G4VQB9_SCHMA Loading...

SERTA domain-containing protein

AlphaFold DB , UniProt , Accession G4VQB9, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 484 aa.

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(Predicted Aligned Error values between residue pairs)
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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
1M36.5Very low38.6Very low248 Ų248135.9 Ų135.9100%1.22269%0.69SS**  0132.40-80.3170.8151.500108.9
2I33.6Very low39.3Very low154 Ų154132.3 Ų132.379%0.7968%0.682SS**  trans-97.3122.9173-62.5174.7000107.7I4I2-I4 HydrophobicContact CG2-CG1 4.07Å; I2-I4 PolarHBondContact O-N 3.5Å
3N34.9Very low39.8Very low161 Ų161129 Ų12986%0.86166%0.662SS**  trans-85.894.1179.4-170.7-2.2000109.6N5N3-N5 PolarHBondContact O-N 3.06Å
4I38.7Very low39.9Very low117 Ų117128.3 Ų128.360%0.665%0.648SS**  trans-79.1120-175.6-58.8176.7000109.7I2 T6I2-I4 HydrophobicContact CG2-CG1 4.07Å; I2-I4 PolarHBondContact O-N 3.5Å; I4-T6 PolarHBondContact O-N 3Å; I4-T6 VanDerWaalsContact O-N 3.09Å
5N38.1Very low40.2Very low100 Ų100127.2 Ų127.254%0.53564%0.644SS.*  trans-69.6104.4-178.5-177.1-4.7000111.6N3 R7 S8N3-N5 PolarHBondContact O-N 3.06Å; N5-R7 PolarHBondContact O-N 2.89Å; N5-R7 WeakPolarHBondContact OD1-CB 3.47Å; N5-R7 PolarHBondContact OD1-N 3.33Å; N5-S8 PolarHBondContact O-N 3.39Å; N5-S8 VanDerWaalsContact O-N 3.15Å; N5-S8 PolarHBondContact O-OG 2.77Å
6T40.5Very low40.3Very low136 Ų136132 Ų13283%0.83465%0.654SS**THydrogen-bonded Turntrans-65.6-6.2-179.355.20000114.9I4I4-T6 PolarHBondContact O-N 3Å; I4-T6 VanDerWaalsContact O-N 3.09Å
7R40.3Very low40.1Very low221 Ų221133.9 Ų133.983%0.83466%0.66SS**THydrogen-bonded Turntrans-89.6-17.9174.4-64.5-174.1174.6-169.7-0.9114.1N5 V9N5-R7 PolarHBondContact O-N 2.89Å; N5-R7 WeakPolarHBondContact OD1-CB 3.47Å; N5-R7 PolarHBondContact OD1-N 3.33Å; R7-V9 PolarHBondContact O-N 3.08Å
8S38.5Very low39.7Very low60 Ų60130.9 Ų130.942%0.4266%0.655SS.*SBendtrans-78.3109.6166.249.30000108.9N5 L10N5-S8 PolarHBondContact O-N 3.39Å; N5-S8 VanDerWaalsContact O-N 3.15Å; N5-S8 PolarHBondContact O-OG 2.77Å; S8-L10 PolarHBondContact O-N 3.4Å
9V39.5Very low39.2Very low108 Ų108134.6 Ų134.666%0.65566%0.662SS**  trans-71.682.4165.1-176.60000107.5R7 R11R7-V9 PolarHBondContact O-N 3.08Å; V9-R11 PolarHBondContact O-N 2.72Å
10L35.6Very low38.8Very low85 Ų85136.4 Ų136.445%0.44567%0.674SS.*  trans-56.2106.4161.3-72.6165.6000106.4S8 Y14S8-L10 PolarHBondContact O-N 3.4Å; L10-Y14 HydrophobicContact CD2-CG 4.43Å
11R48.2Very low38.4Very low105 Ų105139.1 Ų139.140%0.39668%0.683SS.*  trans-66.7155.9171.5-58.2177.4169.9-177.1-4.7108.9V9 E13 Y14V9-R11 PolarHBondContact O-N 2.72Å; R11-E13 VanDerWaalsContact CB-CD 3.42Å; R11-E13 HydrophobicContact CB-CG 4.4Å; R11-E13 WeakPolarHBondContact CB-OE2 3.29Å; R11-E13 WeakPolarHBondContact CD-OE1 3.49Å; R11-E13 IonicContact CZ-OE1 2.74Å; R11-E13 IonicContact NE-OE1 2.73Å; R11-E13 IonicContact NH1-OE1 3.16Å; R11-E13 PolarHBondContact NH1-OE1 3.39Å; R11-E13 PolarHBondContact O-N 2.98Å; R11-E13 VanDerWaalsContact O-N 3.09Å; R11-Y14 HydrophobicContact CB-CD2 4.05Å; R11-Y14 HydrophobicContact CB-CE2 4.33Å; R11-Y14 PolarHBondContact O-N 3.31Å
12P47.5Very low38.1Very low92 Ų92132.3 Ų132.360%0.59766%0.66SS**G310 helixtrans-54.8-31.1-174.1-27.736.8000114.9Y14 L15P12-Y14 PolarHBondContact O-N 3.12Å; P12-Y14 VanDerWaalsContact O-N 3.17Å; P12-L15 PolarHBondContact O-N 3.5Å
13E45.9Very low38Very low90 Ų90131.5 Ų131.542%0.42166%0.662SS.*G310 helixtrans-59.4-24.6175.762.8-93-147.500113.7R11R11-E13 VanDerWaalsContact CB-CD 3.42Å; R11-E13 HydrophobicContact CB-CG 4.4Å; R11-E13 WeakPolarHBondContact CB-OE2 3.29Å; R11-E13 WeakPolarHBondContact CD-OE1 3.49Å; R11-E13 IonicContact CZ-OE1 2.74Å; R11-E13 IonicContact NE-OE1 2.73Å; R11-E13 IonicContact NH1-OE1 3.16Å; R11-E13 PolarHBondContact NH1-OE1 3.39Å; R11-E13 PolarHBondContact O-N 2.98Å; R11-E13 VanDerWaalsContact O-N 3.09Å
14Y40.9Very low37.7Very low119 Ų119129.4 Ų129.447%0.46766%0.657SS.*G310 helixtrans-85.9-7.3176.9-63.2-82.7000114.1L10 R11 P12L10-Y14 HydrophobicContact CD2-CG 4.43Å; R11-Y14 HydrophobicContact CB-CD2 4.05Å; R11-Y14 HydrophobicContact CB-CE2 4.33Å; R11-Y14 PolarHBondContact O-N 3.31Å; P12-Y14 PolarHBondContact O-N 3.12Å; P12-Y14 VanDerWaalsContact O-N 3.17Å
15L43.6Very low37.4Very low112 Ų112129.3 Ų129.359%0.58667%0.667SS**THydrogen-bonded Turntrans-92.8-17.5-180-69.6170.5000113.2P12 H17P12-L15 PolarHBondContact O-N 3.5Å; L15-H17 VanDerWaalsContact C-N 3.34Å
16Y42Very low37.1Very low204 Ų204130.9 Ų130.980%0.868%0.68SS**SBendtrans-897.4177.5-78.8-82.6000114.3
17H38Very low36.5Very low164 Ų164131 Ų13176%0.75968%0.68SS**SBendtrans-107.338.4174.6-68.8-13.1000112.1L15L15-H17 VanDerWaalsContact C-N 3.34Å
18S32.1Very low36.1Very low81 Ų81129.7 Ų129.757%0.56668%0.68SS**SBendtrans-144.3138.3174.5-71.80000109.8
19Y29.7Very low35.9Very low200 Ų200132.9 Ų132.978%0.78470%0.698SS**  trans69.278.4-178.6-54.8-80.8000116.8F21Y19-F21 HydrophobicContact CD1-CD2 4.42Å
20N32.1Very low35.3Very low171 Ų171139.3 Ų139.391%0.91471%0.712SS**  trans-131.273.8140.1-100.7-25.7000109.3S22N20-S22 VanDerWaalsContact C-N 3.29Å; N20-S22 PolarHBondContact O-N 3.45Å; N20-S22 VanDerWaalsContact O-N 3.09Å
21F29.2Very low35.3Very low194 Ų194142.3 Ų142.385%0.85173%0.728SS**  trans-80.567.1176.3-101.8-85.7000110.4Y19Y19-F21 HydrophobicContact CD1-CD2 4.42Å
22S30.2Very low34.5Very low105 Ų105147.4 Ų147.473%0.73475%0.749SS**  trans-167.573.6170.8-80.20000115.1N20N20-S22 VanDerWaalsContact C-N 3.29Å; N20-S22 PolarHBondContact O-N 3.45Å; N20-S22 VanDerWaalsContact O-N 3.09Å
23T31.2Very low33.9Very low136 Ų136148.9 Ų148.983%0.83476%0.756SS**  trans-178.6135.7143.7250000111.3
24P29.4Very low33.4Very low117 Ų117148.2 Ų148.276%0.7676%0.761SS**  trans-94.8161.416536.5-31.9000112
25S31.7Very low33.1Very low115 Ų115146.8 Ų146.880%0.80477%0.769SS**  trans69.6147.8-173.485.40000114.2
26T32Very low32.7Very low134 Ų134148.9 Ų148.982%0.82277%0.773SS**  cis-122.7163.86.348.50000112.8
27V29.5Very low32.4Very low137 Ų137146.3 Ų146.383%0.8377%0.772SS**  trans-80.4131.3178.1174.10000111.1
28K31.8Very low32.3Very low194 Ų194142.4 Ų142.484%0.84376%0.757SS**  trans-165.8132.6145.5-109.1154.1-172.2179.40114.2
29T32.8Very low32.8Very low128 Ų128143.7 Ų143.779%0.78576%0.761SS**  trans43103.8157.240.80000119.6D31T29-D31 PolarHBondContact O-N 3.32Å
30Y28.7Very low33.2Very low243 Ų243138.5 Ų138.595%0.95375%0.747SS**  trans-67.8107.9151.2-90.5-110.1000109.6
31D34.2Very low33.8Very low147 Ų147137.8 Ų137.879%0.78675%0.749SS**  trans-158.640.4158-112.1-29.5000112.6T29 V33T29-D31 PolarHBondContact O-N 3.32Å; D31-V33 PolarHBondContact O-N 3.27Å; D31-V33 VanDerWaalsContact O-N 3.07Å
32Y32.4Very low34Very low213 Ų213131.4 Ų131.484%0.83573%0.732SS**  trans-84.580.9178.7-144.8-86.7000111.2S34Y32-S34 PolarHBondContact O-N 3.07Å
33V34.6Very low34.3Very low123 Ų123131.4 Ų131.475%0.74573%0.729SS**  trans-55122.4172177.90000109D31 S35D31-V33 PolarHBondContact O-N 3.27Å; D31-V33 VanDerWaalsContact O-N 3.07Å; V33-S35 PolarHBondContact O-N 3.33Å
34S34.4Very low34.6Very low75 Ų75129.8 Ų129.852%0.52472%0.719SS.*  trans-68.783.9-1701660000112.5Y32 K36Y32-S34 PolarHBondContact O-N 3.07Å; S34-K36 PolarHBondContact O-N 3.23Å; S34-K36 WeakPolarHBondContact OG-CD 3.3Å; S34-K36 WeakPolarHBondContact OG-CE 3.4Å; S34-K36 WeakPolarHBondContact OG-CG 3.41Å
35S35Very low34.7Very low89 Ų89133.7 Ų133.762%0.62272%0.72SS**  trans-68.253.7174.850.40000113.7V33 I37V33-S35 PolarHBondContact O-N 3.33Å; S35-I37 VanDerWaalsContact C-N 3.31Å; S35-I37 PolarHBondContact O-N 3.05Å
36K36.5Very low34.8Very low157 Ų157136.9 Ų136.968%0.68372%0.722SS**  trans-74.883.5174-75.7175.5-176.71720110S34 N38S34-K36 PolarHBondContact O-N 3.23Å; S34-K36 WeakPolarHBondContact OG-CD 3.3Å; S34-K36 WeakPolarHBondContact OG-CE 3.4Å; S34-K36 WeakPolarHBondContact OG-CG 3.41Å; K36-N38 PolarHBondContact O-N 3.27Å
37I35.3Very low35Very low149 Ų149138.7 Ų138.776%0.76473%0.726SS**  trans-56.1108.9169.3-59174.8000108.1S35 T39S35-I37 VanDerWaalsContact C-N 3.31Å; S35-I37 PolarHBondContact O-N 3.05Å; I37-T39 HydrophobicContact CG2-CG2 4.17Å; I37-T39 PolarHBondContact O-N 3.33Å; I37-T39 VanDerWaalsContact O-N 3.16Å
38N35.4Very low35.2Very low83 Ų83141.8 Ų141.844%0.44473%0.731SS.*  trans-78.597.9177.3174.535.3000109.5K36 N40K36-N38 PolarHBondContact O-N 3.27Å; N38-N40 PolarHBondContact ND2-O 3.28Å; N38-N40 PolarHBondContact O-N 2.81Å; N38-N40 WeakPolarHBondContact OD1-CB 3.46Å; N38-N40 PolarHBondContact OD1-N 3.37Å; N38-N40 PolarHBondContact OD1-ND2 2.97Å
39T41.9Very low35.3Very low107 Ų107135.7 Ų135.766%0.65672%0.723SS**  trans-78.511.1178.653.10000114.5I37I37-T39 HydrophobicContact CG2-CG2 4.17Å; I37-T39 PolarHBondContact O-N 3.33Å; I37-T39 VanDerWaalsContact O-N 3.16Å
40N38.8Very low35.4Very low91 Ų91139.8 Ų139.849%0.48773%0.73SS.*SBendtrans-92129.2170.8-53.4-70.8000110.2N38 A42N38-N40 PolarHBondContact ND2-O 3.28Å; N38-N40 PolarHBondContact O-N 2.81Å; N38-N40 WeakPolarHBondContact OD1-CB 3.46Å; N38-N40 PolarHBondContact OD1-N 3.37Å; N38-N40 PolarHBondContact OD1-ND2 2.97Å; N40-A42 PolarHBondContact O-N 2.89Å
41T44.8Very low35.5Very low156 Ų156133 Ų13396%0.95772%0.718SS**  trans-70.632.6176.245.80000114.4
42A34.2Very low35.5Very low60 Ų60135 Ų13550%0.49672%0.722SS.*SBendtrans-104.3125175.500000109.7N40 V44N40-A42 PolarHBondContact O-N 2.89Å; A42-V44 PolarHBondContact O-N 2.93Å; A42-V44 VanDerWaalsContact O-N 3.12Å
43P36.1Very low35.5Very low105 Ų105131.1 Ų131.168%0.68272%0.721SS**  trans-65.4113.8178.825.8-33.2000110.5Y45P43-Y45 PolarHBondContact O-N 3.16Å
44V36.4Very low35.5Very low102 Ų102134.9 Ų134.962%0.61873%0.727SS**  trans-89.7101.2174.2179.90000108.2A42 H46A42-V44 PolarHBondContact O-N 2.93Å; A42-V44 VanDerWaalsContact O-N 3.12Å; V44-H46 PolarHBondContact O-N 2.87Å
45Y33Very low35.5Very low199 Ų199141.3 Ų141.378%0.7875%0.745SS**  trans-61.7119.8170.8-64.4-86.9000109.6P43 L47P43-Y45 PolarHBondContact O-N 3.16Å; Y45-L47 PolarHBondContact O-N 3.07Å; Y45-L47 VanDerWaalsContact O-N 3.15Å
46H34.1Very low35.5Very low182 Ų182145.3 Ų145.384%0.84376%0.759SS**  trans-67.1110.4171.1-88.8-104.5000109.3V44 E48V44-H46 PolarHBondContact O-N 2.87Å; H46-E48 PolarHBondContact O-N 3.26Å
47L35Very low35.4Very low173 Ų173149.2 Ų149.291%0.90677%0.769SS**  trans-83.191.4172.9-149.983.7000108.8Y45 G49Y45-L47 PolarHBondContact O-N 3.07Å; Y45-L47 VanDerWaalsContact O-N 3.15Å; L47-G49 PolarHBondContact O-N 3.24Å
48E33Very low35.3Very low202 Ų202147.9 Ų147.994%0.94477%0.77SS**  trans-73.397.6179-157.3173.2-146.600109.9H46H46-E48 PolarHBondContact O-N 3.26Å
49G34.6Very low35.2Very low65 Ų65150.5 Ų150.567%0.6778%0.784SS**  trans-143.5119-174.700000111.2L47L47-G49 PolarHBondContact O-N 3.24Å
50K36Very low34.8Very low215 Ų215150 Ų15094%0.93578%0.777SS**  trans-66.1151.6-176.6-69173.8-179.2172.50111.5
51S29.9Very low34.4Very low101 Ų101154.2 Ų154.271%0.70679%0.792SS**  trans-64.6152.9-174.850.30000113.5
52H33.7Very low34Very low188 Ų188159 Ų15987%0.8779%0.792SS**  -164.7136.4123.1-100.7-68.3000110.9
53V33.2Very low34.1Very low132 Ų132162.7 Ų162.780%0.881%0.808SS**  trans-89.5124.1179.6176.80000110.3
54K34.4Very low34Very low202 Ų202164.8 Ų164.888%0.87881%0.809SS**  trans-128.7121.9156.4-75.8-170.4174.7-178.80109.8L56K54-L56 PolarHBondContact O-N 3.16Å
55K34.5Very low34.1Very low209 Ų209164.4 Ų164.491%0.90981%0.808SS**PPolyproline II helixtrans-67.5122.5173.6-74.7175.9176.2171.60109.1
56L35.3Very low34.3Very low173 Ų173165.6 Ų165.691%0.90681%0.813SS**PPolyproline II helixtrans-100129.7159.5-94.4162.7000109.4K54K54-L56 PolarHBondContact O-N 3.16Å
57R34.6Very low34.4Very low239 Ų239166.1 Ų166.190%0.90281%0.812SS**PPolyproline II helixtrans-70.1139.9179.9-149.3175.3-172.6176.31.2108.6D59R57-D59 PolarHBondContact O-N 2.81Å
58P33.1Very low34.4Very low121 Ų121167.8 Ų167.879%0.78681%0.813SS**PPolyproline II helixtrans-76.9116.3-178.630-33.2000110.3
59D33Very low34.5Very low139 Ų139164 Ų16474%0.74381%0.805SS**  trans-153.7155.2161.2-153.32.6000113.9R57R57-D59 PolarHBondContact O-N 2.81Å
60N32.5Very low34.5Very low95 Ų95167 Ų16751%0.50882%0.815SS.*SBendtrans52.5107.1163.8-82.4-72.6000119.9
61K31.2Very low34.4Very low181 Ų181159.8 Ų159.879%0.78780%0.802SS**  trans59.588.7132.7-59.4164.3-176.11480117.3
62R35.5Very low34.6Very low256 Ų256162.3 Ų162.397%0.96681%0.807SS**  trans-111.4122.5144.3-72-165.5174.2-156.9-3.2110.1
63V38Very low34.6Very low137 Ų137164.9 Ų164.983%0.8381%0.811SS**PPolyproline II helixtrans-70.1136-171.7176.30000110.1
64H32.3Very low34.5Very low150 Ų150163.3 Ų163.369%0.69481%0.811SS**PPolyproline II helixtrans-76.7122.9173.5-152.7-66.9000108.8
65P39.9Very low34.6Very low93 Ų93160 Ų16060%0.60481%0.808SS**SBendtrans-60.5150.3165.427.6-33.2000108.9
66Y35.6Very low34.4Very low225 Ų225157 Ų15788%0.88280%0.803SS**SBendtrans71.249.9-170.7-52.4-82.6000116.4
67K37.9Very low34.5Very low192 Ų192154.8 Ų154.884%0.83580%0.796SS**  trans-127.5125.7135.5-79.6-166173-172.10109.5
68K35.1Very low34.6Very low209 Ų209149.2 Ų149.291%0.90979%0.789SS**  trans-86.8130.6163.7-77.8-173.6174.4-175.40108.8
69P33.4Very low34.7Very low121 Ų121151 Ų15179%0.78679%0.792SS**  trans-124.188.8160.434.5-18.5000110.2
70C35.9Very low35Very low129 Ų129149.3 Ų149.387%0.87279%0.788SS**  trans-123.1138.5158.3-58.10000107
71G34.1Very low35.2Very low64 Ų64153.7 Ų153.766%0.6680%0.803SS**  cis129.61062.200000110.1
72N33.5Very low35.6Very low154 Ų154152.4 Ų152.482%0.82481%0.805SS**  trans61.194.8168.9-53-11.9000117.1
73Y34.6Very low35.7Very low242 Ų242148.6 Ų148.695%0.94980%0.795SS**  -129.8136.8126.8-86.4-76.9000108.1
74A30.4Very low35.8Very low98 Ų98150.2 Ų150.281%0.8180%0.797SS**  trans-116.8124.7-170.800000111.1
75T36.1Very low36Very low132 Ų132148.7 Ų148.781%0.8179%0.794SS**  trans-143.2120.6167.730.90000109.9
76N30.8Very low35.6Very low148 Ų148155.3 Ų155.379%0.79181%0.807SS**  trans4.2130.9156.6-50-23.1000116.8
77T36Very low35.9Very low126 Ų126150.5 Ų150.577%0.77380%0.803SS**  -162140.876.429.70000116.1
78T37.8Very low35.7Very low122 Ų122144.1 Ų144.175%0.74879%0.792SS**  trans45.398.3146.357.90000122.9
79N34.6Very low35.7Very low158 Ų158141.3 Ų141.385%0.84579%0.792SS**  71.6162.5116.7-96.5-10.6000121.7
80P39.7Very low35.8Very low104 Ų104140 Ų14068%0.67579%0.786SS**  -138.6-154.1-129.144.8-24.1000115.2
81K37.2Very low35.8Very low187 Ų187141.2 Ų141.281%0.81378%0.784SS**  trans96.2146.7-177-56.9171.9-174.7177.40112.3
82D38.5Very low35.9Very low154 Ų154149.7 Ų149.782%0.82480%0.796SS**  cis-135.4-179.517.7-109.5-50.4000115.4
83K37.7Very low36.1Very low176 Ų176146.7 Ų146.777%0.76579%0.787SS**  trans-106.2131.9-174-59.2170.4177.51740114.9L85K83-L85 HydrophobicContact CB-CD1 3.94Å
84I41.2Very low36.3Very low171 Ų171141.9 Ų141.988%0.87778%0.778SS**  trans-152.6118.7150.4-47.3178.3000106.4
85L35.1Very low36.7Very low118 Ų118142.9 Ų142.962%0.61878%0.779SS**  cis96.692.134.7-87.878.8000116.9K83K83-L85 HydrophobicContact CB-CD1 3.94Å
86W32.7Very low37.1Very low232 Ų232141.3 Ų141.388%0.87977%0.773SS**  trans62.2-176146.2-58115.3000120.1
87P41Very low37.4Very low123 Ų123141.3 Ų141.380%0.79977%0.773SS**  -119.1-168.7-58.335.8-20.4000112.3
88G33.8Very low37.7Very low58 Ų58140 Ų14060%0.59877%0.769SS**  cis148.4128.8-15.400000116
89T35.7Very low37.9Very low151 Ų151142.9 Ų142.993%0.92677%0.774SS**  trans72.3164.2168.880.10000117.6
90S35.1Very low38.1Very low94 Ų94140 Ų14066%0.65777%0.767SS**  cis-158.2143.95.966.40000116.5
91N35.5Very low38.1Very low153 Ų153141.5 Ų141.582%0.81877%0.774SS**  trans59.7153.5135.6-58-5.6000127
92R36.1Very low38.2Very low242 Ų242136.8 Ų136.891%0.91376%0.764SS**  trans81.2151.2165.2-68.4-175.7171.3-146.1-2.7119.7
93S39Very low38.1Very low92 Ų92137.4 Ų137.464%0.64376%0.762SS**  cis-173.7145.5-35.3-115.80000114
94D37.2Very low38.3Very low141 Ų141135.6 Ų135.675%0.75476%0.756SS**  trans73.3140.8144-43.9-21000125.8
95S38.9Very low38.2Very low119 Ų119133.8 Ų133.883%0.83275%0.748SS**  trans63.4150.1168.968.40000118.5
96S45Very low38.4Very low98 Ų98133.1 Ų133.169%0.68575%0.753SS**  cis179.8175.4-13.5-90.70000106.5
97D37.6Very low38.6Very low148 Ų148127 Ų12779%0.79175%0.746SS**  cis-156.6-173.7-44.1-83.5-50.6000105.4
98S42.7Very low38.4Very low99 Ų99126.9 Ų126.969%0.69275%0.748SS**  cis-161.3-174.91354.90000110.3
99E41.6Very low38.6Very low183 Ų183130.4 Ų130.486%0.85576%0.76SS**  trans42145.7149.8-73.7176.5-165.500123.7
100S38.2Very low38.5Very low98 Ų98128.5 Ų128.569%0.68575%0.753SS**  cis-161.6148.6-657.90000114.4
101V40Very low38.5Very low135 Ų135132.5 Ų132.582%0.81877%0.766SS**  38.2152.7127.4-171.70000121.8
102S39.4Very low38.4Very low88 Ų88130.1 Ų130.162%0.61576%0.761SS**  -178.6142.7-65.356.50000114.4
103H37.6Very low38.8Very low166 Ų166129.9 Ų129.977%0.76976%0.762SS**  trans68.2169.8153.8-77.5-127.8000118.3
104E41.1Very low38.8Very low138 Ų138130.9 Ų130.965%0.64576%0.764SS**  cis-163.4167.71.8-132.6165-133.100116
105N38.6Very low39.4Very low133 Ų133130 Ų13071%0.71177%0.769SS**  trans62.4162.6151-65-29.6000120.6
106S38.8Very low39.5Very low105 Ų105134.2 Ų134.273%0.73477%0.766SS**  cis-176.8169.7-8.942.90000109.5
107S38.5Very low39Very low104 Ų104139 Ų13973%0.72777%0.771SS**  cis-176.1162.2-26.1-78.80000111.4
108S35.5Very low39.5Very low119 Ų119137.5 Ų137.583%0.83277%0.772SS**  trans73165.7161.3-55.50000120
109P37.9Very low39.4Very low133 Ų133137.5 Ų137.586%0.86477%0.772SS**  cis-124.1-160.9-6.739.6-21.3000114.8
110S34.5Very low39.6Very low110 Ų110138.2 Ų138.277%0.76978%0.776SS**  trans-133.4163-162.558.80000116.5
111L34.3Very low39.7Very low178 Ų178138.6 Ų138.693%0.93278%0.778SS**  trans-135145.2159.1-91.4173.2000111.8
112S34.9Very low40Very low103 Ų103138.9 Ų138.972%0.7278%0.781SS**  trans-158.6144.317462.20000111.6
113Y43.3Very low39.9Very low238 Ų238140 Ų14093%0.93378%0.784SS**  trans-142.5159.9161.9-133.4-98.5000110.7
114V39.8Very low40Very low113 Ų113138.9 Ų138.969%0.68578%0.779SS**  trans-125.3147.1-160.1178.80000111.7R116V114-R116 HydrophobicContact CG1-CG 4.39Å
115S48.8Very low40.2Very low121 Ų121139.1 Ų139.185%0.84678%0.784SS**  trans-139.3147149.8-170.20000109.9
116R40.8Very low40.3Very low208 Ų208141.6 Ų141.679%0.78579%0.785SS**  trans-143.1143.9-178.7-90-161.1179.6-150.56.5110.8V114V114-R116 HydrophobicContact CG1-CG 4.39Å
117Y35.2Very low40.3Very low198 Ų198144.7 Ų144.778%0.77679%0.788SS**  trans25.3128147-70.7-92.4000119.8
118S48.1Very low40.4Very low118 Ų118144.2 Ų144.283%0.82578%0.781SS**  trans-99154.6135-165.50000109.5
119S40.8Very low40.6Very low99 Ų99147.7 Ų147.769%0.69278%0.781SS**  trans-157135.6177-650000108.2
120E46.2Very low40.7Very low197 Ų197147 Ų14792%0.92178%0.779SS**  trans-126.2141-173.4-158.9154.6-135.200110
121S39.8Very low41.1Very low106 Ų106150.2 Ų150.274%0.74178%0.782SS**  trans-156.6131.8-161.5600000112.2
122T46.3Very low41.5Very low142 Ų142147.3 Ų147.387%0.87177%0.771SS**  trans-135.9147.9172.8-42.70000109.9
123T37.5Very low41.8Very low110 Ų110149.1 Ų149.168%0.67577%0.773SS**  trans-120.4-169.7-161.846.30000112.7
124H39.6Very low41.6Very low144 Ų144144.9 Ų144.967%0.66777%0.766SS**  trans81.9144.1173.2-64.8-83.7000116.2
125N45.7Very low41.7Very low143 Ų143144.6 Ų144.677%0.76577%0.765SS**  cis-142.7-179.811.5-113.8-21.4000114.9
126Y40.4Very low41.3Very low185 Ų185147.3 Ų147.373%0.72576%0.764SS**  trans-86.3160.3-160.1-70.5-99.5000118.6
127E38.4Very low41.2Very low169 Ų169141.6 Ų141.679%0.7976%0.756SS**  trans62.5153.2145.3-75.6-174.2120.500121
128T40.6Very low41.4Very low95 Ų95139 Ų13958%0.58375%0.754SS**  cis-149.2159.50.60.50000113.2
129K40Very low41Very low191 Ų191144.5 Ų144.583%0.8376%0.757SS**  trans55.8106.4149.1-68.6160.3-176.3166.60120.7
130S39.3Very low41Very low118 Ų118148 Ų14883%0.82576%0.762SS**  -170.4172.4108.548.40000111.5
131H42.5Very low40.6Very low178 Ų178145 Ų14582%0.82476%0.757SS**  trans-45148.3-175.6-62.9-96.2000114.1
132V44.3Very low40.7Very low118 Ų118146.2 Ų146.272%0.71576%0.755SS**  cis-148.1149.746.4169.90000112
133N40.1Very low40.3Very low141 Ų141146 Ų14675%0.75475%0.754SS**  trans6.7112.3162.6-44.6-10.4000116.8
134D39Very low40.9Very low149 Ų149146 Ų14680%0.79776%0.759SS**  cis71.6145.138.6-158.217.9000115.5
135V43.2Very low41.6Very low107 Ų107147.9 Ų147.965%0.64877%0.767SS**  trans70.1119.8172.2-171.60000115
136Q39.1Very low42.1Very low177 Ų177146.6 Ų146.683%0.82777%0.767SS**  cis-160.5156.57.4-130.21679.500114.4
137S39.3Very low42.9Very low89 Ų89148.5 Ų148.562%0.62277%0.773SS**  trans50.3111.3138.1-169.70000120.6
138I39.9Very low43.7Very low144 Ų144143.9 Ų143.974%0.73876%0.759SS**  82.9135.460.3-66.1162.7000114.4
139R39.4Very low44.5Very low233 Ų233146.4 Ų146.488%0.87976%0.764SS**  trans68.8143.2-179.8-74166.1176165-2.5114.1
140E39.7Very low45.5Very low172 Ų172140.9 Ų140.980%0.80475%0.749SS**  cis-127147.525.8-66175.6159.800115.1
141T37.9Very low46.7Very low134 Ų134140.6 Ų140.682%0.82274%0.735SS**  trans-88.8113.8170.745.30000110.9
142N43.5Very low48.3Very low131 Ų131134 Ų13470%0.70172%0.715SS**  trans-143.497.1169.5-89.1-54000111.9S144N142-S144 PolarHBondContact O-N 3.04Å; N142-S144 VanDerWaalsContact O-N 3.14Å
143T38Very low50Low137 Ų137133.3 Ų133.384%0.8470%0.704SS**  trans1083159.356.40000117.8H145T143-H145 PolarHBondContact O-N 3.16Å
144S48.1Very low51.8Low112 Ų112129.3 Ų129.378%0.78369%0.69SS**  trans-76.8111.5158.2450000109.5N142N142-S144 PolarHBondContact O-N 3.04Å; N142-S144 VanDerWaalsContact O-N 3.14Å
145H55.9Low53.5Low182 Ų182124.5 Ų124.584%0.84366%0.663SS**  trans-56.1129.6163.4-86.9-71.3000108.6T143 R147T143-H145 PolarHBondContact O-N 3.16Å; H145-R147 PolarHBondContact O-N 3.2Å
146P54.9Low55.2Low117 Ų117126 Ų12676%0.7666%0.663SS**  trans-64.4108.116827.2-31.8000107.4S148P146-S148 PolarHBondContact O-N 2.73Å
147R58.1Low57.3Low225 Ų225121.8 Ų121.885%0.84965%0.645SS**  trans-51.7128.3165.7-91.9-178.3164.8144.3-3.5107.1H145 H149H145-R147 PolarHBondContact O-N 3.2Å; R147-H149 PolarHBondContact O-N 2.81Å; R147-H149 VanDerWaalsContact O-N 3.16Å
148S54.9Low59.3Low71 Ų71123.1 Ų123.150%0.49764%0.637SS.*  trans-50.6123.9-175.843.70000110.1P146 S150 H151 G152P146-S148 PolarHBondContact O-N 2.73Å; S148-S150 PolarHBondContact O-N 3.14Å; S148-S150 VanDerWaalsContact O-N 3.12Å; S148-H151 WeakPolarHBondContact O-CB 3.39Å; S148-H151 PolarHBondContact O-N 3.46Å; S148-G152 PolarHBondContact O-N 2.9Å
149H57.7Low61.3Low148 Ų148123.6 Ų123.669%0.68563%0.629SS**Hα-helixtrans-58.2-32.6-172.8-166.4-18.4000111.4R147 H151 G152 Q153R147-H149 PolarHBondContact O-N 2.81Å; R147-H149 VanDerWaalsContact O-N 3.16Å; H149-H151 PolarHBondContact O-N 3.05Å; H149-G152 PolarHBondContact O-N 3.45Å; H149-Q153 PolarHBondContact O-N 2.89Å
150S60.7Low63.2Low75 Ų75115.2 Ų115.252%0.52461%0.607SS.*Hα-helixtrans-60-36.6171.851.50000114.2S148 G152 Q153 A154S148-S150 PolarHBondContact O-N 3.14Å; S148-S150 VanDerWaalsContact O-N 3.12Å; S150-G152 VanDerWaalsContact C-N 3.33Å; S150-Q153 PolarHBondContact O-N 2.69Å; S150-A154 VanDerWaalsContact O-CB 3.29Å; S150-A154 WeakPolarHBondContact O-CB 3.42Å; S150-A154 PolarHBondContact O-N 3.2Å
151H63.9Low65.3Low113 Ų113115.4 Ų115.452%0.52360%0.6SS.*Hα-helixtrans-69.4-34.4174.4-177.166000111.5S148 H149 E155S148-H151 WeakPolarHBondContact O-CB 3.39Å; S148-H151 PolarHBondContact O-N 3.46Å; H149-H151 PolarHBondContact O-N 3.05Å; H151-E155 VanDerWaalsContact O-CB 3.31Å; H151-E155 WeakPolarHBondContact O-CB 3.28Å; H151-E155 PolarHBondContact O-N 3.3Å
152G76.5Confident67.2Low39 Ų39112.3 Ų112.340%0.40258%0.576SS.*Hα-helixtrans-62.4-47.1170.700000112.3S148 H149 S150 Q156S148-G152 PolarHBondContact O-N 2.9Å; H149-G152 PolarHBondContact O-N 3.45Å; S150-G152 VanDerWaalsContact C-N 3.33Å; G152-Q156 VanDerWaalsContact O-CB 3.3Å; G152-Q156 WeakPolarHBondContact O-CB 3.48Å; G152-Q156 PolarHBondContact O-N 3.31Å
153Q79.9Confident68.8Low103 Ų103109.5 Ų109.548%0.48157%0.567SS.*Hα-helixtrans-64-46.2176.5-72.7172.6-22.600112.1H149 S150 E155 Q156 I157H149-Q153 PolarHBondContact O-N 2.89Å; S150-Q153 PolarHBondContact O-N 2.69Å; Q153-E155 PolarHBondContact O-N 3.06Å; Q153-Q156 WeakPolarHBondContact O-CB 3.38Å; Q153-Q156 PolarHBondContact O-N 3.29Å; Q153-Q156 VanDerWaalsContact O-N 3.17Å; Q153-I157 VanDerWaalsContact O-CG1 3.29Å; Q153-I157 WeakPolarHBondContact O-CG1 3.37Å; Q153-I157 PolarHBondContact O-N 3.4Å
154A78Confident70.8Confident57 Ų57107.9 Ų107.947%0.47155%0.552SS.*Hα-helixtrans-61.9-42.7178.500000112.3S150 I157 R158S150-A154 VanDerWaalsContact O-CB 3.29Å; S150-A154 WeakPolarHBondContact O-CB 3.42Å; S150-A154 PolarHBondContact O-N 3.2Å; A154-I157 PolarHBondContact O-N 2.82Å; A154-R158 WeakPolarHBondContact O-CB 2.98Å; A154-R158 PolarHBondContact O-N 3.4Å
155E75.8Confident72.2Confident48 Ų48106.4 Ų106.422%0.22454%0.538CS..Hα-helixtrans-69-32.6174.517562.8-178.300112.2H151 Q153 R158 R159H151-E155 VanDerWaalsContact O-CB 3.31Å; H151-E155 WeakPolarHBondContact O-CB 3.28Å; H151-E155 PolarHBondContact O-N 3.3Å; Q153-E155 PolarHBondContact O-N 3.06Å; E155-R158 VanDerWaalsContact CD-NH2 3.31Å; E155-R158 IonicContact OE1-CZ 3.41Å; E155-R158 IonicContact OE1-NH2 3.75Å; E155-R158 PolarHBondContact OE1-NH2 2.82Å; E155-R158 IonicContact OE2-CZ 3.08Å; E155-R158 VanDerWaalsContact OE2-CZ 3.32Å; E155-R158 IonicContact OE2-NE 3.55Å; E155-R158 PolarHBondContact OE2-NE 3.02Å; E155-R158 IonicContact OE2-NH2 3.68Å; E155-R158 PolarHBondContact OE2-NH2 3.43Å; E155-R159 WeakPolarHBondContact O-CB 2.93Å; E155-R159 VanDerWaalsContact O-CG 3.23Å; E155-R159 WeakPolarHBondContact O-CG 3.13Å; E155-R159 PolarHBondContact O-N 3.4Å; E155-R159 IonicContact OE1-CZ 2.8Å; E155-R159 IonicContact OE1-NE 3.81Å; E155-R159 PolarHBondContact OE1-NE 3.08Å; E155-R159 IonicContact OE1-NH2 3.01Å; E155-R159 PolarHBondContact OE1-NH2 3.36Å
156Q79.4Confident73.2Confident140 Ų14099.4 Ų99.465%0.65451%0.505SS*.Hα-helixtrans-67.6-43.9173-177.3173.2-9.800111.8G152 Q153 R159 S160G152-Q156 VanDerWaalsContact O-CB 3.3Å; G152-Q156 WeakPolarHBondContact O-CB 3.48Å; G152-Q156 PolarHBondContact O-N 3.31Å; Q153-Q156 WeakPolarHBondContact O-CB 3.38Å; Q153-Q156 PolarHBondContact O-N 3.29Å; Q153-Q156 VanDerWaalsContact O-N 3.17Å; Q156-R159 PolarHBondContact O-N 3.18Å; Q156-S160 PolarHBondContact O-N 2.9Å; Q156-S160 PolarHBondContact O-OG 2.59Å
157I81.2Confident74.2Confident87 Ų8796.8 Ų96.845%0.44649%0.494SS..Hα-helixtrans-63.9-41.2174.1-67.7163000110.5Q153 A154 R159 S160 R161Q153-I157 VanDerWaalsContact O-CG1 3.29Å; Q153-I157 WeakPolarHBondContact O-CG1 3.37Å; Q153-I157 PolarHBondContact O-N 3.4Å; A154-I157 PolarHBondContact O-N 2.82Å; I157-R159 VanDerWaalsContact C-N 3.32Å; I157-R159 PolarHBondContact O-N 2.94Å; I157-S160 WeakPolarHBondContact CA-OG 3.43Å; I157-S160 PolarHBondContact O-N 2.84Å; I157-S160 PolarHBondContact O-OG 3.04Å; I157-S160 VanDerWaalsContact O-OG 3.05Å; I157-R161 HydrophobicContact CG2-CG 4.47Å; I157-R161 WeakPolarHBondContact O-CB 3.35Å; I157-R161 WeakPolarHBondContact O-CG 3.45Å; I157-R161 PolarHBondContact O-N 2.94Å
158R82.8Confident75.2Confident118 Ų11891.4 Ų91.445%0.44548%0.481SS..Hα-helixtrans-60.6-42.2174.2-164.3-166.563.867.43.5111.1A154 E155 E162A154-R158 WeakPolarHBondContact O-CB 2.98Å; A154-R158 PolarHBondContact O-N 3.4Å; E155-R158 VanDerWaalsContact CD-NH2 3.31Å; E155-R158 IonicContact OE1-CZ 3.41Å; E155-R158 IonicContact OE1-NH2 3.75Å; E155-R158 PolarHBondContact OE1-NH2 2.82Å; E155-R158 IonicContact OE2-CZ 3.08Å; E155-R158 VanDerWaalsContact OE2-CZ 3.32Å; E155-R158 IonicContact OE2-NE 3.55Å; E155-R158 PolarHBondContact OE2-NE 3.02Å; E155-R158 IonicContact OE2-NH2 3.68Å; E155-R158 PolarHBondContact OE2-NH2 3.43Å; R158-E162 IonicContact CZ-OE2 3.5Å; R158-E162 IonicContact NH1-OE2 3.35Å; R158-E162 PolarHBondContact NH1-OE2 3.09Å; R158-E162 VanDerWaalsContact O-CB 3.25Å; R158-E162 WeakPolarHBondContact O-CB 3.42Å; R158-E162 PolarHBondContact O-N 2.8Å
159R80.9Confident76.3Confident153 Ų15389.7 Ų89.758%0.57747%0.466SS*.Hα-helixtrans-71.4-37.1178-74.5174.2-170.2-170.98.3113.7E155 Q156 I157 S163E155-R159 WeakPolarHBondContact O-CB 2.93Å; E155-R159 VanDerWaalsContact O-CG 3.23Å; E155-R159 WeakPolarHBondContact O-CG 3.13Å; E155-R159 PolarHBondContact O-N 3.4Å; E155-R159 IonicContact OE1-CZ 2.8Å; E155-R159 IonicContact OE1-NE 3.81Å; E155-R159 PolarHBondContact OE1-NE 3.08Å; E155-R159 IonicContact OE1-NH2 3.01Å; E155-R159 PolarHBondContact OE1-NH2 3.36Å; Q156-R159 PolarHBondContact O-N 3.18Å; I157-R159 VanDerWaalsContact C-N 3.32Å; I157-R159 PolarHBondContact O-N 2.94Å; R159-S163 WeakPolarHBondContact O-CB 3.45Å; R159-S163 PolarHBondContact O-N 3.24Å
160S80.4Confident77.2Confident58 Ų5885.1 Ų85.141%0.40645%0.447SS..Hα-helixtrans-68.1-46.2175.762.60000110.7Q156 I157 E162 S163 I164Q156-S160 PolarHBondContact O-N 2.9Å; Q156-S160 PolarHBondContact O-OG 2.59Å; I157-S160 WeakPolarHBondContact CA-OG 3.43Å; I157-S160 PolarHBondContact O-N 2.84Å; I157-S160 PolarHBondContact O-OG 3.04Å; I157-S160 VanDerWaalsContact O-OG 3.05Å; S160-E162 PolarHBondContact O-N 2.7Å; S160-S163 PolarHBondContact O-N 3.35Å; S160-S163 VanDerWaalsContact O-N 3.13Å; S160-I164 VanDerWaalsContact O-CG1 3.31Å; S160-I164 WeakPolarHBondContact O-CG1 3.43Å; S160-I164 PolarHBondContact O-N 3.41Å
161R82.2Confident78Confident175 Ų17584 Ų8466%0.6644%0.443SS*.Hα-helixtrans-54.7-51170.8-72.6179174.8-170.2-2.6111.4I157 S163 I164 T165I157-R161 HydrophobicContact CG2-CG 4.47Å; I157-R161 WeakPolarHBondContact O-CB 3.35Å; I157-R161 WeakPolarHBondContact O-CG 3.45Å; I157-R161 PolarHBondContact O-N 2.94Å; R161-S163 VanDerWaalsContact C-N 3.29Å; R161-S163 PolarHBondContact O-N 3.14Å; R161-I164 PolarHBondContact O-N 3.04Å; R161-T165 PolarHBondContact O-N 2.04Å; R161-T165 PolarHBondContact O-OG1 3.26Å; R161-T165 VanDerWaalsContact O-OG1 3.09Å
162E78.7Confident78.5Confident69 Ų6984.7 Ų84.732%0.32245%0.446SS..Hα-helixtrans-55.5-43.7175.8-166-158.1119.900111.6R158 S160 F166 K203R158-E162 IonicContact CZ-OE2 3.5Å; R158-E162 IonicContact NH1-OE2 3.35Å; R158-E162 PolarHBondContact NH1-OE2 3.09Å; R158-E162 VanDerWaalsContact O-CB 3.25Å; R158-E162 WeakPolarHBondContact O-CB 3.42Å; R158-E162 PolarHBondContact O-N 2.8Å; S160-E162 PolarHBondContact O-N 2.7Å; E162-F166 HydrophobicContact CG-CD2 3.9Å; E162-F166 HydrophobicContact CG-CE2 3.8Å; E162-F166 WeakPolarHBondContact O-CD2 3.22Å; E162-F166 PolarHBondContact O-N 3.35Å; E162-K203 IonicContact OE1-NZ 2.9Å; E162-K203 PolarHBondContact OE1-NZ 2.89Å
163S78Confident78.6Confident73 Ų7383.1 Ų83.151%0.5143%0.428SS..Hα-helixtrans-66.9-39.3179.3-161.30000113R159 S160 R161 F166 A167R159-S163 WeakPolarHBondContact O-CB 3.45Å; R159-S163 PolarHBondContact O-N 3.24Å; S160-S163 PolarHBondContact O-N 3.35Å; S160-S163 VanDerWaalsContact O-N 3.13Å; R161-S163 VanDerWaalsContact C-N 3.29Å; R161-S163 PolarHBondContact O-N 3.14Å; S163-F166 PolarHBondContact O-N 2.93Å; S163-A167 WeakPolarHBondContact O-CB 3.38Å; S163-A167 PolarHBondContact O-N 3.42Å
164I79.7Confident78.4Confident103 Ų10381.6 Ų81.653%0.52843%0.429SS..Hα-helixtrans-64.7-48.6175.9-67.6161.7000109.8S160 R161 F166 A167 L168S160-I164 VanDerWaalsContact O-CG1 3.31Å; S160-I164 WeakPolarHBondContact O-CG1 3.43Å; S160-I164 PolarHBondContact O-N 3.41Å; R161-I164 PolarHBondContact O-N 3.04Å; I164-F166 VanDerWaalsContact C-N 3.3Å; I164-F166 PolarHBondContact O-N 2.81Å; I164-A167 PolarHBondContact O-N 2.77Å; I164-A167 VanDerWaalsContact O-N 3.11Å; I164-L168 HydrophobicContact CG2-CD1 4.06Å; I164-L168 WeakPolarHBondContact O-CG 3.32Å; I164-L168 PolarHBondContact O-N 2.93Å
165T76.7Confident78.4Confident81 Ų8183.2 Ų83.250%0.49743%0.429SS..Hα-helixtrans-57.9-42.3175.9-52.80000111.7R161 I169R161-T165 PolarHBondContact O-N 2.04Å; R161-T165 PolarHBondContact O-OG1 3.26Å; R161-T165 VanDerWaalsContact O-OG1 3.09Å; T165-I169 HydrophobicContact CG2-CD1 4.02Å; T165-I169 WeakPolarHBondContact O-CB 3.5Å; T165-I169 VanDerWaalsContact O-CG1 3.27Å; T165-I169 WeakPolarHBondContact O-CG1 3.43Å; T165-I169 PolarHBondContact O-N 3.08Å
166F76.3Confident78.2Confident34 Ų3485.2 Ų85.215%0.14945%0.446CS..Hα-helixtrans-67.3-35.6175.7-87.5-67.3000113.7E162 S163 I164 I169 D170 K203 L207E162-F166 HydrophobicContact CG-CD2 3.9Å; E162-F166 HydrophobicContact CG-CE2 3.8Å; E162-F166 WeakPolarHBondContact O-CD2 3.22Å; E162-F166 PolarHBondContact O-N 3.35Å; S163-F166 PolarHBondContact O-N 2.93Å; I164-F166 VanDerWaalsContact C-N 3.3Å; I164-F166 PolarHBondContact O-N 2.81Å; F166-I169 PolarHBondContact O-N 3.19Å; F166-D170 WeakPolarHBondContact O-CB 3.49Å; F166-D170 PolarHBondContact O-N 3.24Å; F166-K203 HydrophobicContact CD1-CB 4.39Å; F166-K203 HydrophobicContact CD1-CD 4.04Å; F166-K203 HydrophobicContact CD1-CG 3.76Å; F166-K203 HydrophobicContact CD2-CD 3.85Å; F166-K203 HydrophobicContact CD2-CG 4.47Å; F166-K203 HydrophobicContact CE1-CB 4Å; F166-K203 HydrophobicContact CE1-CD 3.95Å; F166-K203 HydrophobicContact CE1-CG 3.81Å; F166-K203 HydrophobicContact CE2-CD 3.77Å; F166-K203 HydrophobicContact CG-CD 3.99Å; F166-K203 VanDerWaalsContact CG-CE 3.49Å; F166-K203 HydrophobicContact CG-CG 4.12Å; F166-K203 HydrophobicContact CZ-CB 4.43Å; F166-K203 HydrophobicContact CZ-CD 3.83Å; F166-K203 HydrophobicContact CZ-CG 4.21Å; F166-L207 HydrophobicContact CE1-CD1 4.21Å; F166-L207 HydrophobicContact CE1-CD2 4.18Å; F166-L207 HydrophobicContact CE1-CG 3.93Å; F166-L207 HydrophobicContact CZ-CD1 4.02Å; F166-L207 HydrophobicContact CZ-CD2 4.29Å; F166-L207 HydrophobicContact CZ-CG 4.18Å
167A76.7Confident77.9Confident63 Ų6382.2 Ų82.252%0.52144%0.439SS..Hα-helixtrans-67.2-43.3176.300000111.8S163 I164 I169 D170 A171S163-A167 WeakPolarHBondContact O-CB 3.38Å; S163-A167 PolarHBondContact O-N 3.42Å; I164-A167 PolarHBondContact O-N 2.77Å; I164-A167 VanDerWaalsContact O-N 3.11Å; A167-I169 VanDerWaalsContact C-N 3.35Å; A167-I169 PolarHBondContact O-N 3.27Å; A167-D170 PolarHBondContact O-N 3.23Å; A167-A171 WeakPolarHBondContact O-CB 3.44Å; A167-A171 PolarHBondContact O-N 3.15Å
168L79.1Confident77.5Confident112 Ų11280.7 Ų80.759%0.58643%0.431SS*.Hα-helixtrans-61-42.8174.3-68.2170.7000111.7I164 Q172I164-L168 HydrophobicContact CG2-CD1 4.06Å; I164-L168 WeakPolarHBondContact O-CG 3.32Å; I164-L168 PolarHBondContact O-N 2.93Å; L168-Q172 WeakPolarHBondContact O-CB 3.16Å; L168-Q172 VanDerWaalsContact O-CG 3.32Å; L168-Q172 WeakPolarHBondContact O-CG 3.44Å; L168-Q172 PolarHBondContact O-N 2.86Å
169I77Confident77.3Confident35 Ų3576 Ų7618%0.17942%0.416CS..Hα-helixtrans-63.5-43173.4-70.2167000111.3T165 F166 A167 A171 Q172 L173 N206 V210T165-I169 HydrophobicContact CG2-CD1 4.02Å; T165-I169 WeakPolarHBondContact O-CB 3.5Å; T165-I169 VanDerWaalsContact O-CG1 3.27Å; T165-I169 WeakPolarHBondContact O-CG1 3.43Å; T165-I169 PolarHBondContact O-N 3.08Å; F166-I169 PolarHBondContact O-N 3.19Å; A167-I169 VanDerWaalsContact C-N 3.35Å; A167-I169 PolarHBondContact O-N 3.27Å; I169-A171 VanDerWaalsContact C-N 3.34Å; I169-A171 PolarHBondContact O-N 3.28Å; I169-Q172 PolarHBondContact O-N 3.19Å; I169-L173 HydrophobicContact CG2-CD1 3.79Å; I169-L173 HydrophobicContact CG2-CG 4.22Å; I169-L173 WeakPolarHBondContact O-CB 3.42Å; I169-L173 VanDerWaalsContact O-CG 3.26Å; I169-L173 WeakPolarHBondContact O-CG 3.17Å; I169-L173 PolarHBondContact O-N 3.15Å; I169-N206 HydrophobicContact CG2-CB 3.88Å; I169-V210 HydrophobicContact CG1-CG2 4.42Å; I169-V210 HydrophobicContact CG2-CG2 3.61Å
170D78Confident77.1Confident51 Ų5174.3 Ų74.327%0.27342%0.415SS..Hα-helixtrans-65-39-178.6-150.898.2000111.8F166 A167 L173 S174 R182 N206F166-D170 WeakPolarHBondContact O-CB 3.49Å; F166-D170 PolarHBondContact O-N 3.24Å; A167-D170 PolarHBondContact O-N 3.23Å; D170-L173 CarbonylContact O-C 3.59Å; D170-L173 PolarHBondContact O-N 2.91Å; D170-S174 PolarHBondContact O-N 3.45Å; D170-R182 VanDerWaalsContact CG-NH1 3.31Å; D170-R182 PolarHBondContact O-NH1 3.41Å; D170-R182 IonicContact OD1-CZ 3.54Å; D170-R182 IonicContact OD1-NH1 3.62Å; D170-R182 IonicContact OD1-NH2 2.97Å; D170-R182 PolarHBondContact OD1-NH2 3.01Å; D170-R182 IonicContact OD2-CZ 3.22Å; D170-R182 VanDerWaalsContact OD2-CZ 3.22Å; D170-R182 IonicContact OD2-NH1 2.78Å; D170-R182 PolarHBondContact OD2-NH1 3.13Å; D170-R182 IonicContact OD2-NH2 3.82Å; D170-R182 PolarHBondContact OD2-NH2 3.32Å; D170-N206 PolarHBondContact OD1-ND2 3.35Å
171A76.5Confident76.7Confident53 Ų5374.4 Ų74.444%0.43841%0.413SS..Hα-helixtrans-65-49.5173.200000112.2A167 I169 L173 S174A167-A171 WeakPolarHBondContact O-CB 3.44Å; A167-A171 PolarHBondContact O-N 3.15Å; I169-A171 VanDerWaalsContact C-N 3.34Å; I169-A171 PolarHBondContact O-N 3.28Å; A171-L173 PolarHBondContact O-N 3.13Å; A171-S174 PolarHBondContact O-N 3.14Å; A171-S174 PolarHBondContact O-OG 3.17Å
172Q75Confident76.2Confident127 Ų12767.3 Ų67.359%0.59339%0.386SS*.Hα-helixtrans-61.7-33.2177-70.7-69.2-19.700112.3L168 I169L168-Q172 WeakPolarHBondContact O-CB 3.16Å; L168-Q172 VanDerWaalsContact O-CG 3.32Å; L168-Q172 WeakPolarHBondContact O-CG 3.44Å; L168-Q172 PolarHBondContact O-N 2.86Å; I169-Q172 PolarHBondContact O-N 3.19Å
173L77.8Confident75.9Confident6 Ų667.7 Ų67.73%0.03139%0.391CS..THydrogen-bonded Turntrans-86.20.5175.4-64.5-177.2000114.8I169 D170 A171 L178 S179 R182 N206 V209 V210I169-L173 HydrophobicContact CG2-CD1 3.79Å; I169-L173 HydrophobicContact CG2-CG 4.22Å; I169-L173 WeakPolarHBondContact O-CB 3.42Å; I169-L173 VanDerWaalsContact O-CG 3.26Å; I169-L173 WeakPolarHBondContact O-CG 3.17Å; I169-L173 PolarHBondContact O-N 3.15Å; D170-L173 CarbonylContact O-C 3.59Å; D170-L173 PolarHBondContact O-N 2.91Å; A171-L173 PolarHBondContact O-N 3.13Å; L173-L178 HydrophobicContact CD2-CB 4.01Å; L173-L178 HydrophobicContact CD2-CD1 4.13Å; L173-S179 VanDerWaalsContact O-CA 3.31Å; L173-S179 WeakPolarHBondContact O-CA 3.04Å; L173-S179 PolarHBondContact O-N 2.86Å; L173-R182 WeakPolarHBondContact O-CD 3.27Å; L173-N206 VanDerWaalsContact CD1-CA 3.47Å; L173-N206 HydrophobicContact CD1-CB 3.67Å; L173-V209 HydrophobicContact CD1-CB 4.12Å; L173-V209 HydrophobicContact CD1-CG1 4.39Å; L173-V209 HydrophobicContact CD2-CB 4.25Å; L173-V209 HydrophobicContact CD2-CG1 3.62Å; L173-V210 HydrophobicContact CD1-CG2 4.17Å
174S77.3Confident75.8Confident70 Ų7068.4 Ų68.449%0.4939%0.387SS..THydrogen-bonded Turntrans-91.2-12.3170.572.40000112.5D170 A171 S179D170-S174 PolarHBondContact O-N 3.45Å; A171-S174 PolarHBondContact O-N 3.14Å; A171-S174 PolarHBondContact O-OG 3.17Å; S174-S179 VanDerWaalsContact O-CB 3.32Å; S174-S179 WeakPolarHBondContact O-CB 3.42Å
175I77.3Confident75.3Confident92 Ų9266.4 Ų66.447%0.47237%0.373SS..SBendtrans-82.2133.6177.9-56.3169.2000109.8L178 S179I175-L178 WeakPolarHBondContact O-CB 3.47Å; I175-L178 PolarHBondContact O-N 3.49Å; I175-S179 PolarHBondContact O-N 3.17Å; I175-S179 VanDerWaalsContact O-N 3.1Å
176P71.6Confident75.2Confident90 Ų9064.3 Ų64.358%0.58436%0.359SS*.THydrogen-bonded Turntrans-62.6146.9171.9-22.133.8000112.4S179P176-S179 WeakPolarHBondContact CA-OG 3.22Å
177P73.6Confident75Confident77 Ų7769.4 Ų69.450%0.538%0.383SS..THydrogen-bonded Turncis-83.2-4.30.634.3-36.6000113.9S179 Q180 V181P177-S179 VanDerWaalsContact C-N 3.28Å; P177-S179 PolarHBondContact O-N 2.9Å; P177-Q180 WeakPolarHBondContact O-CB 3.43Å; P177-Q180 PolarHBondContact O-N 2.98Å; P177-V181 PolarHBondContact O-N 2.79Å
178L72.8Confident74.6Confident54 Ų5471.9 Ų71.928%0.28339%0.391SS..Hα-helixtrans-64.3-32-173.5-61.8177000112.8L173 I175 Q180 V181 R182 V213L173-L178 HydrophobicContact CD2-CB 4.01Å; L173-L178 HydrophobicContact CD2-CD1 4.13Å; I175-L178 WeakPolarHBondContact O-CB 3.47Å; I175-L178 PolarHBondContact O-N 3.49Å; L178-Q180 VanDerWaalsContact C-N 3.34Å; L178-Q180 PolarHBondContact O-N 2.73Å; L178-V181 PolarHBondContact O-N 2.72Å; L178-R182 WeakPolarHBondContact O-CB 3.29Å; L178-R182 PolarHBondContact O-N 3.18Å; L178-V213 HydrophobicContact CD2-CG2 3.93Å
179S76.8Confident73.9Confident20 Ų2072.6 Ų72.614%0.1439%0.387CS..Hα-helixtrans-58.7-41170.450.20000113.3L173 S174 I175 P176 P177 V181 R182 D183L173-S179 VanDerWaalsContact O-CA 3.31Å; L173-S179 WeakPolarHBondContact O-CA 3.04Å; L173-S179 PolarHBondContact O-N 2.86Å; S174-S179 VanDerWaalsContact O-CB 3.32Å; S174-S179 WeakPolarHBondContact O-CB 3.42Å; I175-S179 PolarHBondContact O-N 3.17Å; I175-S179 VanDerWaalsContact O-N 3.1Å; P176-S179 WeakPolarHBondContact CA-OG 3.22Å; P177-S179 VanDerWaalsContact C-N 3.28Å; P177-S179 PolarHBondContact O-N 2.9Å; S179-V181 VanDerWaalsContact C-N 3.33Å; S179-V181 PolarHBondContact O-N 2.92Å; S179-R182 WeakPolarHBondContact O-CB 3.49Å; S179-R182 PolarHBondContact O-N 3.5Å; S179-D183 WeakPolarHBondContact O-CB 3.34Å; S179-D183 VanDerWaalsContact O-CG 3.31Å; S179-D183 PolarHBondContact O-N 2.56Å
180Q76.6Confident73.1Confident117 Ų11775.2 Ų75.255%0.54741%0.408SS..Hα-helixtrans-63.9-39.5177.8-56.4178.83.200111.4P177 L178 M184P177-Q180 WeakPolarHBondContact O-CB 3.43Å; P177-Q180 PolarHBondContact O-N 2.98Å; L178-Q180 VanDerWaalsContact C-N 3.34Å; L178-Q180 PolarHBondContact O-N 2.73Å; Q180-M184 VanDerWaalsContact O-CB 3.24Å; Q180-M184 WeakPolarHBondContact O-CB 3.19Å; Q180-M184 PolarHBondContact O-N 3.01Å
181V72.6Confident72Confident60 Ų6076.6 Ų76.636%0.36443%0.434SS..Hα-helixtrans-68.1-42.4176.4-177.30000111.2P177 L178 S179 Y185 V209P177-V181 PolarHBondContact O-N 2.79Å; L178-V181 PolarHBondContact O-N 2.72Å; S179-V181 VanDerWaalsContact C-N 3.33Å; S179-V181 PolarHBondContact O-N 2.92Å; V181-Y185 WeakPolarHBondContact O-CB 3.35Å; V181-Y185 PolarHBondContact O-N 3.16Å; V181-V209 HydrophobicContact CG1-CG1 4.32Å; V181-V209 HydrophobicContact CG1-CG2 4.33Å
182R73.2Confident70.7Confident26 Ų2679 Ų7910%0.09845%0.446CS..Hα-helixtrans-60-48.4174.3172.9-175.3173.9168.93.5111.4D170 L173 L178 S179 Y185 L186D170-R182 VanDerWaalsContact CG-NH1 3.31Å; D170-R182 PolarHBondContact O-NH1 3.41Å; D170-R182 IonicContact OD1-CZ 3.54Å; D170-R182 IonicContact OD1-NH1 3.62Å; D170-R182 IonicContact OD1-NH2 2.97Å; D170-R182 PolarHBondContact OD1-NH2 3.01Å; D170-R182 IonicContact OD2-CZ 3.22Å; D170-R182 VanDerWaalsContact OD2-CZ 3.22Å; D170-R182 IonicContact OD2-NH1 2.78Å; D170-R182 PolarHBondContact OD2-NH1 3.13Å; D170-R182 IonicContact OD2-NH2 3.82Å; D170-R182 PolarHBondContact OD2-NH2 3.32Å; L173-R182 WeakPolarHBondContact O-CD 3.27Å; L178-R182 WeakPolarHBondContact O-CB 3.29Å; L178-R182 PolarHBondContact O-N 3.18Å; S179-R182 WeakPolarHBondContact O-CB 3.49Å; S179-R182 PolarHBondContact O-N 3.5Å; R182-Y185 PolarHBondContact O-N 3.02Å; R182-L186 HydrophobicContact CG-CD1 4.06Å; R182-L186 WeakPolarHBondContact O-CG 3.46Å; R182-L186 PolarHBondContact O-N 3.11Å
183D72Confident69.4Low78 Ų7876.3 Ų76.342%0.41745%0.453SS..Hα-helixtrans-69.9-40.1-178.1-71.8-18.3000111.8S179 Y185 L186 Q187S179-D183 WeakPolarHBondContact O-CB 3.34Å; S179-D183 VanDerWaalsContact O-CG 3.31Å; S179-D183 PolarHBondContact O-N 2.56Å; D183-Y185 VanDerWaalsContact C-N 3.3Å; D183-Y185 PolarHBondContact O-N 3.34Å; D183-L186 PolarHBondContact O-N 2.91Å; D183-Q187 WeakPolarHBondContact O-CB 3.15Å; D183-Q187 WeakPolarHBondContact O-CG 3.18Å; D183-Q187 PolarHBondContact O-N 3.33Å
184M75.6Confident68Low87 Ų8782.1 Ų82.143%0.42949%0.489SS..Hα-helixtrans-57.2-42.2170.5178.6177.968.400111.8Q180 T188Q180-M184 VanDerWaalsContact O-CB 3.24Å; Q180-M184 WeakPolarHBondContact O-CB 3.19Å; Q180-M184 PolarHBondContact O-N 3.01Å; M184-T188 VanDerWaalsContact O-CB 3.29Å; M184-T188 WeakPolarHBondContact O-CB 3.02Å; M184-T188 PolarHBondContact O-N 3.34Å; M184-T188 PolarHBondContact O-OG1 2.89Å
185Y69.6Low66.7Low62 Ų6284 Ų8424%0.24350%0.502CS..Hα-helixtrans-68.7-36.4176.8-169.6-87.8000112.6V181 R182 D183 R189 A205 S208V181-Y185 WeakPolarHBondContact O-CB 3.35Å; V181-Y185 PolarHBondContact O-N 3.16Å; R182-Y185 PolarHBondContact O-N 3.02Å; D183-Y185 VanDerWaalsContact C-N 3.3Å; D183-Y185 PolarHBondContact O-N 3.34Å; Y185-R189 HydrophobicContact CE1-CG 4.46Å; Y185-R189 WeakPolarHBondContact O-CG 2.89Å; Y185-R189 PolarHBondContact O-N 3.45Å; Y185-R189 PolarHBondContact OH-NE 2.76Å; Y185-R189 PolarHBondContact OH-NH2 3.43Å; Y185-A205 HydrophobicContact CD1-CB 3.63Å; Y185-A205 HydrophobicContact CE1-CB 4.04Å; Y185-S208 WeakPolarHBondContact CE2-OG 3.5Å; Y185-S208 PolarHBondContact OH-OG 2.88Å
186L73.4Confident65.2Low37 Ų3787 Ų8719%0.19452%0.519CS..Hα-helixtrans-68.8-46.7174.2-71.9169.8000111.5R182 D183 T188 R189 S190 A205R182-L186 HydrophobicContact CG-CD1 4.06Å; R182-L186 WeakPolarHBondContact O-CG 3.46Å; R182-L186 PolarHBondContact O-N 3.11Å; D183-L186 PolarHBondContact O-N 2.91Å; L186-T188 PolarHBondContact O-N 2.93Å; L186-R189 CarbonylContact O-C 3.54Å; L186-R189 PolarHBondContact O-N 3.29Å; L186-R189 VanDerWaalsContact O-N 3.11Å; L186-S190 WeakPolarHBondContact O-CB 3.46Å; L186-S190 PolarHBondContact O-N 2.85Å; L186-A205 HydrophobicContact CD2-CB 3.78Å; L186-A205 HydrophobicContact CG-CB 4.14Å
187Q72.2Confident64.2Low140 Ų14085.5 Ų85.565%0.65451%0.511SS*.Hα-helixtrans-58.3-47.3176.4-72.6170.322.100111.4D183 R189 S190D183-Q187 WeakPolarHBondContact O-CB 3.15Å; D183-Q187 WeakPolarHBondContact O-CG 3.18Å; D183-Q187 PolarHBondContact O-N 3.33Å; Q187-R189 PolarHBondContact O-N 3.49Å; Q187-S190 WeakPolarHBondContact O-CB 3.34Å; Q187-S190 PolarHBondContact O-N 3.46Å
188T68.1Low63.3Low115 Ų11587.3 Ų87.371%0.70652%0.521SS*.Hα-helixtrans-61.4-26.4178-58.60000112.3M184 L186M184-T188 VanDerWaalsContact O-CB 3.29Å; M184-T188 WeakPolarHBondContact O-CB 3.02Å; M184-T188 PolarHBondContact O-N 3.34Å; M184-T188 PolarHBondContact O-OG1 2.89Å; L186-T188 PolarHBondContact O-N 2.93Å
189R64.4Low62.5Low128 Ų12888 Ų8848%0.48353%0.534SS..Hα-helixtrans-88.3-20.2172-74.2-176.8166.7-74.5-6.4114.4Y185 L186 Q187Y185-R189 HydrophobicContact CE1-CG 4.46Å; Y185-R189 WeakPolarHBondContact O-CG 2.89Å; Y185-R189 PolarHBondContact O-N 3.45Å; Y185-R189 PolarHBondContact OH-NE 2.76Å; Y185-R189 PolarHBondContact OH-NH2 3.43Å; L186-R189 CarbonylContact O-C 3.54Å; L186-R189 PolarHBondContact O-N 3.29Å; L186-R189 VanDerWaalsContact O-N 3.11Å; Q187-R189 PolarHBondContact O-N 3.49Å
190S59.9Low61.4Low90 Ų9096.5 Ų96.563%0.62956%0.563SS**Hα-helixtrans-78.4-20.2-174.1-157.10000113.2L186 Q187 C192L186-S190 WeakPolarHBondContact O-CB 3.46Å; L186-S190 PolarHBondContact O-N 2.85Å; Q187-S190 WeakPolarHBondContact O-CB 3.34Å; Q187-S190 PolarHBondContact O-N 3.46Å; S190-C192 PolarHBondContact O-N 3.12Å
191G55Low60.6Low80 Ų8094 Ų9483%0.82556%0.556SS**SBendtrans-64.116.2-176.400000117.6
192C49.2Very low60.2Low102 Ų10292.8 Ų92.869%0.68955%0.548SS*.SBendtrans-142.853.9178.7-169.20000113.7S190 T194S190-C192 PolarHBondContact O-N 3.12Å; C192-T194 VanDerWaalsContact C-N 3.26Å; C192-T194 PolarHBondContact O-N 3.18Å
193G49Very low60Low72 Ų7294.9 Ų94.974%0.74256%0.558SS**  trans64.7-5.114500000120.5S195G193-S195 PolarHBondContact O-N 3.36Å
194T48.6Very low60Low127 Ų12795.9 Ų95.978%0.77956%0.559SS**  trans-91.387.2-177.659.50000112C192 N196C192-T194 VanDerWaalsContact C-N 3.26Å; C192-T194 PolarHBondContact O-N 3.18Å; T194-N196 VanDerWaalsContact C-N 3.29Å; T194-N196 PolarHBondContact O-N 3.39Å
195S49.6Very low59.7Low110 Ų11091.8 Ų91.877%0.76954%0.538SS*.  trans-66.979.7167.8430000111.7G193G193-S195 PolarHBondContact O-N 3.36Å
196N45.7Very low59.9Low156 Ų15688.9 Ų88.983%0.83453%0.527SS*.  trans-165135.2163-102.1-55000113.1T194T194-N196 VanDerWaalsContact C-N 3.29Å; T194-N196 PolarHBondContact O-N 3.39Å
197S50Low59.9Low58 Ų5891.4 Ų91.441%0.40654%0.541SS..  trans73.156.9171.2-146.20000118.3A199 R200 T201S197-A199 VanDerWaalsContact C-N 3.27Å; S197-A199 PolarHBondContact O-N 3.05Å; S197-R200 PolarHBondContact O-N 3.22Å; S197-R200 WeakPolarHBondContact OG-CD 3.21Å; S197-R200 WeakPolarHBondContact OG-CG 3.32Å; S197-T201 PolarHBondContact O-N 3.43Å
198T55.2Low60Low115 Ų11586.4 Ų86.471%0.70652%0.521SS*.Hα-helixtrans-46.9-44.7166.246.60000113.6R200 T201 T202T198-R200 PolarHBondContact O-N 3.33Å; T198-T201 WeakPolarHBondContact CA-OG1 3.48Å; T198-T201 PolarHBondContact O-N 3.48Å; T198-T201 VanDerWaalsContact O-N 3.16Å; T198-T201 PolarHBondContact O-OG1 3.03Å; T198-T202 PolarHBondContact O-N 3.45Å; T198-T202 PolarHBondContact O-OG1 3.27Å
199A55.7Low60.1Low67 Ų6781.2 Ų81.255%0.55449%0.489SS*.Hα-helixtrans-65.6-19.4-179.400000114.7S197 T202S197-A199 VanDerWaalsContact C-N 3.27Å; S197-A199 PolarHBondContact O-N 3.05Å; A199-T202 PolarHBondContact O-OG1 2.88Å
200R55Low60.5Low200 Ų20077.3 Ų77.376%0.75548%0.479SS*.Hα-helixtrans-90.4-31172.8-73.7-175.6176.6-178.7-0.3112.2S197 T198 K204S197-R200 PolarHBondContact O-N 3.22Å; S197-R200 WeakPolarHBondContact OG-CD 3.21Å; S197-R200 WeakPolarHBondContact OG-CG 3.32Å; T198-R200 PolarHBondContact O-N 3.33Å; R200-K204 PolarHBondContact O-N 2.96Å
201T58.1Low61.1Low65 Ų6579 Ų7940%0.39948%0.477SS..Hα-helixtrans-71-38.2173.954.30000111.3S197 T198 K204 A205S197-T201 PolarHBondContact O-N 3.43Å; T198-T201 WeakPolarHBondContact CA-OG1 3.48Å; T198-T201 PolarHBondContact O-N 3.48Å; T198-T201 VanDerWaalsContact O-N 3.16Å; T198-T201 PolarHBondContact O-OG1 3.03Å; T201-K204 PolarHBondContact O-N 3.47Å; T201-A205 VanDerWaalsContact O-CB 3.26Å; T201-A205 WeakPolarHBondContact O-CB 3.49Å; T201-A205 PolarHBondContact O-N 3.22Å
202T65.7Low61.8Low33 Ų3378 Ų7820%0.20246%0.455CS..Hα-helixtrans-62.4-56.7172.455.20000112T198 A199 K204 A205 N206T198-T202 PolarHBondContact O-N 3.45Å; T198-T202 PolarHBondContact O-OG1 3.27Å; A199-T202 PolarHBondContact O-OG1 2.88Å; T202-K204 PolarHBondContact O-N 3.21Å; T202-A205 PolarHBondContact O-N 2.67Å; T202-N206 WeakPolarHBondContact O-CB 3.35Å; T202-N206 PolarHBondContact O-N 2.9Å; T202-N206 PolarHBondContact O-OD1 2.94Å
203K68.7Low62.6Low70 Ų7075.1 Ų75.130%0.30443%0.434SS..Hα-helixtrans-50.5-40.2177.8-83.4-159.7172.2-165.80113E162 F166 L207E162-K203 IonicContact OE1-NZ 2.9Å; E162-K203 PolarHBondContact OE1-NZ 2.89Å; F166-K203 HydrophobicContact CD1-CB 4.39Å; F166-K203 HydrophobicContact CD1-CD 4.04Å; F166-K203 HydrophobicContact CD1-CG 3.76Å; F166-K203 HydrophobicContact CD2-CD 3.85Å; F166-K203 HydrophobicContact CD2-CG 4.47Å; F166-K203 HydrophobicContact CE1-CB 4Å; F166-K203 HydrophobicContact CE1-CD 3.95Å; F166-K203 HydrophobicContact CE1-CG 3.81Å; F166-K203 HydrophobicContact CE2-CD 3.77Å; F166-K203 HydrophobicContact CG-CD 3.99Å; F166-K203 VanDerWaalsContact CG-CE 3.49Å; F166-K203 HydrophobicContact CG-CG 4.12Å; F166-K203 HydrophobicContact CZ-CB 4.43Å; F166-K203 HydrophobicContact CZ-CD 3.83Å; F166-K203 HydrophobicContact CZ-CG 4.21Å; K203-L207 WeakPolarHBondContact O-CG 3.3Å; K203-L207 PolarHBondContact O-N 3.17Å; K203-L207 VanDerWaalsContact O-N 3.15Å
204K72.1Confident63.6Low100 Ų10075.2 Ų75.244%0.43542%0.42SS..Hα-helixtrans-75.7-37.2177.8-174.2166.7-177.91690113.5R200 T201 T202 S208R200-K204 PolarHBondContact O-N 2.96Å; T201-K204 PolarHBondContact O-N 3.47Å; T202-K204 PolarHBondContact O-N 3.21Å; K204-S208 WeakPolarHBondContact O-CB 3.29Å; K204-S208 PolarHBondContact O-N 3.09Å; K204-S208 VanDerWaalsContact O-N 3.08Å
205A69.4Low64.5Low0 Ų075.9 Ų75.90%041%0.408CS..Hα-helixtrans-62.3-49.6172.600000110.3Y185 L186 T201 T202 L207 S208 V209Y185-A205 HydrophobicContact CD1-CB 3.63Å; Y185-A205 HydrophobicContact CE1-CB 4.04Å; L186-A205 HydrophobicContact CD2-CB 3.78Å; L186-A205 HydrophobicContact CG-CB 4.14Å; T201-A205 VanDerWaalsContact O-CB 3.26Å; T201-A205 WeakPolarHBondContact O-CB 3.49Å; T201-A205 PolarHBondContact O-N 3.22Å; T202-A205 PolarHBondContact O-N 2.67Å; A205-L207 PolarHBondContact O-N 3.41Å; A205-S208 CarbonylContact O-C 3.53Å; A205-S208 WeakPolarHBondContact O-CA 3.16Å; A205-S208 VanDerWaalsContact O-CB 3.31Å; A205-S208 WeakPolarHBondContact O-CB 3.16Å; A205-S208 PolarHBondContact O-N 3.31Å; A205-V209 WeakPolarHBondContact O-CG2 3.32Å; A205-V209 PolarHBondContact O-N 3.24Å
206N72.5Confident65.1Low1 Ų175.9 Ų75.91%0.00540%0.395CS..Hα-helixtrans-56.5-49.5179.4-65.214000111.9I169 D170 L173 T202 S208 V209 V210I169-N206 HydrophobicContact CG2-CB 3.88Å; D170-N206 PolarHBondContact OD1-ND2 3.35Å; L173-N206 VanDerWaalsContact CD1-CA 3.47Å; L173-N206 HydrophobicContact CD1-CB 3.67Å; T202-N206 WeakPolarHBondContact O-CB 3.35Å; T202-N206 PolarHBondContact O-N 2.9Å; T202-N206 PolarHBondContact O-OD1 2.94Å; N206-S208 VanDerWaalsContact C-N 3.28Å; N206-S208 PolarHBondContact O-N 2.82Å; N206-V209 PolarHBondContact O-N 2.8Å; N206-V210 WeakPolarHBondContact O-CG2 3.49Å; N206-V210 PolarHBondContact O-N 3.08Å
207L74.5Confident66.3Low91 Ų9176.7 Ų76.748%0.47639%0.386SS..Hα-helixtrans-60-37.8173.9-73.9171.8000112.5F166 K203 A205 H211F166-L207 HydrophobicContact CE1-CD1 4.21Å; F166-L207 HydrophobicContact CE1-CD2 4.18Å; F166-L207 HydrophobicContact CE1-CG 3.93Å; F166-L207 HydrophobicContact CZ-CD1 4.02Å; F166-L207 HydrophobicContact CZ-CD2 4.29Å; F166-L207 HydrophobicContact CZ-CG 4.18Å; K203-L207 WeakPolarHBondContact O-CG 3.3Å; K203-L207 PolarHBondContact O-N 3.17Å; K203-L207 VanDerWaalsContact O-N 3.15Å; A205-L207 PolarHBondContact O-N 3.41Å; L207-H211 WeakPolarHBondContact O-CB 3.49Å; L207-H211 PolarHBondContact O-N 2.92Å
208S73Confident67.1Low35 Ų3578.4 Ų78.425%0.24539%0.39CS..Hα-helixtrans-66.6-39.1177-1610000111.8Y185 K204 A205 N206 T212Y185-S208 WeakPolarHBondContact CE2-OG 3.5Å; Y185-S208 PolarHBondContact OH-OG 2.88Å; K204-S208 WeakPolarHBondContact O-CB 3.29Å; K204-S208 PolarHBondContact O-N 3.09Å; K204-S208 VanDerWaalsContact O-N 3.08Å; A205-S208 CarbonylContact O-C 3.53Å; A205-S208 WeakPolarHBondContact O-CA 3.16Å; A205-S208 VanDerWaalsContact O-CB 3.31Å; A205-S208 WeakPolarHBondContact O-CB 3.16Å; A205-S208 PolarHBondContact O-N 3.31Å; N206-S208 VanDerWaalsContact C-N 3.28Å; N206-S208 PolarHBondContact O-N 2.82Å; S208-T212 WeakPolarHBondContact O-CB 3.43Å; S208-T212 PolarHBondContact O-N 3.11Å; S208-T212 VanDerWaalsContact O-N 3.13Å; S208-T212 PolarHBondContact O-OG1 2.65Å
209V71.1Confident67.6Low5 Ų575.5 Ų75.53%0.0337%0.367CS..Hα-helixtrans-72.7-47.7177.5-179.80000110.5L173 V181 A205 N206 H211 T212 V213L173-V209 HydrophobicContact CD1-CB 4.12Å; L173-V209 HydrophobicContact CD1-CG1 4.39Å; L173-V209 HydrophobicContact CD2-CB 4.25Å; L173-V209 HydrophobicContact CD2-CG1 3.62Å; V181-V209 HydrophobicContact CG1-CG1 4.32Å; V181-V209 HydrophobicContact CG1-CG2 4.33Å; A205-V209 WeakPolarHBondContact O-CG2 3.32Å; A205-V209 PolarHBondContact O-N 3.24Å; N206-V209 PolarHBondContact O-N 2.8Å; V209-H211 PolarHBondContact O-N 2.97Å; V209-T212 CarbonylContact O-C 3.54Å; V209-T212 WeakPolarHBondContact O-CA 3.17Å; V209-T212 WeakPolarHBondContact O-CB 3.23Å; V209-T212 PolarHBondContact O-N 2.9Å; V209-V213 HydrophobicContact CG1-CG2 4.21Å; V209-V213 WeakPolarHBondContact O-CG2 3.34Å; V209-V213 PolarHBondContact O-N 2.86Å
210V72.2Confident68.2Low46 Ų4677.3 Ų77.328%0.27936%0.364SS..Hα-helixtrans-57.1-49.1175.3171.60000111.3I169 L173 N206 T212 V213 V214I169-V210 HydrophobicContact CG1-CG2 4.42Å; I169-V210 HydrophobicContact CG2-CG2 3.61Å; L173-V210 HydrophobicContact CD1-CG2 4.17Å; N206-V210 WeakPolarHBondContact O-CG2 3.49Å; N206-V210 PolarHBondContact O-N 3.08Å; V210-T212 PolarHBondContact O-N 3.33Å; V210-V213 PolarHBondContact O-N 2.99Å; V210-V214 HydrophobicContact CG1-CG2 4.11Å; V210-V214 WeakPolarHBondContact O-CB 3.31Å; V210-V214 VanDerWaalsContact O-CG2 3.28Å; V210-V214 WeakPolarHBondContact O-CG2 3.49Å; V210-V214 PolarHBondContact O-N 3.5Å
211H72.7Confident68.7Low127 Ų12774.8 Ų74.859%0.58836%0.356SS*.Hα-helixtrans-59.7-34.3176.8179-78000112.2L207 V209 R215L207-H211 WeakPolarHBondContact O-CB 3.49Å; L207-H211 PolarHBondContact O-N 2.92Å; V209-H211 PolarHBondContact O-N 2.97Å; H211-R215 VanDerWaalsContact O-CB 3.23Å; H211-R215 WeakPolarHBondContact O-CB 3.45Å; H211-R215 PolarHBondContact O-N 2.92Å
212T69.1Low69.3Low59 Ų5975.4 Ų75.436%0.36236%0.356SS..Hα-helixtrans-71.6-48.8177.1-58.50000111.1S208 V209 V210 V214 R215 F216S208-T212 WeakPolarHBondContact O-CB 3.43Å; S208-T212 PolarHBondContact O-N 3.11Å; S208-T212 VanDerWaalsContact O-N 3.13Å; S208-T212 PolarHBondContact O-OG1 2.65Å; V209-T212 CarbonylContact O-C 3.54Å; V209-T212 WeakPolarHBondContact O-CA 3.17Å; V209-T212 WeakPolarHBondContact O-CB 3.23Å; V209-T212 PolarHBondContact O-N 2.9Å; V210-T212 PolarHBondContact O-N 3.33Å; T212-V214 PolarHBondContact O-N 2.94Å; T212-R215 PolarHBondContact O-N 3.34Å; T212-F216 HydrophobicContact CG2-CD2 3.73Å; T212-F216 HydrophobicContact CG2-CE2 3.53Å; T212-F216 WeakPolarHBondContact O-CD2 3.49Å; T212-F216 PolarHBondContact O-N 3.46Å
213V67.3Low69.5Low41 Ų4177.3 Ų77.325%0.24837%0.365CS..Hα-helixtrans-60.3-44.6176.3172.70000111.5L178 V209 V210 F216 R217L178-V213 HydrophobicContact CD2-CG2 3.93Å; V209-V213 HydrophobicContact CG1-CG2 4.21Å; V209-V213 WeakPolarHBondContact O-CG2 3.34Å; V209-V213 PolarHBondContact O-N 2.86Å; V210-V213 PolarHBondContact O-N 2.99Å; V213-F216 PolarHBondContact O-N 3.22Å; V213-R217 HydrophobicContact CG1-CG 4.49Å; V213-R217 WeakPolarHBondContact O-CG 3.47Å; V213-R217 PolarHBondContact O-N 3.07Å
214V70.3Confident69.7Low73 Ų7377.6 Ų77.644%0.44237%0.367SS..Hα-helixtrans-63.1-41.9175.7170.40000110.9V210 T212 F216 R217 I218V210-V214 HydrophobicContact CG1-CG2 4.11Å; V210-V214 WeakPolarHBondContact O-CB 3.31Å; V210-V214 VanDerWaalsContact O-CG2 3.28Å; V210-V214 WeakPolarHBondContact O-CG2 3.49Å; V210-V214 PolarHBondContact O-N 3.5Å; T212-V214 PolarHBondContact O-N 2.94Å; V214-F216 VanDerWaalsContact C-N 3.34Å; V214-F216 PolarHBondContact O-N 3.19Å; V214-R217 PolarHBondContact O-N 2.78Å; V214-I218 HydrophobicContact CG1-CD1 3.66Å; V214-I218 HydrophobicContact CG1-CG1 4.36Å; V214-I218 WeakPolarHBondContact O-CB 3.24Å; V214-I218 VanDerWaalsContact O-CG1 3.24Å; V214-I218 WeakPolarHBondContact O-CG1 3.39Å; V214-I218 PolarHBondContact O-N 3.15Å
215R66.4Low69.8Low142 Ų14276 Ų7654%0.53636%0.363SS..Hα-helixtrans-66.4-32.7176.3-171.2176.6-175.5-166.80.4112.9H211 T212 K219H211-R215 VanDerWaalsContact O-CB 3.23Å; H211-R215 WeakPolarHBondContact O-CB 3.45Å; H211-R215 PolarHBondContact O-N 2.92Å; T212-R215 PolarHBondContact O-N 3.34Å; R215-K219 WeakPolarHBondContact O-CG 3.34Å; R215-K219 PolarHBondContact O-N 2.9Å
216F62.7Low70.1Confident110 Ų11079.1 Ų79.148%0.48237%0.374SS..Hα-helixtrans-71-51172.2-81.1-66000111.6T212 V213 V214 I218 K219 E220T212-F216 HydrophobicContact CG2-CD2 3.73Å; T212-F216 HydrophobicContact CG2-CE2 3.53Å; T212-F216 WeakPolarHBondContact O-CD2 3.49Å; T212-F216 PolarHBondContact O-N 3.46Å; V213-F216 PolarHBondContact O-N 3.22Å; V214-F216 VanDerWaalsContact C-N 3.34Å; V214-F216 PolarHBondContact O-N 3.19Å; F216-I218 VanDerWaalsContact C-N 3.29Å; F216-I218 PolarHBondContact O-N 2.95Å; F216-K219 WeakPolarHBondContact O-CA 3.23Å; F216-K219 WeakPolarHBondContact O-CB 3.35Å; F216-K219 PolarHBondContact O-N 3.29Å; F216-E220 WeakPolarHBondContact O-CG 3.41Å; F216-E220 PolarHBondContact O-N 2.84Å
217R71Confident70.4Confident172 Ų17281.8 Ų81.865%0.64939%0.387SS*.Hα-helixtrans-58.7-36.9177.8-74.1-175.1175.6-171.5-1.8113.6V213 V214 E220 Y221V213-R217 HydrophobicContact CG1-CG 4.49Å; V213-R217 WeakPolarHBondContact O-CG 3.47Å; V213-R217 PolarHBondContact O-N 3.07Å; V214-R217 PolarHBondContact O-N 2.78Å; R217-E220 VanDerWaalsContact CA-OE2 3.32Å; R217-E220 WeakPolarHBondContact CA-OE2 3.15Å; R217-E220 PolarHBondContact O-N 3.22Å; R217-Y221 VanDerWaalsContact O-CB 3.23Å; R217-Y221 WeakPolarHBondContact O-CB 3.43Å; R217-Y221 PolarHBondContact O-N 3.32Å
218I66.4Low70.5Confident95 Ų9582.3 Ų82.349%0.48739%0.387SS..Hα-helixtrans-65.2-38.3173.3-70.8168.3000111.2V214 F216 L222V214-I218 HydrophobicContact CG1-CD1 3.66Å; V214-I218 HydrophobicContact CG1-CG1 4.36Å; V214-I218 WeakPolarHBondContact O-CB 3.24Å; V214-I218 VanDerWaalsContact O-CG1 3.24Å; V214-I218 WeakPolarHBondContact O-CG1 3.39Å; V214-I218 PolarHBondContact O-N 3.15Å; F216-I218 VanDerWaalsContact C-N 3.29Å; F216-I218 PolarHBondContact O-N 2.95Å; I218-L222 HydrophobicContact CG2-CD1 3.9Å; I218-L222 HydrophobicContact CG2-CG 4.45Å; I218-L222 VanDerWaalsContact O-CB 3.32Å; I218-L222 WeakPolarHBondContact O-CB 3.33Å; I218-L222 WeakPolarHBondContact O-CD1 3.45Å; I218-L222 WeakPolarHBondContact O-CG 3.48Å; I218-L222 PolarHBondContact O-N 3.3Å
219K65.5Low70.8Confident54 Ų5484.7 Ų84.724%0.23540%0.396CS..Hα-helixtrans-66.9-44.9174.1-78-179.8162.9-167.80111.9R215 F216 L222 I223 D273 L274R215-K219 WeakPolarHBondContact O-CG 3.34Å; R215-K219 PolarHBondContact O-N 2.9Å; F216-K219 WeakPolarHBondContact O-CA 3.23Å; F216-K219 WeakPolarHBondContact O-CB 3.35Å; F216-K219 PolarHBondContact O-N 3.29Å; K219-L222 PolarHBondContact O-N 3.46Å; K219-I223 VanDerWaalsContact O-CG1 3.31Å; K219-I223 WeakPolarHBondContact O-CG1 3.32Å; K219-I223 PolarHBondContact O-N 2.83Å; K219-D273 IonicContact NZ-OD2 2.76Å; K219-D273 PolarHBondContact NZ-OD2 3.07Å; K219-L274 HydrophobicContact CB-CD2 4.16Å; K219-L274 HydrophobicContact CG-CD2 4.19Å
220E68Low71.4Confident105 Ų10585.9 Ų85.949%0.49140%0.4SS..Hα-helixtrans-59.1-52177.7-69.2160.9162.700110.2F216 R217 L222 I223 E224F216-E220 WeakPolarHBondContact O-CG 3.41Å; F216-E220 PolarHBondContact O-N 2.84Å; R217-E220 VanDerWaalsContact CA-OE2 3.32Å; R217-E220 WeakPolarHBondContact CA-OE2 3.15Å; R217-E220 PolarHBondContact O-N 3.22Å; E220-L222 VanDerWaalsContact C-N 3.34Å; E220-L222 PolarHBondContact O-N 3.49Å; E220-I223 WeakPolarHBondContact O-CB 3.48Å; E220-I223 PolarHBondContact O-N 3.35Å; E220-E224 WeakPolarHBondContact O-CG 3.22Å; E220-E224 PolarHBondContact O-N 3.48Å
221Y65.4Low72Confident147 Ų14790.7 Ų90.758%0.57641%0.413SS*.Hα-helixtrans-59.2-38.7175.6-177.4-100.6000113.3R217 I223 E224 L225R217-Y221 VanDerWaalsContact O-CB 3.23Å; R217-Y221 WeakPolarHBondContact O-CB 3.43Å; R217-Y221 PolarHBondContact O-N 3.32Å; Y221-I223 VanDerWaalsContact C-N 3.34Å; Y221-E224 PolarHBondContact O-N 3.48Å; Y221-L225 HydrophobicContact CE1-CD2 4.34Å; Y221-L225 WeakPolarHBondContact O-CB 3.28Å; Y221-L225 PolarHBondContact O-N 3.09Å
222L70.3Confident72.5Confident78 Ų7887.3 Ų87.341%0.40840%0.404SS..Hα-helixtrans-68.7-30.1174.9-74.8170.3000112.9I218 K219 E220 R226 L274I218-L222 HydrophobicContact CG2-CD1 3.9Å; I218-L222 HydrophobicContact CG2-CG 4.45Å; I218-L222 VanDerWaalsContact O-CB 3.32Å; I218-L222 WeakPolarHBondContact O-CB 3.33Å; I218-L222 WeakPolarHBondContact O-CD1 3.45Å; I218-L222 WeakPolarHBondContact O-CG 3.48Å; I218-L222 PolarHBondContact O-N 3.3Å; K219-L222 PolarHBondContact O-N 3.46Å; E220-L222 VanDerWaalsContact C-N 3.34Å; E220-L222 PolarHBondContact O-N 3.49Å; L222-R226 WeakPolarHBondContact O-CB 3.46Å; L222-R226 PolarHBondContact O-N 2.71Å; L222-R226 VanDerWaalsContact O-N 3.08Å; L222-L274 HydrophobicContact CB-CD2 4.43Å; L222-L274 HydrophobicContact CD1-CD1 4.42Å
223I70.8Confident73.3Confident73 Ų7385.4 Ų85.437%0.37439%0.391SS..Hα-helixtrans-72.6-46.4172.5-67.7163000110K219 E220 Y221 R226 E227 L274K219-I223 VanDerWaalsContact O-CG1 3.31Å; K219-I223 WeakPolarHBondContact O-CG1 3.32Å; K219-I223 PolarHBondContact O-N 2.83Å; E220-I223 WeakPolarHBondContact O-CB 3.48Å; E220-I223 PolarHBondContact O-N 3.35Å; Y221-I223 VanDerWaalsContact C-N 3.34Å; I223-R226 WeakPolarHBondContact O-CB 3.29Å; I223-R226 PolarHBondContact O-N 3.28Å; I223-E227 WeakPolarHBondContact O-CG 3.5Å; I223-E227 PolarHBondContact O-N 2.98Å; I223-L274 HydrophobicContact CD1-CD2 4.09Å; I223-L274 HydrophobicContact CG1-CD2 3.77Å
224E72.1Confident74.3Confident76 Ų7685.5 Ų85.536%0.35539%0.39SS..Hα-helixtrans-60.6-46.3177.2-71.6178.1165.900111.7E220 Y221 R226 E227 H228E220-E224 WeakPolarHBondContact O-CG 3.22Å; E220-E224 PolarHBondContact O-N 3.48Å; Y221-E224 PolarHBondContact O-N 3.48Å; E224-R226 PolarHBondContact O-N 3.03Å; E224-E227 PolarHBondContact O-N 2.62Å; E224-H228 WeakPolarHBondContact O-CB 3.33Å; E224-H228 PolarHBondContact O-N 2.92Å
225L74.5Confident75Confident66 Ų6686.3 Ų86.335%0.34640%0.395SS..Hα-helixtrans-61.4-42.7175179.461.7000111.8Y221 H228 I229Y221-L225 HydrophobicContact CE1-CD2 4.34Å; Y221-L225 WeakPolarHBondContact O-CB 3.28Å; Y221-L225 PolarHBondContact O-N 3.09Å; L225-H228 PolarHBondContact O-N 2.88Å; L225-I229 HydrophobicContact CD1-CD1 4.15Å; L225-I229 HydrophobicContact CD1-CG1 4.41Å; L225-I229 HydrophobicContact CG-CD1 4.04Å; L225-I229 VanDerWaalsContact O-CG1 3.29Å; L225-I229 WeakPolarHBondContact O-CG1 3.35Å; L225-I229 PolarHBondContact O-N 3.03Å
226R77.1Confident75.9Confident65 Ų6583 Ų8325%0.24539%0.388CS..Hα-helixtrans-60.8-47.6175.7-176.5-171.5-169.3-143.1-1111.4L222 I223 E224 H228 I229 R230 L275 E279L222-R226 WeakPolarHBondContact O-CB 3.46Å; L222-R226 PolarHBondContact O-N 2.71Å; L222-R226 VanDerWaalsContact O-N 3.08Å; I223-R226 WeakPolarHBondContact O-CB 3.29Å; I223-R226 PolarHBondContact O-N 3.28Å; E224-R226 PolarHBondContact O-N 3.03Å; R226-H228 VanDerWaalsContact C-N 3.33Å; R226-I229 PolarHBondContact O-N 3.15Å; R226-R230 VanDerWaalsContact NH2-NH2 3.16Å; R226-R230 WeakPolarHBondContact O-CB 3.46Å; R226-R230 WeakPolarHBondContact O-CG 3.41Å; R226-R230 PolarHBondContact O-N 2.86Å; R226-L275 VanDerWaalsContact NH2-CD2 3.25Å; R226-E279 IonicContact CZ-OE2 2.62Å; R226-E279 VanDerWaalsContact CZ-OE2 3.22Å; R226-E279 IonicContact NH1-OE1 2.94Å; R226-E279 IonicContact NH1-OE2 2.85Å; R226-E279 PolarHBondContact NH1-OE2 2.96Å; R226-E279 IonicContact NH2-OE1 3.14Å; R226-E279 IonicContact NH2-OE2 2.65Å; R226-E279 PolarHBondContact NH2-OE2 3.2Å
227E78Confident77.1Confident58 Ų5877.8 Ų77.827%0.27137%0.365SS..Hα-helixtrans-73.9-24.4179.9-65.5-54.513500112.2I223 E224 R230 R231I223-E227 WeakPolarHBondContact O-CG 3.5Å; I223-E227 PolarHBondContact O-N 2.98Å; E224-E227 PolarHBondContact O-N 2.62Å; E227-R230 WeakPolarHBondContact OE1-CD 3.4Å; E227-R230 IonicContact OE1-CZ 2.73Å; E227-R230 IonicContact OE1-NE 2.77Å; E227-R230 IonicContact OE1-NH1 2.72Å; E227-R230 PolarHBondContact OE1-NH1 3.44Å; E227-R230 WeakPolarHBondContact OE2-CD 3.37Å; E227-R231 VanDerWaalsContact O-CG 3.3Å; E227-R231 WeakPolarHBondContact O-CG 3.41Å; E227-R231 PolarHBondContact O-N 3.33Å; E227-R231 VanDerWaalsContact O-N 3.11Å; E227-R231 PolarHBondContact O-NH1 3.35Å
228H76.9Confident77.9Confident102 Ų10278 Ų7847%0.47237%0.367SS..Hα-helixtrans-66.6-54.5167.8176.279.3000110.9E224 L225 R226 R230 R231 S232E224-H228 WeakPolarHBondContact O-CB 3.33Å; E224-H228 PolarHBondContact O-N 2.92Å; L225-H228 PolarHBondContact O-N 2.88Å; R226-H228 VanDerWaalsContact C-N 3.33Å; H228-R230 PolarHBondContact O-N 2.88Å; H228-R231 PolarHBondContact O-N 3.03Å; H228-S232 PolarHBondContact O-N 2.98Å; H228-S232 PolarHBondContact O-OG 3.34Å
229I78.9Confident78.7Confident84 Ų8479.5 Ų79.543%0.43138%0.376SS..Hα-helixtrans-52.9-43.1175.5-68.8163.8000110.4L225 R226 S232 L233L225-I229 HydrophobicContact CD1-CD1 4.15Å; L225-I229 HydrophobicContact CD1-CG1 4.41Å; L225-I229 HydrophobicContact CG-CD1 4.04Å; L225-I229 VanDerWaalsContact O-CG1 3.29Å; L225-I229 WeakPolarHBondContact O-CG1 3.35Å; L225-I229 PolarHBondContact O-N 3.03Å; R226-I229 PolarHBondContact O-N 3.15Å; I229-S232 PolarHBondContact O-N 2.87Å; I229-L233 HydrophobicContact CG2-CD1 3.92Å; I229-L233 HydrophobicContact CG2-CG 4.34Å; I229-L233 WeakPolarHBondContact O-CB 3.31Å; I229-L233 VanDerWaalsContact O-CG 3.29Å; I229-L233 WeakPolarHBondContact O-CG 3.4Å; I229-L233 PolarHBondContact O-N 3.43Å
230R84Confident79.5Confident30 Ų3082.2 Ų82.211%0.11339%0.393CS..Hα-helixtrans-61.2-42.1177.3-86.1175.4156.2-167.5-14.7114.3R226 E227 H228 D234 R249 E279R226-R230 VanDerWaalsContact NH2-NH2 3.16Å; R226-R230 WeakPolarHBondContact O-CB 3.46Å; R226-R230 WeakPolarHBondContact O-CG 3.41Å; R226-R230 PolarHBondContact O-N 2.86Å; E227-R230 WeakPolarHBondContact OE1-CD 3.4Å; E227-R230 IonicContact OE1-CZ 2.73Å; E227-R230 IonicContact OE1-NE 2.77Å; E227-R230 IonicContact OE1-NH1 2.72Å; E227-R230 PolarHBondContact OE1-NH1 3.44Å; E227-R230 WeakPolarHBondContact OE2-CD 3.37Å; H228-R230 PolarHBondContact O-N 2.88Å; R230-D234 PolarHBondContact O-N 3.3Å; R230-R249 PolarHBondContact O-NH1 3.45Å; R230-E279 IonicContact CZ-OE1 3.92Å; R230-E279 VanDerWaalsContact CZ-OE1 3.27Å; R230-E279 IonicContact NH1-OE1 3.32Å; R230-E279 PolarHBondContact NH1-OE1 3.47Å; R230-E279 IonicContact NH2-OE1 3.86Å; R230-E279 PolarHBondContact NH2-OE1 2.91Å; R230-E279 IonicContact NH2-OE2 3.05Å
231R83.9Confident80.2Confident148 Ų14879.1 Ų79.156%0.55838%0.38SS*.Hα-helixtrans-66.9-45.3174.4-70.9174.9-164.2102.2-13.6110.8E227 H228 L233 D234 T235E227-R231 VanDerWaalsContact O-CG 3.3Å; E227-R231 WeakPolarHBondContact O-CG 3.41Å; E227-R231 PolarHBondContact O-N 3.33Å; E227-R231 VanDerWaalsContact O-N 3.11Å; E227-R231 PolarHBondContact O-NH1 3.35Å; H228-R231 PolarHBondContact O-N 3.03Å; R231-L233 VanDerWaalsContact C-N 3.29Å; R231-L233 PolarHBondContact O-N 2.87Å; R231-D234 PolarHBondContact O-N 3.46Å; R231-D234 VanDerWaalsContact O-N 3.11Å; R231-T235 PolarHBondContact O-N 3.27Å; R231-T235 PolarHBondContact O-OG1 3.27Å
232S84.4Confident81Confident56 Ų5680.8 Ų80.839%0.39239%0.393SS..Hα-helixtrans-60.5-37.2177.6-56.90000112.3H228 I229 L236H228-S232 PolarHBondContact O-N 2.98Å; H228-S232 PolarHBondContact O-OG 3.34Å; I229-S232 PolarHBondContact O-N 2.87Å; S232-L236 VanDerWaalsContact O-CB 3.27Å; S232-L236 WeakPolarHBondContact O-CB 3.4Å; S232-L236 PolarHBondContact O-N 2.98Å
233L86.1Confident81.6Confident19 Ų1984.8 Ų84.810%0.09942%0.415CS..Hα-helixtrans-69.1-42171.7-70.8172.8000112.9I229 R231 L236 F237 R249 A253 L257I229-L233 HydrophobicContact CG2-CD1 3.92Å; I229-L233 HydrophobicContact CG2-CG 4.34Å; I229-L233 WeakPolarHBondContact O-CB 3.31Å; I229-L233 VanDerWaalsContact O-CG 3.29Å; I229-L233 WeakPolarHBondContact O-CG 3.4Å; I229-L233 PolarHBondContact O-N 3.43Å; R231-L233 VanDerWaalsContact C-N 3.29Å; R231-L233 PolarHBondContact O-N 2.87Å; L233-L236 PolarHBondContact O-N 2.84Å; L233-F237 HydrophobicContact CB-CD2 4.37Å; L233-F237 HydrophobicContact CB-CE2 4.01Å; L233-F237 HydrophobicContact CD2-CE2 3.98Å; L233-F237 HydrophobicContact CD2-CZ 3.86Å; L233-F237 HydrophobicContact CG-CE2 4.49Å; L233-F237 WeakPolarHBondContact O-CB 3.41Å; L233-F237 WeakPolarHBondContact O-CD2 3.36Å; L233-F237 WeakPolarHBondContact O-CG 3.31Å; L233-F237 PolarHBondContact O-N 3.48Å; L233-R249 HydrophobicContact CB-CG 4.02Å; L233-R249 HydrophobicContact CD1-CG 4.26Å; L233-A253 HydrophobicContact CD1-CB 4.12Å; L233-A253 HydrophobicContact CD2-CB 4.31Å; L233-L257 HydrophobicContact CD2-CD1 3.49Å; L233-L257 VanDerWaalsContact CD2-CD1 3.49Å
234D87.8Confident82.3Confident43 Ų4382.8 Ų82.823%0.2340%0.403CS..Hα-helixtrans-60.3-46.4174.1-79.8-16.9000111R230 R231 L236 F237 Y238 Y244 R249R230-D234 PolarHBondContact O-N 3.3Å; R231-D234 PolarHBondContact O-N 3.46Å; R231-D234 VanDerWaalsContact O-N 3.11Å; D234-L236 PolarHBondContact O-N 2.8Å; D234-F237 PolarHBondContact O-N 2.95Å; D234-Y238 WeakPolarHBondContact O-CB 3.2Å; D234-Y238 PolarHBondContact O-N 2.61Å; D234-Y244 HydrophobicContact CB-CE1 4.17Å; D234-Y244 WeakPolarHBondContact OD1-CE1 3.23Å; D234-Y244 PolarHBondContact OD1-OH 3.21Å; D234-R249 WeakPolarHBondContact OD1-CD 3.42Å; D234-R249 IonicContact OD1-CZ 3.82Å; D234-R249 IonicContact OD1-NE 3.27Å; D234-R249 IonicContact OD1-NH1 2.75Å; D234-R249 PolarHBondContact OD1-NH1 3.08Å; D234-R249 IonicContact OD1-NH2 2.79Å; D234-R249 PolarHBondContact OD1-NH2 3.28Å; D234-R249 IonicContact OD2-CZ 3.7Å; D234-R249 IonicContact OD2-NH1 2.92Å; D234-R249 PolarHBondContact OD2-NH1 3.26Å; D234-R249 IonicContact OD2-NH2 3.22Å; D234-R249 PolarHBondContact OD2-NH2 3.45Å
235T85.3Confident83Confident89 Ų8982.1 Ų82.155%0.54640%0.402SS..Hα-helixtrans-63.1-40.4176.5-57.90000111.8R231 N239R231-T235 PolarHBondContact O-N 3.27Å; R231-T235 PolarHBondContact O-OG1 3.27Å; T235-N239 PolarHBondContact O-N 3.14Å; T235-N239 PolarHBondContact O-ND2 3.09Å
236L85.4Confident83.5Confident73 Ų7381.8 Ų81.838%0.38241%0.406SS..Hα-helixtrans-63.5-50.4176.6-177.964.2000111.3S232 L233 D234 N239 L240S232-L236 VanDerWaalsContact O-CB 3.27Å; S232-L236 WeakPolarHBondContact O-CB 3.4Å; S232-L236 PolarHBondContact O-N 2.98Å; L233-L236 PolarHBondContact O-N 2.84Å; D234-L236 PolarHBondContact O-N 2.8Å; L236-N239 PolarHBondContact O-N 3.25Å; L236-L240 HydrophobicContact CD1-CD1 3.83Å; L236-L240 HydrophobicContact CD1-CG 4.49Å; L236-L240 HydrophobicContact CG-CD1 3.86Å; L236-L240 WeakPolarHBondContact O-CG 3.25Å; L236-L240 PolarHBondContact O-N 3.34Å
237F88.2Confident83.8Confident0 Ų085 Ų850%042%0.421CS..Hα-helixtrans-74.7-31.3-175.6-59-37.2000113.5L233 D234 N239 L240 V241 Y244 R249 L252 A253 I256L233-F237 HydrophobicContact CB-CD2 4.37Å; L233-F237 HydrophobicContact CB-CE2 4.01Å; L233-F237 HydrophobicContact CD2-CE2 3.98Å; L233-F237 HydrophobicContact CD2-CZ 3.86Å; L233-F237 HydrophobicContact CG-CE2 4.49Å; L233-F237 WeakPolarHBondContact O-CB 3.41Å; L233-F237 WeakPolarHBondContact O-CD2 3.36Å; L233-F237 WeakPolarHBondContact O-CG 3.31Å; L233-F237 PolarHBondContact O-N 3.48Å; D234-F237 PolarHBondContact O-N 2.95Å; F237-N239 PolarHBondContact O-N 3.17Å; F237-L240 PolarHBondContact O-N 3.41Å; F237-L240 VanDerWaalsContact O-N 3.08Å; F237-V241 PolarHBondContact O-N 3.35Å; F237-Y244 HydrophobicContact CB-CD1 4.29Å; F237-Y244 HydrophobicContact CB-CD2 3.52Å; F237-Y244 HydrophobicContact CB-CE1 4.19Å; F237-Y244 HydrophobicContact CB-CE2 3.41Å; F237-Y244 VanDerWaalsContact CB-CE2 3.41Å; F237-Y244 HydrophobicContact CB-CG 3.97Å; F237-Y244 AromaticContact CD2-CE2 3.78Å; F237-Y244 HydrophobicContact CD2-CE2 3.78Å; F237-Y244 AromaticContact CD2-CZ 3.99Å; F237-Y244 HydrophobicContact CG-CD2 4.48Å; F237-Y244 HydrophobicContact CG-CE2 4.02Å; F237-R249 HydrophobicContact CD2-CG 4.46Å; F237-R249 HydrophobicContact CE2-CG 4.26Å; F237-L252 HydrophobicContact CB-CD1 4.44Å; F237-L252 HydrophobicContact CD1-CB 4.41Å; F237-L252 HydrophobicContact CD2-CB 4.07Å; F237-L252 HydrophobicContact CD2-CD1 4.43Å; F237-L252 HydrophobicContact CE1-CB 4.23Å; F237-L252 HydrophobicContact CE2-CB 3.85Å; F237-L252 HydrophobicContact CG-CB 4.35Å; F237-L252 HydrophobicContact CG-CD1 4.31Å; F237-L252 HydrophobicContact CZ-CB 3.96Å; F237-A253 HydrophobicContact CE2-CB 4.15Å; F237-A253 HydrophobicContact CZ-CB 4.05Å; F237-I256 HydrophobicContact CD1-CD1 4.04Å; F237-I256 HydrophobicContact CE1-CB 4.49Å; F237-I256 HydrophobicContact CE1-CD1 3.73Å
238Y86.7Confident83.9Confident178 Ų17884.1 Ų84.170%0.69842%0.422SS*.Hα-helixtrans-62.6-26.8171.9-167.2-86.6000112.7D234 Y244D234-Y238 WeakPolarHBondContact O-CB 3.2Å; D234-Y238 PolarHBondContact O-N 2.61Å; Y238-Y244 HydrophobicContact CD2-CD1 4.45Å
239N83.6Confident84.3Confident126 Ų12680.7 Ų80.767%0.67440%0.404SS*.THydrogen-bonded Turntrans-90.1-9.1174.3-73.2-65.5000114.1T235 L236 F237T235-N239 PolarHBondContact O-N 3.14Å; T235-N239 PolarHBondContact O-ND2 3.09Å; L236-N239 PolarHBondContact O-N 3.25Å; F237-N239 PolarHBondContact O-N 3.17Å
240L82.1Confident84.2Confident111 Ų11181 Ų8158%0.58141%0.407SS*.THydrogen-bonded Turntrans-114.1-22.6-176.5-71.4176.8000114.3L236 F237L236-L240 HydrophobicContact CD1-CD1 3.83Å; L236-L240 HydrophobicContact CD1-CG 4.49Å; L236-L240 HydrophobicContact CG-CD1 3.86Å; L236-L240 WeakPolarHBondContact O-CG 3.25Å; L236-L240 PolarHBondContact O-N 3.34Å; F237-L240 PolarHBondContact O-N 3.41Å; F237-L240 VanDerWaalsContact O-N 3.08Å
241V81.8Confident83.8Confident39 Ų3984 Ų8424%0.23643%0.428CS..SBendtrans-131.9112-170.2-176.90000110.1F237 N243 Y244 L252F237-V241 PolarHBondContact O-N 3.35Å; V241-N243 PolarHBondContact O-N 3.42Å; V241-Y244 WeakPolarHBondContact O-CB 3.33Å; V241-Y244 PolarHBondContact O-N 2.65Å; V241-L252 HydrophobicContact CG2-CD1 4.31Å
242E82.5Confident83.7Confident182 Ų18277.4 Ų77.485%0.8540%0.404SS*.THydrogen-bonded Turntrans-57.8133.7170.2-65-175.8177.800110.4Y244E242-Y244 VanDerWaalsContact C-N 3.35Å
243N83.1Confident83.5Confident162 Ų16275 Ų7587%0.86639%0.388SS*.THydrogen-bonded Turntrans63.930.7-176.9-47.3-80.3000114.9V241 D245V241-N243 PolarHBondContact O-N 3.42Å; N243-D245 PolarHBondContact O-N 3.02Å
244Y86.4Confident83.1Confident32 Ų3276.3 Ų76.313%0.12540%0.397CS..  trans-53.9126.1173.4174.4-111.5000113.7D234 F237 Y238 V241 E242 R249 L252D234-Y244 HydrophobicContact CB-CE1 4.17Å; D234-Y244 WeakPolarHBondContact OD1-CE1 3.23Å; D234-Y244 PolarHBondContact OD1-OH 3.21Å; F237-Y244 HydrophobicContact CB-CD1 4.29Å; F237-Y244 HydrophobicContact CB-CD2 3.52Å; F237-Y244 HydrophobicContact CB-CE1 4.19Å; F237-Y244 HydrophobicContact CB-CE2 3.41Å; F237-Y244 VanDerWaalsContact CB-CE2 3.41Å; F237-Y244 HydrophobicContact CB-CG 3.97Å; F237-Y244 AromaticContact CD2-CE2 3.78Å; F237-Y244 HydrophobicContact CD2-CE2 3.78Å; F237-Y244 AromaticContact CD2-CZ 3.99Å; F237-Y244 HydrophobicContact CG-CD2 4.48Å; F237-Y244 HydrophobicContact CG-CE2 4.02Å; Y238-Y244 HydrophobicContact CD2-CD1 4.45Å; V241-Y244 WeakPolarHBondContact O-CB 3.33Å; V241-Y244 PolarHBondContact O-N 2.65Å; E242-Y244 VanDerWaalsContact C-N 3.35Å; Y244-R249 VanDerWaalsContact OH-CB 3.22Å; Y244-R249 WeakPolarHBondContact OH-CB 3.24Å; Y244-L252 HydrophobicContact CD2-CD1 3.77Å; Y244-L252 HydrophobicContact CE2-CD1 3.84Å
245D86.5Confident82.4Confident61 Ų6177.4 Ų77.433%0.32640%0.401SS..  trans-109.2128.4167.7176.85.8000110.4N243 K247 S248N243-D245 PolarHBondContact O-N 3.02Å; D245-K247 PolarHBondContact O-N 3.48Å; D245-K247 WeakPolarHBondContact OD1-CG 3.3Å; D245-K247 PolarHBondContact OD1-N 3.05Å; D245-K247 IonicContact OD1-NZ 2.59Å; D245-K247 PolarHBondContact OD1-NZ 3.26Å; D245-K247 VanDerWaalsContact OD1-NZ 3.14Å; D245-K247 WeakPolarHBondContact OD2-CD 3.49Å; D245-K247 WeakPolarHBondContact OD2-CG 3.36Å; D245-K247 IonicContact OD2-NZ 3.83Å; D245-K247 PolarHBondContact OD2-NZ 2.92Å; D245-S248 WeakPolarHBondContact O-CB 3.29Å; D245-S248 PolarHBondContact O-N 3.13Å; D245-S248 PolarHBondContact O-OG 2.86Å
246S84.2Confident81.9Confident60 Ų6076.2 Ų76.242%0.4239%0.39SS..THydrogen-bonded Turntrans-39.4-25.7167.466.40000116.7R249S246-R249 WeakPolarHBondContact O-CB 3.29Å; S246-R249 PolarHBondContact O-NH2 2.93Å
247K84.4Confident81.2Confident133 Ų13376.8 Ų76.858%0.57839%0.393SS*.THydrogen-bonded Turntrans-74.2-26.3175.4-60.9179.9-150.269.90113.5D245D245-K247 PolarHBondContact O-N 3.48Å; D245-K247 WeakPolarHBondContact OD1-CG 3.3Å; D245-K247 PolarHBondContact OD1-N 3.05Å; D245-K247 IonicContact OD1-NZ 2.59Å; D245-K247 PolarHBondContact OD1-NZ 3.26Å; D245-K247 VanDerWaalsContact OD1-NZ 3.14Å; D245-K247 WeakPolarHBondContact OD2-CD 3.49Å; D245-K247 WeakPolarHBondContact OD2-CG 3.36Å; D245-K247 IonicContact OD2-NZ 3.83Å; D245-K247 PolarHBondContact OD2-NZ 2.92Å
248S80.7Confident80Confident39 Ų3979.6 Ų79.627%0.27342%0.422SS..THydrogen-bonded Turntrans-83.7-15.5179700000113.3D245 D250 T251 L252D245-S248 WeakPolarHBondContact O-CB 3.29Å; D245-S248 PolarHBondContact O-N 3.13Å; D245-S248 PolarHBondContact O-OG 2.86Å; S248-D250 PolarHBondContact O-N 2.82Å; S248-T251 CarbonylContact O-C 3.59Å; S248-T251 WeakPolarHBondContact O-CA 3.34Å; S248-T251 VanDerWaalsContact O-CB 3.29Å; S248-T251 WeakPolarHBondContact O-CB 3.46Å; S248-T251 PolarHBondContact O-N 2.92Å; S248-L252 PolarHBondContact O-N 2.94Å; S248-L252 WeakPolarHBondContact OG-CD1 3.47Å
249R84.1Confident78.8Confident30 Ų3075.3 Ų75.311%0.11341%0.411CS..Hα-helixtrans-39.3-56.1-178.7-177.7165.932.4-145.5-34.7114.7R230 L233 D234 F237 Y244 S246 T251 L252 A253R230-R249 PolarHBondContact O-NH1 3.45Å; L233-R249 HydrophobicContact CB-CG 4.02Å; L233-R249 HydrophobicContact CD1-CG 4.26Å; D234-R249 WeakPolarHBondContact OD1-CD 3.42Å; D234-R249 IonicContact OD1-CZ 3.82Å; D234-R249 IonicContact OD1-NE 3.27Å; D234-R249 IonicContact OD1-NH1 2.75Å; D234-R249 PolarHBondContact OD1-NH1 3.08Å; D234-R249 IonicContact OD1-NH2 2.79Å; D234-R249 PolarHBondContact OD1-NH2 3.28Å; D234-R249 IonicContact OD2-CZ 3.7Å; D234-R249 IonicContact OD2-NH1 2.92Å; D234-R249 PolarHBondContact OD2-NH1 3.26Å; D234-R249 IonicContact OD2-NH2 3.22Å; D234-R249 PolarHBondContact OD2-NH2 3.45Å; F237-R249 HydrophobicContact CD2-CG 4.46Å; F237-R249 HydrophobicContact CE2-CG 4.26Å; Y244-R249 VanDerWaalsContact OH-CB 3.22Å; Y244-R249 WeakPolarHBondContact OH-CB 3.24Å; S246-R249 WeakPolarHBondContact O-CB 3.29Å; S246-R249 PolarHBondContact O-NH2 2.93Å; R249-T251 PolarHBondContact O-N 3.4Å; R249-L252 PolarHBondContact O-N 2.75Å; R249-A253 VanDerWaalsContact O-CB 3.22Å; R249-A253 WeakPolarHBondContact O-CB 3.44Å; R249-A253 PolarHBondContact O-N 3.37Å
250D77.5Confident77.6Confident91 Ų9173.8 Ų73.849%0.48741%0.408SS..Hα-helixtrans-67.8-29.8-173.7-61.1-16.7000110.8S248 T254S248-D250 PolarHBondContact O-N 2.82Å; D250-T254 PolarHBondContact O-N 3.4Å; D250-T254 PolarHBondContact O-OG1 3.5Å
251T76.1Confident76.3Confident91 Ų9172.4 Ų72.456%0.55841%0.408SS*.Hα-helixtrans-72.4-49.3172.8-500000111.3S248 R249 A253 T254 E255S248-T251 CarbonylContact O-C 3.59Å; S248-T251 WeakPolarHBondContact O-CA 3.34Å; S248-T251 VanDerWaalsContact O-CB 3.29Å; S248-T251 WeakPolarHBondContact O-CB 3.46Å; S248-T251 PolarHBondContact O-N 2.92Å; R249-T251 PolarHBondContact O-N 3.4Å; T251-A253 VanDerWaalsContact C-N 3.34Å; T251-A253 PolarHBondContact O-N 2.85Å; T251-T254 WeakPolarHBondContact O-CA 3.39Å; T251-T254 VanDerWaalsContact O-CB 3.3Å; T251-T254 WeakPolarHBondContact O-CB 3.44Å; T251-T254 PolarHBondContact O-N 2.97Å; T251-E255 PolarHBondContact O-N 3.05Å
252L81.1Confident74.9Confident10 Ų1081.2 Ų81.25%0.05244%0.437CS..Hα-helixtrans-65-36.1178.7-72.6173.8000112.2F237 V241 Y244 S248 R249 T254 E255 I256 L298F237-L252 HydrophobicContact CB-CD1 4.44Å; F237-L252 HydrophobicContact CD1-CB 4.41Å; F237-L252 HydrophobicContact CD2-CB 4.07Å; F237-L252 HydrophobicContact CD2-CD1 4.43Å; F237-L252 HydrophobicContact CE1-CB 4.23Å; F237-L252 HydrophobicContact CE2-CB 3.85Å; F237-L252 HydrophobicContact CG-CB 4.35Å; F237-L252 HydrophobicContact CG-CD1 4.31Å; F237-L252 HydrophobicContact CZ-CB 3.96Å; V241-L252 HydrophobicContact CG2-CD1 4.31Å; Y244-L252 HydrophobicContact CD2-CD1 3.77Å; Y244-L252 HydrophobicContact CE2-CD1 3.84Å; S248-L252 PolarHBondContact O-N 2.94Å; S248-L252 WeakPolarHBondContact OG-CD1 3.47Å; R249-L252 PolarHBondContact O-N 2.75Å; L252-T254 VanDerWaalsContact C-N 3.29Å; L252-T254 PolarHBondContact O-N 3.01Å; L252-E255 PolarHBondContact O-N 2.87Å; L252-I256 HydrophobicContact CB-CD1 4.31Å; L252-I256 HydrophobicContact CD2-CD1 4.22Å; L252-I256 VanDerWaalsContact O-CB 3.28Å; L252-I256 WeakPolarHBondContact O-CB 3.41Å; L252-I256 WeakPolarHBondContact O-CG1 3.26Å; L252-I256 PolarHBondContact O-N 3.38Å; L252-L298 HydrophobicContact CD2-CD1 4.17Å
253A80.1Confident73.6Confident7 Ų777.8 Ų77.86%0.05842%0.42CS..Hα-helixtrans-65.5-31.9171.500000112.6L233 F237 R249 T251 L257 L259L233-A253 HydrophobicContact CD1-CB 4.12Å; L233-A253 HydrophobicContact CD2-CB 4.31Å; F237-A253 HydrophobicContact CE2-CB 4.15Å; F237-A253 HydrophobicContact CZ-CB 4.05Å; R249-A253 VanDerWaalsContact O-CB 3.22Å; R249-A253 WeakPolarHBondContact O-CB 3.44Å; R249-A253 PolarHBondContact O-N 3.37Å; T251-A253 VanDerWaalsContact C-N 3.34Å; T251-A253 PolarHBondContact O-N 2.85Å; A253-L257 WeakPolarHBondContact O-CB 3.26Å; A253-L257 PolarHBondContact O-N 3.14Å; A253-L259 HydrophobicContact CB-CD1 4.31Å; A253-L259 PolarHBondContact O-N 3.16Å
254T77.2Confident72.4Confident46 Ų4672.5 Ų72.528%0.28240%0.396SS..Hα-helixtrans-71.2-42.9172.2-55.40000111.6D250 T251 L252 G258 L259 S261D250-T254 PolarHBondContact O-N 3.4Å; D250-T254 PolarHBondContact O-OG1 3.5Å; T251-T254 WeakPolarHBondContact O-CA 3.39Å; T251-T254 VanDerWaalsContact O-CB 3.3Å; T251-T254 WeakPolarHBondContact O-CB 3.44Å; T251-T254 PolarHBondContact O-N 2.97Å; L252-T254 VanDerWaalsContact C-N 3.29Å; L252-T254 PolarHBondContact O-N 3.01Å; T254-G258 WeakPolarHBondContact O-CA 3.32Å; T254-G258 PolarHBondContact O-N 3.22Å; T254-L259 WeakPolarHBondContact CA-O 3.48Å; T254-S261 WeakPolarHBondContact OG1-CB 3.5Å
255E72.7Confident70.9Confident66 Ų6674 Ų7431%0.30841%0.411SS..Hα-helixtrans-75.7-44-175.4-173169.1-171.800112.8T251 L252 L298 L299T251-E255 PolarHBondContact O-N 3.05Å; L252-E255 PolarHBondContact O-N 2.87Å; E255-L298 WeakPolarHBondContact OE1-CB 3.37Å; E255-L299 HydrophobicContact CG-CD1 3.78Å; E255-L299 PolarHBondContact OE1-N 2.83Å
256I75.6Confident69.4Low64 Ų6475.4 Ų75.433%0.32842%0.423SS..Hα-helixtrans-88.1-44-173.4-61.6170.1000112F237 L252F237-I256 HydrophobicContact CD1-CD1 4.04Å; F237-I256 HydrophobicContact CE1-CB 4.49Å; F237-I256 HydrophobicContact CE1-CD1 3.73Å; L252-I256 HydrophobicContact CB-CD1 4.31Å; L252-I256 HydrophobicContact CD2-CD1 4.22Å; L252-I256 VanDerWaalsContact O-CB 3.28Å; L252-I256 WeakPolarHBondContact O-CB 3.41Å; L252-I256 WeakPolarHBondContact O-CG1 3.26Å; L252-I256 PolarHBondContact O-N 3.38Å
257L70Confident68.1Low84 Ų8479.1 Ų79.144%0.4444%0.438SS..SBendtrans-97.20.3-174.5-55.1174.5000113L233 A253 L259L233-L257 HydrophobicContact CD2-CD1 3.49Å; L233-L257 VanDerWaalsContact CD2-CD1 3.49Å; A253-L257 WeakPolarHBondContact O-CB 3.26Å; A253-L257 PolarHBondContact O-N 3.14Å; L257-L259 HydrophobicContact CB-CD1 4.03Å; L257-L259 HydrophobicContact CB-CG 3.88Å; L257-L259 HydrophobicContact CD1-CD1 3.93Å; L257-L259 PolarHBondContact O-N 3.12Å
258G64.3Low67.1Low59 Ų5973.8 Ų73.861%0.60842%0.418SS*.  trans61.113.4-17500000114.1T254 P260T254-G258 WeakPolarHBondContact O-CA 3.32Å; T254-G258 PolarHBondContact O-N 3.22Å; G258-P260 WeakPolarHBondContact O-CD 3.27Å
259L61Low65.9Low88 Ų8878.2 Ų78.246%0.46144%0.439SS..  trans-65.1120.4-176.2-72.7172.1000108.8A253 T254 L257 S261A253-L259 HydrophobicContact CB-CD1 4.31Å; A253-L259 PolarHBondContact O-N 3.16Å; T254-L259 WeakPolarHBondContact CA-O 3.48Å; L257-L259 HydrophobicContact CB-CD1 4.03Å; L257-L259 HydrophobicContact CB-CG 3.88Å; L257-L259 HydrophobicContact CD1-CD1 3.93Å; L257-L259 PolarHBondContact O-N 3.12Å; L259-S261 PolarHBondContact O-N 2.78Å; L259-S261 VanDerWaalsContact O-N 3.14Å
260P57.2Low64.6Low95 Ų9584 Ų8462%0.61747%0.465SS*.  trans-65.3122.6-174.425.6-33.8000109.4G258 R262G258-P260 WeakPolarHBondContact O-CD 3.27Å; P260-R262 HydrophobicContact CB-CG 4.33Å; P260-R262 PolarHBondContact O-N 2.87Å
261S55.6Low63.8Low82 Ų8281.5 Ų81.557%0.57345%0.454SS*.  trans-70.144.8176.344.70000113.4T254 L259 Q263T254-S261 WeakPolarHBondContact OG1-CB 3.5Å; L259-S261 PolarHBondContact O-N 2.78Å; L259-S261 VanDerWaalsContact O-N 3.14Å; S261-Q263 PolarHBondContact O-N 2.93Å
262R53Low62.9Low223 Ų22379 Ų7984%0.84244%0.44SS*.  trans-69.774.9167.3-71.7-178.1178.1-140.9-0.4109.2P260 C264P260-R262 HydrophobicContact CB-CG 4.33Å; P260-R262 PolarHBondContact O-N 2.87Å; R262-C264 PolarHBondContact O-N 3.42Å
263Q54.3Low61.7Low110 Ų11082.8 Ų82.851%0.51446%0.46SS..  trans-44.5126.2152.1-57.6-178.718.200106.7S261 T283S261-Q263 PolarHBondContact O-N 2.93Å; Q263-T283 HydrophobicContact CB-CG2 4.24Å
264C58.6Low60.6Low52 Ų5284.1 Ų84.135%0.35147%0.467SS..  trans-64.3146.7-179-149.60000109.3R262 C268 C271R262-C264 PolarHBondContact O-N 3.42Å; C264-C268 HydrophobicContact CB-CB 3.6Å; C264-C268 WeakPolarHBondContact CB-SG 3.32Å; C264-C268 WeakPolarHBondContact SG-CB 3.5Å; C264-C268 CovalentContact SG-SG 2.04Å; C264-C268 PolarHBondContact SG-SG 3.02Å; C264-C271 HydrophobicContact CB-CB 3.55Å; C264-C271 VanDerWaalsContact CB-SG 3.51Å
265S55.8Low59.7Low63 Ų6383.6 Ų83.644%0.44146%0.462SS..  trans-45.8145.9177.8-1800000111.3D267 C268S265-D267 PolarHBondContact O-N 3.08Å; S265-D267 VanDerWaalsContact O-N 3.08Å; S265-D267 PolarHBondContact OG-N 3.37Å; S265-C268 WeakPolarHBondContact O-CB 3.34Å; S265-C268 PolarHBondContact O-N 3.28Å
266P54.5Low58.9Low90 Ų9083.6 Ų83.658%0.58447%0.467SS*.THydrogen-bonded Turntrans-51.9-28.8168.322.1-34.1000112.8C268P266-C268 VanDerWaalsContact C-N 3.26Å; P266-C268 PolarHBondContact O-N 3.24Å
267D56.6Low57.8Low138 Ų13890.3 Ų90.374%0.73849%0.489SS*.THydrogen-bonded Turntrans-84.914.6176.8-48.5-55.9000113.9S265 D269S265-D267 PolarHBondContact O-N 3.08Å; S265-D267 VanDerWaalsContact O-N 3.08Å; S265-D267 PolarHBondContact OG-N 3.37Å; D267-D269 PolarHBondContact O-N 2.97Å; D267-D269 VanDerWaalsContact O-N 3.13Å
268C62.9Low56.9Low22 Ų2292.7 Ų92.715%0.14950%0.502CS..  trans-82.689.9-174.6-174.40000112.1C264 S265 P266 F270 C271 S272C264-C268 HydrophobicContact CB-CB 3.6Å; C264-C268 WeakPolarHBondContact CB-SG 3.32Å; C264-C268 WeakPolarHBondContact SG-CB 3.5Å; C264-C268 CovalentContact SG-SG 2.04Å; C264-C268 PolarHBondContact SG-SG 3.02Å; S265-C268 WeakPolarHBondContact O-CB 3.34Å; S265-C268 PolarHBondContact O-N 3.28Å; P266-C268 VanDerWaalsContact C-N 3.26Å; P266-C268 PolarHBondContact O-N 3.24Å; C268-F270 PolarHBondContact O-N 3Å; C268-C271 HydrophobicContact CB-CB 4.3Å; C268-C271 PolarHBondContact O-N 2.85Å; C268-C271 VanDerWaalsContact SG-CB 3.5Å; C268-C271 PolarHBondContact SG-N 3.21Å; C268-C271 VanDerWaalsContact SG-SG 3.64Å; C268-S272 PolarHBondContact O-N 3.41Å; C268-S272 PolarHBondContact O-OG 3.28Å
269D55.9Low56.4Low132 Ų13292 Ų9271%0.70648%0.483SS*.Hα-helixtrans-46.4-29.2175.6-75.4-25.6000114.8D267 S272D267-D269 PolarHBondContact O-N 2.97Å; D267-D269 VanDerWaalsContact O-N 3.13Å; D269-S272 PolarHBondContact O-OG 3.44Å
270F57Low55.8Low151 Ų15192.8 Ų92.866%0.66248%0.48SS*.Hα-helixtrans-85.8-47-179.4-67.7-89.2000112.7C268 L274C268-F270 PolarHBondContact O-N 3Å; F270-L274 WeakPolarHBondContact O-CG 3.46Å; F270-L274 PolarHBondContact O-N 2.85Å
271C61.5Low55.1Low38 Ų3891.7 Ų91.726%0.25747%0.473SS..Hα-helixtrans-78.8-23.3-179.3-67.60000112.6C264 C268 D273 L274 L275C264-C271 HydrophobicContact CB-CB 3.55Å; C264-C271 VanDerWaalsContact CB-SG 3.51Å; C268-C271 HydrophobicContact CB-CB 4.3Å; C268-C271 PolarHBondContact O-N 2.85Å; C268-C271 VanDerWaalsContact SG-CB 3.5Å; C268-C271 PolarHBondContact SG-N 3.21Å; C268-C271 VanDerWaalsContact SG-SG 3.64Å; C271-D273 VanDerWaalsContact C-N 3.34Å; C271-D273 PolarHBondContact O-N 3.46Å; C271-L274 PolarHBondContact O-N 3.15Å; C271-L275 HydrophobicContact CB-CD1 3.95Å; C271-L275 HydrophobicContact CB-CG 4.15Å; C271-L275 WeakPolarHBondContact O-CB 3.42Å; C271-L275 WeakPolarHBondContact O-CD1 3.31Å; C271-L275 WeakPolarHBondContact O-CG 3.5Å; C271-L275 PolarHBondContact O-N 2.84Å
272S57.1Low54.7Low39 Ų3994.6 Ų94.627%0.27347%0.472SS..Hα-helixtrans-54.9-52.9169.459.10000110C268 D269 L274 R280C268-S272 PolarHBondContact O-N 3.41Å; C268-S272 PolarHBondContact O-OG 3.28Å; D269-S272 PolarHBondContact O-OG 3.44Å; S272-L274 VanDerWaalsContact C-N 3.34Å; S272-L274 PolarHBondContact O-N 2.82Å; S272-R280 PolarHBondContact O-NE 3.09Å; S272-R280 PolarHBondContact O-NH2 2.93Å
273D55.4Low54.4Low89 Ų8985.3 Ų85.348%0.47644%0.44SS..Hα-helixtrans-65-26.8177-85.7-8.5000115.4K219 C271K219-D273 IonicContact NZ-OD2 2.76Å; K219-D273 PolarHBondContact NZ-OD2 3.07Å; C271-D273 VanDerWaalsContact C-N 3.34Å; C271-D273 PolarHBondContact O-N 3.46Å
274L55.8Low53.9Low36 Ų3686.5 Ų86.519%0.18845%0.445CS..Hα-helixtrans-95.8-17.3-177.3-65168.8000114.4K219 L222 I223 F270 C271 S272K219-L274 HydrophobicContact CB-CD2 4.16Å; K219-L274 HydrophobicContact CG-CD2 4.19Å; L222-L274 HydrophobicContact CB-CD2 4.43Å; L222-L274 HydrophobicContact CD1-CD1 4.42Å; I223-L274 HydrophobicContact CD1-CD2 4.09Å; I223-L274 HydrophobicContact CG1-CD2 3.77Å; F270-L274 WeakPolarHBondContact O-CG 3.46Å; F270-L274 PolarHBondContact O-N 2.85Å; C271-L274 PolarHBondContact O-N 3.15Å; S272-L274 VanDerWaalsContact C-N 3.34Å; S272-L274 PolarHBondContact O-N 2.82Å
275L58.5Low53.2Low34 Ų3489.2 Ų89.218%0.17846%0.456CS..SBendtrans-89.9122.5177.3-67.3170.3000110.2R226 C271 E279 R280R226-L275 VanDerWaalsContact NH2-CD2 3.25Å; C271-L275 HydrophobicContact CB-CD1 3.95Å; C271-L275 HydrophobicContact CB-CG 4.15Å; C271-L275 WeakPolarHBondContact O-CB 3.42Å; C271-L275 WeakPolarHBondContact O-CD1 3.31Å; C271-L275 WeakPolarHBondContact O-CG 3.5Å; C271-L275 PolarHBondContact O-N 2.84Å; L275-E279 HydrophobicContact CB-CB 4.38Å; L275-E279 HydrophobicContact CD2-CB 4.36Å; L275-E279 WeakPolarHBondContact CD2-OE2 3.2Å; L275-R280 HydrophobicContact CB-CG 4.16Å; L275-R280 PolarHBondContact O-NE 3.17Å
276P56.3Low52.8Low66 Ų6691.8 Ų91.843%0.42946%0.457SS..  trans-47.9143.6165.5-28.935.5000111.8N278 E279P276-N278 PolarHBondContact O-N 2.74Å; P276-E279 WeakPolarHBondContact CD-OE2 3.34Å; P276-E279 WeakPolarHBondContact O-CB 3.42Å; P276-E279 PolarHBondContact O-N 2.73Å
277R52.3Low52.3Low205 Ų20594 Ų9477%0.77446%0.464SS*.Hα-helixtrans-52.4-31.6-172.3-166.9177.6-176.7-176.10.5113.7E279 R280R277-E279 VanDerWaalsContact C-N 3.33Å; R277-E279 PolarHBondContact O-N 3.24Å; R277-R280 PolarHBondContact O-N 2.77Å
278N51.7Low51.8Low135 Ų13592.2 Ų92.272%0.72246%0.462SS*.Hα-helixtrans-68.6-27.5179.4-60.1-8000113.2P276P276-N278 PolarHBondContact O-N 2.74Å
279E53Low50.8Low43 Ų4398.1 Ų98.120%0.20149%0.493CS..Hα-helixtrans-81.7-35.4178.6-61.7-179168.900111.3R226 R230 L275 P276 R277 C281 R282R226-E279 IonicContact CZ-OE2 2.62Å; R226-E279 VanDerWaalsContact CZ-OE2 3.22Å; R226-E279 IonicContact NH1-OE1 2.94Å; R226-E279 IonicContact NH1-OE2 2.85Å; R226-E279 PolarHBondContact NH1-OE2 2.96Å; R226-E279 IonicContact NH2-OE1 3.14Å; R226-E279 IonicContact NH2-OE2 2.65Å; R226-E279 PolarHBondContact NH2-OE2 3.2Å; R230-E279 IonicContact CZ-OE1 3.92Å; R230-E279 VanDerWaalsContact CZ-OE1 3.27Å; R230-E279 IonicContact NH1-OE1 3.32Å; R230-E279 PolarHBondContact NH1-OE1 3.47Å; R230-E279 IonicContact NH2-OE1 3.86Å; R230-E279 PolarHBondContact NH2-OE1 2.91Å; R230-E279 IonicContact NH2-OE2 3.05Å; L275-E279 HydrophobicContact CB-CB 4.38Å; L275-E279 HydrophobicContact CD2-CB 4.36Å; L275-E279 WeakPolarHBondContact CD2-OE2 3.2Å; P276-E279 WeakPolarHBondContact CD-OE2 3.34Å; P276-E279 WeakPolarHBondContact O-CB 3.42Å; P276-E279 PolarHBondContact O-N 2.73Å; R277-E279 VanDerWaalsContact C-N 3.33Å; R277-E279 PolarHBondContact O-N 3.24Å; E279-C281 PolarHBondContact O-N 2.95Å; E279-C281 VanDerWaalsContact O-N 3.17Å; E279-R282 PolarHBondContact O-N 3.44Å
280R48.5Very low50.1Low106 Ų106100.3 Ų100.340%0.449%0.491SS..Hα-helixtrans-57.6-28.8174-54.9-171.1-166.41803.5113S272 L275 R277 T283S272-R280 PolarHBondContact O-NE 3.09Å; S272-R280 PolarHBondContact O-NH2 2.93Å; L275-R280 HydrophobicContact CB-CG 4.16Å; L275-R280 PolarHBondContact O-NE 3.17Å; R277-R280 PolarHBondContact O-N 2.77Å; R280-T283 PolarHBondContact O-OG1 3.31Å
281C42.2Very low49.2Very low71 Ų71101.9 Ų101.948%0.4850%0.5SS..Hα-helixtrans-80-18.1176.3-63.20000113.5E279 N285E279-C281 PolarHBondContact O-N 2.95Å; E279-C281 VanDerWaalsContact O-N 3.17Å; C281-N285 PolarHBondContact O-ND2 3.42Å
282R47.4Very low48Very low144 Ų144107.5 Ų107.554%0.54353%0.528SS..Hα-helixtrans-78.1-44.5178-72.8-173175.3-177.80.1111.6E279 Q284 N285 Y286E279-R282 PolarHBondContact O-N 3.44Å; R282-Q284 PolarHBondContact O-N 2.85Å; R282-N285 PolarHBondContact O-N 3.05Å; R282-Y286 PolarHBondContact O-N 2.97Å
283T47.3Very low47Very low28 Ų28112.8 Ų112.817%0.17255%0.553CS.*Hα-helixtrans-57-48.8-18051.30000111.6Q263 R280 N285 Y286Q263-T283 HydrophobicContact CB-CG2 4.24Å; R280-T283 PolarHBondContact O-OG1 3.31Å; T283-N285 PolarHBondContact O-N 3.25Å; T283-N285 VanDerWaalsContact O-N 3.16Å; T283-Y286 PolarHBondContact O-N 3.18Å
284Q43.9Very low46Very low135 Ų135117.8 Ų117.863%0.63157%0.567SS**Hα-helixtrans-61.4-25.2179.7-69.4-171.6-22.900114.9R282R282-Q284 PolarHBondContact O-N 2.85Å
285N43.1Very low45.3Very low109 Ų109120.5 Ų120.558%0.58359%0.586SS**Hα-helixtrans-92.8-18.9-178.9-77.9-77.7000113.7C281 R282 T283C281-N285 PolarHBondContact O-ND2 3.42Å; R282-N285 PolarHBondContact O-N 3.05Å; T283-N285 PolarHBondContact O-N 3.25Å; T283-N285 VanDerWaalsContact O-N 3.16Å
286Y47.6Very low44.6Very low117 Ų117124 Ų12446%0.45961%0.613SS.*Hα-helixtrans-76.8-39.8-177.5-103.3-90.8000113.3R282 T283 S288 N289 R290R282-Y286 PolarHBondContact O-N 2.97Å; T283-Y286 PolarHBondContact O-N 3.18Å; Y286-S288 PolarHBondContact O-N 3.41Å; Y286-N289 PolarHBondContact O-N 3.46Å; Y286-R290 PolarHBondContact O-N 2.83Å
287D45.4Very low44.1Very low137 Ų137127.4 Ų127.473%0.73362%0.624SS**THydrogen-bonded Turntrans-66.6-21.9178.7-72.5-32.6000113.3
288S44.7Very low43.8Very low99 Ų99121 Ų12169%0.69260%0.604SS**THydrogen-bonded Turntrans-83.2-11.3-179.6-61.50000114.2Y286Y286-S288 PolarHBondContact O-N 3.41Å
289N43Very low43.6Very low147 Ų147118.9 Ų118.979%0.78659%0.593SS**THydrogen-bonded Turntrans-134.60.4-165.6-118.5-12.5000115.6Y286 Q291Y286-N289 PolarHBondContact O-N 3.46Å; N289-Q291 PolarHBondContact O-N 2.99Å
290R39.9Very low43.4Very low177 Ų177119.3 Ų119.367%0.66860%0.603SS**  trans-81.379.8174.9-89.8-169.2162.9-160.9-4.2112.7Y286Y286-R290 PolarHBondContact O-N 2.83Å
291Q39.6Very low43.2Very low184 Ų184120.7 Ų120.786%0.8661%0.614SS**  trans-74.8141.9145-78.1-169.7-17.400109.4N289 N293N289-Q291 PolarHBondContact O-N 2.99Å; Q291-N293 PolarHBondContact O-N 3.45Å
292N34.9Very low43.4Very low157 Ų157122.5 Ų122.584%0.8462%0.618SS**SBendtrans-74.991.3-167.7-65.7-45.8000112.8
293N35.6Very low43.3Very low149 Ų149120.2 Ų120.280%0.79762%0.624SS**  trans-151.694166.3-87.2-48.4000111.5Q291Q291-N293 PolarHBondContact O-N 3.45Å
294Y35.8Very low42.9Very low195 Ų195123.3 Ų123.377%0.76565%0.647SS**  trans-141.9126.9161-93.5-81.4000108.8
295P41.6Very low42.4Very low93 Ų93123.1 Ų123.160%0.60466%0.655SS**  trans-86.3131.4-17333.1-34.4000112.6Q297P295-Q297 HydrophobicContact CB-CG 4.24Å; P295-Q297 PolarHBondContact O-N 3.26Å
296S42.3Very low42.2Very low106 Ų106122.7 Ų122.774%0.74166%0.66SS**  trans-76.359.2177.1-550000113.1
297Q45.5Very low41.8Very low138 Ų138128.6 Ų128.665%0.64568%0.682SS**  trans-85.7-25.9-177-77.6176.3-12.700114.3P295 A300 Q301P295-Q297 HydrophobicContact CB-CG 4.24Å; P295-Q297 PolarHBondContact O-N 3.26Å; Q297-A300 PolarHBondContact O-N 3.42Å; Q297-Q301 PolarHBondContact O-N 2.77Å
298L47.7Very low41.2Very low71 Ų71127.5 Ų127.537%0.37269%0.685SS.*Hα-helixtrans-69.1-49.4-177.4-100.6165.8000112.8L252 E255 A300 Q301 I302L252-L298 HydrophobicContact CD2-CD1 4.17Å; E255-L298 WeakPolarHBondContact OE1-CB 3.37Å; L298-A300 PolarHBondContact O-N 3.18Å; L298-A300 VanDerWaalsContact O-N 3.08Å; L298-Q301 PolarHBondContact O-N 2.74Å; L298-I302 PolarHBondContact O-N 2.79Å
299L46.8Very low41Very low91 Ų91128 Ų12848%0.47669%0.686SS.*Hα-helixtrans-54.5-28.9174.6-140.977.3000113.9E255 S303E255-L299 HydrophobicContact CG-CD1 3.78Å; E255-L299 PolarHBondContact OE1-N 2.83Å; L299-S303 WeakPolarHBondContact O-CB 3.35Å; L299-S303 PolarHBondContact O-N 2.89Å; L299-S303 PolarHBondContact O-OG 2.94Å
300A48.3Very low40.6Very low51 Ų51126.6 Ų126.642%0.42169%0.687SS.*Hα-helixtrans-74.8-36175.800000113.1Q297 L298 S303 S304Q297-A300 PolarHBondContact O-N 3.42Å; L298-A300 PolarHBondContact O-N 3.18Å; L298-A300 VanDerWaalsContact O-N 3.08Å; A300-S303 PolarHBondContact O-N 3.11Å; A300-S304 PolarHBondContact O-N 3.31Å; A300-S304 PolarHBondContact O-OG 3.19Å
301Q44.3Very low40.4Very low136 Ų136123.4 Ų123.464%0.63669%0.69SS**Hα-helixtrans-64.9-44.3176.6-71.3177.6-28.900111.3Q297 L298 S303 S304Q297-Q301 PolarHBondContact O-N 2.77Å; L298-Q301 PolarHBondContact O-N 2.74Å; Q301-S303 PolarHBondContact O-N 3.48Å; Q301-S304 PolarHBondContact O-N 2.98Å
302I46.9Very low40Very low109 Ų109123 Ų12356%0.55969%0.693SS**Hα-helixtrans-63.2-29.4177.4-56.3170.5000111.6L298L298-I302 PolarHBondContact O-N 2.79Å
303S46.1Very low39.9Very low96 Ų96121.1 Ų121.167%0.67169%0.691SS**THydrogen-bonded Turntrans-87.8-3.7-176.8-57.20000115L299 A300 Q301L299-S303 WeakPolarHBondContact O-CB 3.35Å; L299-S303 PolarHBondContact O-N 2.89Å; L299-S303 PolarHBondContact O-OG 2.94Å; A300-S303 PolarHBondContact O-N 3.11Å; Q301-S303 PolarHBondContact O-N 3.48Å
304S37.2Very low39.9Very low92 Ų92121 Ų12164%0.64370%0.697SS**  trans-92.9-7.9-166.9-68.60000115.5A300 Q301 S306A300-S304 PolarHBondContact O-N 3.31Å; A300-S304 PolarHBondContact O-OG 3.19Å; Q301-S304 PolarHBondContact O-N 2.98Å; S304-S306 PolarHBondContact O-N 3.21Å; S304-S306 VanDerWaalsContact O-N 3.12Å
305T34Very low39.8Very low131 Ų131121.7 Ų121.780%0.80470%0.698SS**  trans-88.859.5-170.438.90000114.3
306S39Very low39.6Very low100 Ų100122.8 Ų122.870%0.69971%0.705SS**  trans-146.6130.2162.483.40000115.7S304S304-S306 PolarHBondContact O-N 3.21Å; S304-S306 VanDerWaalsContact O-N 3.12Å
307R38.6Very low39.3Very low242 Ų242125.7 Ų125.791%0.91371%0.707SS**  trans57.181.6155.8-61.1-176.3-179.9179.71.1119.3
308S34.3Very low39.1Very low113 Ų113127 Ų12779%0.7972%0.716SS**  trans-65.9166.7135.7-1590000110.1
309P39.4Very low38.4Very low110 Ų110127.5 Ų127.571%0.71473%0.726SS**  cis-131.9159.11.840.3-24.7000116.5
310S34Very low37.8Very low117 Ų117131.1 Ų131.182%0.81874%0.744SS**  trans-177.6151.4130.7-83.10000111.9
311P36.5Very low37.3Very low110 Ų110133.9 Ų133.971%0.71476%0.761SS**  trans-94.5148.7-164.735.8-36.2000116.1S313P311-S313 PolarHBondContact O-N 2.91Å
312L32.3Very low37Very low177 Ų177134.5 Ų134.593%0.92777%0.767SS**  trans25.990.9141.2-67.2137.1000118.5
313S30.9Very low36.7Very low116 Ų116135.1 Ų135.181%0.81178%0.778SS**  trans-17177.2138.9-164.70000114.7P311P311-S313 PolarHBondContact O-N 2.91Å
314T36.9Very low36.2Very low148 Ų148134.9 Ų134.991%0.90878%0.777SS**  trans-151.3120149.9-7.50000113.6
315R34.1Very low36.2Very low209 Ų209136.7 Ų136.779%0.78978%0.779SS**PPolyproline II helixtrans-59.8134.1175.1162.9-173.3-179.3-1783.9113.1
316P36.8Very low36.4Very low116 Ų116136.4 Ų136.475%0.75377%0.773SS**PPolyproline II helixtrans-71.5135.9160.330.8-32.5000110.1
317Q35.6Very low36.5Very low167 Ų167136.8 Ų136.878%0.7877%0.771SS**PPolyproline II helixtrans-85.5120.4172.8-72.4-174.8-1300110.7
318I40.7Very low36.5Very low164 Ų164132.2 Ų132.284%0.84176%0.764SS**  trans-128.1141152.8-56.4-179.4000105.8
319S34.1Very low36.6Very low83 Ų83137.6 Ų137.658%0.5877%0.767SS**  trans-127.1148.5-158.4-57.60000112
320I34.8Very low36.4Very low167 Ų167135.8 Ų135.886%0.85676%0.757SS**  trans74.3130.2165.9-52.5149.6000112.5
321S36.1Very low36.6Very low109 Ų109138.4 Ų138.476%0.76276%0.756SS**  cis-148.5164.35.135.80000113.6
322L38.3Very low36.6Very low149 Ų149138.8 Ų138.878%0.7876%0.756SS**  trans-62.6173.7168.2-10671.5000113.4
323P40.3Very low37.2Very low122 Ų122136 Ų13679%0.79275%0.749SS**  cis-135.9179.528.340.2-20.2000118.8
324S35.8Very low37.8Very low91 Ų91136.3 Ų136.364%0.63675%0.748SS**  trans-58.1174.2177.9-28.50000114.6
325N38.2Very low37.7Very low130 Ų130136.4 Ų136.470%0.69574%0.743SS**  cis-163.8154.545-135.227.8000113.9
326D38.6Very low38Very low125 Ų125132.6 Ų132.667%0.66875%0.749SS**  trans44.4152.7146.6-73.2-46.3000123.9
327T39.5Very low37.9Very low107 Ų107134 Ų13466%0.65676%0.755SS**  cis-179.5163-25.7-98.10000109
328L39.3Very low38Very low147 Ų147131.2 Ų131.277%0.7776%0.761SS**  trans84.1126.2160.5-88159.9000123.3
329R36.4Very low37.6Very low226 Ų226128.8 Ų128.885%0.85376%0.759SS**  trans68.7152.1148.4-82176168.2174.5-4.4121.9
330S35.1Very low37.9Very low72 Ų72135.5 Ų135.550%0.50377%0.773SS.*  cis174.3145.4-3958.80000110.9
331Q38.3Very low37.9Very low171 Ų171133.5 Ų133.580%0.79977%0.768SS**  trans67.4154.6157-61.9163.611200117.3
332T36.8Very low38.3Very low118 Ų118131.4 Ų131.472%0.72476%0.764SS**  cis-161.6151.2-21.8270000109.6
333P44.8Very low38.5Very low119 Ų119129.2 Ų129.277%0.77376%0.761SS**  trans-87.4164.1169.437.4-34.8000112.8
334P43.6Very low38.6Very low122 Ų122129.3 Ų129.379%0.79276%0.755SS**  -146.4176.5125.139.4-24.3000116
335D33.9Very low38.8Very low151 Ų151130.7 Ų130.781%0.80776%0.755SS**  trans-66.5166.9-166.8-43-66.3000118.2
336S42.1Very low38.8Very low128 Ų128132 Ų13290%0.89576%0.762SS**  trans-158.4144.1148.3-79.20000111.7
337T33.3Very low38.7Very low145 Ų145131 Ų13189%0.8976%0.76SS**  trans-116.3150.7-173.647.20000112.9
338A38.1Very low38.7Very low109 Ų109135.2 Ų135.290%0.90177%0.77SS**  trans-159.7156.7163.600000110.3
339S33.3Very low38.7Very low114 Ų114133.7 Ų133.780%0.79777%0.769SS**  trans-133.6162-174.459.10000113
340Y39.2Very low38.4Very low223 Ų223128.7 Ų128.788%0.87576%0.759SS**  trans-152.5149.5156.9-158.3-101.9000111.1
341V36Very low38.5Very low125 Ų125130.8 Ų130.876%0.75877%0.771SS**  trans-145.1143.1-171.2174.20000111.3
342G44.5Very low38.3Very low65 Ų65129.4 Ų129.467%0.6776%0.764SS**  trans-157.4130155.600000108.2
343S41.6Very low38.2Very low103 Ų103129.9 Ų129.972%0.7277%0.769SS**  cis81.9121.447.4-171.50000111.3
344D41.3Very low37.7Very low124 Ų124129.7 Ų129.766%0.66377%0.766SS**  cis-154.7154.57.9-114.930.9000113.5
345N40.2Very low37Very low121 Ų121131 Ų13165%0.64777%0.766SS**  trans46.5114.9147.7-47.8-30.5000123.2
346D38.3Very low36.9Very low157 Ų157127.7 Ų127.784%0.8476%0.755SS**  166.3142.8105.9-91.7-14.5000111.3
347V37.9Very low36.2Very low105 Ų105127.5 Ų127.564%0.63675%0.752SS**  cis-171.4154.8-37.8123.50000107.5
348F39.2Very low36.2Very low194 Ų194127.9 Ų127.985%0.85175%0.748SS**  trans77.2143.7179.4-75-56.3000117.9
349P37.8Very low35.8Very low115 Ų115127.6 Ų127.675%0.74774%0.739SS**  -128.2165.7-97.542.9-33.3000117
350D30.7Very low35.7Very low122 Ų122128.5 Ų128.565%0.65274%0.735SS**  trans-74.1168.1168.4-15424.3000111.7E352D350-E352 PolarHBondContact OD1-N 3.26Å; D350-E352 VanDerWaalsContact OD1-N 3.14Å; D350-E352 PolarHBondContact OD2-N 3.05Å
351P38.3Very low35.2Very low115 Ų115123.8 Ų123.875%0.74773%0.725SS**  -142.9134.677.335.4-17.1000117.2
352E34.4Very low35.1Very low143 Ų143124.3 Ų124.367%0.66873%0.729SS**  trans63.3107.5133.9-61.6-104.4123.600119D350 V354D350-E352 PolarHBondContact OD1-N 3.26Å; D350-E352 VanDerWaalsContact OD1-N 3.14Å; D350-E352 PolarHBondContact OD2-N 3.05Å; E352-V354 PolarHBondContact O-N 3.28Å; E352-V354 VanDerWaalsContact O-N 3.16Å
353P32.9Very low34.4Very low127 Ų127128.8 Ų128.883%0.82574%0.737SS**  trans-74.8100.5161.231.4-31.1000110D355P353-D355 PolarHBondContact O-N 3.38Å
354V34.4Very low33.8Very low115 Ų115127 Ų12770%0.69773%0.729SS**  trans-67.8106.6178.6-179.20000110.8E352 S356E352-V354 PolarHBondContact O-N 3.28Å; E352-V354 VanDerWaalsContact O-N 3.16Å; V354-S356 PolarHBondContact O-N 2.92Å
355D30.1Very low33.3Very low151 Ų151128.4 Ų128.481%0.80774%0.736SS**  trans-65.2102.8172-138.6-25.5000109.5P353P353-D355 PolarHBondContact O-N 3.38Å
356S31.3Very low33Very low80 Ų80130.8 Ų130.856%0.55975%0.747SS**  trans-121.985.3178.1-76.80000110.5V354 L358V354-S356 PolarHBondContact O-N 2.92Å; S356-L358 PolarHBondContact O-N 3.4Å
357C28.3Very low32.6Very low125 Ų125130.9 Ų130.985%0.84575%0.747SS**  trans-65.477.5167.3-76.50000110.8
358L31.9Very low32.3Very low153 Ų153130.9 Ų130.980%0.80175%0.747SS**  trans-110.2104.7172.2-73.4175.6000110.1S356 D360S356-L358 PolarHBondContact O-N 3.4Å; L358-D360 PolarHBondContact O-N 3.28Å
359S29.8Very low31.8Very low103 Ų103132.5 Ų132.572%0.7275%0.748SS**  trans-62118.1155.950.60000109.5
360D30.4Very low31.6Very low132 Ų132135 Ų13571%0.70675%0.754SS**  176.3143.4120.3-91.2-16.4000114.2L358L358-D360 PolarHBondContact O-N 3.28Å
361N28.8Very low31.8Very low125 Ų125134 Ų13467%0.66876%0.756SS**  trans40.591.7150.9-66.5-62.1000120.2
362T34.9Very low31.5Very low136 Ų136137.2 Ų137.283%0.83476%0.762SS**  trans-117.549.2149.846.30000112.5A364T362-A364 PolarHBondContact O-N 3.41Å
363N29.1Very low31.2Very low158 Ų158134.3 Ų134.385%0.84576%0.757SS**  trans-67.773.5159.3-82.5-55000109.7
364A28.9Very low31.2Very low67 Ų67135 Ų13555%0.55475%0.753SS**  trans-151.1145.4-170.300000114.1T362T362-A364 PolarHBondContact O-N 3.41Å
365L31.1Very low31Very low152 Ų152140 Ų14080%0.79677%0.766SS**SBendtrans74.131.8151.1-65.4164.7000121.2
366I33.5Very low31.3Very low172 Ų172139 Ų13988%0.88276%0.76SS**SBendtrans-129.355.5151.9-40.3179.6000111.4
367N31.5Very low31.2Very low159 Ų159141.2 Ų141.285%0.8577%0.766SS**SBendtrans-148.923.3-179.5-146.30.6000114.8
368T30.3Very low31.6Very low104 Ų104139.4 Ų139.464%0.63875%0.754SS**SBendtrans-14214.3-16445.70000116.4
369R29.6Very low31.8Very low228 Ų228136.7 Ų136.786%0.8675%0.748SS**SBendtrans-135.1-13.7177.5-86.9-169171.8-177-2.2118.5S371R369-S371 VanDerWaalsContact C-N 3.29Å; R369-S371 PolarHBondContact O-N 3.28Å
370L34.2Very low32.1Very low167 Ų167136.1 Ų136.187%0.87474%0.744SS**THydrogen-bonded Turntrans-82.4-0.9178.7-78168000114.4
371S33.6Very low32.5Very low101 Ų101134.4 Ų134.471%0.70674%0.738SS**THydrogen-bonded Turntrans-90.40.9-173.5480000115.7R369R369-S371 VanDerWaalsContact C-N 3.29Å; R369-S371 PolarHBondContact O-N 3.28Å
372Q31.7Very low33Very low184 Ų184136.3 Ų136.386%0.8675%0.748SS**SBendtrans-137.5-6.6-176.3-77.4-176-22.300115.8L374Q372-L374 PolarHBondContact O-N 3.07Å
373S29.1Very low33.2Very low82 Ų82138.9 Ų138.957%0.57375%0.75SS**SBendtrans-8983.8-177.758.50000113.1
374L31.9Very low33.7Very low142 Ų142141.6 Ų141.674%0.74375%0.748SS**  trans56.967.9148.9-51.9176.9000117.4Q372 L376Q372-L374 PolarHBondContact O-N 3.07Å; L374-L376 HydrophobicContact CD2-CD1 4.08Å; L374-L376 PolarHBondContact O-N 3.25Å
375F31.6Very low34.3Very low219 Ų219144.2 Ų144.296%0.96176%0.76SS**  trans-68.576.1139.7-80.3-84.2000108.5
376L35.4Very low34.7Very low130 Ų130143.1 Ų143.168%0.68175%0.754SS**  trans-67.3138.3165.4-131.177.6000107.7L374 S378L374-L376 HydrophobicContact CD2-CD1 4.08Å; L374-L376 PolarHBondContact O-N 3.25Å; L376-S378 PolarHBondContact O-N 2.9Å; L376-S378 PolarHBondContact O-OG 3.27Å; L376-S378 VanDerWaalsContact O-OG 3.09Å
377D30.3Very low34.9Very low127 Ų127139.3 Ų139.368%0.67974%0.74SS**  trans-64.593.3-171.7-162.9-32.4000111.8S379 S380D377-S379 PolarHBondContact O-N 2.79Å; D377-S379 VanDerWaalsContact O-N 3.08Å; D377-S379 WeakPolarHBondContact OD1-CB 3.47Å; D377-S379 PolarHBondContact OD1-N 3.3Å; D377-S379 PolarHBondContact OD1-OG 3.01Å; D377-S380 PolarHBondContact O-OG 2.95Å
378S35.3Very low35.1Very low86 Ų86135.2 Ų135.260%0.60172%0.724SS**G310 helixtrans-70.6-4.4-168.7-57.40000114.3L376 S380 V381L376-S378 PolarHBondContact O-N 2.9Å; L376-S378 PolarHBondContact O-OG 3.27Å; L376-S378 VanDerWaalsContact O-OG 3.09Å; S378-S380 PolarHBondContact O-N 3.48Å; S378-S380 VanDerWaalsContact O-N 3.14Å; S378-V381 PolarHBondContact O-N 3.16Å
379S36.1Very low35.4Very low97 Ų97139.7 Ų139.768%0.67873%0.731SS**G310 helixtrans-55.9-25.9177.256.60000113.6D377D377-S379 PolarHBondContact O-N 2.79Å; D377-S379 VanDerWaalsContact O-N 3.08Å; D377-S379 WeakPolarHBondContact OD1-CB 3.47Å; D377-S379 PolarHBondContact OD1-N 3.3Å; D377-S379 PolarHBondContact OD1-OG 3.01Å
380S36.2Very low35.7Very low91 Ų91137 Ų13764%0.63673%0.728SS**G310 helixtrans-90.3-9.5-176.158.70000115.8D377 S378D377-S380 PolarHBondContact O-OG 2.95Å; S378-S380 PolarHBondContact O-N 3.48Å; S378-S380 VanDerWaalsContact O-N 3.14Å
381V40.2Very low35.8Very low96 Ų96136 Ų13658%0.58272%0.722SS**G310 helixtrans-83.1-20.5-165.2-178.30000113.5S378 E383S378-V381 PolarHBondContact O-N 3.16Å; V381-E383 PolarHBondContact O-N 2.73Å
382L38.2Very low35.8Very low165 Ų165137.4 Ų137.486%0.86472%0.722SS**G310 helixtrans-78.4-8.8-169.9-71.6172.4000115.9
383E40.7Very low36Very low190 Ų190134.7 Ų134.789%0.88872%0.717SS**G310 helixtrans-84.8-13.8179.3-69.8-156126.500114.6V381V381-E383 PolarHBondContact O-N 2.73Å
384R38.7Very low36.1Very low214 Ų214138.4 Ų138.481%0.80872%0.723SS**SBendtrans-94.1131178.5-75.1-176.8173.7171.3-1.1111.3L386R384-L386 PolarHBondContact O-N 3.48Å
385P40.8Very low36.2Very low123 Ų123139 Ų13980%0.79973%0.727SS**PPolyproline II helixtrans-62.9133.1173.427.2-33.6000109.8
386L40.1Very low36.2Very low129 Ų129132.7 Ų132.768%0.67571%0.71SS**PPolyproline II helixtrans-64.7140.3179.1-67.1172.8000110.6R384 S388R384-L386 PolarHBondContact O-N 3.48Å; L386-S388 PolarHBondContact O-N 2.93Å
387P37.5Very low36.1Very low91 Ų91137.1 Ų137.159%0.59172%0.718SS**PPolyproline II helixtrans-63.1120.9175.6-2233.3000111.3Y389P387-Y389 HydrophobicContact CB-CD2 4.44Å; P387-Y389 HydrophobicContact CB-CE2 3.81Å; P387-Y389 WeakPolarHBondContact O-CD2 3.39Å; P387-Y389 PolarHBondContact O-N 3.42Å
388S35.7Very low36.4Very low73 Ų73139.1 Ų139.151%0.5173%0.728SS.*  trans-82.7115.1178.2-159.10000110.5L386L386-S388 PolarHBondContact O-N 2.93Å
389Y36.2Very low36.2Very low199 Ų199144.2 Ų144.278%0.7874%0.742SS**  trans-101.1102.2176.9-68.6-84.2000110.2P387 I391P387-Y389 HydrophobicContact CB-CD2 4.44Å; P387-Y389 HydrophobicContact CB-CE2 3.81Å; P387-Y389 WeakPolarHBondContact O-CD2 3.39Å; P387-Y389 PolarHBondContact O-N 3.42Å; Y389-I391 PolarHBondContact O-N 2.94Å
390H35.8Very low36Very low170 Ų170149.1 Ų149.179%0.78775%0.752SS**  trans-74.6119.3177.4-75.3-70.9000112N392H390-N392 PolarHBondContact O-N 3.11Å
391I37.3Very low35.8Very low146 Ų146156.7 Ų156.775%0.74977%0.766SS**  trans-85.5107.1175.4-55.9176.9000109.4Y389 V393Y389-I391 PolarHBondContact O-N 2.94Å; I391-V393 HydrophobicContact CG2-CG2 4.11Å; I391-V393 PolarHBondContact O-N 2.88Å
392N32.9Very low35.3Very low132 Ų132158.6 Ų158.671%0.70678%0.778SS**  trans-72.8114.3173.9-88.1-34.9000111.3H390H390-N392 PolarHBondContact O-N 3.11Å
393V36.1Very low34.9Very low127 Ų127160.3 Ų160.377%0.7777%0.773SS**  trans-120.393.3168-1750000109.3I391I391-V393 HydrophobicContact CG2-CG2 4.11Å; I391-V393 PolarHBondContact O-N 2.88Å
394F32Very low34.5Very low159 Ų159159.3 Ų159.370%0.69777%0.773SS**  trans-82.9124.1164.8-81.4-100.5000109.4
395D33.7Very low34.2Very low155 Ų155154.3 Ų154.383%0.82976%0.762SS**  trans-136.9160.7152.5-162.66.6000109.5
396S31.8Very low33.8Very low86 Ų86153.2 Ų153.260%0.60176%0.757SS**  trans-118.3170.9-150.871.10000113.6
397R33.2Very low33.6Very low224 Ų224153.2 Ų153.285%0.84576%0.762SS**  trans57.492170.1-58.4176.2176.3-175.2-0.7115.8
398N36.5Very low33.2Very low168 Ų168153.7 Ų153.790%0.89877%0.768SS**  -171.5100.4129-101.4-55.9000111.7K400N398-K400 PolarHBondContact O-N 3.48Å
399H29.8Very low33.2Very low194 Ų194156.9 Ų156.990%0.89878%0.779SS**  trans-80.2112.2174.7-71.8-62.2000111.7
400K33.6Very low33Very low200 Ų200157.2 Ų157.287%0.8778%0.779SS**  trans-152.5108.7161.2-111.5163.2-172.9171.60111.9N398N398-K400 PolarHBondContact O-N 3.48Å
401R30.3Very low33Very low250 Ų250156.7 Ų156.794%0.94378%0.781SS**  trans47.882.7167.8-64.5-176.6177.7172.8-0.7115.6R403R401-R403 PolarHBondContact O-N 3.42Å
402V29.8Very low32.9Very low136 Ų136154.3 Ų154.382%0.82478%0.777SS**  trans-60.6124.2167177.70000110
403R31.4Very low32.9Very low201 Ų201154.3 Ų154.376%0.75878%0.777SS**  trans-90.7138.9161.4-173.3178.5178.998.5-1.8107.4R401 D405R401-R403 PolarHBondContact O-N 3.42Å; R403-D405 VanDerWaalsContact C-N 3.25Å; R403-D405 WeakPolarHBondContact CD-OD2 3.37Å; R403-D405 PolarHBondContact O-N 2.98Å
404L30.7Very low33.1Very low169 Ų169156 Ų15689%0.88578%0.776SS**  trans-7972.8-178.2-76.7168.4000111.3
405D33.2Very low33.4Very low109 Ų109156.9 Ų156.958%0.58378%0.78SS**  trans-92.6139.7166.4-61.6-56.7000109.1R403 T407R403-D405 VanDerWaalsContact C-N 3.25Å; R403-D405 WeakPolarHBondContact CD-OD2 3.37Å; R403-D405 PolarHBondContact O-N 2.98Å; D405-T407 VanDerWaalsContact C-N 3.3Å; D405-T407 PolarHBondContact O-N 3.34Å
406S32.1Very low33.6Very low99 Ų99155.1 Ų155.169%0.69277%0.771SS**SBendtrans-81.645-151.1-480000116.8
407T35.8Very low33.9Very low129 Ų129162 Ų16279%0.79179%0.786SS**  trans-130.360.4-177.759.50000112.5D405D405-T407 VanDerWaalsContact C-N 3.3Å; D405-T407 PolarHBondContact O-N 3.34Å
408S30Very low34.2Very low101 Ų101155.2 Ų155.271%0.70677%0.769SS**  trans-156.452.4172.2-158.30000113.3R410S408-R410 PolarHBondContact O-N 3.19Å
409L34.8Very low34.2Very low141 Ų141153 Ų15374%0.73876%0.757SS**  trans-84.992.9155.1-84.8171.7000107.6L411L409-L411 PolarHBondContact O-N 3.03Å
410R32.8Very low34.9Very low206 Ų206154.5 Ų154.578%0.77776%0.755SS**  trans-69.7107.1164.5-74.4-178.6170.4-175.7-6.6107.9S408S408-R410 PolarHBondContact O-N 3.19Å
411L36.3Very low35.1Very low159 Ų159149.4 Ų149.483%0.83275%0.75SS**  trans-66.8141.8157.5-65.1173000107.9L409L409-L411 PolarHBondContact O-N 3.03Å
412S34.6Very low35.3Very low96 Ų96140.7 Ų140.767%0.67173%0.731SS**  trans-70135.4-176.2-57.20000111.4E414S412-E414 VanDerWaalsContact C-N 3.28Å; S412-E414 PolarHBondContact O-N 3.48Å
413N32.3Very low35.7Very low132 Ų132141.7 Ų141.771%0.70673%0.732SS**SBendtrans-69.981.6170.3-70.976.9000110.4D416N413-D416 PolarHBondContact ND2-OD2 3.01Å
414E39.6Very low35.8Very low162 Ų162140.1 Ų140.176%0.75774%0.739SS**  trans-130.18.9-178.1-133.8160.1-159.500113.1S412S412-E414 VanDerWaalsContact C-N 3.28Å; S412-E414 PolarHBondContact O-N 3.48Å
415F40.3Very low36.2Very low177 Ų177138.8 Ų138.878%0.77673%0.731SS**SBendtrans-127.3-4.6177.5-75.3-86.3000114.6Y417F415-Y417 PolarHBondContact O-N 2.96Å
416D37.6Very low36.3Very low119 Ų119140.7 Ų140.764%0.63674%0.742SS**THydrogen-bonded Turntrans-79.628.4-173.7-62.8-37.7000114.6N413N413-D416 PolarHBondContact ND2-OD2 3.01Å
417Y37.3Very low36.4Very low231 Ų231145.3 Ų145.391%0.90675%0.75SS**THydrogen-bonded Turntrans-132.15.7-179.2-90.5-71.6000114.8F415F415-Y417 PolarHBondContact O-N 2.96Å
418T39.2Very low36.4Very low81 Ų81141.6 Ų141.650%0.49774%0.737SS.*  trans-82.5115171.7-51.30000109.8W420T418-W420 HydrophobicContact CG2-CD2 4.15Å; T418-W420 HydrophobicContact CG2-CG 4.38Å; T418-W420 HydrophobicContact CG2-CZ2 4.08Å; T418-W420 PolarHBondContact O-N 2.89Å; T418-W420 VanDerWaalsContact O-N 3.14Å
419D36.9Very low36.6Very low122 Ų122143.4 Ų143.465%0.65275%0.746SS**  trans-80.190.6176-167.5-9.6000110.4A421D419-A421 PolarHBondContact O-N 2.89Å; D419-A421 VanDerWaalsContact O-N 3.08Å; D419-A421 WeakPolarHBondContact OD1-CB 3.31Å; D419-A421 PolarHBondContact OD1-N 3.13Å
420W44Very low36.6Very low224 Ų224142.8 Ų142.885%0.84875%0.752SS**THydrogen-bonded Turntrans-71.77.9-178.9-65.593.8000114.2T418T418-W420 HydrophobicContact CG2-CD2 4.15Å; T418-W420 HydrophobicContact CG2-CG 4.38Å; T418-W420 HydrophobicContact CG2-CZ2 4.08Å; T418-W420 PolarHBondContact O-N 2.89Å; T418-W420 VanDerWaalsContact O-N 3.14Å
421A37.8Very low37Very low93 Ų93136.4 Ų136.477%0.76975%0.751SS**THydrogen-bonded Turntrans-97-3.118000000114.5D419D419-A421 PolarHBondContact O-N 2.89Å; D419-A421 VanDerWaalsContact O-N 3.08Å; D419-A421 WeakPolarHBondContact OD1-CB 3.31Å; D419-A421 PolarHBondContact OD1-N 3.13Å
422A34.9Very low36.8Very low67 Ų67138.6 Ų138.655%0.55476%0.757SS**SBendtrans-142.390.4-175.700000113.4
423D37.5Very low37Very low158 Ų158142.2 Ų142.285%0.84576%0.763SS**  trans-176143.4132.5-97.2-21.3000110.2I425D423-I425 PolarHBondContact O-N 3.4Å; D423-I425 VanDerWaalsContact O-N 3.09Å
424D34.1Very low37.3Very low168 Ų168144 Ų14490%0.89877%0.771SS**  trans-71.798.9177-78.8-54.3000110.7D426D424-D426 PolarHBondContact O-N 3.26Å
425I39.5Very low37.3Very low141 Ų141141 Ų14172%0.72376%0.764SS**  trans-77.190.3170.7-56.4-177.9000108.8D423 F427D423-I425 PolarHBondContact O-N 3.4Å; D423-I425 VanDerWaalsContact O-N 3.09Å; I425-F427 WeakPolarHBondContact O-CD2 3.42Å; I425-F427 PolarHBondContact O-N 2.85Å
426D35.6Very low37.3Very low149 Ų149135.9 Ų135.980%0.79775%0.745SS**  trans-59.1120.8177.7-171.213.1000111.7D424 G428D424-D426 PolarHBondContact O-N 3.26Å; D426-G428 PolarHBondContact O-N 2.77Å
427F34Very low37.6Very low196 Ų196136.8 Ų136.886%0.8675%0.749SS**  trans-80.564.9-177.5-83.8-90.3000111.5I425I425-F427 WeakPolarHBondContact O-CD2 3.42Å; I425-F427 PolarHBondContact O-N 2.85Å
428G35.7Very low37.9Very low51 Ų51132.3 Ų132.353%0.52674%0.736SS.*  trans-60.9129.3174.900000112.3D426 C430D426-G428 PolarHBondContact O-N 2.77Å; G428-C430 PolarHBondContact O-N 2.81Å
429P33.9Very low38.2Very low138 Ų138132.8 Ų132.890%0.89674%0.742SS**  trans-75.3108.9-175.729.4-34.2000111
430C34.6Very low38.4Very low129 Ų129133.5 Ų133.587%0.87275%0.746SS**  trans-126.4113.4-178-157.40000112.1G428G428-C430 PolarHBondContact O-N 2.81Å
431G41.2Very low38.6Very low72 Ų72127.7 Ų127.774%0.74274%0.735SS**  trans82.477163.800000116.1E433G431-E433 PolarHBondContact O-N 2.89Å; G431-E433 VanDerWaalsContact O-N 3.09Å
432E33.2Very low38.3Very low205 Ų205131.4 Ų131.496%0.95873%0.734SS**  trans-68.896.6154.6-69.2-176.7157.800109.4
433E37.6Very low38.3Very low171 Ų171135.6 Ų135.680%0.79975%0.747SS**  trans-125.1107.8153.3-169.9161.8-14700108.4G431 V435G431-E433 PolarHBondContact O-N 2.89Å; G431-E433 VanDerWaalsContact O-N 3.09Å; E433-V435 VanDerWaalsContact C-N 3.35Å; E433-V435 PolarHBondContact O-N 2.89Å
434L39.1Very low38.1Very low170 Ų170133.5 Ų133.589%0.8975%0.745SS**  trans-71.990.4179.6-73.5166.7000109D436L434-D436 PolarHBondContact O-N 2.8Å
435V39.9Very low38Very low99 Ų99130.8 Ų130.860%0.674%0.738SS**  trans-66.986.7169.4-177.20000108.6E433 L437 L440E433-V435 VanDerWaalsContact C-N 3.35Å; E433-V435 PolarHBondContact O-N 2.89Å; V435-L437 PolarHBondContact O-N 2.91Å; V435-L440 HydrophobicContact CG1-CD1 4.01Å
436D39Very low37.8Very low70 Ų70128.8 Ų128.837%0.37474%0.737SS.*  trans-55.9119.6173.1161.843.8000110.4L434 H438 S439L434-D436 PolarHBondContact O-N 2.8Å; D436-H438 PolarHBondContact O-N 3.3Å; D436-H438 WeakPolarHBondContact OD1-CB 3.41Å; D436-H438 IonicContact OD1-CD2 3.34Å; D436-H438 PolarHBondContact OD1-CD2 3.47Å; D436-H438 IonicContact OD1-CG 3.73Å; D436-H438 PolarHBondContact OD1-N 2.99Å; D436-H438 WeakPolarHBondContact OD2-CB 3.37Å; D436-S439 WeakPolarHBondContact O-CB 3.32Å; D436-S439 PolarHBondContact O-N 3.04Å; D436-S439 WeakPolarHBondContact OD2-CB 3.49Å; D436-S439 PolarHBondContact OD2-N 3.31Å; D436-S439 PolarHBondContact OD2-OG 3.2Å
437L45.4Very low37.6Very low137 Ų137129 Ų12972%0.71774%0.739SS**THydrogen-bonded Turntrans-63.8-21.2179.1-98.672.8000112.8V435 V441V435-L437 PolarHBondContact O-N 2.91Å; L437-V441 WeakPolarHBondContact O-CG2 3.41Å
438H43Very low37.8Very low138 Ų138127.8 Ų127.864%0.63974%0.739SS**THydrogen-bonded Turntrans-72.6-31174.2-63.2-75.7000112.2D436 L440 V441D436-H438 PolarHBondContact O-N 3.3Å; D436-H438 WeakPolarHBondContact OD1-CB 3.41Å; D436-H438 IonicContact OD1-CD2 3.34Å; D436-H438 PolarHBondContact OD1-CD2 3.47Å; D436-H438 IonicContact OD1-CG 3.73Å; D436-H438 PolarHBondContact OD1-N 2.99Å; D436-H438 WeakPolarHBondContact OD2-CB 3.37Å; H438-L440 PolarHBondContact O-N 3.14Å; H438-V441 PolarHBondContact O-N 3.37Å
439S45.7Very low37.5Very low90 Ų90134.8 Ų134.863%0.62976%0.758SS**THydrogen-bonded Turntrans-70.3-15.5177.6-64.90000114D436D436-S439 WeakPolarHBondContact O-CB 3.32Å; D436-S439 PolarHBondContact O-N 3.04Å; D436-S439 WeakPolarHBondContact OD2-CB 3.49Å; D436-S439 PolarHBondContact OD2-N 3.31Å; D436-S439 PolarHBondContact OD2-OG 3.2Å
440L41Very low37.7Very low138 Ų138133 Ų13372%0.72375%0.749SS**THydrogen-bonded Turntrans-90.50.4172.7-72172.7000114.1V435 H438V435-L440 HydrophobicContact CG1-CD1 4.01Å; H438-L440 PolarHBondContact O-N 3.14Å
441V47.5Very low37.8Very low102 Ų102136.4 Ų136.462%0.61875%0.749SS**SBendtrans-102.4-14.5-176.8177.70000112.9L437 H438L437-V441 WeakPolarHBondContact O-CG2 3.41Å; H438-V441 PolarHBondContact O-N 3.37Å
442F32.7Very low37.4Very low171 Ų171139.7 Ų139.775%0.7575%0.749SS**  trans-126.366.6-169-71.9-78.5000114.8
443D33.1Very low37.3Very low155 Ų155136 Ų13683%0.82974%0.736SS**  trans-143.264.3160.7-152.82.3000113.9
444S34.6Very low37.1Very low114 Ų114136 Ų13680%0.79774%0.736SS**SBendtrans-161.355.5162.9-81.50000113
445S32.5Very low37Very low110 Ų110132.5 Ų132.577%0.76972%0.721SS**  trans54.9132.9151.462.60000122.6
446S35.4Very low36.9Very low100 Ų100137 Ų13770%0.69973%0.733SS**  trans72.297.9154.5580000120.3
447D31.6Very low36.6Very low154 Ų154144 Ų14482%0.82476%0.761SS**  51.492.3122.3-50.4-27000120
448I37Very low36.2Very low170 Ų170143.9 Ų143.987%0.87276%0.761SS**  trans-154.4131.9130.1-98.6143.3000109
449Q30.4Very low36Very low197 Ų197142.3 Ų142.392%0.92176%0.763SS**  trans-119.788.2-167.6-174.8-170.825.700111.6
450S37.4Very low35.7Very low101 Ų101142.2 Ų142.271%0.70677%0.767SS**  trans-159.2109.7168.463.80000115.4
451K36Very low35.7Very low201 Ų201145.3 Ų145.387%0.87477%0.771SS**  trans38.491.9148.3-63.5-172.2175.4-172.70119.2
452L32.9Very low35.2Very low140 Ų140144.8 Ų144.873%0.73376%0.764SS**  14119106.2-160.4164.4000116.5E454L452-E454 HydrophobicContact CD2-CG 3.79Å; L452-E454 HydrophobicContact CG-CG 4.36Å
453D31.4Very low35.7Very low128 Ų128142 Ų14268%0.68476%0.761SS**  trans-145.6119153.5-161.9-32.6000107.9T455D453-T455 PolarHBondContact O-N 3.1Å; D453-T455 PolarHBondContact OD1-OG1 3.04Å
454E34.5Very low36.3Very low171 Ų171137.6 Ų137.680%0.79974%0.743SS**  trans-94.958.8-166.5-73.2176.2143.400112.3L452L452-E454 HydrophobicContact CD2-CG 3.79Å; L452-E454 HydrophobicContact CG-CG 4.36Å
455T36.2Very low36.9Very low96 Ų96137.3 Ų137.359%0.58973%0.732SS**  trans-135.544.6-166.145.60000115.5D453D453-T455 PolarHBondContact O-N 3.1Å; D453-T455 PolarHBondContact OD1-OG1 3.04Å
456F38.5Very low37.6Very low193 Ų193136.7 Ų136.785%0.84672%0.72SS**  trans-135.268.4174-90.2-75.7000115.9
457F31Very low38.2Very low219 Ų219137.8 Ų137.896%0.96172%0.715SS**  trans-81.1127.1145.5-99.5-100.8000108.7
458D38.2Very low38.9Very low133 Ų133136 Ų13671%0.71170%0.702SS**  trans-161.8134.7178.2-171.758.5000111.8
459P38Very low39.4Very low106 Ų106134.5 Ų134.569%0.68869%0.691SS**SBendcis-13723.4-45.240.6-25.1000111.7Y461P459-Y461 PolarHBondContact O-N 3.24Å
460A40.1Very low40Very low87 Ų87132.3 Ų132.372%0.71968%0.679SS**SBendtrans-70.8-37-159.500000115
461Y40.1Very low40.1Very low204 Ų204130 Ų13080%0.866%0.66SS**  trans-154.6115.2174.8-80.1-82.8000108.5P459P459-Y461 PolarHBondContact O-N 3.24Å
462D38.2Very low40.3Very low90 Ų90127.1 Ų127.148%0.48165%0.651SS.*  trans-78134.4153.1-167.6-27.4000107.5S464 D465 L466D462-S464 PolarHBondContact O-N 3.08Å; D462-S464 WeakPolarHBondContact OD1-CB 3.5Å; D462-S464 PolarHBondContact OD1-N 2.76Å; D462-S464 PolarHBondContact OD1-OG 2.9Å; D462-D465 HydrophobicContact CB-CB 4.45Å; D462-D465 PolarHBondContact O-N 2.78Å; D462-L466 PolarHBondContact O-N 3.02Å
463V42.6Very low41Very low113 Ų113126.4 Ų126.469%0.68565%0.649SS**Hα-helixtrans-64.6-28.3175.4-178.20000110.2L466 M467V463-L466 PolarHBondContact O-N 3.47Å; V463-M467 WeakPolarHBondContact O-CG 3.45Å; V463-M467 PolarHBondContact O-N 3.28Å
464S45.2Very low41.8Very low62 Ų62127.3 Ų127.343%0.43465%0.646SS.*Hα-helixtrans-61.7-42.7175.1-43.60000112.3D462 L466 M467 H468D462-S464 PolarHBondContact O-N 3.08Å; D462-S464 WeakPolarHBondContact OD1-CB 3.5Å; D462-S464 PolarHBondContact OD1-N 2.76Å; D462-S464 PolarHBondContact OD1-OG 2.9Å; S464-L466 VanDerWaalsContact C-N 3.34Å; S464-L466 PolarHBondContact O-N 3.06Å; S464-M467 WeakPolarHBondContact O-CB 3.4Å; S464-M467 PolarHBondContact O-N 2.87Å; S464-H468 PolarHBondContact O-CD2 3.09Å; S464-H468 VanDerWaalsContact O-CD2 3.27Å; S464-H468 PolarHBondContact O-N 2.95Å
465D48.8Very low42Very low108 Ų108126.1 Ų126.158%0.57864%0.635SS**Hα-helixtrans-66.3-36.5177.3-92.1-18000111.9D462 M467 H468 H469D462-D465 HydrophobicContact CB-CB 4.45Å; D462-D465 PolarHBondContact O-N 2.78Å; D465-M467 VanDerWaalsContact C-N 3.33Å; D465-H468 PolarHBondContact O-N 3.01Å; D465-H469 PolarHBondContact O-N 3.02Å
466L46.9Very low42.4Very low97 Ų97130.4 Ų130.451%0.50865%0.649SS.*Hα-helixtrans-67.5-36.6175-16568000111.2D462 V463 S464 H469 F470D462-L466 PolarHBondContact O-N 3.02Å; V463-L466 PolarHBondContact O-N 3.47Å; S464-L466 VanDerWaalsContact C-N 3.34Å; S464-L466 PolarHBondContact O-N 3.06Å; L466-H469 PolarHBondContact O-N 3.34Å; L466-F470 WeakPolarHBondContact O-CD2 3.49Å
467M47Very low42.6Very low124 Ų124126.2 Ų126.261%0.61164%0.643SS**Hα-helixtrans-68.1-36.1172.6-73.6-61.1-60.900112.8V463 S464 D465 H469 F470V463-M467 WeakPolarHBondContact O-CG 3.45Å; V463-M467 PolarHBondContact O-N 3.28Å; S464-M467 WeakPolarHBondContact O-CB 3.4Å; S464-M467 PolarHBondContact O-N 2.87Å; D465-M467 VanDerWaalsContact C-N 3.33Å; M467-H469 PolarHBondContact O-N 3.26Å; M467-F470 PolarHBondContact O-N 3.18Å
468H47.1Very low43Very low117 Ų117121.6 Ų121.654%0.54263%0.628SS.*Hα-helixtrans-65.5-14174.6-80.3-52.5000114.3S464 D465 F470S464-H468 PolarHBondContact O-CD2 3.09Å; S464-H468 VanDerWaalsContact O-CD2 3.27Å; S464-H468 PolarHBondContact O-N 2.95Å; D465-H468 PolarHBondContact O-N 3.01Å; H468-F470 VanDerWaalsContact C-N 3.3Å
469H48Very low43Very low138 Ų138124 Ų12464%0.63963%0.634SS**THydrogen-bonded Turntrans-75.6-15.2167.4-90.9-82000114.2D465 L466 M467D465-H469 PolarHBondContact O-N 3.02Å; L466-H469 PolarHBondContact O-N 3.34Å; M467-H469 PolarHBondContact O-N 3.26Å
470F41.2Very low43.2Very low151 Ų151126.1 Ų126.166%0.66264%0.639SS**SBendtrans-112.47.5-178.6-66.2-79.1000114.6L466 M467 H468 M472L466-F470 WeakPolarHBondContact O-CD2 3.49Å; M467-F470 PolarHBondContact O-N 3.18Å; H468-F470 VanDerWaalsContact C-N 3.3Å; F470-M472 PolarHBondContact O-N 2.94Å
471T39.4Very low43.1Very low53 Ų53126.8 Ų126.833%0.32565%0.645SS.*  trans-64.7135.3174.457.20000111.3D473T471-D473 WeakPolarHBondContact CB-OD2 3.43Å; T471-D473 PolarHBondContact O-N 3.31Å; T471-D473 VanDerWaalsContact O-N 3.13Å
472M41.4Very low43.2Very low139 Ų139124.5 Ų124.569%0.68565%0.645SS**G310 helixtrans-68.8-13.7-168.5-69.5-70.4169.600113.8F470 K474 Y475F470-M472 PolarHBondContact O-N 2.94Å; M472-K474 PolarHBondContact O-N 3.21Å; M472-Y475 PolarHBondContact O-N 3.34Å
473D48Very low42.9Very low126 Ų126125 Ų12567%0.67466%0.656SS**G310 helixtrans-60.4-17.8-175.5-46-68.9000114.2T471 Y475T471-D473 WeakPolarHBondContact CB-OD2 3.43Å; T471-D473 PolarHBondContact O-N 3.31Å; T471-D473 VanDerWaalsContact O-N 3.13Å; D473-Y475 PolarHBondContact O-N 3.07Å
474K47Very low43.1Very low146 Ų146128.8 Ų128.864%0.63568%0.683SS**G310 helixtrans-73.9-9.5173.2-78.7171.9-179.3154.60113.9M472M472-K474 PolarHBondContact O-N 3.21Å
475Y40Very low43Very low146 Ų146132.2 Ų132.257%0.57370%0.695SS**  trans-102.869.3176.3-66.4-78.2000112.2M472 D473 S477 L478M472-Y475 PolarHBondContact O-N 3.34Å; D473-Y475 PolarHBondContact O-N 3.07Å; Y475-S477 PolarHBondContact O-N 3.19Å; Y475-L478 HydrophobicContact CG-CD1 4.35Å; Y475-L478 PolarHBondContact O-N 2.9Å
476H44.2Very low42.7Very low187 Ų187133.4 Ų133.487%0.86670%0.701SS**THydrogen-bonded Turntrans-55.8-9.1172.4-89-54.7000115.1
477S43.1Very low42.5Very low104 Ų104135.4 Ų135.473%0.72771%0.712SS**THydrogen-bonded Turntrans-91.6-5.7174.946.80000114.9Y475 Q479Y475-S477 PolarHBondContact O-N 3.19Å; S477-Q479 PolarHBondContact O-N 2.93Å
478L39.4Very low42.2Very low122 Ų122136.1 Ų136.164%0.63972%0.718SS**  trans-10154.7176.7-68178.3000111.8Y475 L480Y475-L478 HydrophobicContact CG-CD1 4.35Å; Y475-L478 PolarHBondContact O-N 2.9Å; L478-L480 VanDerWaalsContact C-N 3.32Å; L478-L480 PolarHBondContact O-N 3.09Å
479Q37.1Very low41.9Very low183 Ų183137.3 Ų137.386%0.85573%0.729SS**  trans-74.685174.2-166.9169.73900110.2S477 A481S477-Q479 PolarHBondContact O-N 2.93Å; Q479-A481 PolarHBondContact O-N 2.66Å; Q479-A481 VanDerWaalsContact O-N 3.16Å
480L43.5Very low41.5Very low151 Ų151137.3 Ų137.379%0.79174%0.735SS**  trans-55.7117.3171.5-80.1166.7000109.8L478 I482L478-L480 VanDerWaalsContact C-N 3.32Å; L478-L480 PolarHBondContact O-N 3.09Å; L480-I482 VanDerWaalsContact C-N 3.27Å; L480-I482 PolarHBondContact O-N 2.92Å
481A38.1Very low41.5Very low102 Ų102136.3 Ų136.384%0.84374%0.74SS**  trans-76.275.2-177.500000111.4Q479 S483Q479-A481 PolarHBondContact O-N 2.66Å; Q479-A481 VanDerWaalsContact O-N 3.16Å; A481-S483 PolarHBondContact O-N 2.82Å; A481-S483 VanDerWaalsContact O-N 3.07Å
482I40.6Very low41.7Very low156 Ų156142.7 Ų142.780%0.877%0.772SS**  trans-73.495.9169.5-55.8176.4000108.1L480L480-I482 VanDerWaalsContact C-N 3.27Å; L480-I482 PolarHBondContact O-N 2.92Å
483S32.6Very low41.7Very low101 Ų101143 Ų14371%0.70678%0.78SS**  trans-80.4144.3160.5-175.10000108.6A481A481-S483 PolarHBondContact O-N 2.82Å; A481-S483 VanDerWaalsContact O-N 3.07Å
484P46.5Very low41.1Very low192 Ų192144.5 Ų144.5100%1.24779%0.789SS**  trans-67.80-174.929.4-38.1000114.1

Retrieved 484 of 484 residues in 65.1 ms (Link to these results)