A0A060XKK2_ONCMY Loading...

Transmembrane protein 71

AlphaFold DB , UniProt , Accession A0A060XKK2, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene tmem71, Length 291 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
1M38.5Very low40.7Very low254 Ų254143.7 Ų143.7100%1.25184%0.841SS**  01120-76.9-179.8177.600107.9
2A35.3Very low40.1Very low98 Ų98140.6 Ų140.681%0.8183%0.833SS**  trans-149.6120.6174.100000107.1
3L40.8Very low40Very low176 Ų176140.1 Ų140.192%0.92184%0.836SS**  trans-115.1126.7170.1-76.9170.3000107.5
4P49.4Very low39.8Very low112 Ų112141 Ų14173%0.72783%0.832SS**  trans-110.5125.6158.231.7-20.3000111.3
5Y38.8Very low39.4Very low209 Ų209145.3 Ų145.382%0.8284%0.836SS**  22.5124.5127.7-85.8-87.5000118.8
6N38.1Very low39.1Very low153 Ų153151.4 Ų151.482%0.81884%0.841SS**  162.1147.494.9-95.8-37000113.1
7G39.5Very low38.7Very low66 Ų66153.4 Ų153.468%0.6884%0.839SS**  trans105.283.8134.300000117.5
8V37.3Very low38.4Very low141 Ų141159 Ų15986%0.85585%0.846SS**  trans-68.3127.2163.6166.40000109.9T10V8-T10 HydrophobicContact CG1-CG2 4.26Å
9V38.5Very low38Very low133 Ų133158.9 Ų158.981%0.80684%0.84SS**  trans-100.6117.3175.4174.40000108.6
10T49.6Very low37.6Very low126 Ų126160.6 Ų160.677%0.77384%0.84SS**  trans-104.8117.8166.260.10000108.8V8V8-T10 HydrophobicContact CG1-CG2 4.26Å
11S42Very low37.3Very low113 Ų113159.9 Ų159.979%0.7984%0.843SS**PPolyproline II helixtrans-84124.9-178.953.80000111.5
12S33Very low37.2Very low106 Ų106155.1 Ų155.174%0.74182%0.821SS**PPolyproline II helixtrans-97.3142.1162.1-63.40000109.9
13P39.1Very low36.9Very low134 Ų134155 Ų15587%0.8782%0.821SS**PPolyproline II helixtrans-89.2139172.515.8-0.3000112.7
14I36.6Very low36.6Very low153 Ų153154.1 Ų154.179%0.78582%0.816SS**PPolyproline II helixtrans-78.7137.5-171.6-75.2154.7000112.2
15K35Very low35.8Very low206 Ų206158 Ų15890%0.89683%0.825SS**PPolyproline II helixtrans-62.2130.6166.4-68.8-176.8175.7-177.70110.7
16R34.8Very low35.5Very low242 Ų242152.8 Ų152.891%0.91382%0.819SS**  trans-120.8119.2161.5-79.6-172.8178.3167.70.6110.8
17K32.2Very low35.2Very low186 Ų186151.8 Ų151.881%0.80982%0.822SS**  trans-79.9128170.6-170.3-174.1-177.2-163.50107.8
18R32.4Very low35.1Very low254 Ų254156.3 Ų156.396%0.95883%0.826SS**  trans-133.1124.4161.2-113.3-177.1-177.4177.20.1108.7
19E30.2Very low34.7Very low158 Ų158154.4 Ų154.474%0.73882%0.819SS**  trans-98.1151.9-173.5-172.5167.5169.400110.5
20K31.8Very low35.1Very low192 Ų192155.4 Ų155.484%0.83582%0.819SS**  trans-30.8141.2-178.9-84.4166.9165.7175.10117.9
21T31.1Very low34.9Very low146 Ų146152.5 Ų152.590%0.89681%0.814SS**  trans-133.6134.3138-52.70000108.4
22L35.7Very low35Very low154 Ų154154.1 Ų154.181%0.80681%0.813SS**  trans-93.1130.9-168.9178.9152.6000109.3
23A29.9Very low35.2Very low96 Ų96154.1 Ų154.179%0.79381%0.813SS**  trans-155.2125.7155.100000108.9
24N32.9Very low35.5Very low156 Ų156156 Ų15683%0.83482%0.815SS**  trans-51.6136.8171.8-84.3-29.4000111.6
25E33.3Very low35.9Very low193 Ų193156.6 Ų156.690%0.90282%0.819SS**  -157.6125.1129.4-111.5172.7-164.100109.7
26S32.3Very low36.3Very low100 Ų100151.8 Ų151.870%0.69981%0.811SS**  trans-76.7128.5-178.259.50000110.8
27C32.8Very low36.5Very low132 Ų132144 Ų14489%0.89279%0.794SS**  trans-137108.1148.9-83.80000107S29C27-S29 PolarHBondContact O-N 3.24Å
28Q35.7Very low37.2Very low162 Ų162141 Ų14176%0.75779%0.794SS**  trans-70.4106.2-176-67.2165.6-1.100109.6L30Q28-L30 VanDerWaalsContact C-N 3.25Å; Q28-L30 HydrophobicContact CB-CD1 4.01Å; Q28-L30 HydrophobicContact CB-CG 4.28Å; Q28-L30 PolarHBondContact O-N 3.34Å
29S30.8Very low37.7Very low101 Ų101135.8 Ų135.871%0.70679%0.785SS**  trans-82.675.2161.5174.60000108.4C27 G31C27-S29 PolarHBondContact O-N 3.24Å; S29-G31 PolarHBondContact O-N 3.33Å
30L45.4Very low38.5Very low153 Ų153132.7 Ų132.780%0.80178%0.781SS**  trans-87.586.7171.2-80158.5000107.8Q28Q28-L30 VanDerWaalsContact C-N 3.25Å; Q28-L30 HydrophobicContact CB-CD1 4.01Å; Q28-L30 HydrophobicContact CB-CG 4.28Å; Q28-L30 PolarHBondContact O-N 3.34Å
31G45.4Very low39.1Very low66 Ų66127.8 Ų127.868%0.6877%0.77SS**SBendtrans-166-19.6176.200000116.6S29S29-G31 PolarHBondContact O-N 3.33Å
32L44.2Very low39.9Very low146 Ų146128.8 Ų128.876%0.76476%0.759SS**SBendtrans-124.44.5-172.1-77.5160.8000114.7
33S37.9Very low40.5Very low106 Ų106127.7 Ų127.774%0.74175%0.75SS**SBendtrans-94.6-5.7-177.8-57.30000115
34L44.7Very low41.3Very low174 Ų174125.6 Ų125.691%0.91173%0.729SS**THydrogen-bonded Turntrans-85.8-7.4179.7-75.9175.7000114.6
35L45.3Very low42.2Very low166 Ų166125.2 Ų125.287%0.86972%0.716SS**THydrogen-bonded Turntrans-115.413.2-177.1-67176.8000114.1
36S43.8Very low43.3Very low105 Ų105119 Ų11973%0.73470%0.695SS**  trans-13254.3178.8-58.40000111
37S38.9Very low44.5Very low77 Ų77118.3 Ų118.354%0.53869%0.686SS.*  trans-104.9119.7157.9-177.50000108D39 S40S37-D39 PolarHBondContact O-N 2.81Å; S37-S40 PolarHBondContact O-N 3.27Å
38P47.8Very low45.7Very low125 Ų125115.5 Ų115.581%0.81266%0.662SS**THydrogen-bonded Turntrans-71.1-6.1-175.128.7-33000114
39D41.6Very low46.9Very low144 Ų144114 Ų11477%0.7767%0.666SS**THydrogen-bonded Turntrans-112.710.6-178.1-65.2-31.2000113.8S37 S41S37-D39 PolarHBondContact O-N 2.81Å; D39-S41 VanDerWaalsContact C-N 3.33Å; D39-S41 PolarHBondContact O-N 3.08Å
40S47.7Very low48.2Very low93 Ų93115.4 Ų115.465%0.6567%0.67SS**  trans-79.482.5175.8-173.10000110.6S37 Y42S37-S40 PolarHBondContact O-N 3.27Å; S40-Y42 PolarHBondContact O-N 2.84Å
41S43.4Very low49.2Very low89 Ų89112.7 Ų112.762%0.62266%0.66SS**  trans-60.3105.5157.251.30000107.7D39 E43D39-S41 VanDerWaalsContact C-N 3.33Å; D39-S41 PolarHBondContact O-N 3.08Å; S41-E43 PolarHBondContact O-N 3.4Å
42Y49.3Very low50.1Low166 Ų166112.2 Ų112.265%0.65166%0.655SS**  trans-64.685.6172.4-173.3-97000109.3S40 C44 R59S40-Y42 PolarHBondContact O-N 2.84Å; Y42-C44 HydrophobicContact CD1-CB 3.98Å; Y42-C44 HydrophobicContact CE1-CB 3.49Å; Y42-C44 VanDerWaalsContact CE1-CB 3.49Å; Y42-C44 VanDerWaalsContact CE1-SG 3.5Å; Y42-C44 PolarHBondContact O-N 3.16Å; Y42-C44 PolarHBondContact OH-SG 3.16Å; Y42-C44 VanDerWaalsContact OH-SG 3.39Å; Y42-R59 PolarHBondContact O-NH2 3.17Å
43E47.1Very low51.2Low131 Ų131108 Ų10861%0.61264%0.638SS**  trans-84.894.7169.2-80.6-171.6159.300107.8S41 Y45S41-E43 PolarHBondContact O-N 3.4Å; E43-Y45 HydrophobicContact CB-CD2 3.76Å; E43-Y45 HydrophobicContact CB-CE2 3.59Å; E43-Y45 HydrophobicContact CG-CE2 3.87Å; E43-Y45 PolarHBondContact O-N 3.14Å; E43-Y45 WeakPolarHBondContact OE2-CE2 3.29Å
44C46.3Very low52.5Low52 Ų52107.2 Ų107.235%0.35163%0.63SS.*  trans-79.174.4177.8-150.10000109.1Y42 S46Y42-C44 HydrophobicContact CD1-CB 3.98Å; Y42-C44 HydrophobicContact CE1-CB 3.49Å; Y42-C44 VanDerWaalsContact CE1-CB 3.49Å; Y42-C44 VanDerWaalsContact CE1-SG 3.5Å; Y42-C44 PolarHBondContact O-N 3.16Å; Y42-C44 PolarHBondContact OH-SG 3.16Å; Y42-C44 VanDerWaalsContact OH-SG 3.39Å; C44-S46 PolarHBondContact O-N 2.67Å
45Y52.1Low53.2Low148 Ų148100.9 Ų100.958%0.5860%0.601SS**  trans-92.388168.4-64.4-66.6000108.6E43 P54E43-Y45 HydrophobicContact CB-CD2 3.76Å; E43-Y45 HydrophobicContact CB-CE2 3.59Å; E43-Y45 HydrophobicContact CG-CE2 3.87Å; E43-Y45 PolarHBondContact O-N 3.14Å; E43-Y45 WeakPolarHBondContact OE2-CE2 3.29Å; Y45-P54 HydrophobicContact CD1-CB 4.45Å
46S57.5Low53.5Low64 Ų6498.3 Ų98.345%0.44860%0.596SS.*PPolyproline II helixtrans-80.6119.2160.766.20000107.5C44 S55 C57C44-S46 PolarHBondContact O-N 2.67Å; S46-S55 WeakPolarHBondContact O-CB 3.21Å; S46-S55 PolarHBondContact O-N 3.36Å; S46-S55 PolarHBondContact O-OG 3.08Å; S46-S55 PolarHBondContact OG-OG 2.73Å; S46-C57 PolarHBondContact OG-SG 2.83Å
47V56.5Low54Low85 Ų8595.7 Ų95.752%0.51558%0.578SS.*BIsolated β-bridgetrans-91.5131.8178.4-177.80000107.4P49V47-P49 WeakPolarHBondContact O-CD 3.38Å
48N58.9Low54.5Low72 Ų72103.4 Ų103.439%0.38560%0.595SS.*PPolyproline II helixtrans-68.7120.2176.8-174.1-29.4000109V50 T51 G52 S53N48-V50 PolarHBondContact O-N 3.47Å; N48-V50 VanDerWaalsContact O-N 3.12Å; N48-V50 PolarHBondContact OD1-N 2.83Å; N48-V50 VanDerWaalsContact OD1-N 3.15Å; N48-T51 PolarHBondContact O-N 2.85Å; N48-G52 PolarHBondContact O-N 2.84Å; N48-S53 PolarHBondContact N-O 3.39Å
49P60.3Low54.6Low130 Ų130106.7 Ų106.784%0.84459%0.591SS**THydrogen-bonded Turntrans-65.5-17.8-172.926.1-34.9000113.8V47V47-P49 WeakPolarHBondContact O-CD 3.38Å
50V59.2Low55.1Low131 Ų131103.6 Ų103.679%0.79458%0.581SS**THydrogen-bonded Turntrans-91.3-26.6-178.7176.70000112.6N48N48-V50 PolarHBondContact O-N 3.47Å; N48-V50 VanDerWaalsContact O-N 3.12Å; N48-V50 PolarHBondContact OD1-N 2.83Å; N48-V50 VanDerWaalsContact OD1-N 3.15Å
51T64.7Low55.2Low97 Ų97104.9 Ų104.960%0.59559%0.587SS**THydrogen-bonded Turntrans-124.5-7.7-169.7-37.70000113.3N48 S53N48-T51 PolarHBondContact O-N 2.85Å; T51-S53 PolarHBondContact O-N 3.09Å
52G64.3Low55.7Low55 Ų55111.3 Ų111.357%0.56760%0.598SS**  trans63.92.9176.100000114.8N48N48-G52 PolarHBondContact O-N 2.84Å
53S68.8Low56.1Low57 Ų57107.3 Ų107.340%0.39959%0.587SS.*PPolyproline II helixtrans-81142.2179.257.30000110.3N48 T51 S55N48-S53 PolarHBondContact N-O 3.39Å; T51-S53 PolarHBondContact O-N 3.09Å; S53-S55 PolarHBondContact O-N 2.88Å; S53-S55 VanDerWaalsContact O-N 3.14Å
54P64.3Low56.5Low91 Ų91104 Ų10459%0.59157%0.574SS**BIsolated β-bridgetrans-62.6118.717323.4-29.5000108.1Y45 S56Y45-P54 HydrophobicContact CD1-CB 4.45Å; P54-S56 PolarHBondContact O-N 3.45Å
55S58.7Low57Low41 Ų41109.5 Ų109.529%0.28760%0.599SS.*PPolyproline II helixtrans-68.2127.3173.279.60000108S46 S53 C57S46-S55 WeakPolarHBondContact O-CB 3.21Å; S46-S55 PolarHBondContact O-N 3.36Å; S46-S55 PolarHBondContact O-OG 3.08Å; S46-S55 PolarHBondContact OG-OG 2.73Å; S53-S55 PolarHBondContact O-N 2.88Å; S53-S55 VanDerWaalsContact O-N 3.14Å; S55-C57 PolarHBondContact O-N 3.46Å; S55-C57 PolarHBondContact OG-SG 3.26Å; S55-C57 VanDerWaalsContact OG-SG 3.34Å
56S53.4Low57.6Low111 Ų111105 Ų10578%0.77659%0.585SS**  trans-70.585.9167.163.90000106.9P54 R58P54-S56 PolarHBondContact O-N 3.45Å; S56-R58 VanDerWaalsContact C-N 3.28Å; S56-R58 PolarHBondContact O-N 3.26Å
57C53.3Low58.2Low51 Ų51103.1 Ų103.135%0.34558%0.576SS.*  trans-59.198.8168.6-68.70000106.9S46 S55 R59S46-C57 PolarHBondContact OG-SG 2.83Å; S55-C57 PolarHBondContact O-N 3.46Å; S55-C57 PolarHBondContact OG-SG 3.26Å; S55-C57 VanDerWaalsContact OG-SG 3.34Å; C57-R59 VanDerWaalsContact C-N 3.26Å; C57-R59 PolarHBondContact O-N 3.39Å
58R49Very low59.4Low239 Ų239103.9 Ų103.990%0.90257%0.57SS**  trans-61.2100.6163.9-91.4-173.8167.7-154.6-1.3104.6S56 S60S56-R58 VanDerWaalsContact C-N 3.28Å; S56-R58 PolarHBondContact O-N 3.26Å; R58-S60 PolarHBondContact O-N 2.87Å
59R50.7Low60.6Low193 Ų193107.2 Ų107.273%0.72858%0.578SS**  trans-47.9114.6168-74.3-174.6176.8-174.9-2.1105.3Y42 C57Y42-R59 PolarHBondContact O-NH2 3.17Å; C57-R59 VanDerWaalsContact C-N 3.26Å; C57-R59 PolarHBondContact O-N 3.39Å
60S51.6Low61.7Low80 Ų80103.7 Ų103.756%0.55955%0.554SS**  trans-47.6137.6170.842.30000107.1R58 R62R58-S60 PolarHBondContact O-N 2.87Å; S60-R62 PolarHBondContact O-N 2.89Å
61P49.6Very low63Low120 Ų120100.6 Ų100.678%0.77953%0.533SS*.SBendtrans-48.5119.5-176.4-20.728.9000106.8L63P61-L63 PolarHBondContact O-N 3.04Å
62R55.3Low63.9Low224 Ų22498 Ų9885%0.84552%0.517SS*.  trans-31102.6-170.2-75-178.6171.9118.5-3.7108.4S60 L64S60-R62 PolarHBondContact O-N 2.89Å; R62-L64 VanDerWaalsContact C-N 3.29Å; R62-L64 PolarHBondContact O-N 2.85Å
63L55.9Low64.5Low82 Ų82102.6 Ų102.643%0.42952%0.524SS..  trans-52.5110.1173-76.9166.3000103.1P61 N65 Y69 Y95P61-L63 PolarHBondContact O-N 3.04Å; L63-N65 PolarHBondContact O-N 3Å; L63-Y69 WeakPolarHBondContact CD1-OH 3.34Å; L63-Y95 HydrophobicContact CD2-CD2 4.5Å; L63-Y95 HydrophobicContact CD2-CE1 4.46Å; L63-Y95 HydrophobicContact CD2-CE2 3.8Å
64L56.6Low65Low62 Ų62104.9 Ų104.933%0.32553%0.531SS..  trans-55.4125.3176.5-69.7160.7000102.8R62 N66 G67 E97 I102R62-L64 VanDerWaalsContact C-N 3.29Å; R62-L64 PolarHBondContact O-N 2.85Å; L64-N66 HydrophobicContact CB-CB 3.92Å; L64-N66 PolarHBondContact O-N 2.96Å; L64-G67 PolarHBondContact O-N 3.3Å; L64-E97 HydrophobicContact CD1-CG 4.38Å; L64-E97 WeakPolarHBondContact CD1-OE1 3.25Å; L64-I102 HydrophobicContact CD1-CD1 4.15Å; L64-I102 HydrophobicContact CD2-CD1 4.11Å
65N57.5Low65.6Low167 Ų167100.7 Ų100.789%0.89350%0.504SS*.THydrogen-bonded Turntrans-53.6-1.2169.5-68.917.2000112.3L63 G67L63-N65 PolarHBondContact O-N 3Å; N65-G67 VanDerWaalsContact C-N 3.35Å
66N63Low66.6Low53 Ų53103 Ų10328%0.28351%0.507SS..THydrogen-bonded Turntrans-80.9-4.2173.3-51.1-22.2000113L64 N98 V100L64-N66 HydrophobicContact CB-CB 3.92Å; L64-N66 PolarHBondContact O-N 2.96Å; N66-N98 HydrophobicContact CB-CB 4.38Å; N66-N98 WeakPolarHBondContact O-CA 3.31Å; N66-N98 WeakPolarHBondContact O-CB 3.46Å; N66-N98 PolarHBondContact O-N 3.48Å; N66-N98 PolarHBondContact O-ND2 3.42Å; N66-V100 HydrophobicContact CB-CG2 4.39Å
67G71.1Confident67.9Low24 Ų24100.5 Ų100.525%0.24749%0.488CS..EExtended strand (participates in β ladder)trans-104.7152.5177.700000113.9L64 N65 K96L64-G67 PolarHBondContact O-N 3.3Å; N65-G67 VanDerWaalsContact C-N 3.35Å; G67-K96 CarbonylContact C-O 3.13Å; G67-K96 VanDerWaalsContact CA-O 3.23Å; G67-K96 WeakPolarHBondContact CA-O 3.43Å
68Y81Confident69.4Low101 Ų101105.6 Ų105.640%0.39650%0.5SS..EExtended strand (participates in β ladder)trans-128.514916858.7-84.3000110.7V70 K96Y68-V70 HydrophobicContact CD2-CG2 3.53Å; Y68-V70 HydrophobicContact CE2-CG2 3.32Å; Y68-K96 HydrophobicContact CE1-CD 4.42Å; Y68-K96 HydrophobicContact CE1-CG 4.39Å; Y68-K96 HydrophobicContact CE2-CB 4.36Å; Y68-K96 HydrophobicContact CE2-CD 4.29Å; Y68-K96 PolarHBondContact N-O 3.23Å; Y68-K96 PolarHBondContact O-N 3.37Å; Y68-K96 WeakPolarHBondContact OH-CD 3.27Å; Y68-K96 WeakPolarHBondContact OH-CE 3.35Å; Y68-K96 PolarHBondContact OH-NZ 2.95Å
69Y84.4Confident71.1Confident142 Ų14296.8 Ų96.856%0.55747%0.47SS*.EExtended strand (participates in β ladder)trans-83.7132.9170.4-63.2-82.7000108.9L63 S94 Y95L63-Y69 WeakPolarHBondContact CD1-OH 3.34Å; Y69-S94 CarbonylContact C-O 3.56Å; Y69-S94 WeakPolarHBondContact CA-O 3.25Å; Y69-Y95 HydrophobicContact CD1-CD2 4.04Å; Y69-Y95 AromaticContact CE1-CD2 3.74Å; Y69-Y95 HydrophobicContact CE1-CD2 3.74Å; Y69-Y95 HydrophobicContact CE1-CG 4.38Å; Y69-Y95 HydrophobicContact CE2-CD2 4.49Å; Y69-Y95 AromaticContact CZ-CD2 3.98Å
70V84Confident72.8Confident56 Ų5695.6 Ų95.634%0.33948%0.479SS..EExtended strand (participates in β ladder)trans-107.6113170.5-179.60000106.9Y68 S94Y68-V70 HydrophobicContact CD2-CG2 3.53Å; Y68-V70 HydrophobicContact CE2-CG2 3.32Å; V70-S94 WeakPolarHBondContact CB-OG 3.42Å; V70-S94 PolarHBondContact N-O 3.01Å; V70-S94 PolarHBondContact O-N 3.49Å; V70-S94 PolarHBondContact O-OG 3.47Å
71L86.6Confident74.4Confident67 Ų6798.7 Ų98.735%0.35148%0.484SS..EExtended strand (participates in β ladder)trans-79131169.9-178.465.6000108.3L86 I91 L93L71-L86 HydrophobicContact CD2-CD1 4.42Å; L71-L86 HydrophobicContact CD2-CD2 3.85Å; L71-I91 HydrophobicContact CD1-CG2 3.35Å; L71-L93 HydrophobicContact CB-CD2 4.28Å; L71-L93 HydrophobicContact CD1-CD2 3.52Å; L71-L93 HydrophobicContact CD1-CG 4.49Å
72T82.4Confident76Confident42 Ų4295.4 Ų95.426%0.25847%0.472SS..  trans-75.6144.3178-47.40000109.8D74 S75 K92T72-D74 WeakPolarHBondContact CB-OD1 3.31Å; T72-D74 WeakPolarHBondContact CG2-OD1 3.44Å; T72-D74 PolarHBondContact O-N 2.92Å; T72-S75 WeakPolarHBondContact O-CB 3.32Å; T72-S75 PolarHBondContact O-N 3.3Å; T72-S75 VanDerWaalsContact O-N 3.09Å; T72-S75 PolarHBondContact O-OG 2.9Å; T72-K92 WeakPolarHBondContact CB-O 3.24Å; T72-K92 HydrophobicContact CG2-CD 4.42Å; T72-K92 PolarHBondContact N-O 2.88Å; T72-K92 PolarHBondContact OG1-O 2.93Å
73E77.8Confident77.4Confident152 Ų15289.2 Ų89.271%0.7146%0.455SS*.G310 helixtrans-65.2-20.9-174.2-65.3178175.900113.9S75 Y76E73-S75 PolarHBondContact O-N 3.34Å; E73-Y76 VanDerWaalsContact CA-CE1 3.44Å; E73-Y76 HydrophobicContact CB-CE1 3.77Å; E73-Y76 HydrophobicContact CG-CE1 4.14Å; E73-Y76 VanDerWaalsContact O-CD1 3.24Å; E73-Y76 WeakPolarHBondContact O-CD1 3.49Å; E73-Y76 WeakPolarHBondContact O-CE1 3.21Å; E73-Y76 VanDerWaalsContact O-CZ 3.32Å
74D79.2Confident78.8Confident104 Ų10489 Ų8956%0.55646%0.457SS*.G310 helixtrans-72.4-10.3175.460.92.1000114T72T72-D74 WeakPolarHBondContact CB-OD1 3.31Å; T72-D74 WeakPolarHBondContact CG2-OD1 3.44Å; T72-D74 PolarHBondContact O-N 2.92Å
75S76.6Confident80Confident3 Ų388.1 Ų88.12%0.02146%0.457CS..G310 helixtrans-90.6-16.7-171-58.60000113.3T72 E73 L86 K90 K92T72-S75 WeakPolarHBondContact O-CB 3.32Å; T72-S75 PolarHBondContact O-N 3.3Å; T72-S75 VanDerWaalsContact O-N 3.09Å; T72-S75 PolarHBondContact O-OG 2.9Å; E73-S75 PolarHBondContact O-N 3.34Å; S75-L86 WeakPolarHBondContact O-CD2 3.3Å; S75-K90 PolarHBondContact OG-O 3.03Å; S75-K92 PolarHBondContact OG-N 2.77Å
76Y79.9Confident81.1Confident90 Ų9084.4 Ų84.435%0.35344%0.436SS..EExtended strand (participates in β ladder)trans-95.5134.8174.763.9-106.1000110.6E73 W78E73-Y76 VanDerWaalsContact CA-CE1 3.44Å; E73-Y76 HydrophobicContact CB-CE1 3.77Å; E73-Y76 HydrophobicContact CG-CE1 4.14Å; E73-Y76 VanDerWaalsContact O-CD1 3.24Å; E73-Y76 WeakPolarHBondContact O-CD1 3.49Å; E73-Y76 WeakPolarHBondContact O-CE1 3.21Å; E73-Y76 VanDerWaalsContact O-CZ 3.32Å; Y76-W78 AromaticContact CD2-CD1 3.54Å; Y76-W78 AromaticContact CD2-NE1 3.11Å; Y76-W78 AromaticContact CE2-CD1 3.62Å; Y76-W78 AromaticContact CE2-NE1 3.04Å
77T80.3Confident81.9Confident59 Ų5984.4 Ų84.436%0.36244%0.438SS..EExtended strand (participates in β ladder)trans-114.6126.816942.80000108.5S85T77-S85 PolarHBondContact N-O 2.95Å; T77-S85 PolarHBondContact O-N 3.04Å; T77-S85 PolarHBondContact O-OG 2.83Å; T77-S85 PolarHBondContact OG1-O 2.88Å; T77-S85 PolarHBondContact OG1-OG 3.5Å
78W84.9Confident82Confident158 Ų15888.9 Ų88.960%0.59846%0.463SS*.EExtended strand (participates in β ladder)trans-84.7128.9171.2-63.890.6000107.8Y76 N83 V84Y76-W78 AromaticContact CD2-CD1 3.54Å; Y76-W78 AromaticContact CD2-NE1 3.11Å; Y76-W78 AromaticContact CE2-CD1 3.62Å; Y76-W78 AromaticContact CE2-NE1 3.04Å; W78-N83 WeakPolarHBondContact CA-O 3.41Å; W78-V84 HydrophobicContact CD2-CG2 3.94Å; W78-V84 HydrophobicContact CE3-CG2 3.52Å; W78-V84 HydrophobicContact CH2-CG2 3.16Å; W78-V84 HydrophobicContact CZ2-CG2 3.57Å; W78-V84 HydrophobicContact CZ3-CG2 3.13Å
79D85.3Confident81.4Confident53 Ų5389 Ų8928%0.28348%0.479SS..  trans-83165166.95913.3000110E81 G82 N83D79-E81 PolarHBondContact O-N 2.92Å; D79-E81 VanDerWaalsContact O-N 3.16Å; D79-G82 PolarHBondContact O-N 3.35Å; D79-G82 PolarHBondContact OD1-N 3.42Å; D79-G82 VanDerWaalsContact OD1-N 3.15Å; D79-N83 PolarHBondContact N-O 3.32Å; D79-N83 VanDerWaalsContact N-O 3.1Å; D79-N83 WeakPolarHBondContact OD1-CA 3.46Å; D79-N83 VanDerWaalsContact OD1-CB 3.3Å; D79-N83 WeakPolarHBondContact OD1-CB 3.27Å; D79-N83 PolarHBondContact OD1-N 3.46Å; D79-N83 PolarHBondContact OD1-ND2 2.9Å; D79-N83 VanDerWaalsContact OD2-CB 3.31Å; D79-N83 WeakPolarHBondContact OD2-CB 3.25Å; D79-N83 PolarHBondContact OD2-ND2 2.92Å
80D85.7Confident81Confident169 Ų16989 Ų8990%0.90448%0.481SS*.THydrogen-bonded Turntrans-67.6-14.6-176.4-65.1-35000111.8
81E85.4Confident80.8Confident145 Ų14589 Ų8968%0.67848%0.479SS*.THydrogen-bonded Turntrans-85.2-4.6173.6-63.771.7-151.800113.5D79D79-E81 PolarHBondContact O-N 2.92Å; D79-E81 VanDerWaalsContact O-N 3.16Å
82G83.7Confident80.6Confident50 Ų5092.1 Ų92.152%0.51549%0.49SS..SBendtrans82.112.2176.100000115.2D79D79-G82 PolarHBondContact O-N 3.35Å; D79-G82 PolarHBondContact OD1-N 3.42Å; D79-G82 VanDerWaalsContact OD1-N 3.15Å
83N84.8Confident80.5Confident94 Ų9495.3 Ų95.350%0.50351%0.505SS..  trans-81.7152.4167.5-38.7-72.1000111.4W78 D79W78-N83 WeakPolarHBondContact CA-O 3.41Å; D79-N83 PolarHBondContact N-O 3.32Å; D79-N83 VanDerWaalsContact N-O 3.1Å; D79-N83 WeakPolarHBondContact OD1-CA 3.46Å; D79-N83 VanDerWaalsContact OD1-CB 3.3Å; D79-N83 WeakPolarHBondContact OD1-CB 3.27Å; D79-N83 PolarHBondContact OD1-N 3.46Å; D79-N83 PolarHBondContact OD1-ND2 2.9Å; D79-N83 VanDerWaalsContact OD2-CB 3.31Å; D79-N83 WeakPolarHBondContact OD2-CB 3.25Å; D79-N83 PolarHBondContact OD2-ND2 2.92Å
84V84.4Confident80.8Confident77 Ų7790.8 Ų90.847%0.46749%0.49SS..EExtended strand (participates in β ladder)trans-98.1119173.9-177.20000108.7W78W78-V84 HydrophobicContact CD2-CG2 3.94Å; W78-V84 HydrophobicContact CE3-CG2 3.52Å; W78-V84 HydrophobicContact CH2-CG2 3.16Å; W78-V84 HydrophobicContact CZ2-CG2 3.57Å; W78-V84 HydrophobicContact CZ3-CG2 3.13Å
85S82.8Confident80.9Confident45 Ų4590 Ų9032%0.31548%0.48SS..EExtended strand (participates in β ladder)trans-105.4139.3171.8550000110.6T77T77-S85 PolarHBondContact N-O 2.95Å; T77-S85 PolarHBondContact O-N 3.04Å; T77-S85 PolarHBondContact O-OG 2.83Å; T77-S85 PolarHBondContact OG1-O 2.88Å; T77-S85 PolarHBondContact OG1-OG 3.5Å
86L80.3Confident81.1Confident88 Ų8895.2 Ų95.246%0.46150%0.502SS..EExtended strand (participates in β ladder)trans-113.4112.9172.1-64.2176.6000107.7L71 S75 P88 I91L71-L86 HydrophobicContact CD2-CD1 4.42Å; L71-L86 HydrophobicContact CD2-CD2 3.85Å; S75-L86 WeakPolarHBondContact O-CD2 3.3Å; L86-P88 WeakPolarHBondContact O-CD 3.3Å; L86-I91 HydrophobicContact CB-CD1 3.91Å
87T79.1Confident81.2Confident54 Ų5495 Ų9533%0.33150%0.504SS..  trans-87.9118.4177-55.90000108.9S89 K90 I91T87-S89 WeakPolarHBondContact CG2-OG 3.22Å; T87-S89 PolarHBondContact O-N 2.97Å; T87-K90 PolarHBondContact O-N 3.47Å; T87-I91 WeakPolarHBondContact O-CG1 3.41Å; T87-I91 PolarHBondContact O-N 3.29Å
88P72.9Confident80.6Confident117 Ų11795.7 Ų95.776%0.7651%0.506SS*.G310 helixtrans-51-33.2-174.7-29.735.5000114.9L86 K90L86-P88 WeakPolarHBondContact O-CD 3.3Å; P88-K90 VanDerWaalsContact C-N 3.3Å; P88-K90 PolarHBondContact O-N 3.44Å
89S69.9Low79.7Confident104 Ų10495.6 Ų95.673%0.72752%0.516SS*.G310 helixtrans-77.2-7.5-179.956.40000115.2T87T87-S89 WeakPolarHBondContact CG2-OG 3.22Å; T87-S89 PolarHBondContact O-N 2.97Å
90K74.7Confident78.6Confident141 Ų14197.3 Ų97.361%0.61353%0.528SS*.G310 helixtrans-121.14-178.6-64.4-177.4-179.8177.10113.7S75 T87 P88 K92S75-K90 PolarHBondContact OG-O 3.03Å; T87-K90 PolarHBondContact O-N 3.47Å; P88-K90 VanDerWaalsContact C-N 3.3Å; P88-K90 PolarHBondContact O-N 3.44Å; K90-K92 PolarHBondContact O-N 3.37Å
91I81.1Confident77.4Confident58 Ų5897.5 Ų97.530%0.29752%0.516SS..  trans-80.5113.8-174.9-46-173.7000110.1L71 L86 T87 L93L71-I91 HydrophobicContact CD1-CG2 3.35Å; L86-I91 HydrophobicContact CB-CD1 3.91Å; T87-I91 WeakPolarHBondContact O-CG1 3.41Å; T87-I91 PolarHBondContact O-N 3.29Å; I91-L93 HydrophobicContact CG2-CD1 4.21Å; I91-L93 HydrophobicContact CG2-CD2 3.79Å; I91-L93 HydrophobicContact CG2-CG 3.68Å
92K80.6Confident76.1Confident131 Ų13195.8 Ų95.857%0.5751%0.51SS*.  trans-99.2101.5172.4-169.3176.6-178178.10110.1T72 S75 K90T72-K92 WeakPolarHBondContact CB-O 3.24Å; T72-K92 HydrophobicContact CG2-CD 4.42Å; T72-K92 PolarHBondContact N-O 2.88Å; T72-K92 PolarHBondContact OG1-O 2.93Å; S75-K92 PolarHBondContact OG-N 2.77Å; K90-K92 PolarHBondContact O-N 3.37Å
93L81Confident74.8Confident110 Ų110102 Ų10258%0.57652%0.523SS*.EExtended strand (participates in β ladder)trans-100.1130.2178.5-63.4173.7000110.5L71 I91L71-L93 HydrophobicContact CB-CD2 4.28Å; L71-L93 HydrophobicContact CD1-CD2 3.52Å; L71-L93 HydrophobicContact CD1-CG 4.49Å; I91-L93 HydrophobicContact CG2-CD1 4.21Å; I91-L93 HydrophobicContact CG2-CD2 3.79Å; I91-L93 HydrophobicContact CG2-CG 3.68Å
94S83.5Confident73.7Confident56 Ų56107.2 Ų107.239%0.39254%0.536SS..EExtended strand (participates in β ladder)trans-116.1133.2169.161.90000110.3Y69 V70Y69-S94 CarbonylContact C-O 3.56Å; Y69-S94 WeakPolarHBondContact CA-O 3.25Å; V70-S94 WeakPolarHBondContact CB-OG 3.42Å; V70-S94 PolarHBondContact N-O 3.01Å; V70-S94 PolarHBondContact O-N 3.49Å; V70-S94 PolarHBondContact O-OG 3.47Å
95Y82.1Confident72.3Confident89 Ų89113.2 Ų113.235%0.34955%0.551SS.*EExtended strand (participates in β ladder)trans-95.1120.9176.3176.1-103.8000109.3L63 Y69 E97L63-Y95 HydrophobicContact CD2-CD2 4.5Å; L63-Y95 HydrophobicContact CD2-CE1 4.46Å; L63-Y95 HydrophobicContact CD2-CE2 3.8Å; Y69-Y95 HydrophobicContact CD1-CD2 4.04Å; Y69-Y95 AromaticContact CE1-CD2 3.74Å; Y69-Y95 HydrophobicContact CE1-CD2 3.74Å; Y69-Y95 HydrophobicContact CE1-CG 4.38Å; Y69-Y95 HydrophobicContact CE2-CD2 4.49Å; Y69-Y95 AromaticContact CZ-CD2 3.98Å; Y95-E97 HydrophobicContact CE1-CB 3.99Å
96K81.8Confident71.2Confident112 Ų112121.2 Ų121.249%0.48757%0.574SS.*EExtended strand (participates in β ladder)trans-112.8111.7177.2-174.2165.6171.7-172.40109.9G67 Y68G67-K96 CarbonylContact C-O 3.13Å; G67-K96 VanDerWaalsContact CA-O 3.23Å; G67-K96 WeakPolarHBondContact CA-O 3.43Å; Y68-K96 HydrophobicContact CE1-CD 4.42Å; Y68-K96 HydrophobicContact CE1-CG 4.39Å; Y68-K96 HydrophobicContact CE2-CB 4.36Å; Y68-K96 HydrophobicContact CE2-CD 4.29Å; Y68-K96 PolarHBondContact N-O 3.23Å; Y68-K96 PolarHBondContact O-N 3.37Å; Y68-K96 WeakPolarHBondContact OH-CD 3.27Å; Y68-K96 WeakPolarHBondContact OH-CE 3.35Å; Y68-K96 PolarHBondContact OH-NZ 2.95Å
97E80.1Confident70.2Confident85 Ų85128.5 Ų128.540%0.39760%0.595SS.*EExtended strand (participates in β ladder)trans-81.2129.1173.1-168.4-176.9150.900110.2L64 Y95 L99L64-E97 HydrophobicContact CD1-CG 4.38Å; L64-E97 WeakPolarHBondContact CD1-OE1 3.25Å; Y95-E97 HydrophobicContact CE1-CB 3.99Å; E97-L99 PolarHBondContact O-N 2.9Å
98N68.2Low69.4Low74 Ų74133.4 Ų133.440%0.39661%0.612SS.*  trans-74.3113.9164.5-64.5-55.7000108N66 V100N66-N98 HydrophobicContact CB-CB 4.38Å; N66-N98 WeakPolarHBondContact O-CA 3.31Å; N66-N98 WeakPolarHBondContact O-CB 3.46Å; N66-N98 PolarHBondContact O-N 3.48Å; N66-N98 PolarHBondContact O-ND2 3.42Å; N98-V100 HydrophobicContact CB-CG2 4.42Å; N98-V100 PolarHBondContact O-N 2.82Å
99L66.1Low68.7Low156 Ų156132.4 Ų132.482%0.81761%0.614SS**  trans-66.565.7169.7-60.8175.5000110.2E97 R101E97-L99 PolarHBondContact O-N 2.9Å; L99-R101 PolarHBondContact O-N 3.33Å
100V62Low68.2Low88 Ų88137.7 Ų137.753%0.53362%0.618SS.*  trans-63.9111.5162.4-179.10000104.3N66 N98 I102N66-V100 HydrophobicContact CB-CG2 4.39Å; N98-V100 HydrophobicContact CB-CG2 4.42Å; N98-V100 PolarHBondContact O-N 2.82Å; V100-I102 VanDerWaalsContact C-N 3.25Å; V100-I102 WeakPolarHBondContact O-CG1 3.49Å; V100-I102 PolarHBondContact O-N 3.48Å
101R61.5Low67.3Low173 Ų173140.6 Ų140.665%0.65363%0.625SS**  trans-5582.6-173.6-170.5176.6118.6153.6-0.9111.9L99 F103 R104L99-R101 PolarHBondContact O-N 3.33Å; R101-F103 PolarHBondContact O-N 3.18Å; R101-R104 HydrophobicContact CG-CG 4.47Å
102I58.2Low66.5Low109 Ų109141.4 Ų141.456%0.55964%0.636SS**  trans-67.1-30.2178.9-46.9-170.3000109L64 V100 R104L64-I102 HydrophobicContact CD1-CD1 4.15Å; L64-I102 HydrophobicContact CD2-CD1 4.11Å; V100-I102 VanDerWaalsContact C-N 3.25Å; V100-I102 WeakPolarHBondContact O-CG1 3.49Å; V100-I102 PolarHBondContact O-N 3.48Å; I102-R104 VanDerWaalsContact C-N 3.3Å; I102-R104 PolarHBondContact O-N 3.27Å; I102-R104 VanDerWaalsContact O-N 3.08Å
103F56.3Low65.5Low180 Ų180140.5 Ų140.579%0.78964%0.636SS**  trans-88.366.2172.5-56.7-71000111.5R101 R105R101-F103 PolarHBondContact O-N 3.18Å; F103-R105 PolarHBondContact O-N 3.31Å
104R60.2Low64.5Low204 Ų204138.3 Ų138.377%0.7763%0.634SS**  trans-73.161.3148.3-69.8-172.7179.6-163.31.6108.6R101 I102 R106R101-R104 HydrophobicContact CG-CG 4.47Å; I102-R104 VanDerWaalsContact C-N 3.3Å; I102-R104 PolarHBondContact O-N 3.27Å; I102-R104 VanDerWaalsContact O-N 3.08Å; R104-R106 VanDerWaalsContact C-N 3.28Å; R104-R106 PolarHBondContact O-N 3.18Å
105R56.1Low63.6Low204 Ų204137.4 Ų137.477%0.7763%0.628SS**  trans-66.598.2162.7-169.3173.6-172.81711.6105.4F103 R107F103-R105 PolarHBondContact O-N 3.31Å; R105-R107 VanDerWaalsContact C-N 3.29Å; R105-R107 PolarHBondContact O-N 3.23Å
106R59.6Low62.8Low212 Ų212137.8 Ų137.880%0.864%0.635SS**  trans-55.499.5168.8-169.2178-172.1172.63.3105.7R104 K108R104-R106 VanDerWaalsContact C-N 3.28Å; R104-R106 PolarHBondContact O-N 3.18Å; R106-K108 PolarHBondContact O-N 2.81Å
107R59.8Low62.1Low242 Ų242139 Ų13991%0.91364%0.641SS**  trans-64.680.7161.4-77-171.8-178.2174.40.6105.3R105 A109R105-R107 VanDerWaalsContact C-N 3.29Å; R105-R107 PolarHBondContact O-N 3.23Å; R107-A109 PolarHBondContact O-N 3.08Å
108K61.7Low61.6Low156 Ų156137.4 Ų137.468%0.67864%0.639SS**  trans-60.1117.5151.1-96.4-175.3172.4-1760103.2R106 R110R106-K108 PolarHBondContact O-N 2.81Å; K108-R110 VanDerWaalsContact C-N 3.3Å; K108-R110 PolarHBondContact O-N 2.92Å
109A58.4Low61.7Low97 Ų97138.6 Ų138.680%0.80265%0.645SS**  trans-48.8107.7162.800000105.4R107 R111R107-A109 PolarHBondContact O-N 3.08Å; A109-R111 PolarHBondContact O-N 3.47Å
110R58.4Low61.8Low215 Ų215137 Ų13781%0.81164%0.635SS**  trans-6998.1170.8-69.1-168.1179.8-163.4-0.1103K108 S112K108-R110 VanDerWaalsContact C-N 3.3Å; K108-R110 PolarHBondContact O-N 2.92Å; R110-S112 PolarHBondContact O-N 3.22Å
111R57.3Low62.2Low202 Ų202136.4 Ų136.476%0.76263%0.632SS**  trans-49.9118.8149.2-83.5-169.9-178.3168-0.1104A109 L113A109-R111 PolarHBondContact O-N 3.47Å; R111-L113 PolarHBondContact O-N 3.2Å
112S62.7Low62.4Low75 Ų75134.4 Ų134.452%0.52463%0.63SS.*  trans-47.3129.5-177.2175.70000107.4R110 A114 S115R110-S112 PolarHBondContact O-N 3.22Å; S112-A114 PolarHBondContact O-N 3.03Å; S112-A114 WeakPolarHBondContact OG-CB 3.36Å; S112-A114 PolarHBondContact OG-N 3.21Å; S112-S115 WeakPolarHBondContact O-CB 3.42Å; S112-S115 PolarHBondContact O-N 2.92Å; S112-S115 PolarHBondContact O-OG 2.9Å
113L60.1Low62.7Low112 Ų112132.9 Ų132.959%0.58663%0.626SS**Hα-helixtrans-56.6-23.6178.2-66.4179.4000110.9R111 S115 L116 F117R111-L113 PolarHBondContact O-N 3.2Å; L113-S115 VanDerWaalsContact C-N 3.27Å; L113-S115 PolarHBondContact O-N 2.99Å; L113-L116 HydrophobicContact CD2-CD1 4.2Å; L113-L116 PolarHBondContact O-N 3.47Å; L113-L116 VanDerWaalsContact O-N 3.13Å; L113-F117 HydrophobicContact CB-CD2 4.45Å; L113-F117 HydrophobicContact CB-CE2 4.24Å; L113-F117 WeakPolarHBondContact O-CD2 3.5Å; L113-F117 PolarHBondContact O-N 2.94Å; L113-F117 VanDerWaalsContact O-N 3.09Å
114A61.3Low62.8Low64 Ų64127.3 Ų127.353%0.52961%0.609SS.*Hα-helixtrans-56.3-36.6170.100000113.3S112 F117 S118S112-A114 PolarHBondContact O-N 3.03Å; S112-A114 WeakPolarHBondContact OG-CB 3.36Å; S112-A114 PolarHBondContact OG-N 3.21Å; A114-F117 PolarHBondContact O-N 3.48Å; A114-S118 WeakPolarHBondContact O-CB 3.17Å; A114-S118 PolarHBondContact O-N 3.27Å; A114-S118 PolarHBondContact O-OG 2.94Å
115S63.8Low62.7Low37 Ų37123.6 Ų123.626%0.25960%0.6SS.*Hα-helixtrans-67.9-32.6176.262.70000113.1S112 L113 S118 D119S112-S115 WeakPolarHBondContact O-CB 3.42Å; S112-S115 PolarHBondContact O-N 2.92Å; S112-S115 PolarHBondContact O-OG 2.9Å; L113-S115 VanDerWaalsContact C-N 3.27Å; L113-S115 PolarHBondContact O-N 2.99Å; S115-S118 VanDerWaalsContact CA-OG 3.28Å; S115-S118 WeakPolarHBondContact CA-OG 3.29Å; S115-S118 PolarHBondContact O-OG 3.29Å; S115-D119 WeakPolarHBondContact O-CB 3.34Å; S115-D119 PolarHBondContact O-N 2.87Å
116L65.8Low62.9Low97 Ų97116.7 Ų116.751%0.50858%0.583SS.*Hα-helixtrans-74.6-36.1175.7-68175.2000111.5L113 M120L113-L116 HydrophobicContact CD2-CD1 4.2Å; L113-L116 PolarHBondContact O-N 3.47Å; L113-L116 VanDerWaalsContact O-N 3.13Å; L116-M120 WeakPolarHBondContact O-CB 3.26Å; L116-M120 PolarHBondContact O-N 3.39Å; L116-M120 VanDerWaalsContact O-N 3.11Å
117F66.9Low62.7Low137 Ų137116.4 Ų116.460%0.60158%0.582SS**Hα-helixtrans-71.1-36.1174.1-71.3-65.7000112L113 A114 T121L113-F117 HydrophobicContact CB-CD2 4.45Å; L113-F117 HydrophobicContact CB-CE2 4.24Å; L113-F117 WeakPolarHBondContact O-CD2 3.5Å; L113-F117 PolarHBondContact O-N 2.94Å; L113-F117 VanDerWaalsContact O-N 3.09Å; A114-F117 PolarHBondContact O-N 3.48Å; F117-T121 WeakPolarHBondContact O-CB 3.46Å; F117-T121 PolarHBondContact O-N 2.98Å; F117-T121 PolarHBondContact O-OG1 2.89Å
118S68.4Low62.6Low52 Ų52110.6 Ų110.636%0.36457%0.569SS.*Hα-helixtrans-63.6-50.7172.760.90000110.5A114 S115 M120 T121 E122A114-S118 WeakPolarHBondContact O-CB 3.17Å; A114-S118 PolarHBondContact O-N 3.27Å; A114-S118 PolarHBondContact O-OG 2.94Å; S115-S118 VanDerWaalsContact CA-OG 3.28Å; S115-S118 WeakPolarHBondContact CA-OG 3.29Å; S115-S118 PolarHBondContact O-OG 3.29Å; S118-M120 VanDerWaalsContact C-N 3.26Å; S118-M120 PolarHBondContact O-N 3.27Å; S118-T121 PolarHBondContact O-N 2.93Å; S118-E122 VanDerWaalsContact O-CG 3.31Å; S118-E122 WeakPolarHBondContact O-CG 3.3Å; S118-E122 PolarHBondContact O-N 3.36Å
119D70.6Confident62.2Low98 Ų98108.8 Ų108.852%0.52457%0.566SS.*Hα-helixtrans-58.6-38.9-179.1-68.4-8.2000112.2S115 T123S115-D119 WeakPolarHBondContact O-CB 3.34Å; S115-D119 PolarHBondContact O-N 2.87Å; D119-T123 PolarHBondContact O-N 2.85Å; D119-T123 PolarHBondContact O-OG1 3.25Å
120M69.7Low62Low122 Ų122112.2 Ų112.260%0.60157%0.566SS**Hα-helixtrans-72.2-33.4176.7-166.5174-179.700112.4L116 S118 T123 C124L116-M120 WeakPolarHBondContact O-CB 3.26Å; L116-M120 PolarHBondContact O-N 3.39Å; L116-M120 VanDerWaalsContact O-N 3.11Å; S118-M120 VanDerWaalsContact C-N 3.26Å; S118-M120 PolarHBondContact O-N 3.27Å; M120-T123 VanDerWaalsContact CA-OG1 3.31Å; M120-T123 WeakPolarHBondContact CA-OG1 3.27Å; M120-T123 PolarHBondContact O-OG1 2.75Å; M120-C124 WeakPolarHBondContact O-CB 3.48Å; M120-C124 PolarHBondContact O-N 2.89Å; M120-C124 PolarHBondContact O-SG 3.32Å
121T69.4Low61.8Low77 Ų77110.9 Ų110.947%0.47257%0.566SS.*Hα-helixtrans-71.7-41.9176.8-53.20000110.3F117 S118 C124 Q125F117-T121 WeakPolarHBondContact O-CB 3.46Å; F117-T121 PolarHBondContact O-N 2.98Å; F117-T121 PolarHBondContact O-OG1 2.89Å; S118-T121 PolarHBondContact O-N 2.93Å; T121-C124 PolarHBondContact O-N 3.38Å; T121-Q125 HydrophobicContact CG2-CG 4.45Å; T121-Q125 WeakPolarHBondContact O-CB 3.06Å; T121-Q125 WeakPolarHBondContact O-CG 3.43Å; T121-Q125 PolarHBondContact O-N 2.75Å
122E65.8Low61.8Low131 Ų131106 Ų10661%0.61256%0.558SS**Hα-helixtrans-61.7-43.3174.2-65.9-59.714300111.7S118 Q125 S126S118-E122 VanDerWaalsContact O-CG 3.31Å; S118-E122 WeakPolarHBondContact O-CG 3.3Å; S118-E122 PolarHBondContact O-N 3.36Å; E122-Q125 PolarHBondContact O-N 3.46Å; E122-S126 PolarHBondContact O-N 2.81Å
123T63.5Low61Low77 Ų77110.9 Ų110.947%0.47257%0.57SS.*Hα-helixtrans-69.9-32.5175.430.50000113.2D119 M120 S126 W127D119-T123 PolarHBondContact O-N 2.85Å; D119-T123 PolarHBondContact O-OG1 3.25Å; M120-T123 VanDerWaalsContact CA-OG1 3.31Å; M120-T123 WeakPolarHBondContact CA-OG1 3.27Å; M120-T123 PolarHBondContact O-OG1 2.75Å; T123-S126 PolarHBondContact O-OG 2.85Å; T123-S126 VanDerWaalsContact O-OG 3.1Å; T123-W127 VanDerWaalsContact O-CD1 3.25Å; T123-W127 PolarHBondContact O-N 2.79Å
124C59Low60.7Low63 Ų63109.6 Ų109.643%0.42658%0.584SS.*Hα-helixtrans-70-37.1171.5-68.30000111.7M120 T121 L128M120-C124 WeakPolarHBondContact O-CB 3.48Å; M120-C124 PolarHBondContact O-N 2.89Å; M120-C124 PolarHBondContact O-SG 3.32Å; T121-C124 PolarHBondContact O-N 3.38Å; C124-L128 VanDerWaalsContact O-CG 3.25Å; C124-L128 WeakPolarHBondContact O-CG 3.42Å; C124-L128 PolarHBondContact O-N 3.43Å; C124-L128 VanDerWaalsContact O-N 3.14Å
125Q58.9Low60.2Low125 Ų125109.7 Ų109.758%0.58459%0.592SS**Hα-helixtrans-66.8-44176-70.3-121-23.400111.3T121 E122 W127 L128 D129T121-Q125 HydrophobicContact CG2-CG 4.45Å; T121-Q125 WeakPolarHBondContact O-CB 3.06Å; T121-Q125 WeakPolarHBondContact O-CG 3.43Å; T121-Q125 PolarHBondContact O-N 2.75Å; E122-Q125 PolarHBondContact O-N 3.46Å; Q125-W127 VanDerWaalsContact C-N 3.29Å; Q125-W127 PolarHBondContact O-N 3.27Å; Q125-L128 PolarHBondContact O-N 2.75Å; Q125-L128 VanDerWaalsContact O-N 3.11Å; Q125-D129 WeakPolarHBondContact O-CB 3.2Å; Q125-D129 PolarHBondContact O-N 3.02Å
126S58.9Low59.1Low60 Ų60114.6 Ų114.642%0.4262%0.62SS.*Hα-helixtrans-62.9-35.8178.576.40000112.6E122 T123 E130E122-S126 PolarHBondContact O-N 2.81Å; T123-S126 PolarHBondContact O-OG 2.85Å; T123-S126 VanDerWaalsContact O-OG 3.1Å; S126-E130 WeakPolarHBondContact O-CB 3.5Å; S126-E130 PolarHBondContact O-N 3.09Å
127W56.3Low58.1Low206 Ų206120.9 Ų120.978%0.7864%0.637SS**Hα-helixtrans-72.1-28.5175.1-90.771.8000113.7T123 Q125T123-W127 VanDerWaalsContact O-CD1 3.25Å; T123-W127 PolarHBondContact O-N 2.79Å; Q125-W127 VanDerWaalsContact C-N 3.29Å; Q125-W127 PolarHBondContact O-N 3.27Å
128L57.8Low56.6Low119 Ų119123 Ų12362%0.62365%0.648SS**Hα-helixtrans-83-33.4176.6-70.7170.9000111.9C124 Q125 V132C124-L128 VanDerWaalsContact O-CG 3.25Å; C124-L128 WeakPolarHBondContact O-CG 3.42Å; C124-L128 PolarHBondContact O-N 3.43Å; C124-L128 VanDerWaalsContact O-N 3.14Å; Q125-L128 PolarHBondContact O-N 2.75Å; Q125-L128 VanDerWaalsContact O-N 3.11Å; L128-V132 VanDerWaalsContact O-CG2 3.25Å; L128-V132 WeakPolarHBondContact O-CG2 3.02Å
129D52.8Low55.3Low118 Ų118126 Ų12663%0.63167%0.666SS**Hα-helixtrans-73.4-38.5180-163.238.9000112Q125 K131Q125-D129 WeakPolarHBondContact O-CB 3.2Å; Q125-D129 PolarHBondContact O-N 3.02Å; D129-K131 PolarHBondContact O-N 3.38Å; D129-K131 VanDerWaalsContact O-N 3.14Å
130E54.9Low54.1Low170 Ų170127.1 Ų127.179%0.79468%0.679SS**Hα-helixtrans-66.1-18.6-179.6-170.6170.6174.300113.6S126S126-E130 WeakPolarHBondContact O-CB 3.5Å; S126-E130 PolarHBondContact O-N 3.09Å
131K53.7Low52.5Low187 Ų187129.5 Ų129.581%0.81369%0.693SS**Hα-helixtrans-119.53-174.6-119.6-158.4179.4-170.40117.4D129D129-K131 PolarHBondContact O-N 3.38Å; D129-K131 VanDerWaalsContact O-N 3.14Å
132V56.5Low50.7Low98 Ų98130.6 Ų130.659%0.59471%0.71SS**Hα-helixtrans-105.6-21.4-179.1177.20000113.4L128L128-V132 VanDerWaalsContact O-CG2 3.25Å; L128-V132 WeakPolarHBondContact O-CG2 3.02Å
133F47Very low49.2Very low178 Ų178132.8 Ų132.878%0.78172%0.72SS**  trans-123.251.3175.9-65.3-77000113.5G135F133-G135 PolarHBondContact O-N 3.26Å
134G54.7Low47.8Very low85 Ų85134.9 Ų134.988%0.87674%0.738SS**  trans-69.590.815900000110.6
135G50.4Low46.5Very low67 Ų67136.9 Ų136.969%0.69175%0.752SS**  trans134.375.6156.600000117F133F133-G135 PolarHBondContact O-N 3.26Å
136V40.8Very low45.3Very low139 Ų139142.1 Ų142.184%0.84277%0.767SS**  trans-133.5112.8143.5-179.30000107.6
137R43.4Very low44Very low230 Ų230146.6 Ų146.687%0.86878%0.783SS**  trans-72.3134.1176.4-67.5-177.5169.8145.1-1.8109.8
138H37Very low42.9Very low182 Ų182144.3 Ų144.384%0.84378%0.781SS**  trans-156.9155.3142.3-87.8-60.5000110.6
139P39.7Very low41.6Very low115 Ų115146.9 Ų146.975%0.74779%0.79SS**  trans-91.6175.6-149.1-122.4000115
140P46.7Very low40.5Very low120 Ų120144.9 Ų144.978%0.77979%0.785SS**  trans-85.9164.4-168.936.5-33.5000113
141L35.4Very low39.5Very low172 Ų172142.7 Ų142.790%0.90178%0.783SS**  trans90106.8160.7-154.481.9000116.4
142A30.7Very low38.6Very low100 Ų100140.5 Ų140.583%0.82679%0.786SS**  trans-173.6143.5131.700000111
143E35.2Very low37.6Very low178 Ų178142.6 Ų142.683%0.83279%0.793SS**  trans-75.9174.6-172.2-59.2160152.800113.6
144S34.8Very low37.6Very low121 Ų121142.3 Ų142.385%0.84680%0.799SS**  trans77.1153.1163.885.50000114.8
145S30.7Very low36.8Very low104 Ų104144.6 Ų144.673%0.72779%0.791SS**  cis-165.5152.416.6172.20000106.9
146W33.9Very low36.1Very low235 Ų235146.8 Ų146.889%0.8979%0.791SS**  trans-56.5168.6166.9-68.680.9000114.1
147M31.1Very low36Very low155 Ų155144.9 Ų144.976%0.76478%0.784SS**  trans113.7110155.9-60.8-72.2-96.500112.8
148E33.5Very low36.1Very low157 Ų157139.5 Ų139.573%0.73478%0.78SS**  91145.761.2-174.1144.9-158.200112
149H31.3Very low36Very low174 Ų174135.1 Ų135.181%0.80677%0.771SS**  trans85133.2178.1-104.7-118.6000117.1
150S28.9Very low35.8Very low75 Ų75138.1 Ų138.152%0.52477%0.772SS.*  cis-179.8134-11.945.60000107.7
151T34.6Very low35.5Very low124 Ų124138.3 Ų138.376%0.76177%0.771SS**  trans49121141.460.30000121.6
152T33.6Very low35.7Very low141 Ų141139.6 Ų139.687%0.86577%0.765SS**  -156.6139121-40.30000110.1
153D35.7Very low35.7Very low142 Ų142141.1 Ų141.176%0.75976%0.76SS**  trans-63.4144.1-165.9-53.3-74.5000117.2
154L46.9Very low36.1Very low173 Ų173139.9 Ų139.991%0.90676%0.759SS**  trans-150.6101130.2-143.382.7000110.6
155D38Very low36.2Very low133 Ų133138 Ų13871%0.71175%0.745SS**  trans-61.5135.5167.8-175.614.6000111.3S157D155-S157 PolarHBondContact OD1-N 3.19Å
156T36.1Very low36.4Very low112 Ų112142.5 Ų142.569%0.68776%0.755SS**  trans-161.281.4142.7-56.50000108.4C158T156-C158 PolarHBondContact O-N 3.37Å
157S39.5Very low36.6Very low99 Ų99138 Ų13869%0.69275%0.747SS**  trans-60.2104.7154.2173.60000109.7D155 S159D155-S157 PolarHBondContact OD1-N 3.19Å; S157-S159 PolarHBondContact O-N 3.17Å
158C43.8Very low36.9Very low117 Ų117138.5 Ų138.579%0.79175%0.751SS**  trans-88.483.9168.2-86.50000110.2T156T156-C158 PolarHBondContact O-N 3.37Å
159S35.9Very low36.7Very low91 Ų91135.4 Ų135.464%0.63675%0.747SS**  trans-78.1114.7158.355.50000108.9S157 T161S157-S159 PolarHBondContact O-N 3.17Å; S159-T161 PolarHBondContact O-N 2.64Å
160F34.8Very low36.5Very low178 Ų178135.4 Ų135.478%0.78175%0.749SS**  trans-88.694.1176.3-169.4-100.3000110.1Y162F160-Y162 AromaticContact CE1-CD2 3.55Å; F160-Y162 HydrophobicContact CE1-CD2 3.55Å; F160-Y162 HydrophobicContact CE1-CE2 4.3Å; F160-Y162 HydrophobicContact CE1-CG 4.46Å; F160-Y162 AromaticContact CZ-CD2 3.51Å; F160-Y162 HydrophobicContact CZ-CD2 3.51Å; F160-Y162 AromaticContact CZ-CE2 3.89Å; F160-Y162 HydrophobicContact CZ-CE2 3.89Å
161T40.7Very low36.5Very low123 Ų123137.6 Ų137.676%0.75576%0.762SS**PPolyproline II helixtrans-84.2125.2160.540.40000108.5S159S159-T161 PolarHBondContact O-N 2.64Å
162Y38.8Very low36.4Very low199 Ų199137.8 Ų137.878%0.7876%0.763SS**PPolyproline II helixtrans-90.5123.2163.9-143.8-102000107.7F160F160-Y162 AromaticContact CE1-CD2 3.55Å; F160-Y162 HydrophobicContact CE1-CD2 3.55Å; F160-Y162 HydrophobicContact CE1-CE2 4.3Å; F160-Y162 HydrophobicContact CE1-CG 4.46Å; F160-Y162 AromaticContact CZ-CD2 3.51Å; F160-Y162 HydrophobicContact CZ-CD2 3.51Å; F160-Y162 AromaticContact CZ-CE2 3.89Å; F160-Y162 HydrophobicContact CZ-CE2 3.89Å
163D31.6Very low36.6Very low133 Ų133139.4 Ų139.471%0.71176%0.758SS**PPolyproline II helixtrans-78.3125.1175-168.16.8000108.7
164D44.1Very low36.7Very low152 Ų152139.8 Ų139.881%0.81376%0.759SS**  trans-10982.6174.5-179.931.1000106.6
165S37.4Very low36.2Very low80 Ų80135.4 Ų135.456%0.55975%0.748SS**  trans-163.367.2175.8-78.70000112.3
166E34.8Very low35.8Very low199 Ų199138 Ų13893%0.9376%0.756SS**  trans-97.381.5143.9-75.7-169.3-171.100108.1
167I38.2Very low35.6Very low140 Ų140141.6 Ų141.672%0.71876%0.764SS**  trans-88.1103.2162.8-61.4174.3000107.1
168I36.3Very low35.3Very low166 Ų166142.7 Ų142.785%0.85177%0.769SS**  trans-10396.8146-62.3178.1000106.6
169S29.2Very low34.5Very low93 Ų93144.7 Ų144.765%0.6577%0.769SS**  trans31.8108.6152.9-55.50000119.6P171S169-P171 WeakPolarHBondContact O-CD 2.9Å
170M27.2Very low34.3Very low173 Ų173147.2 Ų147.285%0.85278%0.78SS**  trans-51.8131.3148.1-93.4-165.3126.700111.3
171P29.9Very low34Very low121 Ų121145 Ų14579%0.78677%0.772SS**  trans-95.6113147.231.6-20.4000108.6S169 K173S169-P171 WeakPolarHBondContact O-CD 2.9Å; P171-K173 PolarHBondContact O-N 3.29Å
172T32.9Very low33.7Very low129 Ų129147.4 Ų147.479%0.79178%0.775SS**  trans-60.7103.2167.4-55.40000110.3
173K37.1Very low33.3Very low175 Ų175144.4 Ų144.476%0.76177%0.768SS**  trans174.4125.9134.4-115.6-176.3165.5-1760113.5P171P171-K173 PolarHBondContact O-N 3.29Å
174L36.9Very low33.4Very low149 Ų149144.8 Ų144.878%0.7877%0.768SS**  trans63111142-73.8159.8000120.5
175A36.4Very low32.6Very low81 Ų81143.1 Ų143.167%0.66976%0.758SS**  trans75.5136.313400000120.7
176H30Very low32.3Very low189 Ų189144.9 Ų144.988%0.87577%0.766SS**  trans89.8109.8161.1-66.4-62.4000119.5
177E31.8Very low32Very low186 Ų186144 Ų14487%0.86976%0.762SS**  trans-63.6157.9162.7-79-163.314800113
178P32.5Very low31.7Very low122 Ų122143.3 Ų143.379%0.79276%0.764SS**  trans-89.5119.2-17934.5-28.8000111.7
179M28.3Very low31.4Very low160 Ų160142 Ų14279%0.78877%0.769SS**  trans-86.7113.9160.5-83.4-176.464.600109.2Q181M179-Q181 PolarHBondContact O-N 3.06Å
180V31.1Very low31.3Very low143 Ų143143.7 Ų143.787%0.86777%0.774SS**  trans-76.596154.7175.70000106
181Q29.5Very low31.3Very low131 Ų131142.9 Ų142.961%0.61277%0.768SS**  trans-90.198.6173.5-179.8165.1-1500107.9M179 E183M179-Q181 PolarHBondContact O-N 3.06Å; Q181-E183 HydrophobicContact CG-CB 4.49Å; Q181-E183 PolarHBondContact O-N 3.27Å
182E32.8Very low31.1Very low175 Ų175143.8 Ų143.882%0.81876%0.762SS**  trans-8592.3165.9-154.4168.9-165.600107I184E182-I184 PolarHBondContact O-N 3.27Å
183E30.7Very low31.2Very low136 Ų136145.6 Ų145.664%0.63676%0.762SS**  trans-73.999.4-180-166-178.1-177.600109.4Q181 I185Q181-E183 HydrophobicContact CG-CB 4.49Å; Q181-E183 PolarHBondContact O-N 3.27Å; E183-I185 HydrophobicContact CG-CD1 4.43Å; E183-I185 HydrophobicContact CG-CG1 3.86Å; E183-I185 PolarHBondContact O-N 3.1Å
184I33.9Very low30.9Very low140 Ų140145.3 Ų145.372%0.71876%0.763SS**  trans-86.688168.4-55.9175.1000107.4E182 T186E182-I184 PolarHBondContact O-N 3.27Å; I184-T186 PolarHBondContact O-N 3.14Å
185I28.7Very low30.7Very low117 Ų117148.1 Ų148.160%0.677%0.769SS**  trans-68.8112.4163.6-56.3177.8000106.6E183 E187E183-I185 HydrophobicContact CG-CD1 4.43Å; E183-I185 HydrophobicContact CG-CG1 3.86Å; E183-I185 PolarHBondContact O-N 3.1Å; I185-E187 HydrophobicContact CG2-CG 4.14Å
186T30.4Very low30.3Very low118 Ų118147.9 Ų147.972%0.72477%0.774SS**  trans-108.6100.4166.6-23.40000107.2I184 T188I184-T186 PolarHBondContact O-N 3.14Å; T186-T188 PolarHBondContact O-N 3.35Å
187E28.9Very low30.6Very low179 Ų179148 Ų14884%0.83678%0.775SS**  trans-64.2113170.2-66.4-176161.600108.9I185I185-E187 HydrophobicContact CG2-CG 4.14Å
188T31.6Very low31.3Very low126 Ų126144.6 Ų144.677%0.77377%0.77SS**  trans-75.4125.1165.142.80000109.4T186T186-T188 PolarHBondContact O-N 3.35Å
189C29Very low31.3Very low140 Ų140147.3 Ų147.395%0.94678%0.776SS**  trans-123.6136.1157.1-1070000110.7
190V28.3Very low31.3Very low127 Ų127143.1 Ų143.177%0.7777%0.774SS**  trans-100.6134.5-157.3156.10000109.5
191H26.8Very low31.2Very low157 Ų157140 Ų14073%0.72777%0.771SS**  trans64.1131.6137.9-152.4-101.1000120.7
192Q26.5Very low31.5Very low139 Ų139141.5 Ų141.565%0.6578%0.782SS**  168.6118.3100.7-171146.5-25.900112.3H194Q192-H194 PolarHBondContact NE2-NE2 3.21Å
193E34.2Very low31.6Very low168 Ų168140.3 Ų140.379%0.78578%0.78SS**  trans-69144.3166.5-66-178.613700111.3
194H29.8Very low31.6Very low169 Ų169140.2 Ų140.278%0.78279%0.785SS**  trans-144.1119.9153.1-94.8-79000110.7Q192Q192-H194 PolarHBondContact NE2-NE2 3.21Å
195F32.7Very low31.7Very low208 Ų208139.5 Ų139.591%0.91279%0.786SS**  trans-78.4148.1172.3-117.7-97.1000111.4
196G29.8Very low32.5Very low76 Ų76139 Ų13978%0.78479%0.79SS**  trans165.7101.3162.200000115.4
197Q34.8Very low33.4Very low190 Ų190139.1 Ų139.189%0.88879%0.794SS**  trans-84.3162.9150.8-94-172.4-3300108.6
198P47.5Very low34.1Very low116 Ų116136.4 Ų136.475%0.75379%0.791SS**  cis-156.617445.442.1-18.9000119.7
199L32.4Very low34.4Very low179 Ų179135.8 Ų135.894%0.93779%0.792SS**  trans65.6123.2143.1-150.970.7000123.7
200G28.5Very low35.1Very low72 Ų72132.6 Ų132.674%0.74278%0.776SS**  trans139.1114.6134.100000120.9
201G29.4Very low35.6Very low77 Ų77136.1 Ų136.179%0.79478%0.781SS**  trans81.8140.9150.300000117.4
202L34.8Very low36.1Very low163 Ų163136.4 Ų136.485%0.85379%0.787SS**  cis-166.2145.723.4-14795.6000109.3
203L35.4Very low37Very low149 Ų149134.8 Ų134.878%0.7879%0.791SS**  trans14.7138148.5-99.591.3000119.5
204D31.1Very low37.1Very low135 Ų135133.9 Ų133.972%0.72279%0.792SS**  174.3160.656-159.60.9000111.4
205V35.2Very low37.9Very low124 Ų124131 Ų13175%0.75279%0.791SS**  trans93.5136.5157.2-174.10000119.7
206P44.9Very low38.1Very low106 Ų106127.3 Ų127.369%0.68879%0.789SS**  -112.7-179.9-129.244.3-38.4000116.2
207P50.7Low39.1Very low122 Ų122129 Ų12979%0.79279%0.788SS**  trans-91.9142.9173.836-30000112.3
208P43.3Very low39.7Very low121 Ų121125.5 Ų125.579%0.78678%0.782SS**  -148.1167.9115.437.3-19.6000110.9
209S36.9Very low39.6Very low113 Ų113126.1 Ų126.179%0.7979%0.786SS**  cis-161.8149.929.148.20000109.7
210A44.7Very low40Very low74 Ų74126.5 Ų126.561%0.61278%0.78SS**  trans-57.4167161.500000112.2
211F37.9Very low40.9Very low200 Ų200128.6 Ų128.688%0.87778%0.78SS**  trans91.779.7172.6-48.9-71000116.6
212L37.8Very low42.1Very low163 Ų163132.7 Ų132.785%0.85378%0.779SS**  -149.2120.6115.6-143.582.7000110.5N214L212-N214 PolarHBondContact O-N 2.85Å
213S45.6Very low43Very low105 Ų105130.2 Ų130.273%0.73477%0.772SS**  trans-43.8117.9166.2158.90000111.4
214N35.5Very low44Very low149 Ų149127.4 Ų127.480%0.79777%0.771SS**  trans-143107151.3-91.5-25.2000108.8L212 C216L212-N214 PolarHBondContact O-N 2.85Å; N214-C216 PolarHBondContact O-N 3.11Å
215S46.1Very low45.3Very low110 Ų110125.3 Ų125.377%0.76976%0.76SS**  trans-57.9122.9169.356.30000110.1
216C37.3Very low46.3Very low129 Ų129126.8 Ų126.887%0.87276%0.756SS**  trans-135.593158.2-130.30000108.5N214N214-C216 PolarHBondContact O-N 3.11Å
217C51.2Low47.3Very low112 Ų112125.1 Ų125.176%0.75775%0.747SS**PPolyproline II helixtrans-67.5150.5166.6-70.80000109.7
218P47.2Very low48.3Very low116 Ų116125.2 Ų125.275%0.75374%0.738SS**PPolyproline II helixtrans-62149.8178.426.4-34000111.5K220P218-K220 PolarHBondContact O-N 3.14Å
219P44.7Very low49.8Very low129 Ų129123 Ų12384%0.83872%0.722SS**PPolyproline II helixtrans-64.8121.5-179.225.8-31.7000110.2
220K42.1Very low51.8Low188 Ų188122.6 Ų122.682%0.81771%0.707SS**PPolyproline II helixtrans-61.6136.4167.1-174176.6-177.5173.90108.4P218 Q222P218-K220 PolarHBondContact O-N 3.14Å; K220-Q222 PolarHBondContact O-N 3.03Å
221P47.8Very low53.6Low116 Ų116121.1 Ų121.175%0.75369%0.694SS**PPolyproline II helixtrans-59.3116.3177.520.8-29.5000109.3P223P221-P223 WeakPolarHBondContact O-CD 3.34Å
222Q53.7Low55.9Low163 Ų163117.2 Ų117.276%0.76268%0.682SS**PPolyproline II helixtrans-62.3125.3167.5-78.8-171.5-2.900107.4K220 A224K220-Q222 PolarHBondContact O-N 3.03Å; Q222-A224 PolarHBondContact O-N 3.46Å
223P54.3Low58.2Low110 Ų110115.1 Ų115.171%0.71467%0.666SS**PPolyproline II helixtrans-64.2122.3164.226.8-28.8000106.4P221 D225P221-P223 WeakPolarHBondContact O-CD 3.34Å; P223-D225 PolarHBondContact O-N 2.96Å
224A55.2Low60.2Low90 Ų90115.4 Ų115.474%0.74466%0.658SS**  trans-38.8119.2173.100000109.1Q222 F226Q222-A224 PolarHBondContact O-N 3.46Å; A224-F226 PolarHBondContact O-N 2.92Å
225D58.6Low62.8Low92 Ų92113.6 Ų113.649%0.49265%0.647SS.*  trans-50.9112.5-167.6-70.3-46.4000109.7P223 S227 M228P223-D225 PolarHBondContact O-N 2.96Å; D225-S227 WeakPolarHBondContact CB-OG 3.3Å; D225-S227 PolarHBondContact O-N 3.11Å; D225-M228 HydrophobicContact CB-CG 4.37Å; D225-M228 PolarHBondContact O-N 3.13Å
226F57.4Low65Low154 Ų154112.5 Ų112.568%0.67563%0.632SS**Hα-helixtrans-56-11.4178.8-163.5-123.9000112A224 K230A224-F226 PolarHBondContact O-N 2.92Å; F226-K230 HydrophobicContact CD1-CD 4.13Å; F226-K230 HydrophobicContact CE1-CD 4.32Å; F226-K230 WeakPolarHBondContact O-CB 3.04Å; F226-K230 VanDerWaalsContact O-CD 3.3Å; F226-K230 WeakPolarHBondContact O-CD 3.34Å; F226-K230 WeakPolarHBondContact O-CG 3.43Å
227S66.2Low67.5Low71 Ų71110.9 Ų110.950%0.49761%0.613SS.*Hα-helixtrans-74.3-37.3173.161.90000113.8D225 K230 A231D225-S227 WeakPolarHBondContact CB-OG 3.3Å; D225-S227 PolarHBondContact O-N 3.11Å; S227-K230 PolarHBondContact O-N 3.21Å; S227-A231 WeakPolarHBondContact O-CB 3.33Å; S227-A231 PolarHBondContact O-N 2.96Å
228M70.9Confident69.3Low125 Ų125110 Ų11062%0.61660%0.604SS**Hα-helixtrans-71.9-43.6-174.9-68.8-63.1-174.500111.4D225 K230 A231 L232D225-M228 HydrophobicContact CB-CG 4.37Å; D225-M228 PolarHBondContact O-N 3.13Å; M228-K230 VanDerWaalsContact C-N 3.33Å; M228-K230 PolarHBondContact O-N 3.02Å; M228-A231 PolarHBondContact O-N 3.32Å; M228-L232 WeakPolarHBondContact O-CG 3.27Å; M228-L232 PolarHBondContact O-N 2.82Å
229T75.8Confident71.3Confident73 Ų73111.5 Ų111.545%0.44860%0.599SS.*Hα-helixtrans-65-39.6175.8-38.20000111.2L232 F233T229-L232 PolarHBondContact O-N 2.86Å; T229-F233 HydrophobicContact CG2-CD2 4.06Å; T229-F233 HydrophobicContact CG2-CE2 3.61Å; T229-F233 WeakPolarHBondContact O-CD2 3.32Å; T229-F233 PolarHBondContact O-N 3.02Å
230K77.1Confident73.3Confident106 Ų106109.1 Ų109.146%0.46158%0.578SS.*Hα-helixtrans-64.3-41.4174.3-76.8178.5175.8178.70112.5F226 S227 M228 L232 F233 I234F226-K230 HydrophobicContact CD1-CD 4.13Å; F226-K230 HydrophobicContact CE1-CD 4.32Å; F226-K230 WeakPolarHBondContact O-CB 3.04Å; F226-K230 VanDerWaalsContact O-CD 3.3Å; F226-K230 WeakPolarHBondContact O-CD 3.34Å; F226-K230 WeakPolarHBondContact O-CG 3.43Å; S227-K230 PolarHBondContact O-N 3.21Å; M228-K230 VanDerWaalsContact C-N 3.33Å; M228-K230 PolarHBondContact O-N 3.02Å; K230-L232 VanDerWaalsContact C-N 3.34Å; K230-L232 PolarHBondContact O-N 2.84Å; K230-F233 PolarHBondContact O-N 2.98Å; K230-I234 VanDerWaalsContact O-CG1 3.27Å; K230-I234 WeakPolarHBondContact O-CG1 3.35Å; K230-I234 PolarHBondContact O-N 2.94Å
231A82.8Confident75.2Confident42 Ų42105.5 Ų105.535%0.34756%0.563SS.*Hα-helixtrans-61.8-42.8175.800000111.3S227 M228 F233 I234 I235S227-A231 WeakPolarHBondContact O-CB 3.33Å; S227-A231 PolarHBondContact O-N 2.96Å; M228-A231 PolarHBondContact O-N 3.32Å; A231-F233 PolarHBondContact O-N 2.9Å; A231-I234 PolarHBondContact O-N 2.69Å; A231-I235 VanDerWaalsContact O-CG1 3.27Å; A231-I235 WeakPolarHBondContact O-CG1 3.22Å; A231-I235 PolarHBondContact O-N 2.7Å
232L85.9Confident76.7Confident118 Ų118102.9 Ų102.962%0.61855%0.548SS*.Hα-helixtrans-62.7-40.8175.3-70172.2000112.4M228 T229 K230 I235 L236M228-L232 WeakPolarHBondContact O-CG 3.27Å; M228-L232 PolarHBondContact O-N 2.82Å; T229-L232 PolarHBondContact O-N 2.86Å; K230-L232 VanDerWaalsContact C-N 3.34Å; K230-L232 PolarHBondContact O-N 2.84Å; L232-I235 PolarHBondContact O-N 3.03Å; L232-L236 WeakPolarHBondContact O-CB 3.41Å; L232-L236 PolarHBondContact O-N 2.64Å
233F87.8Confident77.8Confident120 Ų12097 Ų9753%0.52653%0.526SS..Hα-helixtrans-64.4-39.2174.3-78.6-61.5000112.5T229 K230 A231 L236 M237T229-F233 HydrophobicContact CG2-CD2 4.06Å; T229-F233 HydrophobicContact CG2-CE2 3.61Å; T229-F233 WeakPolarHBondContact O-CD2 3.32Å; T229-F233 PolarHBondContact O-N 3.02Å; K230-F233 PolarHBondContact O-N 2.98Å; A231-F233 PolarHBondContact O-N 2.9Å; F233-L236 PolarHBondContact O-N 2.76Å; F233-M237 WeakPolarHBondContact O-CB 3.27Å; F233-M237 WeakPolarHBondContact O-CG 3.46Å; F233-M237 PolarHBondContact O-N 2.81Å
234I87.3Confident78.9Confident111 Ų11195.7 Ų95.757%0.56952%0.516SS*.Hα-helixtrans-63.9-45.8176.1-67.4163.6000110.3K230 A231 L236 M237 V238K230-I234 VanDerWaalsContact O-CG1 3.27Å; K230-I234 WeakPolarHBondContact O-CG1 3.35Å; K230-I234 PolarHBondContact O-N 2.94Å; A231-I234 PolarHBondContact O-N 2.69Å; I234-L236 PolarHBondContact O-N 3.37Å; I234-M237 PolarHBondContact O-N 2.89Å; I234-V238 WeakPolarHBondContact O-CG2 3.2Å; I234-V238 PolarHBondContact O-N 3.05Å
235I90.4Very high79.4Confident111 Ų11195.7 Ų95.757%0.56950%0.5SS*.Hα-helixtrans-61.6-44.6177.7-66.5163.5000110.7A231 L232 M237 V238 F239A231-I235 VanDerWaalsContact O-CG1 3.27Å; A231-I235 WeakPolarHBondContact O-CG1 3.22Å; A231-I235 PolarHBondContact O-N 2.7Å; L232-I235 PolarHBondContact O-N 3.03Å; I235-M237 PolarHBondContact O-N 2.81Å; I235-V238 PolarHBondContact O-N 3.21Å; I235-F239 WeakPolarHBondContact O-CB 3.3Å; I235-F239 PolarHBondContact O-N 2.66Å
236L91Very high79.9Confident86 Ų8694.8 Ų94.845%0.4550%0.501SS..Hα-helixtrans-61.2-43.7176.9-177.269.7000111.5L232 F233 I234 F239 I240L232-L236 WeakPolarHBondContact O-CB 3.41Å; L232-L236 PolarHBondContact O-N 2.64Å; F233-L236 PolarHBondContact O-N 2.76Å; I234-L236 PolarHBondContact O-N 3.37Å; L236-F239 PolarHBondContact O-N 3.08Å; L236-I240 HydrophobicContact CD1-CD1 4.25Å; L236-I240 HydrophobicContact CD2-CD1 4.45Å; L236-I240 HydrophobicContact CG-CD1 3.89Å; L236-I240 VanDerWaalsContact O-CG1 3.27Å; L236-I240 WeakPolarHBondContact O-CG1 3.18Å; L236-I240 PolarHBondContact O-N 2.93Å
237M90.5Very high80.4Confident96 Ų9698.3 Ų98.347%0.47351%0.509SS..Hα-helixtrans-62.6-47.3177.3-72.9-63.7171.900111.1F233 I234 I235 F239 I240 F241F233-M237 WeakPolarHBondContact O-CB 3.27Å; F233-M237 WeakPolarHBondContact O-CG 3.46Å; F233-M237 PolarHBondContact O-N 2.81Å; I234-M237 PolarHBondContact O-N 2.89Å; I235-M237 PolarHBondContact O-N 2.81Å; M237-F239 VanDerWaalsContact C-N 3.27Å; M237-F239 PolarHBondContact O-N 2.76Å; M237-I240 PolarHBondContact O-N 3.22Å; M237-F241 HydrophobicContact CB-CD2 4.26Å; M237-F241 HydrophobicContact CB-CE2 4.22Å; M237-F241 WeakPolarHBondContact O-CB 3.36Å; M237-F241 WeakPolarHBondContact O-CD2 3.29Å; M237-F241 PolarHBondContact O-N 2.83Å; M237-F241 HydrophobicContact SD-CE2 4.43Å
238V89.4Confident80.3Confident94 Ų9497.7 Ų97.757%0.5751%0.505SS*.Hα-helixtrans-59.7-38.4176.3173.30000111.4I234 I235 S242I234-V238 WeakPolarHBondContact O-CG2 3.2Å; I234-V238 PolarHBondContact O-N 3.05Å; I235-V238 PolarHBondContact O-N 3.21Å; V238-S242 VanDerWaalsContact O-CB 3.29Å; V238-S242 WeakPolarHBondContact O-CB 3.12Å; V238-S242 PolarHBondContact O-N 3.38Å; V238-S242 PolarHBondContact O-OG 3.28Å
239F89.6Confident79.9Confident146 Ų14697.6 Ų97.664%0.6451%0.506SS*.Hα-helixtrans-67.9-40.9176.2-166.9-101.8000112.6I235 L236 M237 S242 A243I235-F239 WeakPolarHBondContact O-CB 3.3Å; I235-F239 PolarHBondContact O-N 2.66Å; L236-F239 PolarHBondContact O-N 3.08Å; M237-F239 VanDerWaalsContact C-N 3.27Å; M237-F239 PolarHBondContact O-N 2.76Å; F239-S242 WeakPolarHBondContact CA-OG 3.31Å; F239-S242 PolarHBondContact O-OG 2.8Å; F239-A243 WeakPolarHBondContact O-CB 3.25Å; F239-A243 PolarHBondContact O-N 3.34Å
240I85.7Confident79.2Confident79 Ų79100.6 Ų100.641%0.40552%0.518SS..Hα-helixtrans-66.9-46.2176.5-68.6167.4000110.3L236 M237 A243 V244L236-I240 HydrophobicContact CD1-CD1 4.25Å; L236-I240 HydrophobicContact CD2-CD1 4.45Å; L236-I240 HydrophobicContact CG-CD1 3.89Å; L236-I240 VanDerWaalsContact O-CG1 3.27Å; L236-I240 WeakPolarHBondContact O-CG1 3.18Å; L236-I240 PolarHBondContact O-N 2.93Å; M237-I240 PolarHBondContact O-N 3.22Å; I240-A243 PolarHBondContact O-N 3.01Å; I240-V244 HydrophobicContact CG2-CG2 4.26Å; I240-V244 WeakPolarHBondContact O-CB 3.15Å; I240-V244 WeakPolarHBondContact O-CG2 3.48Å; I240-V244 PolarHBondContact O-N 3.09Å
241F81.7Confident78.7Confident112 Ų112104.4 Ų104.449%0.49153%0.53SS..Hα-helixtrans-61.1-50.3176.6-78.4-62.9000110.8M237 A243 V244 F245M237-F241 HydrophobicContact CB-CD2 4.26Å; M237-F241 HydrophobicContact CB-CE2 4.22Å; M237-F241 WeakPolarHBondContact O-CB 3.36Å; M237-F241 WeakPolarHBondContact O-CD2 3.29Å; M237-F241 PolarHBondContact O-N 2.83Å; M237-F241 HydrophobicContact SD-CE2 4.43Å; F241-A243 VanDerWaalsContact C-N 3.29Å; F241-A243 PolarHBondContact O-N 2.83Å; F241-V244 PolarHBondContact O-N 2.96Å; F241-F245 VanDerWaalsContact C-CD2 3.49Å; F241-F245 HydrophobicContact CB-CD2 3.97Å; F241-F245 HydrophobicContact CB-CE2 3.84Å; F241-F245 HydrophobicContact CD1-CD2 4.45Å; F241-F245 AromaticContact CD1-CE2 3.6Å; F241-F245 HydrophobicContact CD1-CE2 3.6Å; F241-F245 HydrophobicContact CD1-CZ 4.2Å; F241-F245 HydrophobicContact CG-CE2 4.12Å; F241-F245 VanDerWaalsContact O-CB 3.3Å; F241-F245 WeakPolarHBondContact O-CB 3.39Å; F241-F245 WeakPolarHBondContact O-CD2 3.31Å; F241-F245 WeakPolarHBondContact O-CG 3.42Å; F241-F245 PolarHBondContact O-N 2.77Å
242S79Confident78.3Confident62 Ų62103 Ų10343%0.43452%0.52SS..Hα-helixtrans-60.5-36.3176.2580000112.7V238 F239 S246V238-S242 VanDerWaalsContact O-CB 3.29Å; V238-S242 WeakPolarHBondContact O-CB 3.12Å; V238-S242 PolarHBondContact O-N 3.38Å; V238-S242 PolarHBondContact O-OG 3.28Å; F239-S242 WeakPolarHBondContact CA-OG 3.31Å; F239-S242 PolarHBondContact O-OG 2.8Å; S242-S246 WeakPolarHBondContact O-CA 3.13Å; S242-S246 WeakPolarHBondContact O-CB 3.45Å; S242-S246 PolarHBondContact O-N 3.31Å; S242-S246 PolarHBondContact O-OG 3.39Å
243A76.9Confident77.9Confident38 Ų38102.5 Ų102.531%0.31452%0.517SS..Hα-helixtrans-68.7-42.4175.600000112.9F239 I240 F241 S246 R247F239-A243 WeakPolarHBondContact O-CB 3.25Å; F239-A243 PolarHBondContact O-N 3.34Å; I240-A243 PolarHBondContact O-N 3.01Å; F241-A243 VanDerWaalsContact C-N 3.29Å; F241-A243 PolarHBondContact O-N 2.83Å; A243-S246 PolarHBondContact O-N 2.63Å; A243-S246 PolarHBondContact O-OG 3.39Å; A243-R247 PolarHBondContact O-N 3.38Å
244V77.2Confident77.4Confident83 Ų8399.9 Ų99.950%0.50351%0.511SS..Hα-helixtrans-66.8-44.9176.6171.70000110.3I240 F241 R247 C248I240-V244 HydrophobicContact CG2-CG2 4.26Å; I240-V244 WeakPolarHBondContact O-CB 3.15Å; I240-V244 WeakPolarHBondContact O-CG2 3.48Å; I240-V244 PolarHBondContact O-N 3.09Å; F241-V244 PolarHBondContact O-N 2.96Å; V244-R247 PolarHBondContact O-N 3.46Å; V244-C248 WeakPolarHBondContact O-CB 3.25Å; V244-C248 PolarHBondContact O-N 3.04Å
245F67Low77.1Confident91 Ų91100.1 Ų100.140%0.39951%0.511SS..Hα-helixtrans-70-31.4176.1-66.7-57.3000112.1F241 R247 C248 L249F241-F245 VanDerWaalsContact C-CD2 3.49Å; F241-F245 HydrophobicContact CB-CD2 3.97Å; F241-F245 HydrophobicContact CB-CE2 3.84Å; F241-F245 HydrophobicContact CD1-CD2 4.45Å; F241-F245 AromaticContact CD1-CE2 3.6Å; F241-F245 HydrophobicContact CD1-CE2 3.6Å; F241-F245 HydrophobicContact CD1-CZ 4.2Å; F241-F245 HydrophobicContact CG-CE2 4.12Å; F241-F245 VanDerWaalsContact O-CB 3.3Å; F241-F245 WeakPolarHBondContact O-CB 3.39Å; F241-F245 WeakPolarHBondContact O-CD2 3.31Å; F241-F245 WeakPolarHBondContact O-CG 3.42Å; F241-F245 PolarHBondContact O-N 2.77Å; F245-R247 PolarHBondContact O-N 2.94Å; F245-C248 CarbonylContact O-C 3.59Å; F245-C248 PolarHBondContact O-N 2.92Å; F245-C248 VanDerWaalsContact O-N 3.09Å; F245-L249 WeakPolarHBondContact O-CA 3.37Å; F245-L249 WeakPolarHBondContact O-CD2 3.38Å; F245-L249 WeakPolarHBondContact O-CG 3.43Å; F245-L249 PolarHBondContact O-N 2.78Å
246S67.8Low76.8Confident73 Ų7397.5 Ų97.551%0.5151%0.506SS..Hα-helixtrans-63.6-28.3174.776.20000113S242 A243S242-S246 WeakPolarHBondContact O-CA 3.13Å; S242-S246 WeakPolarHBondContact O-CB 3.45Å; S242-S246 PolarHBondContact O-N 3.31Å; S242-S246 PolarHBondContact O-OG 3.39Å; A243-S246 PolarHBondContact O-N 2.63Å; A243-S246 PolarHBondContact O-OG 3.39Å
247R67.8Low76.5Confident227 Ų22799.3 Ų99.386%0.85751%0.511SS*.Hα-helixtrans-88.4-16.3175.8-68.5-176.5179.6177.32.6113.2A243 V244 F245A243-R247 PolarHBondContact O-N 3.38Å; V244-R247 PolarHBondContact O-N 3.46Å; F245-R247 PolarHBondContact O-N 2.94Å
248C65.7Low76.2Confident59 Ų5998 Ų9840%0.39951%0.508SS..SBendtrans-132.938-175.8-72.60000110.9V244 F245 L250 W251 G252V244-C248 WeakPolarHBondContact O-CB 3.25Å; V244-C248 PolarHBondContact O-N 3.04Å; F245-C248 CarbonylContact O-C 3.59Å; F245-C248 PolarHBondContact O-N 2.92Å; F245-C248 VanDerWaalsContact O-N 3.09Å; C248-L250 PolarHBondContact O-N 2.91Å; C248-L250 VanDerWaalsContact O-N 3.08Å; C248-W251 HydrophobicContact CB-CB 4.31Å; C248-W251 PolarHBondContact O-N 2.82Å; C248-G252 PolarHBondContact O-N 2.93Å
249L61.5Low76.2Confident123 Ų12396.9 Ų96.964%0.64450%0.501SS*.Hα-helixtrans-57.1-33.9-173.6-75173.2000111F245 L253F245-L249 WeakPolarHBondContact O-CA 3.37Å; F245-L249 WeakPolarHBondContact O-CD2 3.38Å; F245-L249 WeakPolarHBondContact O-CG 3.43Å; F245-L249 PolarHBondContact O-N 2.78Å; L249-L253 VanDerWaalsContact O-CB 3.3Å; L249-L253 WeakPolarHBondContact O-CB 3.17Å; L249-L253 PolarHBondContact O-N 3.27Å
250L61.4Low76.1Confident135 Ų13595.5 Ų95.571%0.70750%0.495SS*.Hα-helixtrans-71.8-33.3178.2-158.365.8000113.3C248 T254C248-L250 PolarHBondContact O-N 2.91Å; C248-L250 VanDerWaalsContact O-N 3.08Å; L250-T254 VanDerWaalsContact O-CG2 3.26Å; L250-T254 WeakPolarHBondContact O-CG2 3.45Å; L250-T254 PolarHBondContact O-N 2.98Å; L250-T254 PolarHBondContact O-OG1 3.32Å
251W66.4Low76.3Confident187 Ų18796.1 Ų96.171%0.70850%0.499SS*.Hα-helixtrans-88.8-31.1-179.8-74.780.7000112.7C248 T254 M255C248-W251 HydrophobicContact CB-CB 4.31Å; C248-W251 PolarHBondContact O-N 2.82Å; W251-T254 WeakPolarHBondContact CA-OG1 3.07Å; W251-T254 PolarHBondContact O-OG1 3.15Å; W251-M255 WeakPolarHBondContact O-CB 3.28Å; W251-M255 VanDerWaalsContact O-CG 3.25Å; W251-M255 WeakPolarHBondContact O-CG 3.48Å; W251-M255 PolarHBondContact O-N 3.16Å
252G74.4Confident76.7Confident13 Ų1396.2 Ų96.213%0.13450%0.504CS..Hα-helixtrans-65.7-42173.200000111.7C248 M255 A256C248-G252 PolarHBondContact O-N 2.93Å; G252-M255 PolarHBondContact O-N 2.63Å; G252-A256 WeakPolarHBondContact O-CB 3.33Å; G252-A256 PolarHBondContact O-N 3.1Å
253L76.8Confident77.1Confident106 Ų10698 Ų9856%0.55551%0.507SS*.Hα-helixtrans-65.4-41.7177.4-149.382.9000111.3L249 A256 F257L249-L253 VanDerWaalsContact O-CB 3.3Å; L249-L253 WeakPolarHBondContact O-CB 3.17Å; L249-L253 PolarHBondContact O-N 3.27Å; L253-A256 PolarHBondContact O-N 2.88Å; L253-F257 HydrophobicContact CD1-CE2 4.35Å; L253-F257 HydrophobicContact CD2-CD2 4.25Å; L253-F257 HydrophobicContact CD2-CE2 3.55Å; L253-F257 HydrophobicContact CG-CD2 3.88Å; L253-F257 HydrophobicContact CG-CE2 3.47Å; L253-F257 VanDerWaalsContact CG-CE2 3.47Å; L253-F257 HydrophobicContact CG-CZ 4.45Å; L253-F257 WeakPolarHBondContact O-CB 3.41Å; L253-F257 WeakPolarHBondContact O-CD2 3.07Å; L253-F257 PolarHBondContact O-N 3.48Å
254T78.4Confident77.5Confident66 Ų66100.8 Ų100.841%0.40552%0.515SS..Hα-helixtrans-66.7-38.8176.854.30000112.4L250 W251 F257 T258L250-T254 VanDerWaalsContact O-CG2 3.26Å; L250-T254 WeakPolarHBondContact O-CG2 3.45Å; L250-T254 PolarHBondContact O-N 2.98Å; L250-T254 PolarHBondContact O-OG1 3.32Å; W251-T254 WeakPolarHBondContact CA-OG1 3.07Å; W251-T254 PolarHBondContact O-OG1 3.15Å; T254-F257 PolarHBondContact O-N 3.26Å; T254-T258 WeakPolarHBondContact O-CB 3.39Å; T254-T258 VanDerWaalsContact O-CG2 3.22Å; T254-T258 WeakPolarHBondContact O-CG2 3.45Å; T254-T258 PolarHBondContact O-N 3.34Å; T254-T258 PolarHBondContact O-OG1 2.92Å
255M81.4Confident78Confident116 Ų116101.2 Ų101.257%0.57151%0.514SS*.Hα-helixtrans-68.4-36.5174.8-66.8-56.7-67.500112.4W251 G252 T258 T259W251-M255 WeakPolarHBondContact O-CB 3.28Å; W251-M255 VanDerWaalsContact O-CG 3.25Å; W251-M255 WeakPolarHBondContact O-CG 3.48Å; W251-M255 PolarHBondContact O-N 3.16Å; G252-M255 PolarHBondContact O-N 2.63Å; M255-T258 VanDerWaalsContact CA-OG1 3.3Å; M255-T258 WeakPolarHBondContact CA-OG1 3.23Å; M255-T258 PolarHBondContact O-OG1 2.85Å; M255-T259 WeakPolarHBondContact O-CB 3.41Å; M255-T259 VanDerWaalsContact O-CG2 3.25Å; M255-T259 WeakPolarHBondContact O-CG2 3.01Å; M255-T259 PolarHBondContact O-N 2.79Å; M255-T259 PolarHBondContact O-OG1 2.92Å
256A82.9Confident78.8Confident56 Ų56104.9 Ų104.946%0.46353%0.526SS..Hα-helixtrans-67.5-42.1173.800000112.1G252 L253 T259 F260G252-A256 WeakPolarHBondContact O-CB 3.33Å; G252-A256 PolarHBondContact O-N 3.1Å; L253-A256 PolarHBondContact O-N 2.88Å; A256-T259 WeakPolarHBondContact CA-OG1 3.03Å; A256-T259 PolarHBondContact O-OG1 3.2Å; A256-F260 VanDerWaalsContact O-CB 3.29Å; A256-F260 WeakPolarHBondContact O-CB 3.34Å; A256-F260 PolarHBondContact O-N 2.94Å
257F84.8Confident79.4Confident124 Ų124105.5 Ų105.554%0.54452%0.523SS..Hα-helixtrans-67.2-42.7176.1-78.9-59.9000112.4L253 T254 F260 I261L253-F257 HydrophobicContact CD1-CE2 4.35Å; L253-F257 HydrophobicContact CD2-CD2 4.25Å; L253-F257 HydrophobicContact CD2-CE2 3.55Å; L253-F257 HydrophobicContact CG-CD2 3.88Å; L253-F257 HydrophobicContact CG-CE2 3.47Å; L253-F257 VanDerWaalsContact CG-CE2 3.47Å; L253-F257 HydrophobicContact CG-CZ 4.45Å; L253-F257 WeakPolarHBondContact O-CB 3.41Å; L253-F257 WeakPolarHBondContact O-CD2 3.07Å; L253-F257 PolarHBondContact O-N 3.48Å; T254-F257 PolarHBondContact O-N 3.26Å; F257-F260 PolarHBondContact O-N 2.81Å; F257-I261 WeakPolarHBondContact O-CB 3.31Å; F257-I261 VanDerWaalsContact O-CG1 3.25Å; F257-I261 WeakPolarHBondContact O-CG1 3.3Å; F257-I261 PolarHBondContact O-N 2.99Å
258T85.3Confident79.9Confident69 Ų69101.9 Ų101.942%0.42351%0.514SS..Hα-helixtrans-64.6-41.2177.949.60000111.9T254 M255 I261 L262T254-T258 WeakPolarHBondContact O-CB 3.39Å; T254-T258 VanDerWaalsContact O-CG2 3.22Å; T254-T258 WeakPolarHBondContact O-CG2 3.45Å; T254-T258 PolarHBondContact O-N 3.34Å; T254-T258 PolarHBondContact O-OG1 2.92Å; M255-T258 VanDerWaalsContact CA-OG1 3.3Å; M255-T258 WeakPolarHBondContact CA-OG1 3.23Å; M255-T258 PolarHBondContact O-OG1 2.85Å; T258-I261 PolarHBondContact O-N 3.3Å; T258-L262 WeakPolarHBondContact O-CB 3.19Å; T258-L262 WeakPolarHBondContact O-CG 3.42Å; T258-L262 PolarHBondContact O-N 3.34Å
259T87.8Confident80.4Confident69 Ų69103.4 Ų103.442%0.42352%0.521SS..Hα-helixtrans-66.6-40.6174.551.20000112.1M255 A256 L262 I263M255-T259 WeakPolarHBondContact O-CB 3.41Å; M255-T259 VanDerWaalsContact O-CG2 3.25Å; M255-T259 WeakPolarHBondContact O-CG2 3.01Å; M255-T259 PolarHBondContact O-N 2.79Å; M255-T259 PolarHBondContact O-OG1 2.92Å; A256-T259 WeakPolarHBondContact CA-OG1 3.03Å; A256-T259 PolarHBondContact O-OG1 3.2Å; T259-L262 PolarHBondContact O-N 3.14Å; T259-I263 VanDerWaalsContact O-CG1 3.27Å; T259-I263 WeakPolarHBondContact O-CG1 3.24Å; T259-I263 PolarHBondContact O-N 2.76Å
260F88.7Confident80.6Confident117 Ų117100.4 Ų100.451%0.51351%0.511SS..Hα-helixtrans-61.9-45.3174.2-177.7-100.5000112.2A256 F257 L262 I263 M264A256-F260 VanDerWaalsContact O-CB 3.29Å; A256-F260 WeakPolarHBondContact O-CB 3.34Å; A256-F260 PolarHBondContact O-N 2.94Å; F257-F260 PolarHBondContact O-N 2.81Å; F260-L262 PolarHBondContact O-N 2.64Å; F260-I263 PolarHBondContact O-N 3.29Å; F260-M264 HydrophobicContact CD1-CG 4.21Å; F260-M264 HydrophobicContact CE1-CG 3.85Å; F260-M264 HydrophobicContact CE2-CG 4.34Å; F260-M264 HydrophobicContact CZ-CG 3.92Å; F260-M264 HydrophobicContact CZ-SD 4.19Å; F260-M264 VanDerWaalsContact O-CG 3.3Å; F260-M264 WeakPolarHBondContact O-CG 3.47Å; F260-M264 PolarHBondContact O-N 3.2Å
261I88.6Confident80.7Confident92 Ų92101.1 Ų101.147%0.47251%0.51SS..Hα-helixtrans-63.3-41.8176.7-68.8-64.7000111.2F257 T258 I263 M264 I265F257-I261 WeakPolarHBondContact O-CB 3.31Å; F257-I261 VanDerWaalsContact O-CG1 3.25Å; F257-I261 WeakPolarHBondContact O-CG1 3.3Å; F257-I261 PolarHBondContact O-N 2.99Å; T258-I261 PolarHBondContact O-N 3.3Å; I261-I263 PolarHBondContact O-N 2.84Å; I261-M264 PolarHBondContact O-N 3.32Å; I261-I265 HydrophobicContact CG2-CD1 3.65Å; I261-I265 HydrophobicContact CG2-CG1 4.34Å; I261-I265 WeakPolarHBondContact O-CB 3.44Å; I261-I265 WeakPolarHBondContact O-CD1 3.12Å; I261-I265 WeakPolarHBondContact O-CG1 3.44Å; I261-I265 PolarHBondContact O-N 3.48Å
262L90Very high80.2Confident115 Ų11596.2 Ų96.260%0.60250%0.504SS*.Hα-helixtrans-62.7-40.8175.4-79.4166.3000112.6T258 T259 F260 I265 Y266T258-L262 WeakPolarHBondContact O-CB 3.19Å; T258-L262 WeakPolarHBondContact O-CG 3.42Å; T258-L262 PolarHBondContact O-N 3.34Å; T259-L262 PolarHBondContact O-N 3.14Å; F260-L262 PolarHBondContact O-N 2.64Å; L262-I265 PolarHBondContact O-N 3.03Å; L262-Y266 WeakPolarHBondContact O-CB 3.44Å; L262-Y266 PolarHBondContact O-N 3.01Å
263I89.2Confident79.5Confident98 Ų9897.2 Ų97.250%0.50351%0.514SS..Hα-helixtrans-65.3-42.9175.6-68.9164.6000110.4T259 F260 I261 Y266 L267T259-I263 VanDerWaalsContact O-CG1 3.27Å; T259-I263 WeakPolarHBondContact O-CG1 3.24Å; T259-I263 PolarHBondContact O-N 2.76Å; F260-I263 PolarHBondContact O-N 3.29Å; I261-I263 PolarHBondContact O-N 2.84Å; I263-Y266 PolarHBondContact O-N 3.09Å; I263-L267 HydrophobicContact CG2-CD1 3.98Å; I263-L267 HydrophobicContact CG2-CG 4.34Å; I263-L267 WeakPolarHBondContact O-CB 3.1Å; I263-L267 VanDerWaalsContact O-CG 3.27Å; I263-L267 WeakPolarHBondContact O-CG 3.21Å; I263-L267 PolarHBondContact O-N 3.32Å
264M84Confident78.3Confident97 Ų9798.3 Ų98.348%0.47853%0.528SS..Hα-helixtrans-65.6-39.4177.6-69.4-62.6-82.900112.2F260 I261 L267 F268F260-M264 HydrophobicContact CD1-CG 4.21Å; F260-M264 HydrophobicContact CE1-CG 3.85Å; F260-M264 HydrophobicContact CE2-CG 4.34Å; F260-M264 HydrophobicContact CZ-CG 3.92Å; F260-M264 HydrophobicContact CZ-SD 4.19Å; F260-M264 VanDerWaalsContact O-CG 3.3Å; F260-M264 WeakPolarHBondContact O-CG 3.47Å; F260-M264 PolarHBondContact O-N 3.2Å; I261-M264 PolarHBondContact O-N 3.32Å; M264-L267 PolarHBondContact O-N 2.79Å; M264-L267 HydrophobicContact SD-CD1 4.37Å; M264-F268 VanDerWaalsContact O-CB 3.31Å; M264-F268 WeakPolarHBondContact O-CB 3.46Å; M264-F268 PolarHBondContact O-N 3.23Å
265I87.4Confident77.1Confident93 Ų93103.1 Ų103.148%0.47755%0.548SS..Hα-helixtrans-63.1-45172.6-69164.4000110.2I261 L262 L267 F268 V269I261-I265 HydrophobicContact CG2-CD1 3.65Å; I261-I265 HydrophobicContact CG2-CG1 4.34Å; I261-I265 WeakPolarHBondContact O-CB 3.44Å; I261-I265 WeakPolarHBondContact O-CD1 3.12Å; I261-I265 WeakPolarHBondContact O-CG1 3.44Å; I261-I265 PolarHBondContact O-N 3.48Å; L262-I265 PolarHBondContact O-N 3.03Å; I265-L267 VanDerWaalsContact C-N 3.34Å; I265-L267 PolarHBondContact O-N 2.88Å; I265-F268 PolarHBondContact O-N 2.89Å; I265-V269 HydrophobicContact CG2-CG2 4.23Å; I265-V269 WeakPolarHBondContact O-CB 3.14Å; I265-V269 VanDerWaalsContact O-CG2 3.24Å; I265-V269 WeakPolarHBondContact O-CG2 3.47Å; I265-V269 PolarHBondContact O-N 3.33Å
266Y84.5Confident75.8Confident167 Ų167100.2 Ų100.266%0.65555%0.548SS*.Hα-helixtrans-61.8-41.5177.1180-96.9000112L262 I263 S270L262-Y266 WeakPolarHBondContact O-CB 3.44Å; L262-Y266 PolarHBondContact O-N 3.01Å; I263-Y266 PolarHBondContact O-N 3.09Å; Y266-S270 WeakPolarHBondContact O-CB 3.48Å; Y266-S270 PolarHBondContact O-N 3.2Å; Y266-S270 PolarHBondContact O-OG 3.15Å
267L81.1Confident74.3Confident86 Ų86106.5 Ų106.545%0.4557%0.565SS.*Hα-helixtrans-66-39.4175.5-71.3174.5000112.1I263 M264 I265 S270 Q271I263-L267 HydrophobicContact CG2-CD1 3.98Å; I263-L267 HydrophobicContact CG2-CG 4.34Å; I263-L267 WeakPolarHBondContact O-CB 3.1Å; I263-L267 VanDerWaalsContact O-CG 3.27Å; I263-L267 WeakPolarHBondContact O-CG 3.21Å; I263-L267 PolarHBondContact O-N 3.32Å; M264-L267 PolarHBondContact O-N 2.79Å; M264-L267 HydrophobicContact SD-CD1 4.37Å; I265-L267 VanDerWaalsContact C-N 3.34Å; I265-L267 PolarHBondContact O-N 2.88Å; L267-S270 VanDerWaalsContact CA-OG 3.29Å; L267-S270 WeakPolarHBondContact CA-OG 3.4Å; L267-S270 PolarHBondContact O-N 3.36Å; L267-S270 PolarHBondContact O-OG 3.12Å; L267-Q271 WeakPolarHBondContact O-CB 3.1Å; L267-Q271 PolarHBondContact O-N 3.28Å
268F77.4Confident72.6Confident152 Ų152112.7 Ų112.767%0.66759%0.585SS**Hα-helixtrans-68.6-41.1177.1-171.9-99.8000112.3M264 I265 S272M264-F268 VanDerWaalsContact O-CB 3.31Å; M264-F268 WeakPolarHBondContact O-CB 3.46Å; M264-F268 PolarHBondContact O-N 3.23Å; I265-F268 PolarHBondContact O-N 2.89Å; F268-S272 WeakPolarHBondContact O-CB 3.17Å; F268-S272 PolarHBondContact O-N 3.05Å; F268-S272 VanDerWaalsContact O-N 3.09Å; F268-S272 PolarHBondContact O-OG 2.93Å
269V76.1Confident71.1Confident91 Ų91120.1 Ų120.155%0.55261%0.605SS**Hα-helixtrans-70.6-34.5175.6174.20000111.4I265 S272I265-V269 HydrophobicContact CG2-CG2 4.23Å; I265-V269 WeakPolarHBondContact O-CB 3.14Å; I265-V269 VanDerWaalsContact O-CG2 3.24Å; I265-V269 WeakPolarHBondContact O-CG2 3.47Å; I265-V269 PolarHBondContact O-N 3.33Å; V269-S272 VanDerWaalsContact CA-OG 3.31Å; V269-S272 WeakPolarHBondContact CA-OG 3.44Å; V269-S272 PolarHBondContact O-OG 2.92Å; V269-S272 VanDerWaalsContact O-OG 3.08Å
270S66.9Low69.5Low60 Ų60126.8 Ų126.842%0.4263%0.628SS.*Hα-helixtrans-78.8-31.5177.155.90000113.4Y266 L267 S272 G273Y266-S270 WeakPolarHBondContact O-CB 3.48Å; Y266-S270 PolarHBondContact O-N 3.2Å; Y266-S270 PolarHBondContact O-OG 3.15Å; L267-S270 VanDerWaalsContact CA-OG 3.29Å; L267-S270 WeakPolarHBondContact CA-OG 3.4Å; L267-S270 PolarHBondContact O-N 3.36Å; L267-S270 PolarHBondContact O-OG 3.12Å; S270-S272 VanDerWaalsContact C-N 3.34Å; S270-G273 PolarHBondContact O-N 3.26Å
271Q61.8Low67.7Low150 Ų150125.7 Ų125.770%0.70164%0.641SS**Hα-helixtrans-71.8-25.8169.7-88.7-166.4-1.100113.3L267 G273L267-Q271 WeakPolarHBondContact O-CB 3.1Å; L267-Q271 PolarHBondContact O-N 3.28Å; Q271-G273 PolarHBondContact O-N 3.41Å
272S56.3Low65.9Low84 Ų84129.6 Ų129.659%0.58765%0.654SS**THydrogen-bonded Turntrans-81.96.6173.547.40000113.7F268 V269 S270F268-S272 WeakPolarHBondContact O-CB 3.17Å; F268-S272 PolarHBondContact O-N 3.05Å; F268-S272 VanDerWaalsContact O-N 3.09Å; F268-S272 PolarHBondContact O-OG 2.93Å; V269-S272 VanDerWaalsContact CA-OG 3.31Å; V269-S272 WeakPolarHBondContact CA-OG 3.44Å; V269-S272 PolarHBondContact O-OG 2.92Å; V269-S272 VanDerWaalsContact O-OG 3.08Å; S270-S272 VanDerWaalsContact C-N 3.34Å
273G59.9Low64.2Low33 Ų33130.1 Ų130.134%0.3466%0.662SS.*SBendtrans-60.6148.6160.900000111S270 Q271 M275S270-G273 PolarHBondContact O-N 3.26Å; Q271-G273 PolarHBondContact O-N 3.41Å; G273-M275 PolarHBondContact O-N 2.9Å
274P52.1Low62.7Low130 Ų130132.6 Ų132.684%0.84467%0.672SS**  trans-62104.4-166.624.8-32.7000110.9G276P274-G276 PolarHBondContact O-N 3Å
275M52.6Low61.2Low167 Ų167135 Ų13582%0.82369%0.687SS**  trans-65.731.2164.3-88.3156.454.400112.4G273G273-M275 PolarHBondContact O-N 2.9Å
276G53.9Low59.6Low55 Ų55138.6 Ų138.657%0.56771%0.705SS**THydrogen-bonded Turntrans-85.2112.817000000108.9P274P274-G276 PolarHBondContact O-N 3Å
277K52Low58.2Low188 Ų188136.2 Ų136.282%0.81771%0.708SS**THydrogen-bonded Turntrans105.244.3168.6-52.2160.8-175.81790115.9R279K277-R279 PolarHBondContact O-N 3.48Å
278W49.9Very low57.1Low254 Ų254137.4 Ų137.496%0.96272%0.723SS**  trans-80102.1143.7-88.673.9000108
279R52.5Low55.9Low225 Ų225137.7 Ų137.785%0.84972%0.724SS**  trans-61.3138.9-171.3-63.8177.3-166-1322.8110.1K277 A281K277-R279 PolarHBondContact O-N 3.48Å; R279-A281 PolarHBondContact O-N 3.33Å
280K55Low54.7Low209 Ų209141 Ų14191%0.90974%0.739SS**  trans-28.8118164.8-73.4-179.8171.8-178.40111.8K282K280-K282 PolarHBondContact O-N 3.2Å
281A50.8Low53.6Low94 Ų94149.4 Ų149.478%0.77777%0.771SS**  trans-58.4127.816100000108.2R279 T283R279-A281 PolarHBondContact O-N 3.33Å; A281-T283 PolarHBondContact O-N 3.25Å
282K51.5Low53.2Low174 Ų174149.4 Ų149.476%0.75778%0.775SS**  trans-66.4109.7177.4-167.7176.4-179-177.60107.4K280 E284K280-K282 PolarHBondContact O-N 3.2Å; K282-E284 HydrophobicContact CG-CG 4.23Å; K282-E284 PolarHBondContact O-N 3.28Å; K282-E284 VanDerWaalsContact O-N 3.17Å
283T53.4Low53Low126 Ų126152.8 Ų152.877%0.77379%0.785SS**  trans-71.5101.8165.443.10000106.8A281A281-T283 PolarHBondContact O-N 3.25Å
284E56.9Low52.6Low150 Ų150159.4 Ų159.470%0.70181%0.809SS**  trans-81.8115.1171.3-46.1-167.6-165.200106.9K282 I286K282-E284 HydrophobicContact CG-CG 4.23Å; K282-E284 PolarHBondContact O-N 3.28Å; K282-E284 VanDerWaalsContact O-N 3.17Å; E284-I286 PolarHBondContact O-N 3.21Å; E284-I286 VanDerWaalsContact O-N 3.16Å
285D54.2Low52.7Low148 Ų148161.2 Ų161.279%0.79181%0.807SS**  trans-56.8110.2178.7-68-48.7000110.9T287D285-T287 VanDerWaalsContact C-N 3.29Å; D285-T287 PolarHBondContact O-N 3.22Å; D285-T287 VanDerWaalsContact O-N 3.08Å
286I52.9Low52.7Low167 Ų167160.8 Ų160.886%0.85681%0.806SS**  trans-81.388.2163.8-47.2175000106.3E284 S288E284-I286 PolarHBondContact O-N 3.21Å; E284-I286 VanDerWaalsContact O-N 3.16Å; I286-S288 PolarHBondContact O-N 3.29Å; I286-S288 VanDerWaalsContact O-N 3.14Å
287T55.8Low52.6Low117 Ų117167.9 Ų167.972%0.71882%0.822SS**  trans-63107.5167.7-69.40000108.5D285 K289D285-T287 VanDerWaalsContact C-N 3.29Å; D285-T287 PolarHBondContact O-N 3.22Å; D285-T287 VanDerWaalsContact O-N 3.08Å; T287-K289 HydrophobicContact CG2-CB 4.46Å; T287-K289 PolarHBondContact O-N 3.06Å
288S56.6Low52.6Low111 Ų111166.4 Ų166.478%0.77682%0.823SS**  trans-72113.2162.658.90000108.7I286I286-S288 PolarHBondContact O-N 3.29Å; I286-S288 VanDerWaalsContact O-N 3.14Å
289K52.8Low52.8Low158 Ų158159.7 Ų159.769%0.68781%0.812SS**  trans-138.293.6161.6-171.9168.2175.21590108.9T287 E291T287-K289 HydrophobicContact CG2-CB 4.46Å; T287-K289 PolarHBondContact O-N 3.06Å; K289-E291 IonicContact NZ-OE2 3.89Å
290N50.4Low52.9Low160 Ų160154.3 Ų154.386%0.85681%0.809SS**  trans-118.296.1167.5-52.812.3000105
291E43.9Very low52.7Low237 Ų237149.3 Ų149.3100%1.10780%0.8SS**  trans-108.30156.1-85.5178.1146.800107.1K289K289-E291 IonicContact NZ-OE2 3.89Å

Retrieved 291 of 291 residues in 723.7 ms (Link to these results)