A0A096LVC1_POEFO Loading...

Uncharacterized LOC103140884

AlphaFold DB , UniProt , Accession A0A096LVC1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 282 aa.

Structure Viewer
Loading PAE data...
(Predicted Aligned Error values between residue pairs)
Error loading PAE data: please refresh the page.

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
1M37.1Very low44.7Very low219 Ų219136.6 Ų136.6100%1.07982%0.816SS**  0131.60-68.9-170.376.200107.2
2D38.6Very low44.6Very low139 Ų139145.6 Ų145.674%0.74383%0.825SS**  trans57110.9156.5-39.1-32.5000117.1
3G40.9Very low45.2Very low64 Ų64152.6 Ų152.666%0.6683%0.83SS**  cis8987.625.400000110.6
4F46.6Very low45.3Very low208 Ų208147.9 Ų147.991%0.91282%0.822SS**  trans-156.9104.3151.9-92.5-70.5000110.6
5G41.5Very low45.7Very low80 Ų80150.6 Ų150.683%0.82583%0.826SS**  trans-69.4139.8164.100000110.2
6R47.4Very low46.2Very low239 Ų239148.9 Ų148.990%0.90282%0.822SS**  trans-122.6107.3175.7-149.6163.8173.3-113.20.9109.1
7A50.4Low46.3Very low93 Ų93148.6 Ų148.677%0.76983%0.825SS**  trans-62.7127.4171.300000109.8
8V47Very low46.2Very low141 Ų141149.3 Ų149.386%0.85583%0.825SS**  trans-99.895.2167.4179.70000107.5
9V47.2Very low46.3Very low117 Ų117149.1 Ų149.171%0.70982%0.823SS**  trans-57.1135163.4171.60000108.3V11V9-V11 PolarHBondContact O-N 3.46Å
10G50.5Low46.1Very low69 Ų69150.9 Ų150.971%0.71183%0.825SS**  trans-54.5125178.800000112
11V44.3Very low45.9Very low134 Ų134149.1 Ų149.181%0.81282%0.824SS**  trans-121.1129.8168175.30000107.3V9V9-V11 PolarHBondContact O-N 3.46Å
12W43.4Very low46.3Very low244 Ų244146.6 Ų146.692%0.92481%0.814SS**  trans-57.2139-176.8-70.671.8000111A14W12-A14 PolarHBondContact O-N 3.46Å; W12-A14 VanDerWaalsContact O-N 3.1Å
13R53.3Low46Very low237 Ų237143.4 Ų143.489%0.89481%0.814SS**  trans-57.1111.4-179.1-162-174.7-68.2-128.92.7109.4
14A45.4Very low46Very low87 Ų87144.6 Ų144.672%0.71982%0.818SS**  trans-69134169.700000109.3W12 T16W12-A14 PolarHBondContact O-N 3.46Å; W12-A14 VanDerWaalsContact O-N 3.1Å; A14-T16 PolarHBondContact O-N 3.1Å
15H51.3Low45.7Very low188 Ų188143.5 Ų143.587%0.8782%0.816SS**  trans-77.8115.4172.8-73-91.2000108.8
16T53.8Low45.4Very low124 Ų124144.9 Ų144.976%0.76181%0.813SS**PPolyproline II helixtrans-82.4122.3162.649.80000108.3A14 L18A14-T16 PolarHBondContact O-N 3.1Å; T16-L18 PolarHBondContact O-N 3.12Å
17V48.3Very low45.2Very low144 Ų144139.1 Ų139.187%0.87381%0.809SS**PPolyproline II helixtrans-62.4123.8168.5176.10000107.4
18L45.2Very low44.9Very low160 Ų160139.7 Ų139.784%0.83881%0.805SS**PPolyproline II helixtrans-83.8129.4177.9-87.7168.7000110T16T16-L18 PolarHBondContact O-N 3.12Å
19D47.2Very low44.8Very low145 Ų145142 Ų14278%0.77581%0.807SS**PPolyproline II helixtrans-54.8139.7172.5-169.327.3000111.9
20E43.2Very low44.8Very low185 Ų185142.9 Ų142.986%0.86481%0.812SS**  trans-86.8104.5-178.347.6-158.4108.800109.1
21S41.4Very low44.7Very low115 Ų115143.1 Ų143.180%0.80480%0.803SS**  trans-141.6124.5163.7-166.40000112
22D44.8Very low45Very low165 Ų165142.5 Ų142.588%0.88280%0.795SS**  trans-66.2147.6178.8-153-7.3000112
23G32.6Very low45.5Very low72 Ų72140.3 Ų140.374%0.74279%0.787SS**  trans165.397.5-179.700000113.6
24A40.8Very low45.5Very low90 Ų90137.8 Ų137.874%0.74478%0.783SS**  trans-64.4163.2-178.100000115
25E40.9Very low46.2Very low185 Ų185144 Ų14486%0.86479%0.787SS**  trans76.287.3162.3-61.3-69.315600117.7
26S34.4Very low46.4Very low109 Ų109144.6 Ų144.676%0.76279%0.787SS**  trans179.995.6130.81750000109.2P28S26-P28 WeakPolarHBondContact O-CD 3.34Å
27S43.9Very low46.6Very low117 Ų117146.1 Ų146.182%0.81879%0.788SS**  trans-76.8120.5169.3179.60000110.1
28P43.4Very low46.9Very low106 Ų106145.1 Ų145.169%0.68878%0.784SS**  trans-94.6112.3162.331.1-19.9000109.4S26 V30S26-P28 WeakPolarHBondContact O-CD 3.34Å; P28-V30 PolarHBondContact O-N 3.29Å; P28-V30 VanDerWaalsContact O-N 3.12Å
29E45.9Very low47.3Very low189 Ų189141.9 Ų141.988%0.88378%0.775SS**  trans-38.3105.8168.5-169.7152.8166.300113.3S31E29-S31 PolarHBondContact O-N 2.99Å
30V46.9Very low47.8Very low135 Ų135138.6 Ų138.682%0.81876%0.763SS**  trans-75.3107.6172.6178.70000108.2P28 D32P28-V30 PolarHBondContact O-N 3.29Å; P28-V30 VanDerWaalsContact O-N 3.12Å; V30-D32 PolarHBondContact O-N 2.94Å
31S47.5Very low48.7Very low75 Ų75136.1 Ų136.152%0.52476%0.761SS.*  trans-58.498.3172.3-145.30000110.2E29 R33E29-S31 PolarHBondContact O-N 2.99Å; S31-R33 PolarHBondContact O-N 2.92Å; S31-R33 PolarHBondContact OG-NH1 3.21Å
32D51.3Low50.1Low121 Ų121133.7 Ų133.765%0.64774%0.744SS**  trans-71.178.8168.5-176.715.6000109.8V30 F34V30-D32 PolarHBondContact O-N 2.94Å; D32-F34 VanDerWaalsContact C-N 3.28Å; D32-F34 PolarHBondContact OD1-N 3.2Å
33R54.8Low51.6Low198 Ų198131.4 Ų131.475%0.74773%0.731SS**  trans-93.923173.1-59.4-157.1-65.1-96.27.4112.8S31S31-R33 PolarHBondContact O-N 2.92Å; S31-R33 PolarHBondContact OG-NH1 3.21Å
34F52.7Low53.8Low184 Ų184129.9 Ų129.981%0.80772%0.716SS**  trans-113.153164.9-68.7-82.1000109.9D32 K36D32-F34 VanDerWaalsContact C-N 3.28Å; D32-F34 PolarHBondContact OD1-N 3.2Å; F34-K36 PolarHBondContact O-N 2.87Å
35R60Low55.5Low218 Ų218128.3 Ų128.382%0.82370%0.699SS**  trans-57.2100.4153.7-69.4-155.2-173.8-147.54.2107.3M37R35-M37 PolarHBondContact O-N 3.48Å
36K56.5Low57.3Low199 Ų199123.8 Ų123.887%0.86568%0.681SS**  trans-45.3106.7167.3-72.1162.9179.7170.20107F34F34-K36 PolarHBondContact O-N 2.87Å
37M57.2Low59.5Low156 Ų156125.6 Ų125.677%0.76867%0.671SS**  trans-54.4130.9168-72.7-68.5164.600106.7R35 S39R35-M37 PolarHBondContact O-N 3.48Å; M37-S39 VanDerWaalsContact C-N 3.32Å; M37-S39 PolarHBondContact O-N 3.23Å
38P53.6Low61.4Low123 Ų123124.7 Ų124.780%0.79966%0.655SS**  trans-57.8105.6174.122.1-29.3000106.4S40P38-S40 PolarHBondContact O-N 3.06Å; P38-S40 VanDerWaalsContact O-N 3.16Å
39S53.8Low63Low92 Ų92122.4 Ų122.464%0.64364%0.641SS**  trans-59.2123.5-179.6-63.90000106.3M37 T41M37-S39 VanDerWaalsContact C-N 3.32Å; M37-S39 PolarHBondContact O-N 3.23Å; S39-T41 WeakPolarHBondContact O-CG2 3.07Å; S39-T41 PolarHBondContact O-N 2.95Å
40S59.3Low64.3Low76 Ų76118.3 Ų118.353%0.53163%0.625SS.*  trans-69.472.2165.540.60000107.6P38 S42P38-S40 PolarHBondContact O-N 3.06Å; P38-S40 VanDerWaalsContact O-N 3.16Å; S40-S42 PolarHBondContact O-N 3.23Å
41T60.4Low65.7Low133 Ų133120.7 Ų120.782%0.81662%0.619SS**  trans-73.4-6.6-16855.60000113.6S39S39-T41 WeakPolarHBondContact O-CG2 3.07Å; S39-T41 PolarHBondContact O-N 2.95Å
42S71.8Confident66.9Low64 Ų64125 Ų12545%0.44863%0.628SS.*SBendtrans-99.9128.2174.585.90000110.7S40 G44 S45 L46S40-S42 PolarHBondContact O-N 3.23Å; S42-G44 PolarHBondContact O-N 3.12Å; S42-S45 WeakPolarHBondContact O-CB 3.19Å; S42-S45 PolarHBondContact O-N 2.88Å; S42-S45 PolarHBondContact OG-N 3Å; S42-S45 VanDerWaalsContact OG-N 3.13Å; S42-L46 PolarHBondContact O-N 2.87Å
43L76.1Confident68.2Low117 Ų117127.7 Ų127.761%0.61363%0.63SS**Hα-helixtrans-55.3-22.6172.3-157.9137.6000111.6R47L43-R47 HydrophobicContact CD2-CG 4.36Å; L43-R47 VanDerWaalsContact CD2-NE 3.32Å; L43-R47 WeakPolarHBondContact O-CB 3.5Å; L43-R47 VanDerWaalsContact O-CG 3.27Å; L43-R47 WeakPolarHBondContact O-CG 3.49Å; L43-R47 PolarHBondContact O-N 3.14Å
44G77.9Confident68.9Low41 Ų41125.4 Ų125.442%0.42363%0.631SS.*Hα-helixtrans-65.5-47.4169.300000113.8S42 L46 R47 M48S42-G44 PolarHBondContact O-N 3.12Å; G44-L46 PolarHBondContact O-N 3.49Å; G44-R47 PolarHBondContact O-N 3.03Å; G44-M48 WeakPolarHBondContact O-CG 3.43Å; G44-M48 PolarHBondContact O-N 3.44Å
45S78.1Confident70Confident57 Ų57122.1 Ų122.140%0.39963%0.628SS.*Hα-helixtrans-62.7-41.9178.3-175.90000111.7S42 M48 S49S42-S45 WeakPolarHBondContact O-CB 3.19Å; S42-S45 PolarHBondContact O-N 2.88Å; S42-S45 PolarHBondContact OG-N 3Å; S42-S45 VanDerWaalsContact OG-N 3.13Å; S45-M48 PolarHBondContact O-N 2.91Å; S45-S49 PolarHBondContact O-N 3.29Å
46L78.1Confident70.8Confident90 Ų90119.1 Ų119.147%0.47163%0.628SS.*Hα-helixtrans-65.8-40175.5-17365000112.5S42 G44 M48 S49 L50S42-L46 PolarHBondContact O-N 2.87Å; G44-L46 PolarHBondContact O-N 3.49Å; L46-M48 VanDerWaalsContact C-N 3.32Å; L46-M48 PolarHBondContact O-N 2.88Å; L46-S49 PolarHBondContact O-N 3.48Å; L46-S49 PolarHBondContact O-OG 3.24Å; L46-L50 HydrophobicContact CG-CD1 4.27Å; L46-L50 VanDerWaalsContact O-CG 3.32Å; L46-L50 WeakPolarHBondContact O-CG 3.46Å; L46-L50 PolarHBondContact O-N 3.09Å
47R81.1Confident71.5Confident147 Ų147120.7 Ų120.756%0.55563%0.628SS**Hα-helixtrans-63.3-39.6174.3-82.6178.5178.1-177.42.5112L43 G44 R51L43-R47 HydrophobicContact CD2-CG 4.36Å; L43-R47 VanDerWaalsContact CD2-NE 3.32Å; L43-R47 WeakPolarHBondContact O-CB 3.5Å; L43-R47 VanDerWaalsContact O-CG 3.27Å; L43-R47 WeakPolarHBondContact O-CG 3.49Å; L43-R47 PolarHBondContact O-N 3.14Å; G44-R47 PolarHBondContact O-N 3.03Å; R47-R51 WeakPolarHBondContact O-CB 3.2Å; R47-R51 WeakPolarHBondContact O-CD 3.37Å; R47-R51 WeakPolarHBondContact O-CG 3.49Å; R47-R51 PolarHBondContact O-N 3.34Å
48M83.7Confident72Confident98 Ų98118.9 Ų118.948%0.48363%0.631SS.*Hα-helixtrans-67.4-43.1177.5-71.1-55.5-6300111.6G44 S45 L46 R51 K52G44-M48 WeakPolarHBondContact O-CG 3.43Å; G44-M48 PolarHBondContact O-N 3.44Å; S45-M48 PolarHBondContact O-N 2.91Å; L46-M48 VanDerWaalsContact C-N 3.32Å; L46-M48 PolarHBondContact O-N 2.88Å; M48-R51 PolarHBondContact O-N 2.88Å; M48-K52 VanDerWaalsContact O-CG 3.23Å; M48-K52 WeakPolarHBondContact O-CG 3.29Å; M48-K52 PolarHBondContact O-N 2.79Å; M48-K52 VanDerWaalsContact O-N 3.12Å
49S76.9Confident72.6Confident58 Ų58119.6 Ų119.641%0.40663%0.633SS.*Hα-helixtrans-63.9-42.9178.171.10000111.9S45 L46 K52 R53S45-S49 PolarHBondContact O-N 3.29Å; L46-S49 PolarHBondContact O-N 3.48Å; L46-S49 PolarHBondContact O-OG 3.24Å; S49-K52 PolarHBondContact O-N 3.33Å; S49-R53 WeakPolarHBondContact O-CG 3.43Å; S49-R53 PolarHBondContact O-N 3.16Å
50L72.8Confident73Confident102 Ų102122.3 Ų122.353%0.53464%0.635SS.*Hα-helixtrans-65.8-38.7177.5-68.1175.1000112.8L46 K52 R53L46-L50 HydrophobicContact CG-CD1 4.27Å; L46-L50 VanDerWaalsContact O-CG 3.32Å; L46-L50 WeakPolarHBondContact O-CG 3.46Å; L46-L50 PolarHBondContact O-N 3.09Å; L50-K52 PolarHBondContact O-N 3.08Å; L50-R53 PolarHBondContact O-N 3.47Å
51R75.4Confident72.8Confident185 Ų185123.5 Ų123.570%0.69865%0.65SS**Hα-helixtrans-66.4-25.4175-74.9170.8179173.8-3.6113.4R47 M48R47-R51 WeakPolarHBondContact O-CB 3.2Å; R47-R51 WeakPolarHBondContact O-CD 3.37Å; R47-R51 WeakPolarHBondContact O-CG 3.49Å; R47-R51 PolarHBondContact O-N 3.34Å; M48-R51 PolarHBondContact O-N 2.88Å
52K73.4Confident72.8Confident166 Ų166122.4 Ų122.472%0.72264%0.639SS**THydrogen-bonded Turntrans-86.8-7.7178.6-67.8-68.8178.2-178.70113.2M48 S49 L50M48-K52 VanDerWaalsContact O-CG 3.23Å; M48-K52 WeakPolarHBondContact O-CG 3.29Å; M48-K52 PolarHBondContact O-N 2.79Å; M48-K52 VanDerWaalsContact O-N 3.12Å; S49-K52 PolarHBondContact O-N 3.33Å; L50-K52 PolarHBondContact O-N 3.08Å
53R77.9Confident72.3Confident178 Ų178124.7 Ų124.767%0.67266%0.655SS**SBendtrans-82.8120.3173-64.2178.989.9179.25.3108.6S49 L50S49-R53 WeakPolarHBondContact O-CG 3.43Å; S49-R53 PolarHBondContact O-N 3.16Å; L50-R53 PolarHBondContact O-N 3.47Å
54L70.6Confident70.5Confident150 Ų150127 Ų12779%0.78567%0.667SS**PPolyproline II helixtrans-57.1147.7173.3-71.4163000110L56L54-L56 PolarHBondContact O-N 2.96Å; L54-L56 VanDerWaalsContact O-N 3.11Å
55P75.8Confident69Low114 Ų114130.6 Ų130.674%0.7468%0.683SS**PPolyproline II helixtrans-56.2122.6177.121.5-30.3000109.3R57P55-R57 PolarHBondContact O-N 3.38Å
56L75.4Confident67.6Low155 Ų155135.9 Ų135.981%0.81270%0.701SS**PPolyproline II helixtrans-60.8129.7179.4-62.7175.8000108.4L54L54-L56 PolarHBondContact O-N 2.96Å; L54-L56 VanDerWaalsContact O-N 3.11Å
57R73.1Confident66Low232 Ų232137.3 Ų137.388%0.87572%0.716SS**PPolyproline II helixtrans-63.8136.2173.6-69.6-73.6169.2139.4-4.1108.5P55 V59P55-R57 PolarHBondContact O-N 3.38Å; R57-V59 PolarHBondContact O-N 3.11Å; R57-V59 VanDerWaalsContact O-N 3.14Å
58S67.1Low64.1Low118 Ų118135.1 Ų135.183%0.82572%0.723SS**PPolyproline II helixtrans-59.7117.2174.549.70000109Q60S58-Q60 PolarHBondContact O-N 3.44Å
59V65Low61.7Low139 Ų139136.6 Ų136.684%0.84274%0.738SS**  trans-73111.7172.1177.60000107R57 A61R57-V59 PolarHBondContact O-N 3.11Å; R57-V59 VanDerWaalsContact O-N 3.14Å; V59-A61 PolarHBondContact O-N 3.01Å
60Q63Low59.8Low148 Ų148139.7 Ų139.769%0.69275%0.754SS**  trans-65.5114.2172-164.3-175.422.700107.5S58 N62S58-Q60 PolarHBondContact O-N 3.44Å; Q60-N62 VanDerWaalsContact CD-ND2 3.3Å; Q60-N62 VanDerWaalsContact CG-OD1 3.31Å; Q60-N62 WeakPolarHBondContact CG-OD1 3.23Å; Q60-N62 PolarHBondContact O-N 3.44Å; Q60-N62 PolarHBondContact OE1-ND2 3.39Å
61A55.6Low58.2Low102 Ų102142.7 Ų142.784%0.84377%0.766SS**  trans-7475.9174.100000109.3V59 S63V59-A61 PolarHBondContact O-N 3.01Å; A61-S63 PolarHBondContact O-N 3.09Å
62N59.9Low56.5Low110 Ų110142 Ų14259%0.58877%0.774SS**  trans-83.896.8168.3-65.9-28.6000108.2Q60Q60-N62 VanDerWaalsContact CD-ND2 3.3Å; Q60-N62 VanDerWaalsContact CG-OD1 3.31Å; Q60-N62 WeakPolarHBondContact CG-OD1 3.23Å; Q60-N62 PolarHBondContact O-N 3.44Å; Q60-N62 PolarHBondContact OE1-ND2 3.39Å
63S60.5Low54.7Low111 Ų111141.2 Ų141.278%0.77677%0.773SS**  trans167.694.9140.642.50000111A61A61-S63 PolarHBondContact O-N 3.09Å
64L40Very low53.1Low167 Ų167142.9 Ų142.987%0.87479%0.785SS**  trans-150.8136.2137.4-143.979.9000107.8
65P46.5Very low51.5Low115 Ų115144.4 Ų144.475%0.74779%0.788SS**  trans-70.7135.8-168.2-12.728.2000111.9
66E48Very low50.4Low168 Ų168147.9 Ų147.979%0.78580%0.795SS**  trans-41.9129.6157.5-70.9-71.5151.400111.6S68E66-S68 PolarHBondContact O-N 2.86Å
67P43.9Very low49Very low120 Ų120145.7 Ų145.778%0.77979%0.79SS**  trans-80.290.8159.832.3-29000108.6T69P67-T69 PolarHBondContact O-N 2.93Å
68S42.2Very low48.4Very low102 Ų102144 Ų14471%0.71379%0.789SS**  trans-82108.4167.759.80000110.3E66E66-S68 PolarHBondContact O-N 2.86Å
69T33.2Very low47.8Very low129 Ų129142.5 Ų142.579%0.79178%0.777SS**  trans164.8127.6154.223.60000105.2P67P67-T69 PolarHBondContact O-N 2.93Å
70T36.7Very low48Very low122 Ų122139.5 Ų139.575%0.74876%0.761SS**  cis-172.7152.328.26.20000106.2I72T70-I72 PolarHBondContact O-N 2.91Å
71E39.4Very low47.8Very low165 Ų165137.5 Ų137.577%0.77176%0.759SS**  trans-4.3111.8169-68.7-176.2127.900118.3Q73E71-Q73 PolarHBondContact O-N 3.09Å
72I39.3Very low48Very low170 Ų170135.8 Ų135.887%0.87275%0.745SS**  trans-88.589.5156.4-61.1171.4000106.5T70T70-I72 PolarHBondContact O-N 2.91Å
73Q35.9Very low48.2Very low151 Ų151138.5 Ų138.571%0.70675%0.747SS**  trans-55.9141.9158.4-70.3-174.9800109E71 E75E71-Q73 PolarHBondContact O-N 3.09Å; Q73-E75 PolarHBondContact O-N 2.72Å
74K44.9Very low48.2Very low213 Ų213140.1 Ų140.193%0.92674%0.741SS**  trans-54104.7175.5-71.5175.2175174.50110.2
75E36.7Very low49.2Very low182 Ų182138 Ų13885%0.8573%0.729SS**  trans-144.9117156-124.5-175.217300110.5Q73 P77Q73-E75 PolarHBondContact O-N 2.72Å; E75-P77 VanDerWaalsContact O-CD 3.3Å; E75-P77 WeakPolarHBondContact O-CD 3.5Å
76Q53.2Low50.2Low186 Ų186135 Ų13587%0.86971%0.711SS**  trans-55123.6172.8-77.2-83.96.800110.6
77P44.9Very low50.9Low110 Ų110135.5 Ų135.571%0.71471%0.706SS**  trans-101.4119.2165.722.8-5.7000110E75E75-P77 VanDerWaalsContact O-CD 3.3Å; E75-P77 WeakPolarHBondContact O-CD 3.5Å
78K60.2Low52Low195 Ų195133.5 Ų133.585%0.84870%0.695SS**  trans-35.4137164.5-69.1157.2179.1167.70111S80K78-S80 PolarHBondContact O-N 2.79Å
79P55.8Low53.2Low88 Ų88131.1 Ų131.157%0.57168%0.681SS**  trans-65.5101.2-174.626.3-33.7000110.8
80S68.2Low55.1Low75 Ų75133.3 Ų133.352%0.52468%0.675SS.*  trans-64.4149178.369.70000111.3K78 A82 R83K78-S80 PolarHBondContact O-N 2.79Å; S80-A82 PolarHBondContact O-N 3.45Å; S80-R83 PolarHBondContact O-N 2.7Å
81T58.4Low56.8Low106 Ų106132.7 Ų132.765%0.6567%0.667SS**Hα-helixtrans-50.4-28.8-179.4-42.30000112.8R83 K84 L85T81-R83 VanDerWaalsContact C-N 3.35Å; T81-R83 PolarHBondContact O-N 2.95Å; T81-K84 PolarHBondContact O-N 3.37Å; T81-L85 WeakPolarHBondContact O-CG 3.46Å; T81-L85 PolarHBondContact O-N 3.23Å; T81-L85 VanDerWaalsContact O-N 3.08Å
82A59.3Low58.3Low66 Ų66128.2 Ų128.255%0.54565%0.654SS.*Hα-helixtrans-61.1-35.9174.100000113.8S80 L85 S86S80-A82 PolarHBondContact O-N 3.45Å; A82-L85 PolarHBondContact O-N 3.43Å; A82-S86 PolarHBondContact O-N 2.96Å; A82-S86 PolarHBondContact O-OG 2.93Å
83R65.3Low60Low167 Ų167124.6 Ų124.663%0.6364%0.635SS**Hα-helixtrans-73.7-28177-165.8174.8174-168.7-1.6112.4S80 T81 S86 R87S80-R83 PolarHBondContact O-N 2.7Å; T81-R83 VanDerWaalsContact C-N 3.35Å; T81-R83 PolarHBondContact O-N 2.95Å; R83-S86 WeakPolarHBondContact CA-OG 3.35Å; R83-S86 PolarHBondContact O-OG 2.77Å; R83-R87 WeakPolarHBondContact O-CB 3.47Å; R83-R87 PolarHBondContact O-N 2.95Å; R83-R87 VanDerWaalsContact O-N 3.17Å
84K61.2Low61.9Low146 Ų146122.3 Ų122.364%0.63563%0.628SS**Hα-helixtrans-72.2-41.7173.4-64.9-177.8-178.9178.40111T81 R87 S88T81-K84 PolarHBondContact O-N 3.37Å; K84-R87 PolarHBondContact O-N 3.2Å; K84-S88 PolarHBondContact O-N 3.49Å; K84-S88 VanDerWaalsContact O-N 3.12Å
85L60.9Low63.3Low122 Ų122117.4 Ų117.464%0.63961%0.608SS**Hα-helixtrans-64.6-43.2175-67.4172.1000112T81 A82 R87 S88 A89T81-L85 WeakPolarHBondContact O-CG 3.46Å; T81-L85 PolarHBondContact O-N 3.23Å; T81-L85 VanDerWaalsContact O-N 3.08Å; A82-L85 PolarHBondContact O-N 3.43Å; L85-R87 PolarHBondContact O-N 2.99Å; L85-S88 PolarHBondContact O-N 3.26Å; L85-A89 PolarHBondContact O-N 3.42Å
86S66.1Low64.9Low51 Ų51113.4 Ų113.436%0.35759%0.591SS.*Hα-helixtrans-68.2-34.1178.766.40000113.3A82 R83 R90A82-S86 PolarHBondContact O-N 2.96Å; A82-S86 PolarHBondContact O-OG 2.93Å; R83-S86 WeakPolarHBondContact CA-OG 3.35Å; R83-S86 PolarHBondContact O-OG 2.77Å; S86-R90 WeakPolarHBondContact O-CB 3.46Å; S86-R90 VanDerWaalsContact O-CG 3.28Å; S86-R90 WeakPolarHBondContact O-CG 3.07Å; S86-R90 PolarHBondContact O-N 3.31Å; S86-R90 VanDerWaalsContact O-N 3.1Å
87R63.1Low65.7Low179 Ų179107.1 Ų107.168%0.67557%0.567SS**Hα-helixtrans-64.4-42.3170.7-99.9-177.2154.6-151.5-3.8112.4R83 K84 L85 R90 N91R83-R87 WeakPolarHBondContact O-CB 3.47Å; R83-R87 PolarHBondContact O-N 2.95Å; R83-R87 VanDerWaalsContact O-N 3.17Å; K84-R87 PolarHBondContact O-N 3.2Å; L85-R87 PolarHBondContact O-N 2.99Å; R87-R90 PolarHBondContact O-N 2.71Å; R87-N91 VanDerWaalsContact O-CG 3.24Å; R87-N91 PolarHBondContact O-N 2.74Å; R87-N91 PolarHBondContact O-ND2 3.2Å
88S67.8Low67.2Low79 Ų79106.2 Ų106.255%0.55255%0.553SS**Hα-helixtrans-64.5-45.4178.3-177.90000112.1K84 L85 R90 N91 S92K84-S88 PolarHBondContact O-N 3.49Å; K84-S88 VanDerWaalsContact O-N 3.12Å; L85-S88 PolarHBondContact O-N 3.26Å; S88-R90 PolarHBondContact O-N 3.48Å; S88-N91 PolarHBondContact O-N 3.37Å; S88-S92 PolarHBondContact O-N 2.89Å
89A67.4Low67.9Low51 Ų51104.2 Ų104.242%0.42154%0.54SS..Hα-helixtrans-61.4-42.6176.500000112.2L85 N91 S92 I93L85-A89 PolarHBondContact O-N 3.42Å; A89-N91 PolarHBondContact O-N 2.75Å; A89-S92 PolarHBondContact O-N 3.31Å; A89-I93 WeakPolarHBondContact O-CG1 3.38Å; A89-I93 PolarHBondContact O-N 3.44Å
90R72.3Confident68.7Low176 Ų176106.6 Ų106.666%0.66454%0.542SS*.Hα-helixtrans-63.7-39.9175.9-74.7177.5-179.8-177.20.8112.5S86 R87 S88 I93 N94S86-R90 WeakPolarHBondContact O-CB 3.46Å; S86-R90 VanDerWaalsContact O-CG 3.28Å; S86-R90 WeakPolarHBondContact O-CG 3.07Å; S86-R90 PolarHBondContact O-N 3.31Å; S86-R90 VanDerWaalsContact O-N 3.1Å; R87-R90 PolarHBondContact O-N 2.71Å; S88-R90 PolarHBondContact O-N 3.48Å; R90-I93 PolarHBondContact O-N 2.98Å; R90-N94 WeakPolarHBondContact O-CB 3.48Å; R90-N94 VanDerWaalsContact O-CG 3.25Å; R90-N94 PolarHBondContact O-N 3.48Å; R90-N94 PolarHBondContact O-ND2 2.93Å
91N72.3Confident68.8Low108 Ų108108.8 Ų108.858%0.57854%0.543SS*.Hα-helixtrans-67.2-37.4176.1-70.4-14.4000112.1R87 S88 A89 Q95R87-N91 VanDerWaalsContact O-CG 3.24Å; R87-N91 PolarHBondContact O-N 2.74Å; R87-N91 PolarHBondContact O-ND2 3.2Å; S88-N91 PolarHBondContact O-N 3.37Å; A89-N91 PolarHBondContact O-N 2.75Å; N91-Q95 VanDerWaalsContact O-CB 3.27Å; N91-Q95 WeakPolarHBondContact O-CB 3.35Å; N91-Q95 PolarHBondContact O-N 3.16Å
92S72Confident69.3Low71 Ų71109.4 Ų109.450%0.49753%0.534SS..Hα-helixtrans-63.5-45.5175.3-179.50000112.2S88 A89 Q95 M96S88-S92 PolarHBondContact O-N 2.89Å; A89-S92 PolarHBondContact O-N 3.31Å; S92-Q95 PolarHBondContact O-N 2.91Å; S92-M96 WeakPolarHBondContact O-CB 3.49Å; S92-M96 PolarHBondContact O-N 3.35Å
93I73.6Confident69.3Low94 Ų94110.5 Ų110.548%0.48253%0.534SS..Hα-helixtrans-65-46.1177.6-65.2165.4000110.7A89 R90 Q95 M96 C97A89-I93 WeakPolarHBondContact O-CG1 3.38Å; A89-I93 PolarHBondContact O-N 3.44Å; R90-I93 PolarHBondContact O-N 2.98Å; I93-Q95 VanDerWaalsContact C-N 3.32Å; I93-Q95 PolarHBondContact O-N 3.14Å; I93-M96 WeakPolarHBondContact O-CB 3.37Å; I93-M96 PolarHBondContact O-N 2.9Å; I93-C97 PolarHBondContact O-N 3.31Å; I93-C97 PolarHBondContact O-SG 2.93Å; I93-C97 VanDerWaalsContact O-SG 3.32Å
94N75.6Confident69Low104 Ų104112.2 Ų112.256%0.55654%0.54SS*.Hα-helixtrans-62.2-40178.6-73.9-13.4000112.1R90 M96 C97 Q98R90-N94 WeakPolarHBondContact O-CB 3.48Å; R90-N94 VanDerWaalsContact O-CG 3.25Å; R90-N94 PolarHBondContact O-N 3.48Å; R90-N94 PolarHBondContact O-ND2 2.93Å; N94-M96 VanDerWaalsContact C-N 3.34Å; N94-C97 PolarHBondContact O-N 3.14Å; N94-Q98 WeakPolarHBondContact O-CB 3.48Å; N94-Q98 PolarHBondContact O-N 3.11Å
95Q75.4Confident68.9Low109 Ų109111.3 Ų111.351%0.50954%0.539SS..Hα-helixtrans-67.8-35.7177.8-160-179.45500111.7N91 S92 I93 R99N91-Q95 VanDerWaalsContact O-CB 3.27Å; N91-Q95 WeakPolarHBondContact O-CB 3.35Å; N91-Q95 PolarHBondContact O-N 3.16Å; S92-Q95 PolarHBondContact O-N 2.91Å; I93-Q95 VanDerWaalsContact C-N 3.32Å; I93-Q95 PolarHBondContact O-N 3.14Å; Q95-R99 WeakPolarHBondContact O-CG 3.48Å; Q95-R99 PolarHBondContact O-N 3.26Å
96M70.8Confident68.5Low99 Ų99112.7 Ų112.749%0.48854%0.539SS..Hα-helixtrans-66.4-46.2173.2-172.4-149.2-70.100111.6S92 I93 N94 Q98 R99 F100S92-M96 WeakPolarHBondContact O-CB 3.49Å; S92-M96 PolarHBondContact O-N 3.35Å; I93-M96 WeakPolarHBondContact O-CB 3.37Å; I93-M96 PolarHBondContact O-N 2.9Å; N94-M96 VanDerWaalsContact C-N 3.34Å; M96-Q98 VanDerWaalsContact C-N 3.33Å; M96-Q98 PolarHBondContact O-N 3.29Å; M96-R99 WeakPolarHBondContact O-CB 3.48Å; M96-R99 PolarHBondContact O-N 2.86Å; M96-F100 HydrophobicContact CG-CD2 3.88Å; M96-F100 HydrophobicContact CG-CE2 3.4Å; M96-F100 HydrophobicContact CG-CZ 4.28Å; M96-F100 WeakPolarHBondContact O-CD2 3.47Å; M96-F100 PolarHBondContact O-N 2.92Å; M96-F100 HydrophobicContact SD-CD2 4.32Å; M96-F100 HydrophobicContact SD-CE2 3.57Å; M96-F100 VanDerWaalsContact SD-CE2 3.57Å
97C70Confident67.9Low54 Ų54113.4 Ų113.437%0.36555%0.545SS..Hα-helixtrans-59.9-42.3176-69.70000112I93 N94 R99 F100 Q101I93-C97 PolarHBondContact O-N 3.31Å; I93-C97 PolarHBondContact O-SG 2.93Å; I93-C97 VanDerWaalsContact O-SG 3.32Å; N94-C97 PolarHBondContact O-N 3.14Å; C97-R99 VanDerWaalsContact C-N 3.34Å; C97-R99 PolarHBondContact O-N 3.24Å; C97-F100 PolarHBondContact O-N 2.73Å; C97-Q101 WeakPolarHBondContact O-CG 3.41Å; C97-Q101 PolarHBondContact O-N 2.85Å
98Q75.7Confident67.4Low91 Ų91114.6 Ų114.643%0.42555%0.549SS..Hα-helixtrans-66-35.9176.7-162.8-177.547.200112.1N94 M96 Q101 R102N94-Q98 WeakPolarHBondContact O-CB 3.48Å; N94-Q98 PolarHBondContact O-N 3.11Å; M96-Q98 VanDerWaalsContact C-N 3.33Å; M96-Q98 PolarHBondContact O-N 3.29Å; Q98-Q101 PolarHBondContact O-N 3.47Å; Q98-R102 WeakPolarHBondContact O-CG 3.31Å; Q98-R102 PolarHBondContact O-N 2.92Å
99R74.6Confident66.8Low152 Ų152118.6 Ų118.657%0.57456%0.559SS**Hα-helixtrans-63-46.9172.2-74.3-176.1-149.6-164.17.3111.2Q95 M96 C97 Q101 R102 T103Q95-R99 WeakPolarHBondContact O-CG 3.48Å; Q95-R99 PolarHBondContact O-N 3.26Å; M96-R99 WeakPolarHBondContact O-CB 3.48Å; M96-R99 PolarHBondContact O-N 2.86Å; C97-R99 VanDerWaalsContact C-N 3.34Å; C97-R99 PolarHBondContact O-N 3.24Å; R99-Q101 VanDerWaalsContact C-N 3.32Å; R99-Q101 PolarHBondContact O-N 2.96Å; R99-R102 PolarHBondContact O-N 3.4Å; R99-T103 WeakPolarHBondContact O-CB 3.21Å; R99-T103 PolarHBondContact O-N 3.39Å; R99-T103 PolarHBondContact O-OG1 3.49Å
100F72.9Confident66.3Low138 Ų138124.9 Ų124.961%0.60558%0.58SS**Hα-helixtrans-64.6-34.7178.6-71.6-56.7000113.5M96 C97 R104M96-F100 HydrophobicContact CG-CD2 3.88Å; M96-F100 HydrophobicContact CG-CE2 3.4Å; M96-F100 HydrophobicContact CG-CZ 4.28Å; M96-F100 WeakPolarHBondContact O-CD2 3.47Å; M96-F100 PolarHBondContact O-N 2.92Å; M96-F100 HydrophobicContact SD-CD2 4.32Å; M96-F100 HydrophobicContact SD-CE2 3.57Å; M96-F100 VanDerWaalsContact SD-CE2 3.57Å; C97-F100 PolarHBondContact O-N 2.73Å; F100-R104 WeakPolarHBondContact O-CB 3.45Å; F100-R104 PolarHBondContact O-N 3.34Å
101Q70.9Confident65.2Low121 Ų121120.1 Ų120.157%0.56557%0.573SS**Hα-helixtrans-63.9-47.4172.4-71.8172.627.900111.2C97 Q98 R99 R104 E105C97-Q101 WeakPolarHBondContact O-CG 3.41Å; C97-Q101 PolarHBondContact O-N 2.85Å; Q98-Q101 PolarHBondContact O-N 3.47Å; R99-Q101 VanDerWaalsContact C-N 3.32Å; R99-Q101 PolarHBondContact O-N 2.96Å; Q101-R104 WeakPolarHBondContact O-CB 3.46Å; Q101-R104 PolarHBondContact O-N 2.85Å; Q101-E105 PolarHBondContact O-N 2.97Å; Q101-E105 VanDerWaalsContact O-N 3.13Å
102R68Low64.9Low120 Ų120123.7 Ų123.745%0.45359%0.591SS.*Hα-helixtrans-64.1-41.1175.3-71.5-172.2-178.1115.80.8112.8Q98 R99 R104 E105 F106Q98-R102 WeakPolarHBondContact O-CG 3.31Å; Q98-R102 PolarHBondContact O-N 2.92Å; R99-R102 PolarHBondContact O-N 3.4Å; R102-R104 PolarHBondContact O-N 3.44Å; R102-E105 WeakPolarHBondContact O-CB 3.2Å; R102-E105 PolarHBondContact O-N 3.46Å; R102-E105 VanDerWaalsContact O-N 3.11Å; R102-F106 VanDerWaalsContact O-CD2 3.29Å; R102-F106 WeakPolarHBondContact O-CD2 3.47Å; R102-F106 PolarHBondContact O-N 3.24Å
103T58.6Low64.2Low88 Ų88125.3 Ų125.354%0.5460%0.597SS.*Hα-helixtrans-62.4-33.8176.3-53.70000111.3R99 S107R99-T103 WeakPolarHBondContact O-CB 3.21Å; R99-T103 PolarHBondContact O-N 3.39Å; R99-T103 PolarHBondContact O-OG1 3.49Å; T103-S107 WeakPolarHBondContact O-CB 3.4Å; T103-S107 PolarHBondContact O-N 2.86Å; T103-S107 PolarHBondContact O-OG 3.2Å; T103-S107 VanDerWaalsContact O-OG 3.12Å
104R60.5Low63.3Low204 Ų204125.2 Ų125.277%0.7761%0.611SS**Hα-helixtrans-68-35.9174-171.5178.7178-157.1-0.2112.4F100 Q101 R102 S107F100-R104 WeakPolarHBondContact O-CB 3.45Å; F100-R104 PolarHBondContact O-N 3.34Å; Q101-R104 WeakPolarHBondContact O-CB 3.46Å; Q101-R104 PolarHBondContact O-N 2.85Å; R102-R104 PolarHBondContact O-N 3.44Å; R104-S107 WeakPolarHBondContact CA-OG 3.39Å; R104-S107 PolarHBondContact O-OG 3.5Å
105E57.9Low62.3Low127 Ų127126.2 Ų126.259%0.59362%0.621SS**Hα-helixtrans-69.1-48.1175.1-69.2165.1-177.900111.6Q101 R102 S107 R108Q101-E105 PolarHBondContact O-N 2.97Å; Q101-E105 VanDerWaalsContact O-N 3.13Å; R102-E105 WeakPolarHBondContact O-CB 3.2Å; R102-E105 PolarHBondContact O-N 3.46Å; R102-E105 VanDerWaalsContact O-N 3.11Å; E105-S107 VanDerWaalsContact C-N 3.35Å; E105-S107 PolarHBondContact O-N 2.65Å; E105-R108 WeakPolarHBondContact O-CB 3.44Å; E105-R108 PolarHBondContact O-N 3.26Å
106F53.9Low61.2Low150 Ų150127.2 Ų127.266%0.65864%0.637SS**Hα-helixtrans-68.1-28.5176.3-79.8-76.7000113.6R102 R108R102-F106 VanDerWaalsContact O-CD2 3.29Å; R102-F106 WeakPolarHBondContact O-CD2 3.47Å; R102-F106 PolarHBondContact O-N 3.24Å; F106-R108 PolarHBondContact O-N 2.81Å
107S51.8Low60.4Low67 Ų67126 Ų12647%0.46965%0.65SS.*THydrogen-bonded Turntrans-74.4-9.3176.869.80000114.4T103 R104 E105 E109T103-S107 WeakPolarHBondContact O-CB 3.4Å; T103-S107 PolarHBondContact O-N 2.86Å; T103-S107 PolarHBondContact O-OG 3.2Å; T103-S107 VanDerWaalsContact O-OG 3.12Å; R104-S107 WeakPolarHBondContact CA-OG 3.39Å; R104-S107 PolarHBondContact O-OG 3.5Å; E105-S107 VanDerWaalsContact C-N 3.35Å; E105-S107 PolarHBondContact O-N 2.65Å; S107-E109 VanDerWaalsContact C-N 3.27Å; S107-E109 PolarHBondContact O-N 2.94Å
108R53.1Low59.2Low203 Ų203134.4 Ų134.477%0.76667%0.674SS**THydrogen-bonded Turntrans-74.2-22-178.4-160178-177.6-163.1-2.8112.2E105 F106E105-R108 WeakPolarHBondContact O-CB 3.44Å; E105-R108 PolarHBondContact O-N 3.26Å; F106-R108 PolarHBondContact O-N 2.81Å
109E56.3Low57.6Low164 Ų164137.2 Ų137.277%0.76669%0.692SS**SBendtrans-84.9-16-178.1-69.7155.7-173.100113S107S107-E109 VanDerWaalsContact C-N 3.27Å; S107-E109 PolarHBondContact O-N 2.94Å
110E57.1Low56.5Low182 Ų182135.2 Ų135.285%0.8570%0.698SS**SBendtrans-117.121.2177.8-95.2-173.616700113.7L112E110-L112 PolarHBondContact O-N 3.19Å
111C48.4Very low55.4Low77 Ų77136.6 Ų136.652%0.5271%0.707SS.*  trans-84.2102.1174.9-168.50000110.5V113C111-V113 PolarHBondContact O-N 3.13Å; C111-V113 PolarHBondContact SG-O 2.76Å; C111-V113 VanDerWaalsContact SG-O 3.36Å
112L66.5Low54.1Low182 Ų182138.5 Ų138.595%0.95372%0.719SS**SBendtrans-65.78.2173.9-67.3174.7000114.5E110E110-L112 PolarHBondContact O-N 3.19Å
113V56.5Low52.6Low105 Ų105137.6 Ų137.664%0.63674%0.737SS**SBendtrans-122.7106.1176.1-178.60000108.2C111 T115C111-V113 PolarHBondContact O-N 3.13Å; C111-V113 PolarHBondContact SG-O 2.76Å; C111-V113 VanDerWaalsContact SG-O 3.36Å; V113-T115 PolarHBondContact O-N 2.89Å
114A55.3Low51.4Low93 Ų93137.2 Ų137.277%0.76975%0.751SS**  trans-63.3114.3166.500000108.2P116A114-P116 WeakPolarHBondContact O-CD 3.49Å
115T53.6Low50.2Low124 Ų124132.2 Ų132.276%0.76175%0.753SS**  trans-81.7115.4169.6-28.10000106.7V113 G117V113-T115 PolarHBondContact O-N 2.89Å; T115-G117 PolarHBondContact O-N 3.02Å
116P53.7Low49.1Very low130 Ų130131.9 Ų131.984%0.84477%0.765SS**SBendtrans-73.9121.2178.1-10.127000108.7A114A114-P116 WeakPolarHBondContact O-CD 3.49Å
117G54.1Low48.6Very low74 Ų74130.1 Ų130.176%0.76377%0.771SS**  trans119.372.216900000114.2T115T115-G117 PolarHBondContact O-N 3.02Å
118R43.6Very low47.8Very low230 Ų230133.1 Ų133.187%0.86879%0.791SS**  trans-157.5115.7137.6-88.1-126.7179.7-148.81.1108.3P120R118-P120 WeakPolarHBondContact O-CD 3.32Å
119D43Very low47.3Very low151 Ų151129.7 Ų129.781%0.80779%0.793SS**  trans-86.7119.6173.1-147.5-7.4000108.1
120P50.8Low46.7Very low109 Ų109128 Ų12871%0.70880%0.796SS**  trans-94.4113.415531.7-24.3000108.4R118R118-P120 WeakPolarHBondContact O-CD 3.32Å
121E49.7Very low45.8Very low167 Ų167130.3 Ų130.378%0.7880%0.797SS**  trans-53.3148.5172-61178.714600111.5
122I43.9Very low45.4Very low162 Ų162137.5 Ų137.583%0.83181%0.813SS**  trans89.792.8163.5-46.2161.4000115.9
123A36.8Very low44.3Very low100 Ų100135 Ų13583%0.82681%0.805SS**  159.3124.2113.300000112.3
124G32.3Very low43.9Very low80 Ų80136.4 Ų136.483%0.82582%0.817SS**  trans96.7101.2148.300000118.6
125A36.2Very low43.2Very low100 Ų100143.6 Ų143.683%0.82682%0.824SS**  trans37.6108.4139.500000120.3
126S35.1Very low42.4Very low120 Ų120149.3 Ų149.384%0.83983%0.832SS**  167.4128101.156.80000110.5
127S42.3Very low41.6Very low113 Ų113147.9 Ų147.979%0.7983%0.83SS**  trans-63.7125.8173.452.50000111.3
128C36.4Very low41Very low130 Ų130148.8 Ų148.888%0.87883%0.831SS**  trans-16093.2154.2-100.90000110.2
129T41.7Very low41Very low131 Ų131144.1 Ų144.180%0.80483%0.828SS**  trans-74.7129.7164.735.50000109.5R131T129-R131 PolarHBondContact O-N 3.31Å
130P43.3Very low41.4Very low129 Ų129143 Ų14384%0.83883%0.829SS**  trans-76.1111.1165.627.3-27.7000109.2
131R37.9Very low40.9Very low229 Ų229149.1 Ų149.186%0.86484%0.838SS**  trans-57.2130.4173.5-85.3171.8154.5-128.31.5112.4T129T129-R131 PolarHBondContact O-N 3.31Å
132R40.4Very low40.4Very low229 Ų229152.6 Ų152.686%0.86484%0.844SS**  trans39.4119.5131.5-74.6-176.5156.1176.2-4.8119.7
133T42.8Very low40.4Very low129 Ų129151 Ų15179%0.79184%0.842SS**  trans-35.6132.9147.149.40000114.8
134P49.5Very low41Very low135 Ų135152.4 Ų152.488%0.87784%0.842SS**  trans-88.8126.716129.2-23000111.1
135R39.5Very low41.2Very low244 Ų244160 Ų16092%0.92185%0.846SS**  trans-91.7122.6179.9-169.7-178.6175.9-152.70.1108.8
136R36.7Very low41.3Very low244 Ų244160.9 Ų160.992%0.92185%0.846SS**  trans24.9120.2145-151.7179.7-164.6-164.74.5119.2
137A37Very low41.5Very low99 Ų99160 Ų16082%0.81885%0.846SS**  trans-145.7114.2150.700000107.1
138A41.4Very low41.4Very low93 Ų93159.5 Ų159.577%0.76985%0.849SS**  112.2120.692.600000109.1
139T45Very low41.9Very low133 Ų133162.9 Ų162.982%0.81685%0.849SS**  trans-62.3160.6-177.444.40000114
140P51.1Low42.3Very low126 Ų126163.1 Ų163.182%0.81885%0.852SS**  -127.3132.6121.832.1-21.1000112.9
141R40.2Very low41.9Very low238 Ų238160.2 Ų160.290%0.89885%0.846SS**  trans-55.7131.9163.1-77.3173.4161.2-149.6-2.7109.9
142R39.8Very low41.9Very low241 Ų241160.9 Ų160.991%0.90985%0.849SS**  trans-165.6108.5139.7-107.9169.4-174.9-166.91.3111
143T42Very low41.9Very low128 Ų128156.6 Ų156.679%0.78585%0.848SS**  trans-64.6146.3166.5-28.30000110R145T143-R145 HydrophobicContact CG2-CB 4.48Å
144P50.1Low42Very low129 Ų129156.2 Ų156.284%0.83885%0.848SS**  trans-118.3116.1132.231.5-26.3000110.4
145R36.5Very low41.3Very low240 Ų240153 Ų15391%0.90684%0.839SS**  trans-78.3115.5167.6-178.4-177.2-170.1-179.82.6106.7T143T143-R145 HydrophobicContact CG2-CB 4.48Å
146S39.3Very low41.5Very low119 Ų119147 Ų14783%0.83283%0.834SS**  trans-142.6115.5153.581.60000109
147A38.6Very low41.7Very low101 Ų101147 Ų14784%0.83583%0.834SS**  trans-96.1126.8171.700000107.3
148A40.3Very low42.1Very low102 Ų102150.4 Ų150.484%0.84383%0.833SS**  trans-147.7133.5158.100000108.3
149K46.7Very low42.1Very low202 Ų202158 Ų15888%0.87884%0.842SS**  trans-66161.3-164.4-65171.2177.5176.80113.8
150P49Very low42.1Very low135 Ų135160.1 Ų160.188%0.87784%0.84SS**  trans-78.1128.1171.232.3-30.3000109.9
151G35.6Very low41.6Very low69 Ų69160.3 Ų160.371%0.71184%0.839SS**  trans-150.7108.8-177.900000113.1
152R37.2Very low42Very low243 Ų243154.6 Ų154.692%0.91783%0.833SS**  trans60.9117.7148.9-65.4-175174.8-170.2-1.9120
153T42.2Very low42.3Very low139 Ų139152 Ų15285%0.85383%0.831SS**  trans-52.3142.3149-28.50000111.4
154P44.8Very low42.2Very low121 Ų121150.1 Ų150.179%0.78683%0.828SS**  trans-134.1148.6131.632.4-17000111.8
155G34.7Very low42.3Very low66 Ų66149.6 Ų149.668%0.6883%0.828SS**  trans-80.8-174.7-172.400000115.9
156S43.6Very low42.6Very low118 Ų118144.7 Ų144.783%0.82582%0.824SS**  trans53.6108.3161.467.80000118.4
157R40.1Very low42.9Very low245 Ų245150.5 Ų150.593%0.92583%0.828SS**  -162.8119.6121.5-114.6172.4176.8172.7-0.6111.4
158E44.8Very low43.2Very low171 Ų171148.7 Ų148.780%0.79982%0.819SS**  trans-52133.3159-74169.3114.200110.3
159R43.1Very low43.7Very low253 Ų253149.7 Ų149.796%0.95581%0.814SS**  trans-143.4121.6150.8-100.9-176.8-178.5-133-0.1109
160K44.1Very low44.1Very low177 Ų177149.3 Ų149.377%0.7781%0.813SS**  trans-88.3140.7178.9-69.7175.5175.5173.70110.6
161T40.5Very low44.3Very low130 Ų130149.3 Ų149.380%0.79881%0.81SS**  trans70.8148.4149.143.70000120.1
162P48.5Very low45.3Very low118 Ų118149.4 Ų149.477%0.76681%0.811SS**  cis-134.5153.233.537.1-17.2000119.1
163E45.8Very low46.5Very low186 Ų186144.3 Ų144.387%0.86979%0.792SS**  trans9101.8143.1-66.7-75.9153.900117.8
164A41.1Very low48.1Very low88 Ų88139.9 Ų139.973%0.72777%0.774SS**  trans-150.595154.600000109.1V166A164-V166 PolarHBondContact O-N 2.99Å
165S50.9Low49.4Very low119 Ų119144.5 Ų144.583%0.83278%0.776SS**  trans-20.992.1169.158.60000116.7
166V43.5Very low51.3Low136 Ų136151 Ų15182%0.82478%0.78SS**  trans-113.9107.3145.8-1770000105.8A164 G168A164-V166 PolarHBondContact O-N 2.99Å; V166-G168 VanDerWaalsContact C-N 3.28Å; V166-G168 PolarHBondContact O-N 3.48Å
167R45.7Very low52.9Low241 Ų241149.2 Ų149.291%0.90976%0.759SS**  trans-53.490.5-177.9-150.7-176.4-64.2-109.33.7108.6V169R167-V169 PolarHBondContact O-N 3.04Å
168G44.1Very low54.7Low63 Ų63142.6 Ų142.665%0.64974%0.741SS**  trans-58.4112.1174.500000107.9V166 K170V166-G168 VanDerWaalsContact C-N 3.28Å; V166-G168 PolarHBondContact O-N 3.48Å; G168-K170 VanDerWaalsContact C-N 3.31Å; G168-K170 PolarHBondContact O-N 3.41Å
169V51.1Low56.2Low124 Ų124138.8 Ų138.875%0.75273%0.729SS**  trans-58107161.3171.90000104.5R167 T171R167-V169 PolarHBondContact O-N 3.04Å; V169-T171 HydrophobicContact CG1-CG2 4.47Å; V169-T171 PolarHBondContact O-N 3.47Å
170K55.2Low57.8Low193 Ų193134.9 Ų134.984%0.83972%0.715SS**  trans-53.793.5172.8-77.4178.9173.3179.60107.8G168 G172G168-K170 VanDerWaalsContact C-N 3.31Å; G168-K170 PolarHBondContact O-N 3.41Å; K170-G172 PolarHBondContact O-N 3.3Å
171T53.8Low59.1Low135 Ų135130.6 Ų130.683%0.82870%0.698SS**  trans-78.850.2168.241.60000109V169V169-T171 HydrophobicContact CG1-CG2 4.47Å; V169-T171 PolarHBondContact O-N 3.47Å
172G57.4Low60.4Low71 Ų71127.4 Ų127.473%0.73269%0.685SS**  trans-100.424.6167.800000111.4K170 G174K170-G172 PolarHBondContact O-N 3.3Å; G172-G174 PolarHBondContact O-N 2.96Å
173R61.4Low61.3Low136 Ų136124.7 Ų124.751%0.51367%0.673SS.*  trans-76.9104.6174.6-65.4-156.8-173.4-72.35.4107.2Q177 L178R173-Q177 HydrophobicContact CB-CB 4.13Å; R173-Q177 HydrophobicContact CB-CG 4.2Å; R173-Q177 VanDerWaalsContact CD-CD 3.47Å; R173-Q177 HydrophobicContact CG-CG 4.39Å; R173-L178 HydrophobicContact CB-CG 4.34Å
174G76.2Confident62.2Low47 Ų47121.1 Ų121.149%0.48566%0.659SS.*  trans-50.6152.1179.200000111.5G172 R176 Q177 L178G172-G174 PolarHBondContact O-N 2.96Å; G174-R176 CarbonylContact O-C 3.58Å; G174-R176 PolarHBondContact O-N 3.34Å; G174-Q177 WeakPolarHBondContact O-CA 3.44Å; G174-Q177 WeakPolarHBondContact O-CB 3.3Å; G174-Q177 PolarHBondContact O-N 3.28Å; G174-L178 PolarHBondContact O-N 3.22Å
175R72.8Confident63.3Low217 Ų217127 Ų12782%0.81966%0.662SS**Hα-helixtrans-43.9-37.8-177.6-175.7177.9166.7-153.3-2.3113.1Q177 L178 V179R175-Q177 PolarHBondContact O-N 2.9Å; R175-L178 PolarHBondContact O-N 3.11Å; R175-V179 HydrophobicContact CG-CG2 4.46Å; R175-V179 WeakPolarHBondContact O-CB 3.42Å; R175-V179 WeakPolarHBondContact O-CG2 3.36Å; R175-V179 PolarHBondContact O-N 3.33Å
176R73.5Confident64.1Low204 Ų204123.2 Ų123.277%0.7764%0.636SS**Hα-helixtrans-59.5-40.8173.9-85.3-178.4171.4-178.7-2.2114.2G174 R180G174-R176 CarbonylContact O-C 3.58Å; G174-R176 PolarHBondContact O-N 3.34Å; R176-R180 WeakPolarHBondContact O-CB 3.41Å; R176-R180 WeakPolarHBondContact O-CG 3.34Å; R176-R180 PolarHBondContact O-N 3.46Å
177Q76.9Confident65Low79 Ų79122.4 Ų122.437%0.36963%0.633SS.*Hα-helixtrans-73.8-36.5179.5-171.5170.627.900112R173 G174 R175 R180 M181R173-Q177 HydrophobicContact CB-CB 4.13Å; R173-Q177 HydrophobicContact CB-CG 4.2Å; R173-Q177 VanDerWaalsContact CD-CD 3.47Å; R173-Q177 HydrophobicContact CG-CG 4.39Å; G174-Q177 WeakPolarHBondContact O-CA 3.44Å; G174-Q177 WeakPolarHBondContact O-CB 3.3Å; G174-Q177 PolarHBondContact O-N 3.28Å; R175-Q177 PolarHBondContact O-N 2.9Å; Q177-R180 PolarHBondContact O-N 2.95Å; Q177-M181 WeakPolarHBondContact O-CB 3.41Å; Q177-M181 VanDerWaalsContact O-CG 3.29Å; Q177-M181 WeakPolarHBondContact O-CG 3.5Å; Q177-M181 PolarHBondContact O-N 3.14Å
178L78Confident65.4Low107 Ų107118.9 Ų118.956%0.5663%0.625SS**Hα-helixtrans-65.4-42.5172.2-73.8168.1000111.6R173 G174 R175 M181 A182R173-L178 HydrophobicContact CB-CG 4.34Å; G174-L178 PolarHBondContact O-N 3.22Å; R175-L178 PolarHBondContact O-N 3.11Å; L178-M181 PolarHBondContact O-N 3.16Å; L178-A182 WeakPolarHBondContact O-CB 3.46Å; L178-A182 PolarHBondContact O-N 3.02Å
179V76.9Confident66.2Low91 Ų91117.6 Ų117.655%0.55261%0.606SS**Hα-helixtrans-61.6-44.3173.8170.30000111.2R175 M181 A182 A183R175-V179 HydrophobicContact CG-CG2 4.46Å; R175-V179 WeakPolarHBondContact O-CB 3.42Å; R175-V179 WeakPolarHBondContact O-CG2 3.36Å; R175-V179 PolarHBondContact O-N 3.33Å; V179-M181 VanDerWaalsContact C-N 3.32Å; V179-M181 PolarHBondContact O-N 3.38Å; V179-A182 PolarHBondContact O-N 3.3Å; V179-A183 WeakPolarHBondContact O-CB 3.38Å; V179-A183 PolarHBondContact O-N 3.43Å
180R76.3Confident66.7Low171 Ų171114.3 Ų114.365%0.64559%0.588SS**Hα-helixtrans-61.2-40.5174.7-74.4171.3-176179.90111.9R176 Q177 L184R176-R180 WeakPolarHBondContact O-CB 3.41Å; R176-R180 WeakPolarHBondContact O-CG 3.34Å; R176-R180 PolarHBondContact O-N 3.46Å; Q177-R180 PolarHBondContact O-N 2.95Å; R180-L184 WeakPolarHBondContact O-CG 3.45Å; R180-L184 PolarHBondContact O-N 3.35Å; R180-L184 VanDerWaalsContact O-N 3.15Å
181M72.3Confident67.1Low87 Ų87110.4 Ų110.443%0.42958%0.583SS.*Hα-helixtrans-70.2-39.2177.2-75.3-94.855.500112.6Q177 L178 V179 A183 L184 R185Q177-M181 WeakPolarHBondContact O-CB 3.41Å; Q177-M181 VanDerWaalsContact O-CG 3.29Å; Q177-M181 WeakPolarHBondContact O-CG 3.5Å; Q177-M181 PolarHBondContact O-N 3.14Å; L178-M181 PolarHBondContact O-N 3.16Å; V179-M181 VanDerWaalsContact C-N 3.32Å; V179-M181 PolarHBondContact O-N 3.38Å; M181-A183 VanDerWaalsContact C-N 3.35Å; M181-L184 HydrophobicContact CE-CB 4.23Å; M181-L184 HydrophobicContact CE-CD1 4.02Å; M181-L184 CarbonylContact O-C 3.58Å; M181-L184 PolarHBondContact O-N 3.3Å; M181-R185 WeakPolarHBondContact O-CB 3.29Å; M181-R185 PolarHBondContact O-N 3.2Å
182A67.8Low67.5Low63 Ų63110.4 Ų110.452%0.52158%0.578SS.*Hα-helixtrans-66.3-35.6175.500000112.2L178 V179 R185 S186L178-A182 WeakPolarHBondContact O-CB 3.46Å; L178-A182 PolarHBondContact O-N 3.02Å; V179-A182 PolarHBondContact O-N 3.3Å; A182-R185 CarbonylContact O-C 3.6Å; A182-R185 PolarHBondContact O-N 3.27Å; A182-S186 PolarHBondContact O-N 3.12Å
183A67.1Low68Low61 Ų61108.8 Ų108.850%0.50455%0.554SS.*Hα-helixtrans-64-41.9172.600000111.7V179 M181 R185 S186 S189V179-A183 WeakPolarHBondContact O-CB 3.38Å; V179-A183 PolarHBondContact O-N 3.43Å; M181-A183 VanDerWaalsContact C-N 3.35Å; A183-R185 VanDerWaalsContact C-N 3.32Å; A183-S186 VanDerWaalsContact O-CB 3.23Å; A183-S186 WeakPolarHBondContact O-CB 3.47Å; A183-S186 PolarHBondContact O-N 2.96Å; A183-S189 WeakPolarHBondContact O-CB 3.45Å
184L64.8Low68.9Low110 Ų110108.3 Ų108.358%0.57656%0.557SS**Hα-helixtrans-72.4-23.1174.5-66173.6000113.3R180 M181R180-L184 WeakPolarHBondContact O-CG 3.45Å; R180-L184 PolarHBondContact O-N 3.35Å; R180-L184 VanDerWaalsContact O-N 3.15Å; M181-L184 HydrophobicContact CE-CB 4.23Å; M181-L184 HydrophobicContact CE-CD1 4.02Å; M181-L184 CarbonylContact O-C 3.58Å; M181-L184 PolarHBondContact O-N 3.3Å
185R64.4Low69.2Low213 Ų213114.7 Ų114.780%0.80457%0.572SS**THydrogen-bonded Turntrans-95.37.3174.3-130.768.8163.4168.5-2.5113.2M181 A182 A183M181-R185 WeakPolarHBondContact O-CB 3.29Å; M181-R185 PolarHBondContact O-N 3.2Å; A182-R185 CarbonylContact O-C 3.6Å; A182-R185 PolarHBondContact O-N 3.27Å; A183-R185 VanDerWaalsContact C-N 3.32Å
186S66.9Low69.8Low39 Ų39111 Ų11127%0.27356%0.564SS.*  trans-56.5136.7175.6169.20000109.3A182 A183 F188 S189A182-S186 PolarHBondContact O-N 3.12Å; A183-S186 VanDerWaalsContact O-CB 3.23Å; A183-S186 WeakPolarHBondContact O-CB 3.47Å; A183-S186 PolarHBondContact O-N 2.96Å; S186-F188 PolarHBondContact O-N 3.17Å; S186-F188 PolarHBondContact OG-N 2.81Å; S186-S189 WeakPolarHBondContact O-CA 3.23Å; S186-S189 PolarHBondContact O-N 2.93Å
187P61.8Low70.4Confident118 Ų118107.1 Ų107.177%0.76655%0.549SS*.THydrogen-bonded Turntrans-54-20.8174.7-23.932.1000113.8
188F56Low71Confident167 Ų167108.5 Ų108.573%0.73256%0.558SS**THydrogen-bonded Turntrans-94.1-7.2176.8-58.7-76.6000113.9S186 R197S186-F188 PolarHBondContact O-N 3.17Å; S186-F188 PolarHBondContact OG-N 2.81Å; F188-R197 PolarHBondContact O-NH2 2.93Å
189S60.9Low71.6Confident37 Ų37110 Ų11026%0.25956%0.56SS.*  trans-102.146176.8-168.80000110.9A183 S186A183-S189 WeakPolarHBondContact O-CB 3.45Å; S186-S189 WeakPolarHBondContact O-CA 3.23Å; S186-S189 PolarHBondContact O-N 2.93Å
190S61.3Low72.4Confident54 Ų54111.4 Ų111.438%0.37856%0.559SS.*  trans-76.6134.3172.5-176.60000109.8N192 T193S190-N192 PolarHBondContact O-N 3.24Å; S190-N192 PolarHBondContact OG-N 3.28Å; S190-T193 PolarHBondContact O-N 2.89Å; S190-T193 PolarHBondContact O-OG1 3.43Å
191P62.6Low73.3Confident111 Ų111107.3 Ų107.372%0.72155%0.55SS*.G310 helixtrans-52.9-24.2172.3-23.832.2000112.9T193 E194P191-T193 PolarHBondContact O-N 3.15Å; P191-E194 PolarHBondContact O-N 3.45Å
192N62.6Low74.4Confident136 Ų136110 Ų11073%0.72756%0.559SS**G310 helixtrans-68.1-16177.7-16010.9000113.7S190S190-N192 PolarHBondContact O-N 3.24Å; S190-N192 PolarHBondContact OG-N 3.28Å
193T68.3Low75.8Confident37 Ų37110.8 Ų110.823%0.22755%0.554CS.*G310 helixtrans-89.9-11178.164.10000113.6S190 P191 K195 Q196 R197S190-T193 PolarHBondContact O-N 2.89Å; S190-T193 PolarHBondContact O-OG1 3.43Å; P191-T193 PolarHBondContact O-N 3.15Å; T193-K195 PolarHBondContact O-N 3.06Å; T193-Q196 PolarHBondContact O-N 2.92Å; T193-Q196 VanDerWaalsContact O-N 3.14Å; T193-R197 VanDerWaalsContact O-CG 3.29Å; T193-R197 WeakPolarHBondContact O-CG 3.3Å; T193-R197 PolarHBondContact O-N 3.34Å; T193-R197 PolarHBondContact OG1-NE 3.01Å
194E80.3Confident77.2Confident126 Ų126112 Ų11259%0.58955%0.552SS**Hα-helixtrans-62.9-45.3-172.9-172.6172.5-168.100112.3P191 Q196 R197 I198P191-E194 PolarHBondContact O-N 3.45Å; E194-Q196 VanDerWaalsContact C-N 3.29Å; E194-Q196 PolarHBondContact O-N 2.79Å; E194-R197 PolarHBondContact O-N 3.5Å; E194-I198 HydrophobicContact CG-CD1 4.16Å; E194-I198 WeakPolarHBondContact O-CG1 3.27Å; E194-I198 PolarHBondContact O-N 3.28Å
195K82.6Confident78.8Confident181 Ų181113.1 Ų113.179%0.78755%0.554SS**Hα-helixtrans-62.5-36.6175.3-66.5-177.7-179.1177.30112.6T193 K199T193-K195 PolarHBondContact O-N 3.06Å; K195-K199 WeakPolarHBondContact O-CB 3.48Å; K195-K199 PolarHBondContact O-N 3.2Å; K195-K199 VanDerWaalsContact O-N 3.11Å
196Q85.1Confident80.4Confident139 Ų139106 Ų10665%0.6554%0.537SS*.Hα-helixtrans-71.3-37.3177.2-68.3-174.4-12.200111.7T193 E194 K199 F200T193-Q196 PolarHBondContact O-N 2.92Å; T193-Q196 VanDerWaalsContact O-N 3.14Å; E194-Q196 VanDerWaalsContact C-N 3.29Å; E194-Q196 PolarHBondContact O-N 2.79Å; Q196-K199 PolarHBondContact O-N 3.31Å; Q196-F200 WeakPolarHBondContact O-CB 3.23Å; Q196-F200 PolarHBondContact O-N 2.92Å
197R85.3Confident81.8Confident122 Ų122108.1 Ų108.146%0.4655%0.548SS..Hα-helixtrans-64.4-47.9174.3-71.8172.8-176.5-165.61111.4F188 T193 E194 K199 F200 D201F188-R197 PolarHBondContact O-NH2 2.93Å; T193-R197 VanDerWaalsContact O-CG 3.29Å; T193-R197 WeakPolarHBondContact O-CG 3.3Å; T193-R197 PolarHBondContact O-N 3.34Å; T193-R197 PolarHBondContact OG1-NE 3.01Å; E194-R197 PolarHBondContact O-N 3.5Å; R197-K199 VanDerWaalsContact C-N 3.25Å; R197-K199 PolarHBondContact O-N 2.86Å; R197-F200 CarbonylContact O-C 3.57Å; R197-F200 WeakPolarHBondContact O-CB 3.36Å; R197-F200 PolarHBondContact O-N 3.3Å; R197-D201 WeakPolarHBondContact O-CB 3.46Å; R197-D201 VanDerWaalsContact O-CG 3.25Å; R197-D201 PolarHBondContact O-N 3.34Å
198I89.3Confident83.6Confident108 Ų108104.9 Ų104.955%0.55453%0.528SS*.Hα-helixtrans-57.9-41.2175.7-65.6163.9000110.9E194 K202E194-I198 HydrophobicContact CG-CD1 4.16Å; E194-I198 WeakPolarHBondContact O-CG1 3.27Å; E194-I198 PolarHBondContact O-N 3.28Å; I198-K202 WeakPolarHBondContact O-CB 3.37Å; I198-K202 PolarHBondContact O-N 2.86Å
199K91.9Very high85.6Confident138 Ų13899.3 Ų99.360%0.651%0.51SS*.Hα-helixtrans-64.1-46.1175.1-173.9-177.7175.6-170.40111.6K195 Q196 R197 D201 K202 D203K195-K199 WeakPolarHBondContact O-CB 3.48Å; K195-K199 PolarHBondContact O-N 3.2Å; K195-K199 VanDerWaalsContact O-N 3.11Å; Q196-K199 PolarHBondContact O-N 3.31Å; R197-K199 VanDerWaalsContact C-N 3.25Å; R197-K199 PolarHBondContact O-N 2.86Å; K199-D201 PolarHBondContact O-N 2.76Å; K199-K202 PolarHBondContact O-N 2.97Å; K199-D203 WeakPolarHBondContact O-CB 3.39Å; K199-D203 PolarHBondContact O-N 3.07Å
200F92.8Very high87.3Confident122 Ų12299.2 Ų99.254%0.53552%0.515SS..Hα-helixtrans-61.2-42.9177.8178.9-100.6000112.1Q196 R197 D203 L204Q196-F200 WeakPolarHBondContact O-CB 3.23Å; Q196-F200 PolarHBondContact O-N 2.92Å; R197-F200 CarbonylContact O-C 3.57Å; R197-F200 WeakPolarHBondContact O-CB 3.36Å; R197-F200 PolarHBondContact O-N 3.3Å; F200-D203 CarbonylContact O-C 3.38Å; F200-D203 PolarHBondContact O-N 3.12Å; F200-L204 HydrophobicContact CD1-CD1 3.83Å; F200-L204 HydrophobicContact CD1-CG 4.18Å; F200-L204 HydrophobicContact CE1-CD1 3.32Å; F200-L204 HydrophobicContact CE1-CD2 4.38Å; F200-L204 HydrophobicContact CE1-CG 3.83Å; F200-L204 HydrophobicContact CE2-CG 4.49Å; F200-L204 HydrophobicContact CZ-CD1 3.86Å; F200-L204 HydrophobicContact CZ-CD2 4.09Å; F200-L204 HydrophobicContact CZ-CG 3.99Å; F200-L204 WeakPolarHBondContact O-CG 3.39Å; F200-L204 PolarHBondContact O-N 3.39Å
201D95.3Very high89.1Confident84 Ų84101 Ų10145%0.44952%0.519SS..Hα-helixtrans-63.9-42.4177.1-66.4-24.9000111R197 K199 D203 L204 E205R197-D201 WeakPolarHBondContact O-CB 3.46Å; R197-D201 VanDerWaalsContact O-CG 3.25Å; R197-D201 PolarHBondContact O-N 3.34Å; K199-D201 PolarHBondContact O-N 2.76Å; D201-D203 VanDerWaalsContact C-N 3.33Å; D201-D203 PolarHBondContact O-N 3.29Å; D201-L204 WeakPolarHBondContact O-CB 3.19Å; D201-L204 PolarHBondContact O-N 2.99Å; D201-E205 WeakPolarHBondContact O-CG 3.43Å; D201-E205 PolarHBondContact O-N 3.15Å
202K95.9Very high90.8Very high145 Ų145103.7 Ų103.763%0.6352%0.515SS*.Hα-helixtrans-62.1-41173-173.5179.2-178.3178.30112.1I198 K199 E205 S206I198-K202 WeakPolarHBondContact O-CB 3.37Å; I198-K202 PolarHBondContact O-N 2.86Å; K199-K202 PolarHBondContact O-N 2.97Å; K202-E205 PolarHBondContact O-N 3.3Å; K202-S206 PolarHBondContact O-N 3.28Å
203D96.7Very high92.4Very high78 Ų78105.9 Ų105.942%0.41751%0.513SS..Hα-helixtrans-64.6-42.4176-69.8-13.4000110K199 F200 D201 E205 S206 V207K199-D203 WeakPolarHBondContact O-CB 3.39Å; K199-D203 PolarHBondContact O-N 3.07Å; F200-D203 CarbonylContact O-C 3.38Å; F200-D203 PolarHBondContact O-N 3.12Å; D201-D203 VanDerWaalsContact C-N 3.33Å; D201-D203 PolarHBondContact O-N 3.29Å; D203-E205 PolarHBondContact O-N 3.33Å; D203-S206 WeakPolarHBondContact CA-OG 3.44Å; D203-S206 PolarHBondContact O-N 3.43Å; D203-S206 PolarHBondContact O-OG 3.48Å; D203-V207 WeakPolarHBondContact O-CG2 3.42Å; D203-V207 PolarHBondContact O-N 3.07Å
204L97.1Very high93.9Very high87 Ų87109.9 Ų109.946%0.45553%0.532SS..Hα-helixtrans-61-43.7173.7-75.5-177.8000112.6F200 D201 S206 V207 S208F200-L204 HydrophobicContact CD1-CD1 3.83Å; F200-L204 HydrophobicContact CD1-CG 4.18Å; F200-L204 HydrophobicContact CE1-CD1 3.32Å; F200-L204 HydrophobicContact CE1-CD2 4.38Å; F200-L204 HydrophobicContact CE1-CG 3.83Å; F200-L204 HydrophobicContact CE2-CG 4.49Å; F200-L204 HydrophobicContact CZ-CD1 3.86Å; F200-L204 HydrophobicContact CZ-CD2 4.09Å; F200-L204 HydrophobicContact CZ-CG 3.99Å; F200-L204 WeakPolarHBondContact O-CG 3.39Å; F200-L204 PolarHBondContact O-N 3.39Å; D201-L204 WeakPolarHBondContact O-CB 3.19Å; D201-L204 PolarHBondContact O-N 2.99Å; L204-S206 VanDerWaalsContact C-N 3.3Å; L204-S206 PolarHBondContact O-N 3.06Å; L204-V207 PolarHBondContact O-N 3.37Å; L204-S208 WeakPolarHBondContact O-CB 3.41Å; L204-S208 PolarHBondContact O-N 3.28Å
205E97.4Very high94.7Very high134 Ų134110.9 Ų110.963%0.62654%0.535SS*.Hα-helixtrans-59.3-44.1174.6-76.8-179.8-179.400110.8D201 K202 D203 V207 S208 S209D201-E205 WeakPolarHBondContact O-CG 3.43Å; D201-E205 PolarHBondContact O-N 3.15Å; K202-E205 PolarHBondContact O-N 3.3Å; D203-E205 PolarHBondContact O-N 3.33Å; E205-V207 PolarHBondContact O-N 3.01Å; E205-S208 PolarHBondContact O-N 2.92Å; E205-S208 PolarHBondContact O-OG 3.28Å; E205-S209 WeakPolarHBondContact O-CB 3.29Å; E205-S209 PolarHBondContact O-N 3.48Å
206S97.5Very high95.4Very high64 Ų64108.6 Ų108.645%0.44853%0.527SS..Hα-helixtrans-63.1-43.8178.4740000112.2K202 D203 L204 S209 G210K202-S206 PolarHBondContact O-N 3.28Å; D203-S206 WeakPolarHBondContact CA-OG 3.44Å; D203-S206 PolarHBondContact O-N 3.43Å; D203-S206 PolarHBondContact O-OG 3.48Å; L204-S206 VanDerWaalsContact C-N 3.3Å; L204-S206 PolarHBondContact O-N 3.06Å; S206-S209 PolarHBondContact O-N 2.99Å; S206-S209 PolarHBondContact O-OG 3.46Å; S206-G210 PolarHBondContact O-N 3.28Å
207V98.3Very high96Very high83 Ų83106.7 Ų106.750%0.50352%0.521SS..Hα-helixtrans-61.2-46173.7171.50000110.8D203 L204 E205 S209 G210 I211D203-V207 WeakPolarHBondContact O-CG2 3.42Å; D203-V207 PolarHBondContact O-N 3.07Å; L204-V207 PolarHBondContact O-N 3.37Å; E205-V207 PolarHBondContact O-N 3.01Å; V207-S209 VanDerWaalsContact C-N 3.29Å; V207-S209 PolarHBondContact O-N 2.75Å; V207-G210 PolarHBondContact O-N 3.23Å; V207-G210 VanDerWaalsContact O-N 3.14Å; V207-I211 HydrophobicContact CG1-CD1 3.77Å; V207-I211 HydrophobicContact CG1-CG1 4.39Å; V207-I211 WeakPolarHBondContact O-CG1 3.32Å; V207-I211 PolarHBondContact O-N 3.28Å
208S97.9Very high96.6Very high50 Ų50103.8 Ų103.835%0.3552%0.519SS..Hα-helixtrans-60.8-40179.481.60000111.8L204 E205 I211 R212L204-S208 WeakPolarHBondContact O-CB 3.41Å; L204-S208 PolarHBondContact O-N 3.28Å; E205-S208 PolarHBondContact O-N 2.92Å; E205-S208 PolarHBondContact O-OG 3.28Å; S208-I211 PolarHBondContact O-N 2.96Å; S208-R212 WeakPolarHBondContact O-CG 3.34Å; S208-R212 PolarHBondContact O-N 3.01Å
209S98.1Very high96.9Very high49 Ų49105 Ų10534%0.34352%0.52SS..Hα-helixtrans-67.1-39176.881.60000111.6E205 S206 V207 R212 R213E205-S209 WeakPolarHBondContact O-CB 3.29Å; E205-S209 PolarHBondContact O-N 3.48Å; S206-S209 PolarHBondContact O-N 2.99Å; S206-S209 PolarHBondContact O-OG 3.46Å; V207-S209 VanDerWaalsContact C-N 3.29Å; V207-S209 PolarHBondContact O-N 2.75Å; S209-R212 PolarHBondContact O-N 3.42Å; S209-R213 WeakPolarHBondContact O-CG 3.45Å; S209-R213 PolarHBondContact O-N 3.26Å
210G97.9Very high97.1Very high36 Ų36100.4 Ų100.437%0.37151%0.508SS..Hα-helixtrans-62.8-46.4174.600000112.1S206 V207 R212 R213 L214S206-G210 PolarHBondContact O-N 3.28Å; V207-G210 PolarHBondContact O-N 3.23Å; V207-G210 VanDerWaalsContact O-N 3.14Å; G210-R212 VanDerWaalsContact C-N 3.34Å; G210-R212 PolarHBondContact O-N 3.29Å; G210-R213 WeakPolarHBondContact O-CB 3.49Å; G210-R213 PolarHBondContact O-N 3Å; G210-L214 PolarHBondContact O-N 3.43Å
211I98.1Very high97.3Very high90 Ų90100.6 Ų100.646%0.46251%0.509SS..Hα-helixtrans-62.1-42.1176.1-66167.2000110.7V207 S208 R213 L214 K215V207-I211 HydrophobicContact CG1-CD1 3.77Å; V207-I211 HydrophobicContact CG1-CG1 4.39Å; V207-I211 WeakPolarHBondContact O-CG1 3.32Å; V207-I211 PolarHBondContact O-N 3.28Å; S208-I211 PolarHBondContact O-N 2.96Å; I211-R213 PolarHBondContact O-N 2.79Å; I211-L214 PolarHBondContact O-N 3.22Å; I211-K215 WeakPolarHBondContact O-CG 3.44Å; I211-K215 PolarHBondContact O-N 3.37Å
212R98.1Very high97.3Very high168 Ų168101.1 Ų101.163%0.63451%0.512SS*.Hα-helixtrans-59.3-47.4174.3-74.9177.5-172.7-171.93.7110.9S208 S209 G210 L214 K215 H216S208-R212 WeakPolarHBondContact O-CG 3.34Å; S208-R212 PolarHBondContact O-N 3.01Å; S209-R212 PolarHBondContact O-N 3.42Å; G210-R212 VanDerWaalsContact C-N 3.34Å; G210-R212 PolarHBondContact O-N 3.29Å; R212-L214 VanDerWaalsContact C-N 3.33Å; R212-L214 PolarHBondContact O-N 2.71Å; R212-K215 PolarHBondContact O-N 2.84Å; R212-H216 PolarHBondContact O-N 3.14Å; R212-H216 VanDerWaalsContact O-N 3.08Å; R212-H216 PolarHBondContact O-ND1 2.81Å
213R97.8Very high97.2Very high183 Ų18397.5 Ų97.569%0.69150%0.499SS*.Hα-helixtrans-58.5-44.8177.1-71.1173.7-174.4-167.52.6111.7S209 G210 I211 K215 H216 L217S209-R213 WeakPolarHBondContact O-CG 3.45Å; S209-R213 PolarHBondContact O-N 3.26Å; G210-R213 WeakPolarHBondContact O-CB 3.49Å; G210-R213 PolarHBondContact O-N 3Å; I211-R213 PolarHBondContact O-N 2.79Å; R213-K215 VanDerWaalsContact C-N 3.33Å; R213-K215 PolarHBondContact O-N 2.92Å; R213-H216 PolarHBondContact O-N 3.11Å; R213-H216 VanDerWaalsContact O-N 3.16Å; R213-L217 WeakPolarHBondContact O-CG 3.47Å; R213-L217 PolarHBondContact O-N 3.03Å
214L98.1Very high97Very high120 Ų12098.5 Ų98.563%0.62850%0.504SS*.Hα-helixtrans-61.4-40.3177.9-174.560.3000112.1G210 I211 R212 H216 L217 S218G210-L214 PolarHBondContact O-N 3.43Å; I211-L214 PolarHBondContact O-N 3.22Å; R212-L214 VanDerWaalsContact C-N 3.33Å; R212-L214 PolarHBondContact O-N 2.71Å; L214-H216 PolarHBondContact O-N 3.38Å; L214-L217 PolarHBondContact O-N 3.27Å; L214-S218 PolarHBondContact O-N 3.08Å
215K97.8Very high96.7Very high148 Ų14898.3 Ų98.364%0.64350%0.502SS*.Hα-helixtrans-61.4-41.1173.7-74.6-176174.9-172.10112.9I211 R212 R213 L217 S218 K219I211-K215 WeakPolarHBondContact O-CG 3.44Å; I211-K215 PolarHBondContact O-N 3.37Å; R212-K215 PolarHBondContact O-N 2.84Å; R213-K215 VanDerWaalsContact C-N 3.33Å; R213-K215 PolarHBondContact O-N 2.92Å; K215-L217 VanDerWaalsContact C-N 3.34Å; K215-S218 PolarHBondContact O-N 3.31Å; K215-K219 PolarHBondContact O-N 2.83Å
216H97.8Very high96.3Very high132 Ų13298.7 Ų98.761%0.61150%0.504SS*.Hα-helixtrans-65.7-39.1176.1-67.794.5000111.8R212 R213 L214 K219 A220R212-H216 PolarHBondContact O-N 3.14Å; R212-H216 VanDerWaalsContact O-N 3.08Å; R212-H216 PolarHBondContact O-ND1 2.81Å; R213-H216 PolarHBondContact O-N 3.11Å; R213-H216 VanDerWaalsContact O-N 3.16Å; L214-H216 PolarHBondContact O-N 3.38Å; H216-K219 PolarHBondContact O-N 2.96Å; H216-A220 WeakPolarHBondContact O-CB 3.44Å; H216-A220 PolarHBondContact O-N 3.29Å
217L97.4Very high95.6Very high100 Ų100105.3 Ų105.352%0.52452%0.519SS..Hα-helixtrans-65.4-45.1175.1-69174.9000111.6R213 L214 K215 K219 A220 F221R213-L217 WeakPolarHBondContact O-CG 3.47Å; R213-L217 PolarHBondContact O-N 3.03Å; L214-L217 PolarHBondContact O-N 3.27Å; K215-L217 VanDerWaalsContact C-N 3.34Å; L217-K219 VanDerWaalsContact C-N 3.3Å; L217-K219 PolarHBondContact O-N 3Å; L217-A220 WeakPolarHBondContact O-CB 3.47Å; L217-A220 PolarHBondContact O-N 3.1Å; L217-A220 VanDerWaalsContact O-N 3.11Å; L217-F221 HydrophobicContact CB-CE2 4.42Å; L217-F221 WeakPolarHBondContact O-CD2 3.28Å; L217-F221 PolarHBondContact O-N 3.49Å
218S96.8Very high94.6Very high61 Ų61108.6 Ų108.643%0.42753%0.529SS..Hα-helixtrans-54-49.4174.2-170.50000110.7L214 K215 A220 F221 D222L214-S218 PolarHBondContact O-N 3.08Å; K215-S218 PolarHBondContact O-N 3.31Å; S218-A220 VanDerWaalsContact C-N 3.32Å; S218-A220 PolarHBondContact O-N 3Å; S218-F221 WeakPolarHBondContact O-CB 3.49Å; S218-F221 PolarHBondContact O-N 3.49Å; S218-F221 VanDerWaalsContact O-N 3.09Å; S218-D222 PolarHBondContact O-N 3.17Å
219K96.9Very high93.4Very high132 Ų132111.9 Ų111.957%0.57454%0.543SS*.Hα-helixtrans-60.1-41.6177.2-175.1176.4179.4178.90112.5K215 H216 L217 F221 D222 D223K215-K219 PolarHBondContact O-N 2.83Å; H216-K219 PolarHBondContact O-N 2.96Å; L217-K219 VanDerWaalsContact C-N 3.3Å; L217-K219 PolarHBondContact O-N 3Å; K219-F221 VanDerWaalsContact C-N 3.29Å; K219-F221 PolarHBondContact O-N 3.21Å; K219-D222 PolarHBondContact O-N 3.41Å; K219-D223 WeakPolarHBondContact O-CB 3.3Å; K219-D223 VanDerWaalsContact O-CG 3.23Å; K219-D223 PolarHBondContact O-N 3.14Å
220A96.4Very high92.1Very high43 Ų43118.3 Ų118.336%0.35556%0.56SS.*Hα-helixtrans-63.4-36176.500000112.1H216 L217 S218 I224H216-A220 WeakPolarHBondContact O-CB 3.44Å; H216-A220 PolarHBondContact O-N 3.29Å; L217-A220 WeakPolarHBondContact O-CB 3.47Å; L217-A220 PolarHBondContact O-N 3.1Å; L217-A220 VanDerWaalsContact O-N 3.11Å; S218-A220 VanDerWaalsContact C-N 3.32Å; S218-A220 PolarHBondContact O-N 3Å; A220-I224 WeakPolarHBondContact O-CD1 3.34Å; A220-I224 VanDerWaalsContact O-CG1 3.23Å; A220-I224 WeakPolarHBondContact O-CG1 3.42Å; A220-I224 PolarHBondContact O-N 2.89Å; A220-I224 VanDerWaalsContact O-N 3.14Å
221F96.1Very high90.2Very high126 Ų126122.8 Ų122.855%0.55358%0.582SS**Hα-helixtrans-68.2-44.7172.7-73.1-63.3000111.9L217 S218 K219 D223 I224 I225L217-F221 HydrophobicContact CB-CE2 4.42Å; L217-F221 WeakPolarHBondContact O-CD2 3.28Å; L217-F221 PolarHBondContact O-N 3.49Å; S218-F221 WeakPolarHBondContact O-CB 3.49Å; S218-F221 PolarHBondContact O-N 3.49Å; S218-F221 VanDerWaalsContact O-N 3.09Å; K219-F221 VanDerWaalsContact C-N 3.29Å; K219-F221 PolarHBondContact O-N 3.21Å; F221-D223 VanDerWaalsContact C-N 3.26Å; F221-D223 PolarHBondContact O-N 2.87Å; F221-I224 PolarHBondContact O-N 2.65Å; F221-I224 VanDerWaalsContact O-N 3.09Å; F221-I225 VanDerWaalsContact O-CG1 3.29Å; F221-I225 WeakPolarHBondContact O-CG1 3.38Å; F221-I225 PolarHBondContact O-N 3.45Å
222D95.4Very high88.5Confident94 Ų94122 Ų12250%0.50360%0.597SS.*Hα-helixtrans-57.5-41.8175.9-60.7-33.5000111S218 K219 I224 I225 Q226S218-D222 PolarHBondContact O-N 3.17Å; K219-D222 PolarHBondContact O-N 3.41Å; D222-I224 PolarHBondContact O-N 3.2Å; D222-I225 PolarHBondContact O-N 3.04Å; D222-Q226 WeakPolarHBondContact O-CB 3.28Å; D222-Q226 PolarHBondContact O-N 3.47Å
223D93.5Very high86.4Confident69 Ų69118.1 Ų118.137%0.36960%0.595SS.*Hα-helixtrans-65.3-35.4176.5-70.5-18.6000112.6K219 F221 R227K219-D223 WeakPolarHBondContact O-CB 3.3Å; K219-D223 VanDerWaalsContact O-CG 3.23Å; K219-D223 PolarHBondContact O-N 3.14Å; F221-D223 VanDerWaalsContact C-N 3.26Å; F221-D223 PolarHBondContact O-N 2.87Å; D223-R227 WeakPolarHBondContact O-CB 3.5Å; D223-R227 WeakPolarHBondContact O-CD 3.19Å; D223-R227 WeakPolarHBondContact O-CG 3.47Å; D223-R227 PolarHBondContact O-N 2.86Å
224I93.3Very high84.5Confident99 Ų99115.4 Ų115.451%0.50860%0.604SS.*Hα-helixtrans-72.1-47.7177.4-69.4164.5000110.1A220 F221 D222 Q226 R227 E228A220-I224 WeakPolarHBondContact O-CD1 3.34Å; A220-I224 VanDerWaalsContact O-CG1 3.23Å; A220-I224 WeakPolarHBondContact O-CG1 3.42Å; A220-I224 PolarHBondContact O-N 2.89Å; A220-I224 VanDerWaalsContact O-N 3.14Å; F221-I224 PolarHBondContact O-N 2.65Å; F221-I224 VanDerWaalsContact O-N 3.09Å; D222-I224 PolarHBondContact O-N 3.2Å; I224-Q226 VanDerWaalsContact C-N 3.35Å; I224-Q226 PolarHBondContact O-N 3.27Å; I224-R227 WeakPolarHBondContact O-CB 3.46Å; I224-R227 PolarHBondContact O-N 3.06Å; I224-R227 VanDerWaalsContact O-N 3.12Å; I224-E228 PolarHBondContact O-N 2.83Å
225I89.7Confident82.8Confident83 Ų83119 Ų11943%0.42662%0.615SS.*Hα-helixtrans-61.4-45.5178.9-65.5164.9000109.7F221 D222 R227 E228 D229F221-I225 VanDerWaalsContact O-CG1 3.29Å; F221-I225 WeakPolarHBondContact O-CG1 3.38Å; F221-I225 PolarHBondContact O-N 3.45Å; D222-I225 PolarHBondContact O-N 3.04Å; I225-R227 PolarHBondContact O-N 3.37Å; I225-E228 PolarHBondContact O-N 2.73Å; I225-D229 WeakPolarHBondContact CG2-OD2 3.35Å; I225-D229 WeakPolarHBondContact O-CB 3.46Å; I225-D229 PolarHBondContact O-N 2.98Å
226Q89.9Confident80.7Confident142 Ų142118.1 Ų118.166%0.66463%0.626SS**Hα-helixtrans-60.8-31.8176.4-173.1178.340.400113.1D222 I224D222-Q226 WeakPolarHBondContact O-CB 3.28Å; D222-Q226 PolarHBondContact O-N 3.47Å; I224-Q226 VanDerWaalsContact C-N 3.35Å; I224-Q226 PolarHBondContact O-N 3.27Å
227R82.6Confident78.5Confident204 Ų204117.3 Ų117.377%0.7763%0.632SS**Hα-helixtrans-75.8-33.9174.7-75.7171.9-176.8-139.51.8112.5D223 I224 I225D223-R227 WeakPolarHBondContact O-CB 3.5Å; D223-R227 WeakPolarHBondContact O-CD 3.19Å; D223-R227 WeakPolarHBondContact O-CG 3.47Å; D223-R227 PolarHBondContact O-N 2.86Å; I224-R227 WeakPolarHBondContact O-CB 3.46Å; I224-R227 PolarHBondContact O-N 3.06Å; I224-R227 VanDerWaalsContact O-N 3.12Å; I225-R227 PolarHBondContact O-N 3.37Å
228E76.9Confident76.3Confident151 Ų151117.1 Ų117.171%0.70665%0.654SS**Hα-helixtrans-71.1-40.6177.3-173.4170.3-171.200111.5I224 I225 R230I224-E228 PolarHBondContact O-N 2.83Å; I225-E228 PolarHBondContact O-N 2.73Å; E228-R230 PolarHBondContact O-N 3.04Å
229D73.9Confident74.3Confident120 Ų120117.4 Ų117.464%0.64267%0.667SS**SBendtrans-74.9-2.6-179.4-69.3-26.9000114.2I225 P231I225-D229 WeakPolarHBondContact CG2-OD2 3.35Å; I225-D229 WeakPolarHBondContact O-CB 3.46Å; I225-D229 PolarHBondContact O-N 2.98Å; D229-P231 WeakPolarHBondContact O-CD 3.27Å
230R70.6Confident72.1Confident184 Ų184115.4 Ų115.469%0.69468%0.675SS**  trans-95.198.7175.1-166.6174.8-175.9-177.51.1110.4E228 G232E228-R230 PolarHBondContact O-N 3.04Å; R230-G232 PolarHBondContact O-N 3.09Å
231P56.8Low69.8Low129 Ų129122.5 Ų122.584%0.83870%0.703SS**THydrogen-bonded Turntrans-69.6103.2173.929.1-34000109.1D229D229-P231 WeakPolarHBondContact O-CD 3.27Å
232G62.5Low67.4Low75 Ų75124.3 Ų124.377%0.77372%0.715SS**THydrogen-bonded Turntrans138.627164.600000119.5R230R230-G232 PolarHBondContact O-N 3.09Å
233S53.5Low65.6Low85 Ų85129.3 Ų129.359%0.59473%0.727SS**  trans-152.660.8163.660.90000114K235S233-K235 PolarHBondContact O-N 2.93Å
234S57.9Low63.8Low127 Ų127135.5 Ų135.589%0.88875%0.751SS**  trans-7654.7163.462.30000111.4
235K63.1Low62.1Low195 Ų195134.3 Ų134.385%0.84875%0.745SS**  trans-137.692.5162.3-75.1-171.6-179.8176.20107.9S233S233-K235 PolarHBondContact O-N 2.93Å
236C53.5Low60.6Low129 Ų129135.3 Ų135.387%0.87275%0.751SS**SBendtrans-168.6151.8134.7-98.50000111.5
237P51.2Low59.2Low116 Ų116134.3 Ų134.375%0.75377%0.767SS**  trans-90.6120-142.933.3-32.4000112.5G239P237-G239 PolarHBondContact O-N 3.46Å
238G51.6Low58.4Low96 Ų96128.6 Ų128.699%0.9976%0.759SS**  trans-75.275.715900000110.2
239G55.8Low57.5Low66 Ų66124 Ų12468%0.6875%0.751SS**  trans-169.757.3-17500000115.8P237P237-G239 PolarHBondContact O-N 3.46Å
240A49.1Very low56.9Low90 Ų90126.2 Ų126.274%0.74476%0.755SS**  trans-16443.5163.700000114.3M242A240-M242 PolarHBondContact O-N 3.25Å
241M48.9Very low56.3Low192 Ų192124.1 Ų124.195%0.94676%0.757SS**  trans-82.883.7143.9-80.6-164.3178.500106R243M241-R243 VanDerWaalsContact C-N 3.26Å; M241-R243 PolarHBondContact O-N 3.24Å
242M45.7Very low56.3Low164 Ų164120.5 Ų120.581%0.80874%0.735SS**  trans-56.197.5167.4-83.9-164.877.200107.6A240 K244A240-M242 PolarHBondContact O-N 3.25Å; M242-K244 PolarHBondContact O-N 2.94Å; M242-K244 VanDerWaalsContact O-N 3.09Å
243R58.1Low56.2Low199 Ų199127.6 Ų127.675%0.75174%0.738SS**  trans-52.9116.6151.3-66.1-177-69.2-179.9-1104.5M241 L245M241-R243 VanDerWaalsContact C-N 3.26Å; M241-R243 PolarHBondContact O-N 3.24Å; R243-L245 HydrophobicContact CB-CG 4.2Å; R243-L245 PolarHBondContact O-N 3.44Å
244K56.3Low56.5Low200 Ų200126.9 Ų126.987%0.8773%0.733SS**  trans-62.479.2165.4-69.6-91.7-174.5177.70106.6M242M242-K244 PolarHBondContact O-N 2.94Å; M242-K244 VanDerWaalsContact O-N 3.09Å
245L56.4Low56.6Low73 Ų73125.3 Ų125.338%0.38272%0.715SS.*  trans-84.8124.4160.9-69.7169.5000104.3R243 L251R243-L245 HydrophobicContact CB-CG 4.2Å; R243-L245 PolarHBondContact O-N 3.44Å; L245-L251 HydrophobicContact CD2-CD2 3.92Å; L245-L251 HydrophobicContact CD2-CG 4.45Å
246D57.6Low56.6Low104 Ų104121.9 Ų121.956%0.55671%0.705SS**  trans-55.9155.3167-59.8-40000108.5S248 G249D246-S248 PolarHBondContact O-N 3.12Å; D246-G249 PolarHBondContact O-N 3.49Å
247A62.3Low56.9Low122 Ų122120 Ų120100%1.00869%0.69SS**THydrogen-bonded Turntrans-54.2-6.7-172.800000115.6
248S63.9Low57.3Low84 Ų84123 Ų12359%0.58769%0.686SS**THydrogen-bonded Turntrans-95.8-3175.767.50000115.3D246 K250D246-S248 PolarHBondContact O-N 3.12Å; S248-K250 PolarHBondContact O-N 3.32Å
249G59.3Low57.8Low53 Ų53127.7 Ų127.755%0.54667%0.674SS.*  trans64.13.517600000115.6D246D246-G249 PolarHBondContact O-N 3.49Å
250K60Low58Low167 Ų167127.3 Ų127.373%0.72666%0.664SS**  trans-95.2122.5-179.9-68.8177.1-176.6176.50109.4S248 S252S248-K250 PolarHBondContact O-N 3.32Å; K250-S252 PolarHBondContact O-N 3.21Å
251L58.7Low58.6Low140 Ų140125.3 Ų125.373%0.73365%0.645SS**  trans-61.8102.8169.6-69167.2000108.1L245 R253L245-L251 HydrophobicContact CD2-CD2 3.92Å; L245-L251 HydrophobicContact CD2-CG 4.45Å; L251-R253 PolarHBondContact O-N 2.98Å; L251-R253 VanDerWaalsContact O-N 3.11Å
252S58Low59.2Low53 Ų53120.5 Ų120.537%0.37162%0.623SS.*  trans-55.7119.2179.4-177.20000109.7K250 S254 N255K250-S252 PolarHBondContact O-N 3.21Å; S252-S254 PolarHBondContact O-N 3.48Å; S252-S254 PolarHBondContact OG-OG 3.49Å; S252-N255 WeakPolarHBondContact O-CB 3.43Å; S252-N255 PolarHBondContact O-N 3Å
253R58.5Low60Low225 Ų225118 Ų11885%0.84961%0.613SS**Hα-helixtrans-51.5-29.6-177.5-85.7179.3154.5-177.5-6.3112.5L251 N255 L256 T257L251-R253 PolarHBondContact O-N 2.98Å; L251-R253 VanDerWaalsContact O-N 3.11Å; R253-N255 VanDerWaalsContact C-N 3.34Å; R253-N255 PolarHBondContact O-N 3.45Å; R253-L256 PolarHBondContact O-N 3.45Å; R253-T257 PolarHBondContact O-N 3.39Å; R253-T257 PolarHBondContact O-OG1 2.9Å
254S59.7Low60.2Low70 Ų70111.8 Ų111.849%0.4960%0.599SS.*Hα-helixtrans-67.1-29.1177.459.10000113.9S252 T257 R258S252-S254 PolarHBondContact O-N 3.48Å; S252-S254 PolarHBondContact OG-OG 3.49Å; S254-T257 PolarHBondContact O-OG1 3.03Å; S254-T257 VanDerWaalsContact O-OG1 3.14Å; S254-R258 VanDerWaalsContact O-CB 3.3Å; S254-R258 WeakPolarHBondContact O-CB 3.47Å; S254-R258 PolarHBondContact O-N 3.3Å; S254-R258 VanDerWaalsContact O-N 3.16Å
255N60.8Low60.5Low93 Ų93107.6 Ų107.650%0.49759%0.586SS.*Hα-helixtrans-76.8-31.8176.5-76.8-52.8000112.1S252 R253 R259S252-N255 WeakPolarHBondContact O-CB 3.43Å; S252-N255 PolarHBondContact O-N 3Å; R253-N255 VanDerWaalsContact C-N 3.34Å; R253-N255 PolarHBondContact O-N 3.45Å; N255-R259 WeakPolarHBondContact O-CB 3.34Å; N255-R259 WeakPolarHBondContact O-CG 3.47Å; N255-R259 PolarHBondContact O-N 3.32Å; N255-R259 VanDerWaalsContact O-N 3.12Å
256L62.3Low60.7Low124 Ų124108 Ų10865%0.64959%0.592SS**Hα-helixtrans-71.2-44.6177.5-157.1104000111R253 R259 A260R253-L256 PolarHBondContact O-N 3.45Å; L256-R259 PolarHBondContact O-N 3.45Å; L256-A260 PolarHBondContact O-N 3.45Å
257T60.6Low60.9Low90 Ų90108.8 Ų108.855%0.55260%0.595SS**Hα-helixtrans-66.4-40.1177.854.40000111.9R253 S254 R259 A260 S261R253-T257 PolarHBondContact O-N 3.39Å; R253-T257 PolarHBondContact O-OG1 2.9Å; S254-T257 PolarHBondContact O-OG1 3.03Å; S254-T257 VanDerWaalsContact O-OG1 3.14Å; T257-R259 VanDerWaalsContact C-N 3.32Å; T257-R259 PolarHBondContact O-N 3.31Å; T257-A260 PolarHBondContact O-N 2.99Å; T257-S261 PolarHBondContact O-N 2.73Å; T257-S261 PolarHBondContact O-OG 3.02Å
258R60.6Low60.9Low178 Ų178104.3 Ų104.367%0.67256%0.562SS**Hα-helixtrans-63.9-34.7174.6-164.2178.8-166.9-1352.6112.7S254 S261 N262S254-R258 VanDerWaalsContact O-CB 3.3Å; S254-R258 WeakPolarHBondContact O-CB 3.47Å; S254-R258 PolarHBondContact O-N 3.3Å; S254-R258 VanDerWaalsContact O-N 3.16Å; R258-S261 PolarHBondContact O-OG 3.42Å; R258-S261 VanDerWaalsContact O-OG 3.07Å; R258-N262 VanDerWaalsContact O-CG 3.26Å; R258-N262 PolarHBondContact O-N 3.3Å; R258-N262 PolarHBondContact O-ND2 2.94Å
259R61.3Low60.8Low194 Ų194101.8 Ų101.873%0.73255%0.549SS*.Hα-helixtrans-72.5-39.1174.3-80.6-174.4172-145-0.9112.4N255 L256 T257 L263N255-R259 WeakPolarHBondContact O-CB 3.34Å; N255-R259 WeakPolarHBondContact O-CG 3.47Å; N255-R259 PolarHBondContact O-N 3.32Å; N255-R259 VanDerWaalsContact O-N 3.12Å; L256-R259 PolarHBondContact O-N 3.45Å; T257-R259 VanDerWaalsContact C-N 3.32Å; T257-R259 PolarHBondContact O-N 3.31Å; R259-L263 PolarHBondContact O-N 3.03Å
260A60.3Low61Low58 Ų58109 Ų10948%0.47956%0.56SS.*Hα-helixtrans-65-41.6176.800000112.2L256 T257 L263 S264L256-A260 PolarHBondContact O-N 3.45Å; T257-A260 PolarHBondContact O-N 2.99Å; A260-L263 PolarHBondContact O-N 2.97Å; A260-S264 PolarHBondContact O-N 3.39Å
261S60.9Low61Low48 Ų48103.6 Ų103.634%0.33655%0.546SS..Hα-helixtrans-67.9-35.1178.462.10000113.2T257 R258 L263 S264 N265T257-S261 PolarHBondContact O-N 2.73Å; T257-S261 PolarHBondContact O-OG 3.02Å; R258-S261 PolarHBondContact O-OG 3.42Å; R258-S261 VanDerWaalsContact O-OG 3.07Å; S261-L263 VanDerWaalsContact C-N 3.33Å; S261-L263 PolarHBondContact O-N 3.25Å; S261-S264 WeakPolarHBondContact CA-OG 3.42Å; S261-S264 PolarHBondContact O-N 3.16Å; S261-S264 PolarHBondContact O-OG 3.41Å; S261-N265 WeakPolarHBondContact O-CB 3.16Å; S261-N265 PolarHBondContact O-N 3.37Å; S261-N265 PolarHBondContact O-ND2 2.99Å
262N61.9Low61Low92 Ų92102 Ų10249%0.49254%0.538SS..Hα-helixtrans-63.7-40.2174-73.9-13.2000111.6R258 T266R258-N262 VanDerWaalsContact O-CG 3.26Å; R258-N262 PolarHBondContact O-N 3.3Å; R258-N262 PolarHBondContact O-ND2 2.94Å; N262-T266 WeakPolarHBondContact O-CG2 3.39Å; N262-T266 PolarHBondContact O-N 2.99Å; N262-T266 VanDerWaalsContact O-N 3.15Å; N262-T266 PolarHBondContact O-OG1 3.42Å
263L63.2Low61.3Low112 Ų112104 Ų10459%0.58655%0.549SS*.Hα-helixtrans-67.9-42.7176.6-70.3172.6000112R259 A260 S261 N265 T266 L267R259-L263 PolarHBondContact O-N 3.03Å; A260-L263 PolarHBondContact O-N 2.97Å; S261-L263 VanDerWaalsContact C-N 3.33Å; S261-L263 PolarHBondContact O-N 3.25Å; L263-N265 VanDerWaalsContact C-N 3.31Å; L263-N265 PolarHBondContact O-N 3.49Å; L263-T266 WeakPolarHBondContact CA-OG1 3.4Å; L263-T266 PolarHBondContact O-N 3.17Å; L263-T266 PolarHBondContact O-OG1 3.44Å; L263-L267 PolarHBondContact O-N 3.36Å
264S60.7Low61.2Low67 Ų6795.7 Ų95.747%0.46953%0.527SS..Hα-helixtrans-62.8-38176.865.10000112.3A260 S261 L267 G268A260-S264 PolarHBondContact O-N 3.39Å; S261-S264 WeakPolarHBondContact CA-OG 3.42Å; S261-S264 PolarHBondContact O-N 3.16Å; S261-S264 PolarHBondContact O-OG 3.41Å; S264-L267 PolarHBondContact O-N 3.24Å; S264-G268 PolarHBondContact O-N 2.88Å
265N64.3Low61.3Low112 Ų11296.3 Ų96.360%0.59953%0.528SS*.Hα-helixtrans-65.8-39.1176.3-70.1-14000111.8S261 L263 G269S261-N265 WeakPolarHBondContact O-CB 3.16Å; S261-N265 PolarHBondContact O-N 3.37Å; S261-N265 PolarHBondContact O-ND2 2.99Å; L263-N265 VanDerWaalsContact C-N 3.31Å; L263-N265 PolarHBondContact O-N 3.49Å; N265-G269 PolarHBondContact O-N 3.12Å
266T60.8Low61.2Low81 Ų8197.4 Ų97.450%0.49753%0.534SS..Hα-helixtrans-68.6-41.5176.852.80000113.1N262 L263 G269 W270N262-T266 WeakPolarHBondContact O-CG2 3.39Å; N262-T266 PolarHBondContact O-N 2.99Å; N262-T266 VanDerWaalsContact O-N 3.15Å; N262-T266 PolarHBondContact O-OG1 3.42Å; L263-T266 WeakPolarHBondContact CA-OG1 3.4Å; L263-T266 PolarHBondContact O-N 3.17Å; L263-T266 PolarHBondContact O-OG1 3.44Å; T266-G269 PolarHBondContact O-N 3.05Å; T266-W270 VanDerWaalsContact O-CD1 3.25Å; T266-W270 PolarHBondContact O-N 2.96Å
267L60.3Low61.1Low121 Ų12195.7 Ų95.763%0.63453%0.533SS*.Hα-helixtrans-70.6-39.9176.3-95140.9000112.4L263 S264 G269 W270 A271L263-L267 PolarHBondContact O-N 3.36Å; S264-L267 PolarHBondContact O-N 3.24Å; L267-G269 VanDerWaalsContact C-N 3.31Å; L267-G269 PolarHBondContact O-N 3.11Å; L267-W270 PolarHBondContact O-N 3.01Å; L267-A271 PolarHBondContact O-N 2.9Å; L267-A271 VanDerWaalsContact O-N 3.09Å
268G62.6Low61.1Low29 Ų2998 Ų9830%0.29954%0.54SS..Hα-helixtrans-63-36.6173.500000112.5S264 W270 A271 N272S264-G268 PolarHBondContact O-N 2.88Å; G268-W270 VanDerWaalsContact C-N 3.33Å; G268-W270 PolarHBondContact O-N 3.33Å; G268-A271 PolarHBondContact O-N 2.93Å; G268-N272 PolarHBondContact O-N 3.36Å; G268-N272 PolarHBondContact O-ND2 2.94Å
269G63.1Low60.8Low31 Ų3199.5 Ų99.532%0.3255%0.546SS..Hα-helixtrans-60.5-40.1172.200000112.8N265 T266 L267 T273N265-G269 PolarHBondContact O-N 3.12Å; T266-G269 PolarHBondContact O-N 3.05Å; L267-G269 VanDerWaalsContact C-N 3.31Å; L267-G269 PolarHBondContact O-N 3.11Å; G269-T273 WeakPolarHBondContact O-CB 3.29Å; G269-T273 PolarHBondContact O-N 3.13Å; G269-T273 PolarHBondContact O-OG1 3.4Å
270W61.8Low60.3Low205 Ų20599 Ų9978%0.77755%0.549SS*.Hα-helixtrans-69.5-39.7177.7-73.823.3000112.4T266 L267 G268 T273 A274T266-W270 VanDerWaalsContact O-CD1 3.25Å; T266-W270 PolarHBondContact O-N 2.96Å; L267-W270 PolarHBondContact O-N 3.01Å; G268-W270 VanDerWaalsContact C-N 3.33Å; G268-W270 PolarHBondContact O-N 3.33Å; W270-T273 PolarHBondContact O-N 3.22Å; W270-A274 WeakPolarHBondContact O-CB 3.43Å; W270-A274 PolarHBondContact O-N 3.21Å
271A60.5Low60.2Low52 Ų52102.1 Ų102.143%0.4356%0.564SS.*Hα-helixtrans-61.5-44.9175.600000111.7L267 G268 T273 A274 V275L267-A271 PolarHBondContact O-N 2.9Å; L267-A271 VanDerWaalsContact O-N 3.09Å; G268-A271 PolarHBondContact O-N 2.93Å; A271-T273 VanDerWaalsContact C-N 3.33Å; A271-T273 PolarHBondContact O-N 3.01Å; A271-A274 PolarHBondContact O-N 3.49Å; A271-V275 WeakPolarHBondContact O-CB 3.32Å; A271-V275 VanDerWaalsContact O-CG2 3.28Å; A271-V275 WeakPolarHBondContact O-CG2 3.37Å; A271-V275 PolarHBondContact O-N 3.18Å
272N59.8Low59.4Low106 Ų106111.2 Ų111.257%0.56761%0.609SS**Hα-helixtrans-66.7-35.1177.7-68.2-25.6000112.4G268 N276G268-N272 PolarHBondContact O-N 3.36Å; G268-N272 PolarHBondContact O-ND2 2.94Å; N272-N276 VanDerWaalsContact O-CB 3.3Å; N272-N276 WeakPolarHBondContact O-CB 3.39Å; N272-N276 VanDerWaalsContact O-CG 3.31Å; N272-N276 PolarHBondContact O-N 2.78Å; N272-N276 PolarHBondContact O-ND2 3.32Å
273T62.6Low59.3Low97 Ų97112.2 Ų112.260%0.59562%0.615SS**Hα-helixtrans-70.1-40.2176.9-47.90000111.5G269 W270 A271 S277G269-T273 WeakPolarHBondContact O-CB 3.29Å; G269-T273 PolarHBondContact O-N 3.13Å; G269-T273 PolarHBondContact O-OG1 3.4Å; W270-T273 PolarHBondContact O-N 3.22Å; A271-T273 VanDerWaalsContact C-N 3.33Å; A271-T273 PolarHBondContact O-N 3.01Å; T273-S277 PolarHBondContact O-N 3.31Å; T273-S277 VanDerWaalsContact O-N 3.16Å
274A58.1Low59.1Low49 Ų49112.2 Ų112.241%0.40562%0.617SS.*Hα-helixtrans-66.2-45176.300000111.8W270 A271 S277 I278W270-A274 WeakPolarHBondContact O-CB 3.43Å; W270-A274 PolarHBondContact O-N 3.21Å; A271-A274 PolarHBondContact O-N 3.49Å; A274-S277 PolarHBondContact O-N 3.48Å; A274-S277 PolarHBondContact O-OG 3.28Å; A274-I278 WeakPolarHBondContact O-CG1 3.49Å
275V59.9Low59Low84 Ų84114.7 Ų114.751%0.50963%0.625SS.*Hα-helixtrans-66.4-38.8179.2173.70000111.8A271 S277 I278 R279A271-V275 WeakPolarHBondContact O-CB 3.32Å; A271-V275 VanDerWaalsContact O-CG2 3.28Å; A271-V275 WeakPolarHBondContact O-CG2 3.37Å; A271-V275 PolarHBondContact O-N 3.18Å; V275-S277 VanDerWaalsContact C-N 3.29Å; V275-S277 PolarHBondContact O-N 3.33Å; V275-I278 PolarHBondContact O-N 3.44Å; V275-R279 PolarHBondContact O-N 2.94Å
276N59.2Low58.7Low115 Ų115114.9 Ų114.962%0.61563%0.626SS**Hα-helixtrans-70.8-22176.1-76.6-21.4000113.7N272 I278N272-N276 VanDerWaalsContact O-CB 3.3Å; N272-N276 WeakPolarHBondContact O-CB 3.39Å; N272-N276 VanDerWaalsContact O-CG 3.31Å; N272-N276 PolarHBondContact O-N 2.78Å; N272-N276 PolarHBondContact O-ND2 3.32Å; N276-I278 VanDerWaalsContact C-N 3.29Å
277S61.3Low58.5Low89 Ų89117 Ų11762%0.62263%0.634SS**Hα-helixtrans-75.5-18.1173.875.40000113.7T273 A274 V275T273-S277 PolarHBondContact O-N 3.31Å; T273-S277 VanDerWaalsContact O-N 3.16Å; A274-S277 PolarHBondContact O-N 3.48Å; A274-S277 PolarHBondContact O-OG 3.28Å; V275-S277 VanDerWaalsContact C-N 3.29Å; V275-S277 PolarHBondContact O-N 3.33Å
278I59.4Low58.4Low139 Ų139116.7 Ų116.771%0.71363%0.634SS**Hα-helixtrans-96.7-26.8-176.6-62.7165.9000111.5A274 V275 N276 K280A274-I278 WeakPolarHBondContact O-CG1 3.49Å; V275-I278 PolarHBondContact O-N 3.44Å; N276-I278 VanDerWaalsContact C-N 3.29Å; I278-K280 PolarHBondContact O-N 3.21Å
279R54.7Low58.1Low209 Ų209123 Ų12379%0.78966%0.658SS**  trans-95.477.7172.5-79-172.8174-172.8-1.1111.6V275V275-R279 PolarHBondContact O-N 2.94Å
280K50.4Low57.8Low183 Ų183130.1 Ų130.180%0.79669%0.685SS**  trans-113111.8153.2-77.4-172.1176.1-174.40108I278I278-K280 PolarHBondContact O-N 3.21Å
281P59.6Low57.4Low123 Ų123123.8 Ų123.880%0.79968%0.677SS**  trans-72.7138.3167.830.8-29.6000108.9
282N43.5Very low57.1Low240 Ų240130.4 Ų130.4100%1.28370%0.699SS**  trans-74.90154.5-77.5-33000108.7

Retrieved 282 of 282 residues in 153.8 ms (Link to these results)