å; L194-I203 WeakPolarHBondContact O-CG1 3.31Å; L194-I203 PolarHBondContact O-N 3.31Å; S201-I203 PolarHBondContact O-N 2.95Å; I203-R205 PolarHBondContact O-N 3.43Å; I203-L206 WeakPolarHBondContact O-CB 3.27Å; I203-L206 PolarHBondContact O-N 2.99Å; I203-K207 PolarHBondContact O-N 3.07Å; I203-K207 VanDerWaalsContact O-N 3.14Å; I203-I215 HydrophobicContact CG2-CD1 3.66Å
204V42.8Very low44Very low107 Ų107104.2 Ų104.265%0.64848%0.481SS*.Hα-helixtrans-54.5-35168.7-173.20000112.2R202R202-V204 PolarHBondContact O-N 3.1Å; R202-V204 VanDerWaalsContact O-N 3.09Å
205R44.2Very low43.8Very low171 Ų171104.9 Ų104.965%0.64548%0.484SS*.Hα-helixtrans-80.6-26.7173.7-66.7-171.5170.4173.4-2.9113.2R202 I203 Q208 Q209R202-R205 WeakPolarHBondContact O-CA 3.34Å; R202-R205 WeakPolarHBondContact O-CB 3.43Å; R202-R205 PolarHBondContact O-N 3.38Å; I203-R205 PolarHBondContact O-N 3.43Å; R205-Q208 PolarHBondContact O-N 3.23Å; R205-Q209 WeakPolarHBondContact O-CB 3.44Å; R205-Q209 PolarHBondContact O-N 3.47Å; R205-Q209 VanDerWaalsContact O-N 3.1Å
206L44.4Very low43.5Very low21 Ų21100.3 Ų100.311%0.1147%0.473CS..Hα-helixtrans-68-37.1175.1-91.7100.8000112.4C196 S201 R202 I203 Q208 Q209 Y210C196-L206 HydrophobicContact CB-CD1 3.55Å; S201-L206 WeakPolarHBondContact OG-CD1 3.29Å; R202-L206 PolarHBondContact O-N 3.02Å; I203-L206 WeakPolarHBondContact O-CB 3.27Å; I203-L206 PolarHBondContact O-N 2.99Å; L206-Q208 PolarHBondContact O-N 3.04Å; L206-Q209 PolarHBondContact O-N 3.39Å; L206-Y210 HydrophobicContact CD2-CD2 4.24Å; L206-Y210 HydrophobicContact CD2-CE2 4.32Å; L206-Y210 HydrophobicContact CG-CD2 4.38Å; L206-Y210 HydrophobicContact CG-CE2 4.49Å; L206-Y210 PolarHBondContact O-N 3.18Å
207K45.1Very low43.1Very low147 Ų147102.9 Ų102.964%0.63949%0.488SS*.Hα-helixtrans-62.6-31.7176.9-165.5175.5179.9179.70112.2I203 I215I203-K207 PolarHBondContact O-N 3.07Å; I203-K207 VanDerWaalsContact O-N 3.14Å; K207-I215 HydrophobicContact CB-CD1 3.97Å; K207-I215 HydrophobicContact CD-CD1 4.48Å; K207-I215 HydrophobicContact CG-CD1 4.31Å
208Q48Very low42.5Very low159 Ų159102 Ų10274%0.74348%0.481SS*.Hα-helixtrans-76.6-35.5175-70.8-179.5-20.400112.6R205 L206R205-Q208 PolarHBondContact O-N 3.23Å; L206-Q208 PolarHBondContact O-N 3.04Å
209Q46Very low41.9Very low127 Ų12799 Ų9959%0.59347%0.47SS*.Hα-helixtrans-82.7-23.1-177.3-164.7170.2-5.400113R205 L206R205-Q209 WeakPolarHBondContact O-CB 3.44Å; R205-Q209 PolarHBondContact O-N 3.47Å; R205-Q209 VanDerWaalsContact O-N 3.1Å; L206-Q209 PolarHBondContact O-N 3.39Å
210Y43.7Very low41.4Very low115 Ų115100.6 Ų100.645%0.45147%0.471SS..  trans-132.680-178.6-58-81.5000111L206 R212 C213L206-Y210 HydrophobicContact CD2-CD2 4.24Å; L206-Y210 HydrophobicContact CD2-CE2 4.32Å; L206-Y210 HydrophobicContact CG-CD2 4.38Å; L206-Y210 HydrophobicContact CG-CE2 4.49Å; L206-Y210 PolarHBondContact O-N 3.18Å; Y210-R212 PolarHBondContact O-N 3.04Å; Y210-R212 VanDerWaalsContact O-N 3.08Å; Y210-C213 VanDerWaalsContact CB-SG 3.58Å; Y210-C213 PolarHBondContact O-N 3.3Å
211P42Very low40.4Very low113 Ų113100.8 Ų100.873%0.73448%0.481SS*.THydrogen-bonded Turntrans-63.6-16.2179.325.6-34.4000113.2
212R38.5Very low39.8Very low199 Ų199104.4 Ų104.475%0.75149%0.493SS*.THydrogen-bonded Turntrans-87.1-3.9177.2-68.3-173.3163.9179.4-6114.3Y210Y210-R212 PolarHBondContact O-N 3.04Å; Y210-R212 VanDerWaalsContact O-N 3.08Å
213C37.5Very low39.1Very low34 Ų34102.7 Ų102.723%0.2350%0.5CS..  trans-94.9117.5178.7-700000110.3Y210Y210-C213 VanDerWaalsContact CB-SG 3.58Å; Y210-C213 PolarHBondContact O-N 3.3Å
214R35.8Very low38.4Very low115 Ų115105.7 Ų105.743%0.43452%0.52SS..  trans-81.7125.9166.6-65.1-175.2-170-162.3-7.5108.4A105 S106 P135A105-R214 PolarHBondContact O-NH2 3.06Å; S106-R214 VanDerWaalsContact CA-NH2 3.31Å; P135-R214 VanDerWaalsContact CD-O 3.26Å; P135-R214 WeakPolarHBondContact CD-O 3.37Å; P135-R214 HydrophobicContact CG-CB 4.07Å
215I40.1Very low38.2Very low52 Ų52105.2 Ų105.227%0.26752%0.519SS..  trans-98106.2174.4-58.7167.7000106V132 I203 K207 V217V132-I215 HydrophobicContact CG1-CG2 3.79Å; I203-I215 HydrophobicContact CG2-CD1 3.66Å; K207-I215 HydrophobicContact CB-CD1 3.97Å; K207-I215 HydrophobicContact CD-CD1 4.48Å; K207-I215 HydrophobicContact CG-CD1 4.31Å; I215-V217 HydrophobicContact CG2-CG2 4.23Å
216V37Very low37.9Very low61 Ų61101.7 Ų101.737%0.3752%0.518SS..EExtended strand (participates in β ladder)trans-100.7122.5173.1-170.80000108V132 F133V132-V216 CarbonylContact C-O 3.09Å; V132-V216 VanDerWaalsContact CA-O 3.27Å; V132-V216 WeakPolarHBondContact CA-O 3.37Å; F133-V216 HydrophobicContact CB-CB 3.67Å; F133-V216 HydrophobicContact CB-CG2 4.07Å; F133-V216 HydrophobicContact CD1-CG2 4.2Å; F133-V216 PolarHBondContact N-O 3.36Å
217V34.4Very low37.6Very low68 Ų68108.9 Ų108.941%0.41256%0.556SS.*EExtended strand (participates in β ladder)trans-100.9107.5178.3-175.60000109R130 F131 I215R130-V217 HydrophobicContact CB-CG1 3.99Å; R130-V217 HydrophobicContact CG-CG1 4.48Å; F131-V217 CarbonylContact O-C 3.49Å; F131-V217 WeakPolarHBondContact O-CA 3.1Å; I215-V217 HydrophobicContact CG2-CG2 4.23Å
218H35.2Very low37.2Very low116 Ų116111.7 Ų111.754%0.53756%0.564SS.*EExtended strand (participates in β ladder)trans-93.7115.7173.5-98.4-75.5000110.5R130 F131R130-H218 CarbonylContact C-O 3.41Å; R130-H218 WeakPolarHBondContact CA-O 3.26Å; F131-H218 HydrophobicContact CB-CB 4.06Å; F131-H218 PolarHBondContact N-O 3.25Å; F131-H218 PolarHBondContact O-N 3.09Å
219T30.4Very low36.6Very low85 Ų85108.2 Ų108.252%0.52156%0.562SS.*EExtended strand (participates in β ladder)trans-84.7110.7167.547.80000108.4R130R130-T219 HydrophobicContact CG-CG2 4.1Å
220Q32.6Very low36.2Very low99 Ų99108.9 Ų108.946%0.46357%0.57SS.*EExtended strand (participates in β ladder)trans-100.4117.7164.8-66.5-168.8-2.200108.4R129 F131 F222R129-Q220 PolarHBondContact O-N 3.22Å; F131-Q220 HydrophobicContact CD2-CB 4.42Å; F131-Q220 HydrophobicContact CD2-CG 4.22Å; F131-Q220 HydrophobicContact CE2-CB 4Å; F131-Q220 HydrophobicContact CE2-CG 4.09Å; Q220-F222 HydrophobicContact CB-CD2 4.38Å; Q220-F222 HydrophobicContact CB-CE2 3.98Å; Q220-F222 PolarHBondContact O-N 3.09Å
221I29Very low35.8Very low146 Ų146110 Ų11075%0.74958%0.584SS**  trans-81.4106.5169.1-57.9171000105.4P223I221-P223 WeakPolarHBondContact O-CD 3.25Å
222F33.7Very low35.8Very low107 Ų107111.3 Ų111.347%0.46959%0.585SS.*PPolyproline II helixtrans-79.6121.6173.3-78.2-86.8000108.8F131 Q220F131-F222 HydrophobicContact CE2-CE2 4.18Å; F131-F222 HydrophobicContact CZ-CE2 4.27Å; Q220-F222 HydrophobicContact CB-CD2 4.38Å; Q220-F222 HydrophobicContact CB-CE2 3.98Å; Q220-F222 PolarHBondContact O-N 3.09Å
223P33.5Very low36.1Very low102 Ų102109.2 Ų109.266%0.66259%0.588SS**PPolyproline II helixtrans-64.7147.2168.326.7-31.3000109.5I221I221-P223 WeakPolarHBondContact O-CD 3.25Å
224P32.1Very low36Very low75 Ų75117.1 Ų117.149%0.48762%0.621SS.*PPolyproline II helixtrans-54.6138.5175.323.6-34.2000110.4W126W126-P224 HydrophobicContact CE3-CB 4.4Å; W126-P224 HydrophobicContact CH2-CB 3.34Å; W126-P224 HydrophobicContact CZ2-CB 3.52Å; W126-P224 HydrophobicContact CZ3-CB 3.79Å
225P38.4Very low36.4Very low97 Ų97116.1 Ų116.163%0.6364%0.637SS**PPolyproline II helixtrans-57.3138.6169.224.1-31.1000108.7L227P225-L227 PolarHBondContact O-N 2.76Å
226P38.8Very low36.4Very low98 Ų98118.7 Ų118.764%0.63666%0.66SS**PPolyproline II helixtrans-59.4118.6175.724.6-31.4000107.5Y228P226-Y228 PolarHBondContact O-N 3.15Å; P226-Y228 VanDerWaalsContact O-N 3.11Å
227L37.4Very low36.5Very low171 Ų171120.2 Ų120.290%0.89567%0.674SS**PPolyproline II helixtrans-55.9120.5164.8-72.2172.2000105.9P225 A229P225-L227 PolarHBondContact O-N 2.76Å; L227-A229 PolarHBondContact O-N 3.41Å
228Y36.9Very low37.2Very low206 Ų206123.2 Ų123.281%0.80869%0.692SS**  trans-44.8115176.3-97.3-103.2000108.8P226 N230P226-Y228 PolarHBondContact O-N 3.15Å; P226-Y228 VanDerWaalsContact O-N 3.11Å; Y228-N230 PolarHBondContact O-N 2.93Å
229A35.1Very low37.5Very low86 Ų86123.8 Ų123.871%0.71171%0.706SS**  trans-63.286.2154.100000106.2L227 N231L227-A229 PolarHBondContact O-N 3.41Å; A229-N231 PolarHBondContact O-N 3.39Å
230N38.1Very low37.8Very low142 Ų142125 Ų12576%0.75972%0.719SS**  trans-68.980.2158.9-95.3-15.4000106.4Y228 D232Y228-N230 PolarHBondContact O-N 2.93Å; N230-D232 PolarHBondContact O-N 2.82Å
231N35.8Very low38.3Very low138 Ų138125.6 Ų125.674%0.73873%0.733SS**  trans-64108.3141.9-74.7-19.5000104.8A229A229-N231 PolarHBondContact O-N 3.39Å
232D41.8Very low38.6Very low141 Ų141123.2 Ų123.275%0.75474%0.735SS**  trans-176117.7144.3-90-27.3000110.6N230N230-D232 PolarHBondContact O-N 2.82Å
233L45.6Very low38.9Very low155 Ų155126.2 Ų126.281%0.81276%0.755SS**  trans78.7109.2151.1-76.880.8000120.3
234E34.9Very low39.4Very low199 Ų199132.3 Ų132.393%0.9377%0.765SS**  trans-17.2121.4142.6-63.4-178.497.100116.1
235A43.5Very low39.8Very low94 Ų94140 Ų14078%0.77779%0.786SS**  trans-173.490.2141.900000108.4
236S40Very low40Very low107 Ų107141.1 Ų141.175%0.74880%0.797SS**  48.4112.2111.5-1670000116.1
237S39.7Very low40.1Very low93 Ų93139.2 Ų139.265%0.6580%0.795SS**  trans68.5102.1136.160.70000120.1
238T49.1Very low40.2Very low130 Ų130142.4 Ų142.480%0.79880%0.797SS**  152.6132.7108.145.70000111.2
239P40.2Very low40.4Very low128 Ų128142.4 Ų142.483%0.83182%0.824SS**  trans-95.8121.7163.533.6-23.5000108.7
240S38Very low40.7Very low112 Ų112145.3 Ų145.378%0.78383%0.83SS**  trans-153.5139.4172-1290000114.5
241S42Very low40.8Very low110 Ų110145.4 Ų145.477%0.76983%0.834SS**  trans96.390.7157-49.10000118
242A35.3Very low41.1Very low96 Ų96145.8 Ų145.879%0.79384%0.839SS**  trans-18128.5139.500000115.9
243L41.7Very low41.1Very low170 Ų170146.1 Ų146.189%0.8984%0.844SS**  trans-125.4117.2153-89.1167.7000108.9
244R42.7Very low40.8Very low231 Ų231145.6 Ų145.687%0.87285%0.846SS**  trans-70.1139.3174-63.5-169.1173.4-160.2-0.3109.8
245Y41.7Very low41.2Very low235 Ų235142 Ų14292%0.92284%0.841SS**  trans-127.9107.8151.2-104.1-90.2000108.7
246S41.2Very low41Very low122 Ų122145.4 Ų145.485%0.85385%0.845SS**  trans-85.5134.8166.7172.90000107.8
247G41.4Very low41.1Very low58 Ų58148.4 Ų148.460%0.59885%0.853SS**  trans-178.9111172.600000113.1
248Y40.1Very low41.2Very low238 Ų238153 Ų15393%0.93387%0.87SS**  trans98.2108.6162.5-63-83.8000117.1
249C41.3Very low40.5Very low206 Ų206155.1 Ų155.1100%1.39288%0.876SS**  trans-53.70166.9-55.60000113.2

Retrieved 249 of 249 residues in 133.3 ms (Link to these results)