A0A096M1W7_POEFO Loading...

Family with sequence similarity 117 member Aa

AlphaFold DB , UniProt , Accession A0A096M1W7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 396 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M35.7Very low39.6Very low229 Ų229134.1 Ų134.1100%1.12885%0.852SS**  0120.50-65.7159.778.400106.3
2S37.4Very low39.4Very low126 Ų126132.6 Ų132.688%0.88185%0.846SS**  54.6110102.2-470000111
3G38Very low39.8Very low78 Ų78131 Ų13180%0.80484%0.841SS**  126.6169.750.400000106.6
4R45.7Very low40Very low234 Ų234132.9 Ų132.988%0.88384%0.841SS**  cis-168.5149.39.9-147.2179.781.6-132.46.8107.8
5S42Very low40.3Very low118 Ų118134.9 Ų134.983%0.82584%0.842SS**  trans67.4147.7160.1-156.70000117.6
6G34.9Very low40.7Very low73 Ų73132.6 Ų132.675%0.75383%0.833SS**  cis155.4171.4-7.800000111.8
7G35.7Very low41Very low85 Ų85134.6 Ų134.688%0.87684%0.835SS**  trans131.795.9172.400000114.9
8A39.3Very low42Very low95 Ų95135.3 Ų135.379%0.78583%0.827SS**  trans-103.5162.6154.100000108
9P51.9Low42.4Very low115 Ų115133.9 Ų133.975%0.74782%0.82SS**  -150.5154.58938.2-21000117.2
10R43.3Very low42.7Very low250 Ų250135.6 Ų135.694%0.94382%0.823SS**  trans41.3124.7140.2-61.8174.5173.1176.4-3.2120.2
11G31.6Very low43.1Very low72 Ų72140.4 Ų140.474%0.74283%0.827SS**  trans-172.3112.4157.500000115.7
12C37.1Very low43.8Very low116 Ų116134 Ų13478%0.78481%0.81SS**  trans36.7102.5154.7-59.70000120.5
13S45.5Very low44.4Very low112 Ų112133.5 Ų133.578%0.78380%0.802SS**  trans-23.6131.9140.450.90000116.2
14N42Very low45.4Very low158 Ų158136 Ų13685%0.84580%0.801SS**  trans-121.7109.2156.3-79.5-77.1000108.7S16N14-S16 PolarHBondContact O-N 3.13Å
15L44.3Very low45.6Very low162 Ų162130.4 Ų130.485%0.84880%0.795SS**  trans-77.3117.8171-70.9169.5000108.2L17L15-L17 PolarHBondContact O-N 2.85Å
16S46.3Very low45.9Very low99 Ų99133 Ų13369%0.69279%0.792SS**  trans-70.6100.7177.448.30000110.5N14 Q18N14-S16 PolarHBondContact O-N 3.13Å; S16-Q18 PolarHBondContact O-N 3.31Å
17L46.9Very low46.7Very low166 Ų166138.5 Ų138.587%0.86980%0.798SS**  trans-66.498.3172.8-68.2176.1000109.6L15L15-L17 PolarHBondContact O-N 2.85Å
18Q57.8Low47.3Very low148 Ų148141.5 Ų141.569%0.69279%0.793SS**  trans-66.2128.1172.4-65.3-65.6-22.100109.4S16 L20S16-Q18 PolarHBondContact O-N 3.31Å; Q18-L20 PolarHBondContact O-N 3.14Å
19P49.9Very low47.6Very low109 Ų109146.1 Ų146.171%0.70880%0.798SS**  trans-69.1123.6177.227.7-33000110.1R21P19-R21 PolarHBondContact O-N 3.12Å; P19-R21 VanDerWaalsContact O-N 3.09Å
20L48.4Very low47.1Very low167 Ų167152.5 Ų152.587%0.87481%0.808SS**  trans-62.9113.5175.6-77.977.7000109.5Q18 A22Q18-L20 PolarHBondContact O-N 3.14Å; L20-A22 VanDerWaalsContact C-N 3.3Å; L20-A22 PolarHBondContact O-N 3.04Å
21R50.5Low47Very low237 Ų237143.7 Ų143.789%0.89479%0.794SS**  trans-72.785.4171.4-73.9-137-78.8168.1-9.3110.5P19 T23P19-R21 PolarHBondContact O-N 3.12Å; P19-R21 VanDerWaalsContact O-N 3.09Å; R21-T23 PolarHBondContact O-N 2.95Å
22A51.5Low47.6Very low95 Ų95145.7 Ų145.779%0.78580%0.797SS**  trans-67.9107.8168.800000109.8L20L20-A22 VanDerWaalsContact C-N 3.3Å; L20-A22 PolarHBondContact O-N 3.04Å
23T50.4Low48Very low115 Ų115144.7 Ų144.771%0.70680%0.797SS**  trans-148.583.5170.4-50.30000109.5R21R21-T23 PolarHBondContact O-N 2.95Å
24V58Low47.9Very low129 Ų129145.4 Ų145.478%0.78280%0.799SS**  trans-101.3111.8166.6-176.80000107.2F26V24-F26 PolarHBondContact O-N 3.01Å; V24-F26 VanDerWaalsContact O-N 3.13Å
25P50.9Low47.8Very low118 Ų118145.3 Ų145.377%0.76680%0.798SS**  trans-73105.1178.128.7-32.6000109.8Q27P25-Q27 PolarHBondContact O-N 3.19Å
26F48.3Very low47.3Very low173 Ų173143.7 Ų143.776%0.75980%0.798SS**  trans-82.311417462.1-86.6000109.9V24 L28V24-F26 PolarHBondContact O-N 3.01Å; V24-F26 VanDerWaalsContact O-N 3.13Å; F26-L28 HydrophobicContact CD2-CD1 4.35Å; F26-L28 HydrophobicContact CD2-CG 4.11Å; F26-L28 HydrophobicContact CE2-CD1 4.02Å; F26-L28 HydrophobicContact CE2-CG 4.29Å; F26-L28 PolarHBondContact O-N 3.2Å
27Q51.8Low47Very low187 Ų187150 Ų15087%0.87481%0.807SS**  trans-92.894.7-174.5-163.2172.312.100110.5P25 Q29P25-Q27 PolarHBondContact O-N 3.19Å; Q27-Q29 PolarHBondContact O-N 3.15Å; Q27-Q29 VanDerWaalsContact O-N 3.08Å
28L47Very low46.5Very low149 Ų149150.3 Ų150.378%0.7880%0.804SS**  trans-68.6103.5178-77.9169.7000111.4F26 R30F26-L28 HydrophobicContact CD2-CD1 4.35Å; F26-L28 HydrophobicContact CD2-CG 4.11Å; F26-L28 HydrophobicContact CE2-CD1 4.02Å; F26-L28 HydrophobicContact CE2-CG 4.29Å; F26-L28 PolarHBondContact O-N 3.2Å; L28-R30 PolarHBondContact O-N 3.34Å
29Q45.5Very low45.8Very low191 Ų191148.7 Ų148.789%0.89381%0.807SS**  trans-65.9113169.3-70.6-174.8-13.800110.3Q27 G31Q27-Q29 PolarHBondContact O-N 3.15Å; Q27-Q29 VanDerWaalsContact O-N 3.08Å; Q29-G31 PolarHBondContact O-N 2.99Å; Q29-G31 VanDerWaalsContact O-N 3.14Å
30R42.8Very low45Very low250 Ų250152.5 Ų152.594%0.94381%0.812SS**  trans-82.288.3179-168.2179.5-170174.73.5110.4L28L28-R30 PolarHBondContact O-N 3.34Å
31G41Very low44.7Very low64 Ų64149 Ų14966%0.6681%0.807SS**  trans-62.5130.3-178.800000114.2Q29Q29-G31 PolarHBondContact O-N 2.99Å; Q29-G31 VanDerWaalsContact O-N 3.14Å
32S44.5Very low44.1Very low114 Ų114144.3 Ų144.380%0.79780%0.804SS**  trans34113.3154.259.60000119.4
33A43.9Very low43.8Very low96 Ų96147.2 Ų147.279%0.79381%0.807SS**PPolyproline II helixtrans-69.7140.6157.300000110.9
34P44.8Very low43.4Very low126 Ų126151.1 Ų151.182%0.81881%0.814SS**PPolyproline II helixtrans-77.5128175.331-33000111
35L40.1Very low43Very low156 Ų156152 Ų15282%0.81782%0.82SS**PPolyproline II helixtrans-83.3121.2176.9-166156000109.3R37L35-R37 PolarHBondContact O-N 3.36Å
36C33.4Very low42.4Very low128 Ų128150.4 Ų150.487%0.86582%0.817SS**PPolyproline II helixtrans-63.8126.2-179-88.30000112.2
37R40Very low42.2Very low232 Ų232147 Ų14788%0.87582%0.821SS**  trans-127.2117.4159.1-91-170.7168.3-176.6-3.1109.7L35L35-R37 PolarHBondContact O-N 3.36Å
38E36.3Very low41.8Very low172 Ų172149.4 Ų149.480%0.80482%0.822SS**  trans-65.5143.1161.6-161.5-162.6127.800109.4
39P43.7Very low41.8Very low115 Ų115147.7 Ų147.775%0.74782%0.819SS**  -143.5133118.334.5-20.2000114.4
40K33.3Very low42.3Very low188 Ų188144.3 Ų144.382%0.81781%0.814SS**  trans40.6130.8147.6-69.2-166.7171.5-171.80120.7
41A40.3Very low42.7Very low94 Ų94143 Ų14378%0.77781%0.809SS**  trans-64.9146.7173.400000114.7
42V38.1Very low43.1Very low138 Ų138145.4 Ų145.484%0.83681%0.813SS**  trans-145.2127.3146.9138.50000106.5K44V42-K44 PolarHBondContact O-N 3.14Å
43D45.6Very low43.5Very low157 Ų157145.7 Ų145.784%0.8481%0.81SS**  trans-72.5124.8179-71.6-79.5000112.2
44K42.6Very low44.2Very low196 Ų196148.4 Ų148.485%0.85281%0.81SS**  trans-154.2117.5152.9-152.1143.5-172.7169.80113V42 A46V42-K44 PolarHBondContact O-N 3.14Å; K44-A46 PolarHBondContact O-N 3.21Å
45T48.7Very low44.7Very low148 Ų148152.3 Ų152.391%0.90881%0.808SS**  trans-58.7114.3177.3-51.60000111.8
46A38.8Very low45.4Very low85 Ų85155.2 Ų155.270%0.70281%0.808SS**  trans-15292.3168.300000109.7K44 R48K44-A46 PolarHBondContact O-N 3.21Å; A46-R48 PolarHBondContact O-N 3.08Å; A46-R48 VanDerWaalsContact O-N 3.15Å
47A43.9Very low46.6Very low101 Ų101156 Ų15684%0.83581%0.809SS**  trans-62.9115.6177.600000110.2
48R43.4Very low47.3Very low238 Ų238151.2 Ų151.290%0.89880%0.8SS**PPolyproline II helixtrans-82121.5171.5-78.1-176.7170.3172.5-0.7109.1A46A46-R48 PolarHBondContact O-N 3.08Å; A46-R48 VanDerWaalsContact O-N 3.15Å
49P48Very low48.6Very low112 Ų112146.1 Ų146.173%0.72778%0.784SS**PPolyproline II helixtrans-64.7143.1172.927.3-33.8000110.1R51P49-R51 PolarHBondContact O-N 3.37Å
50P54.9Low49.6Very low120 Ų120146.8 Ų146.878%0.77978%0.78SS**PPolyproline II helixtrans-63.3130.8173.927.1-33.5000109.5P52P50-P52 WeakPolarHBondContact O-CD 3.25Å
51R51.4Low51.2Low223 Ų223143.4 Ų143.484%0.84277%0.771SS**PPolyproline II helixtrans-64.3122.2179.4-71177.1174.3154.1-4.3109.7P49 T53P49-R51 PolarHBondContact O-N 3.37Å; R51-T53 VanDerWaalsContact C-N 3.29Å; R51-T53 PolarHBondContact O-N 3.47Å; R51-T53 PolarHBondContact O-OG1 3.49Å
52P48.9Very low52.5Low114 Ų114142.4 Ų142.474%0.7476%0.756SS**  trans-7086.3178.328.8-34.5000109.8P50 I54P50-P52 WeakPolarHBondContact O-CD 3.25Å; P52-I54 HydrophobicContact CB-CG1 4.4Å; P52-I54 PolarHBondContact O-N 3.19Å
53T53.7Low54Low120 Ų120141 Ų14174%0.73674%0.742SS**  trans-84.857.9-174.4-49.80000109.7R51 R55R51-T53 VanDerWaalsContact C-N 3.29Å; R51-T53 PolarHBondContact O-N 3.47Å; R51-T53 PolarHBondContact O-OG1 3.49Å; T53-R55 PolarHBondContact O-N 3.32Å
54I57.6Low55.3Low153 Ų153136.5 Ų136.579%0.78572%0.72SS**  trans-74.372.2-179-53.5179000109.1P52P52-I54 HydrophobicContact CB-CG1 4.4Å; P52-I54 PolarHBondContact O-N 3.19Å
55R55.4Low56.8Low208 Ų208129.1 Ų129.179%0.78570%0.7SS**  trans-144.255.1172.9-76.1-159.8167.4-156-4.7111.7T53T53-R55 PolarHBondContact O-N 3.32Å
56R55.8Low58.1Low217 Ų217124.8 Ų124.882%0.81967%0.674SS**SBendtrans-171.4150.8151.6-97.2141.6-166.895.4-8.8108.8L58R56-L58 PolarHBondContact O-N 3.07Å; R56-L58 VanDerWaalsContact O-N 3.16Å
57T57.7Low59.4Low144 Ų144127.1 Ų127.188%0.88367%0.666SS**  trans-69.4102.2166.646.80000108.3
58L54.2Low61.1Low132 Ų132129.3 Ų129.369%0.69166%0.663SS**  trans-72.5147.7174.1-63.6177.3000109.8R56 T62R56-L58 PolarHBondContact O-N 3.07Å; R56-L58 VanDerWaalsContact O-N 3.16Å; L58-T62 HydrophobicContact CB-CG2 4.03Å; L58-T62 HydrophobicContact CD1-CG2 4.39Å
59S64.4Low62.6Low66 Ų66125.3 Ų125.346%0.46266%0.655SS.*  trans-73158.8177.956.10000111.5D61 T62S59-D61 WeakPolarHBondContact CB-OD2 3.46Å; S59-D61 PolarHBondContact O-N 3.18Å; S59-D61 VanDerWaalsContact O-N 3.1Å; S59-D61 PolarHBondContact OG-OD2 3.45Å; S59-T62 PolarHBondContact O-N 3.27Å; S59-T62 PolarHBondContact O-OG1 3.08Å
60L65.4Low63.6Low128 Ų128122.2 Ų122.267%0.6764%0.642SS**THydrogen-bonded Turntrans-58.4-27.1-174.8-143.7157.5000112T62 I63 V64L60-T62 PolarHBondContact O-N 3.49Å; L60-I63 HydrophobicContact CD2-CD1 4.01Å; L60-I63 HydrophobicContact CD2-CG1 4.04Å; L60-I63 HydrophobicContact CG-CD1 4.44Å; L60-I63 WeakPolarHBondContact O-CG1 3.07Å; L60-I63 PolarHBondContact O-N 3.37Å; L60-V64 HydrophobicContact CD2-CG2 4.02Å; L60-V64 PolarHBondContact O-N 3.44Å
61D66.9Low64.2Low117 Ų117121.3 Ų121.363%0.62663%0.628SS**Hα-helixtrans-51.6-32.1174.5-34.4-63.7000113S59 I63 V64S59-D61 WeakPolarHBondContact CB-OD2 3.46Å; S59-D61 PolarHBondContact O-N 3.18Å; S59-D61 VanDerWaalsContact O-N 3.1Å; S59-D61 PolarHBondContact OG-OD2 3.45Å; D61-I63 VanDerWaalsContact C-N 3.26Å; D61-I63 PolarHBondContact O-N 3.33Å; D61-V64 PolarHBondContact O-N 3.29Å
62T67.8Low64.9Low74 Ų74117.8 Ų117.845%0.45462%0.615SS.*Hα-helixtrans-68.6-19-178.659.10000114.4L58 S59 L60L58-T62 HydrophobicContact CB-CG2 4.03Å; L58-T62 HydrophobicContact CD1-CG2 4.39Å; S59-T62 PolarHBondContact O-N 3.27Å; S59-T62 PolarHBondContact O-OG1 3.08Å; L60-T62 PolarHBondContact O-N 3.49Å
63I68.8Low65.7Low107 Ų107118 Ų11855%0.54962%0.616SS.*Hα-helixtrans-100.9-19.8172.758.5165.7000113.3L60 D61 Y67L60-I63 HydrophobicContact CD2-CD1 4.01Å; L60-I63 HydrophobicContact CD2-CG1 4.04Å; L60-I63 HydrophobicContact CG-CD1 4.44Å; L60-I63 WeakPolarHBondContact O-CG1 3.07Å; L60-I63 PolarHBondContact O-N 3.37Å; D61-I63 VanDerWaalsContact C-N 3.26Å; D61-I63 PolarHBondContact O-N 3.33Å; I63-Y67 WeakPolarHBondContact O-CB 3.28Å
64V73.9Confident66.1Low63 Ų63121.8 Ų121.838%0.38262%0.617SS.*Hα-helixtrans-68-42-176.41730000112.3L60 D61 Y67 L68L60-V64 HydrophobicContact CD2-CG2 4.02Å; L60-V64 PolarHBondContact O-N 3.44Å; D61-V64 PolarHBondContact O-N 3.29Å; V64-Y67 WeakPolarHBondContact O-CB 3.34Å; V64-Y67 PolarHBondContact O-N 2.98Å; V64-L68 HydrophobicContact CG1-CD1 3.75Å; V64-L68 HydrophobicContact CG1-CG 4.16Å; V64-L68 WeakPolarHBondContact O-CG 3.49Å; V64-L68 PolarHBondContact O-N 3.06Å; V64-L68 VanDerWaalsContact O-N 3.08Å
65G73.9Confident65.8Low42 Ų42123.3 Ų123.343%0.43362%0.62SS.*Hα-helixtrans-56.1-57.8-177.500000114.1Y67 L68 Q69G65-Y67 VanDerWaalsContact C-N 3.29Å; G65-Y67 PolarHBondContact O-N 3.03Å; G65-L68 PolarHBondContact O-N 3.1Å; G65-Q69 PolarHBondContact O-N 3.41Å
66P74.6Confident65.7Low56 Ų56117.9 Ų117.936%0.36462%0.62SS.*Hα-helixtrans-61.3-36.1178.2-23.734.1000113.5Q69 G70 Q71P66-Q69 CarbonylContact O-C 3.56Å; P66-Q69 PolarHBondContact O-N 2.57Å; P66-G70 PolarHBondContact O-N 2.9Å; P66-Q71 VanDerWaalsContact CB-O 3.28Å; P66-Q71 WeakPolarHBondContact CB-O 3.08Å; P66-Q71 CarbonylContact O-C 3.55Å; P66-Q71 PolarHBondContact O-N 2.97Å
67Y67.1Low65.2Low134 Ų134116.4 Ų116.453%0.52562%0.623SS.*Hα-helixtrans-63.1-47.2-178.6-161.2-67.9000111.8I63 V64 G65 Q69 G70 W72I63-Y67 WeakPolarHBondContact O-CB 3.28Å; V64-Y67 WeakPolarHBondContact O-CB 3.34Å; V64-Y67 PolarHBondContact O-N 2.98Å; G65-Y67 VanDerWaalsContact C-N 3.29Å; G65-Y67 PolarHBondContact O-N 3.03Å; Y67-Q69 PolarHBondContact O-N 3.13Å; Y67-G70 PolarHBondContact O-N 2.89Å; Y67-W72 HydrophobicContact CD2-CE3 4.45Å; Y67-W72 AromaticContact CD2-CH2 3.99Å; Y67-W72 HydrophobicContact CD2-CH2 3.99Å; Y67-W72 AromaticContact CD2-CZ3 3.94Å; Y67-W72 HydrophobicContact CD2-CZ3 3.94Å; Y67-W72 HydrophobicContact CE1-CH2 4.18Å; Y67-W72 HydrophobicContact CE1-CZ2 4.18Å; Y67-W72 HydrophobicContact CE2-CE3 4.38Å; Y67-W72 AromaticContact CE2-CH2 3.24Å; Y67-W72 HydrophobicContact CE2-CH2 3.24Å; Y67-W72 AromaticContact CE2-CZ2 3.99Å; Y67-W72 HydrophobicContact CE2-CZ2 3.99Å; Y67-W72 AromaticContact CE2-CZ3 3.47Å; Y67-W72 HydrophobicContact CE2-CZ3 3.47Å; Y67-W72 VanDerWaalsContact CE2-CZ3 3.47Å; Y67-W72 AromaticContact CZ-CH2 3.35Å; Y67-W72 AromaticContact CZ-CZ2 3.8Å; Y67-W72 WeakPolarHBondContact OH-CH2 3.44Å
68L79.6Confident64.5Low147 Ų147113.9 Ų113.977%0.7762%0.616SS**Hα-helixtrans-65.3-22.4176.4-68.4176.1000113V64 G65V64-L68 HydrophobicContact CG1-CD1 3.75Å; V64-L68 HydrophobicContact CG1-CG 4.16Å; V64-L68 WeakPolarHBondContact O-CG 3.49Å; V64-L68 PolarHBondContact O-N 3.06Å; V64-L68 VanDerWaalsContact O-N 3.08Å; G65-L68 PolarHBondContact O-N 3.1Å
69Q74.1Confident64.2Low155 Ų155114.5 Ų114.572%0.72463%0.626SS**THydrogen-bonded Turntrans-94.68.9179.2-150.5164.421.300113.1G65 P66 Y67 Q71G65-Q69 PolarHBondContact O-N 3.41Å; P66-Q69 CarbonylContact O-C 3.56Å; P66-Q69 PolarHBondContact O-N 2.57Å; Y67-Q69 PolarHBondContact O-N 3.13Å; Q69-Q71 PolarHBondContact O-N 3.21Å
70G69.1Low63.4Low46 Ų46115.2 Ų115.247%0.47464%0.643SS.*THydrogen-bonded Turntrans680.1-178.100000114.7P66 Y67 W72P66-G70 PolarHBondContact O-N 2.9Å; Y67-G70 PolarHBondContact O-N 2.89Å; G70-W72 VanDerWaalsContact C-N 3.28Å; G70-W72 PolarHBondContact O-N 2.82Å; G70-W72 VanDerWaalsContact O-N 3.07Å
71Q68.9Low62.3Low102 Ų102113.3 Ų113.348%0.47765%0.646SS.*  trans-87.773.2177.7-61.4-52.6-45.700109.6P66 Q69P66-Q71 VanDerWaalsContact CB-O 3.28Å; P66-Q71 WeakPolarHBondContact CB-O 3.08Å; P66-Q71 CarbonylContact O-C 3.55Å; P66-Q71 PolarHBondContact O-N 2.97Å; Q69-Q71 PolarHBondContact O-N 3.21Å
72W65.9Low61.1Low149 Ų149113.9 Ų113.956%0.56465%0.654SS**  trans-50.8144.8164-68.992.6000110.7Y67 G70 R74Y67-W72 HydrophobicContact CD2-CE3 4.45Å; Y67-W72 AromaticContact CD2-CH2 3.99Å; Y67-W72 HydrophobicContact CD2-CH2 3.99Å; Y67-W72 AromaticContact CD2-CZ3 3.94Å; Y67-W72 HydrophobicContact CD2-CZ3 3.94Å; Y67-W72 HydrophobicContact CE1-CH2 4.18Å; Y67-W72 HydrophobicContact CE1-CZ2 4.18Å; Y67-W72 HydrophobicContact CE2-CE3 4.38Å; Y67-W72 AromaticContact CE2-CH2 3.24Å; Y67-W72 HydrophobicContact CE2-CH2 3.24Å; Y67-W72 AromaticContact CE2-CZ2 3.99Å; Y67-W72 HydrophobicContact CE2-CZ2 3.99Å; Y67-W72 AromaticContact CE2-CZ3 3.47Å; Y67-W72 HydrophobicContact CE2-CZ3 3.47Å; Y67-W72 VanDerWaalsContact CE2-CZ3 3.47Å; Y67-W72 AromaticContact CZ-CH2 3.35Å; Y67-W72 AromaticContact CZ-CZ2 3.8Å; Y67-W72 WeakPolarHBondContact OH-CH2 3.44Å; G70-W72 VanDerWaalsContact C-N 3.28Å; G70-W72 PolarHBondContact O-N 2.82Å; G70-W72 VanDerWaalsContact O-N 3.07Å; W72-R74 VanDerWaalsContact C-N 3.33Å; W72-R74 PolarHBondContact O-N 3.35Å
73P64.6Low59.8Low117 Ų117115.5 Ų115.576%0.7667%0.667SS**  trans-6196168.2-18.831.9000109.2E75P73-E75 PolarHBondContact O-N 3.37Å
74R62.7Low58.8Low200 Ų200118.1 Ų118.176%0.75568%0.681SS**PPolyproline II helixtrans-61.9129.3170-76-166.5-74.7-78.13.7107.7W72 A76W72-R74 VanDerWaalsContact C-N 3.33Å; W72-R74 PolarHBondContact O-N 3.35Å; R74-A76 PolarHBondContact O-N 3.09Å
75E50.5Low57.5Low185 Ų185120.6 Ų120.686%0.86469%0.692SS**PPolyproline II helixtrans-54.2130173.8-65.7-179.3-171.100108.7P73 E77P73-E75 PolarHBondContact O-N 3.37Å; E75-E77 PolarHBondContact O-N 3.15Å
76A53.6Low56.4Low94 Ų94124 Ų12478%0.77770%0.7SS**PPolyproline II helixtrans-63.5126.2-177.700000109.2R74 A78R74-A76 PolarHBondContact O-N 3.09Å; A76-A78 PolarHBondContact O-N 3.2Å
77E45.7Very low55.4Low186 Ų186128.8 Ų128.887%0.86972%0.715SS**  trans-50.6113-166.4-67.6163.313800111.6E75 T79E75-E77 PolarHBondContact O-N 3.15Å; E77-T79 PolarHBondContact O-N 3.03Å
78A43.5Very low55Low91 Ų91126.4 Ų126.475%0.75272%0.723SS**  trans-73.987.3-157.800000112.8A76 G80A76-A78 PolarHBondContact O-N 3.2Å; A78-G80 VanDerWaalsContact C-N 3.26Å; A78-G80 PolarHBondContact O-N 3.07Å
79T47.3Very low53.7Low146 Ų146125.1 Ų125.190%0.89672%0.721SS**SBendtrans-71.481.8168-55.70000110E77E77-T79 PolarHBondContact O-N 3.03Å
80G48.4Very low52.2Low80 Ų80125.1 Ų125.183%0.82572%0.721SS**SBendtrans68.644.7161.200000116.9A78A78-G80 VanDerWaalsContact C-N 3.26Å; A78-G80 PolarHBondContact O-N 3.07Å
81A40.7Very low51.2Low88 Ų88128.1 Ų128.173%0.72773%0.731SS**  trans-97128.8167.400000110.9
82T42.9Very low50.1Low130 Ų130129 Ų12980%0.79875%0.745SS**  trans-63.7136.6-179.642.30000112I84T82-I84 PolarHBondContact O-N 3.3Å
83C40.7Very low49.1Very low108 Ų108127.4 Ų127.473%0.7376%0.756SS**  trans-68.799-177.755.20000112.3N85C83-N85 PolarHBondContact O-N 3.06Å; C83-N85 PolarHBondContact O-ND2 2.73Å
84I46.6Very low48.1Very low162 Ų162126.1 Ų126.183%0.83175%0.75SS**  trans-73.496.7173.1-38.5179.1000107.8T82 D86T82-I84 PolarHBondContact O-N 3.3Å; I84-D86 PolarHBondContact O-N 3.03Å
85N47.2Very low47.5Very low115 Ų115129.3 Ų129.362%0.61576%0.762SS**  trans-70.9100-179.8-82.3-106.8000109.8C83C83-N85 PolarHBondContact O-N 3.06Å; C83-N85 PolarHBondContact O-ND2 2.73Å
86D51.4Low47Very low113 Ų113126.2 Ų126.260%0.60476%0.756SS**  trans-56.9141.8173.6-171.35.1000110.8I84 A88I84-D86 PolarHBondContact O-N 3.03Å; D86-A88 WeakPolarHBondContact OD1-CB 3.21Å; D86-A88 PolarHBondContact OD1-N 3.16Å
87K53.8Low46.6Very low157 Ų157129.4 Ų129.468%0.68375%0.754SS**SBendtrans-106.63.7179.4-62.7-59.4-179.4-173.90113
88A57.2Low46.6Very low84 Ų84128.5 Ų128.569%0.69475%0.75SS**THydrogen-bonded Turntrans-75.2-20178.500000114.9D86D86-A88 WeakPolarHBondContact OD1-CB 3.21Å; D86-A88 PolarHBondContact OD1-N 3.16Å
89T53Low46.7Very low119 Ų119129.5 Ų129.573%0.7375%0.747SS**THydrogen-bonded Turntrans-107.612.4-168.951.70000115.4T91T89-T91 PolarHBondContact O-N 2.97Å
90Q43.2Very low46.4Very low155 Ų155133 Ų13372%0.72474%0.744SS**  trans-93.396.3177-167168.311.800112.1
91T46.8Very low46.4Very low110 Ų110132.8 Ų132.868%0.67574%0.742SS**  trans-57.4126.7171.4-54.20000110.8T89 C93T89-T91 PolarHBondContact O-N 2.97Å; T91-C93 PolarHBondContact O-N 3.25Å
92P46.4Very low46.7Very low120 Ų120140.2 Ų140.278%0.77975%0.752SS**  trans-77.686.4-17630-35000112.4S94P92-S94 VanDerWaalsContact C-N 3.34Å; P92-S94 PolarHBondContact O-N 3.18Å; P92-S94 VanDerWaalsContact O-N 3.11Å
93C44.8Very low47.4Very low116 Ų116146 Ų14678%0.78476%0.758SS**  trans-83.658.2-178.5-64.30000114.4T91T91-C93 PolarHBondContact O-N 3.25Å
94S44.2Very low47.7Very low90 Ų90146.3 Ų146.363%0.62976%0.762SS**  trans-164.2103.3161.149.80000114.1P92P92-S94 VanDerWaalsContact C-N 3.34Å; P92-S94 PolarHBondContact O-N 3.18Å; P92-S94 VanDerWaalsContact O-N 3.11Å
95W49.4Very low48.1Very low266 Ų266146 Ų146100%1.00877%0.768SS**  trans-89.9100.7151.1-77.585.7000107.9
96T39.5Very low48.5Very low121 Ų121143.4 Ų143.474%0.74277%0.768SS**  trans-120.8123.6173.348.20000110.2E98T96-E98 PolarHBondContact O-N 3.43Å
97E46.6Very low48.5Very low160 Ų160141.8 Ų141.875%0.74878%0.778SS**  trans-80.995.4-168.1-171.6-171.6150.400112.7T99E97-T99 VanDerWaalsContact C-N 3.35Å; E97-T99 WeakPolarHBondContact CG-OG1 3.25Å; E97-T99 PolarHBondContact O-N 3.38Å; E97-T99 PolarHBondContact OE1-OG1 3.08Å
98E44.5Very low48.1Very low167 Ų167141.9 Ų141.978%0.7878%0.78SS**  trans-78.379.2172.9-178.678.6-117.200111T96 R100T96-E98 PolarHBondContact O-N 3.43Å; E98-R100 VanDerWaalsContact C-N 3.32Å; E98-R100 PolarHBondContact O-N 2.87Å
99T46Very low48.5Very low112 Ų112147.5 Ų147.569%0.68779%0.789SS**  trans-79.575.8176.3-70.70000111.3E97E97-T99 VanDerWaalsContact C-N 3.35Å; E97-T99 WeakPolarHBondContact CG-OG1 3.25Å; E97-T99 PolarHBondContact O-N 3.38Å; E97-T99 PolarHBondContact OE1-OG1 3.08Å
100R40.6Very low48.7Very low219 Ų219152.2 Ų152.283%0.82679%0.794SS**  trans-139.6100.4170.9-150.2173.6-166.3-165.94.7114.4E98E98-R100 VanDerWaalsContact C-N 3.32Å; E98-R100 PolarHBondContact O-N 2.87Å
101G49.1Very low49.1Very low77 Ų77148.7 Ų148.779%0.79479%0.786SS**  trans-73.4136.8-176.400000115
102R46.5Very low49.7Very low244 Ų244148.1 Ų148.192%0.92179%0.792SS**  trans-120.9139.6147.8-73.7-166.2-176.9-86.84109.6S104R102-S104 PolarHBondContact O-N 3.33Å
103R58.1Low50.3Low250 Ų250147.1 Ų147.194%0.94379%0.788SS**  trans-66.3117.5173.2-64.2173.5-71.9-103.93.3108.5
104S46.2Very low50.7Low115 Ų115149.6 Ų149.680%0.80478%0.781SS**  trans-114.5120.7170.1-166.90000109.5R102 G106R102-S104 PolarHBondContact O-N 3.33Å; S104-G106 PolarHBondContact O-N 3.46Å
105V56.5Low51.6Low157 Ų157146.7 Ų146.795%0.95277%0.765SS**  trans-89.295.1179.5177.20000108
106G54.2Low52.4Low60 Ų60137.7 Ų137.762%0.61974%0.743SS**  trans-168.5107179.200000110.9S104 H108S104-G106 PolarHBondContact O-N 3.46Å; G106-H108 PolarHBondContact O-N 3.03Å
107G52.4Low54Low79 Ų79134.9 Ų134.981%0.81473%0.732SS**  trans-76.274.3-16900000114.9K109G107-K109 PolarHBondContact O-N 2.81Å; G107-K109 VanDerWaalsContact O-N 3.09Å
108H45.5Very low55.5Low158 Ų158132.1 Ų132.173%0.73172%0.719SS**  trans-70.9101.1174.3-176.874.3000111.8G106 R110 S111G106-H108 PolarHBondContact O-N 3.03Å; H108-R110 VanDerWaalsContact C-N 3.26Å; H108-R110 PolarHBondContact NE2-O 3.33Å; H108-R110 PolarHBondContact O-N 2.94Å; H108-S111 PolarHBondContact CD2-OG 3.31Å; H108-S111 PolarHBondContact NE2-N 3.2Å; H108-S111 PolarHBondContact NE2-OG 2.95Å
109K64Low57.4Low202 Ų202129.3 Ų129.388%0.87871%0.706SS**  trans-78.28.9-172.9-81.5-74-176.91800116G107G107-K109 PolarHBondContact O-N 2.81Å; G107-K109 VanDerWaalsContact O-N 3.09Å
110R57.5Low59.4Low219 Ų219129.2 Ų129.283%0.82670%0.701SS**  trans-139.355.1-177.2-66.6-170.9-179.3-85.70.4113.8H108H108-R110 VanDerWaalsContact C-N 3.26Å; H108-R110 PolarHBondContact NE2-O 3.33Å; H108-R110 PolarHBondContact O-N 2.94Å
111S53Low61.7Low81 Ų81125 Ų12557%0.56669%0.688SS**  trans-136.8101.3161.7-68.70000109.9H108 S113H108-S111 PolarHBondContact CD2-OG 3.31Å; H108-S111 PolarHBondContact NE2-N 3.2Å; H108-S111 PolarHBondContact NE2-OG 2.95Å; S111-S113 PolarHBondContact O-N 3.48Å
112A57.7Low63.6Low97 Ų97125.6 Ų125.680%0.80267%0.67SS**  trans-80.948.8166.800000110.5W114A112-W114 PolarHBondContact O-N 3.03Å
113S60.6Low65.6Low99 Ų99116 Ų11669%0.69264%0.639SS**  trans-81.697.4171.6-1720000107.1S111 G115S111-S113 PolarHBondContact O-N 3.48Å; S113-G115 PolarHBondContact O-N 2.94Å; S113-G115 VanDerWaalsContact O-N 3.11Å
114W52.1Low67.2Low168 Ų168106.8 Ų106.864%0.63662%0.616SS**  trans-59.9112.2173.7-67.587.6000108.7A112 E118 E122A112-W114 PolarHBondContact O-N 3.03Å; W114-E118 HydrophobicContact CE3-CB 4.49Å; W114-E122 VanDerWaalsContact CZ3-CD 3.45Å; W114-E122 HydrophobicContact CZ3-CG 4.42Å; W114-E122 WeakPolarHBondContact CZ3-OE1 3.38Å; W114-E122 WeakPolarHBondContact CZ3-OE2 3.45Å
115G63.2Low69.5Low29 Ų29108.2 Ų108.230%0.29961%0.608SS.*  trans-64.2146.5176.300000110.2S113 A117 E118 H119S113-G115 PolarHBondContact O-N 2.94Å; S113-G115 VanDerWaalsContact O-N 3.11Å; G115-A117 PolarHBondContact O-N 3.31Å; G115-A117 VanDerWaalsContact O-N 3.11Å; G115-E118 PolarHBondContact N-OE2 2.99Å; G115-E118 WeakPolarHBondContact O-CA 3.31Å; G115-E118 WeakPolarHBondContact O-CB 3.41Å; G115-E118 PolarHBondContact O-N 2.81Å; G115-H119 PolarHBondContact O-N 3.39Å
116S67.3Low71.3Confident77 Ų77105.8 Ų105.854%0.53859%0.589SS.*Hα-helixtrans-50.6-39.2174.6176.70000111.8E118 H119 L120S116-E118 VanDerWaalsContact C-N 3.26Å; S116-E118 PolarHBondContact O-N 3.03Å; S116-H119 PolarHBondContact O-N 2.78Å; S116-L120 WeakPolarHBondContact O-CB 3.41Å; S116-L120 VanDerWaalsContact O-CG 3.31Å; S116-L120 WeakPolarHBondContact O-CG 3.16Å; S116-L120 PolarHBondContact O-N 2.92Å
117A72.6Confident73.1Confident63 Ų63111 Ų11152%0.52159%0.59SS.*Hα-helixtrans-69.9-10.3175.800000115.7G115 K121G115-A117 PolarHBondContact O-N 3.31Å; G115-A117 VanDerWaalsContact O-N 3.11Å; A117-K121 WeakPolarHBondContact O-CD 3.44Å; A117-K121 WeakPolarHBondContact O-CE 3.38Å; A117-K121 WeakPolarHBondContact O-CG 3.38Å; A117-K121 PolarHBondContact O-NZ 3.23Å; A117-K121 VanDerWaalsContact O-NZ 3.17Å
118E77.4Confident75Confident102 Ų102113 Ų11348%0.47758%0.578SS.*Hα-helixtrans-96.3-47.5171.9-69.5155.6169.200109.5W114 G115 S116 L120 K121 E122W114-E118 HydrophobicContact CE3-CB 4.49Å; G115-E118 PolarHBondContact N-OE2 2.99Å; G115-E118 WeakPolarHBondContact O-CA 3.31Å; G115-E118 WeakPolarHBondContact O-CB 3.41Å; G115-E118 PolarHBondContact O-N 2.81Å; S116-E118 VanDerWaalsContact C-N 3.26Å; S116-E118 PolarHBondContact O-N 3.03Å; E118-L120 VanDerWaalsContact C-N 3.32Å; E118-L120 PolarHBondContact O-N 3.48Å; E118-K121 WeakPolarHBondContact O-CA 3.3Å; E118-K121 WeakPolarHBondContact O-CB 3.42Å; E118-K121 PolarHBondContact O-N 3.32Å; E118-E122 PolarHBondContact O-N 3.05Å
119H85.3Confident77.2Confident108 Ų108110.6 Ų110.650%0.557%0.567SS.*Hα-helixtrans-53.3-46.5174-179.667.5000112.3G115 S116 K121 E122 V123G115-H119 PolarHBondContact O-N 3.39Å; S116-H119 PolarHBondContact O-N 2.78Å; H119-K121 VanDerWaalsContact C-N 3.27Å; H119-K121 PolarHBondContact O-N 2.79Å; H119-E122 PolarHBondContact O-N 3.47Å; H119-E122 VanDerWaalsContact O-N 3.11Å; H119-V123 WeakPolarHBondContact O-CG2 3.34Å; H119-V123 PolarHBondContact O-N 2.86Å
120L86.8Confident78.3Confident110 Ų110105.7 Ų105.758%0.57655%0.55SS*.Hα-helixtrans-60.2-33.3176.1-72.2171000113.2S116 E118 A124S116-L120 WeakPolarHBondContact O-CB 3.41Å; S116-L120 VanDerWaalsContact O-CG 3.31Å; S116-L120 WeakPolarHBondContact O-CG 3.16Å; S116-L120 PolarHBondContact O-N 2.92Å; E118-L120 VanDerWaalsContact C-N 3.32Å; E118-L120 PolarHBondContact O-N 3.48Å; L120-A124 WeakPolarHBondContact O-CB 3.15Å; L120-A124 PolarHBondContact O-N 2.95Å
121K89.8Confident79.5Confident129 Ų129101.6 Ų101.656%0.56154%0.54SS*.Hα-helixtrans-73.6-34.4176-66.6168.2-171.4151.50111.6A117 E118 H119 K125A117-K121 WeakPolarHBondContact O-CD 3.44Å; A117-K121 WeakPolarHBondContact O-CE 3.38Å; A117-K121 WeakPolarHBondContact O-CG 3.38Å; A117-K121 PolarHBondContact O-NZ 3.23Å; A117-K121 VanDerWaalsContact O-NZ 3.17Å; E118-K121 WeakPolarHBondContact O-CA 3.3Å; E118-K121 WeakPolarHBondContact O-CB 3.42Å; E118-K121 PolarHBondContact O-N 3.32Å; H119-K121 VanDerWaalsContact C-N 3.27Å; H119-K121 PolarHBondContact O-N 2.79Å; K121-K125 WeakPolarHBondContact O-CG 3.26Å; K121-K125 PolarHBondContact O-N 2.97Å
122E88.2Confident80.7Confident90 Ų90104.7 Ų104.742%0.42154%0.543SS..Hα-helixtrans-71-41.9173.9-62.4-150.8135.100112W114 E118 H119 A124 K125 L126W114-E122 VanDerWaalsContact CZ3-CD 3.45Å; W114-E122 HydrophobicContact CZ3-CG 4.42Å; W114-E122 WeakPolarHBondContact CZ3-OE1 3.38Å; W114-E122 WeakPolarHBondContact CZ3-OE2 3.45Å; E118-E122 PolarHBondContact O-N 3.05Å; H119-E122 PolarHBondContact O-N 3.47Å; H119-E122 VanDerWaalsContact O-N 3.11Å; E122-A124 VanDerWaalsContact C-N 3.3Å; E122-A124 PolarHBondContact O-N 3.42Å; E122-K125 PolarHBondContact O-N 3.28Å; E122-L126 WeakPolarHBondContact O-CB 3.39Å; E122-L126 PolarHBondContact O-N 2.93Å
123V89.8Confident81.2Confident43 Ų43108.6 Ų108.626%0.26154%0.537SS..Hα-helixtrans-59.3-40.9171.9172.20000111H119 L126 R127H119-V123 WeakPolarHBondContact O-CG2 3.34Å; H119-V123 PolarHBondContact O-N 2.86Å; V123-L126 PolarHBondContact O-N 3.38Å; V123-R127 WeakPolarHBondContact O-CB 3.31Å; V123-R127 VanDerWaalsContact O-CG 3.32Å; V123-R127 WeakPolarHBondContact O-CG 3.33Å; V123-R127 PolarHBondContact O-N 3.08Å
124A92.3Very high81.4Confident56 Ų56107.7 Ų107.746%0.46353%0.531SS..Hα-helixtrans-64.3-45.4174.100000112.7L120 E122 R127 H128L120-A124 WeakPolarHBondContact O-CB 3.15Å; L120-A124 PolarHBondContact O-N 2.95Å; E122-A124 VanDerWaalsContact C-N 3.3Å; E122-A124 PolarHBondContact O-N 3.42Å; A124-R127 PolarHBondContact O-N 3.04Å; A124-H128 WeakPolarHBondContact O-CB 3.5Å; A124-H128 PolarHBondContact O-N 3.06Å
125K93.7Very high81.8Confident146 Ų146110.6 Ų110.664%0.63554%0.542SS*.Hα-helixtrans-60.9-43.1174.5-76.5173179.3178.30112.2K121 E122 H128 H129K121-K125 WeakPolarHBondContact O-CG 3.26Å; K121-K125 PolarHBondContact O-N 2.97Å; E122-K125 PolarHBondContact O-N 3.28Å; K125-H128 PolarHBondContact O-N 3.01Å; K125-H129 WeakPolarHBondContact O-CB 3.11Å; K125-H129 PolarHBondContact O-N 3.34Å
126L93.6Very high81.3Confident105 Ų105115.7 Ų115.755%0.5556%0.562SS.*Hα-helixtrans-65-46.2179179.560.2000110.9E122 V123 H128 H129 L130E122-L126 WeakPolarHBondContact O-CB 3.39Å; E122-L126 PolarHBondContact O-N 2.93Å; V123-L126 PolarHBondContact O-N 3.38Å; L126-H128 VanDerWaalsContact C-N 3.34Å; L126-H128 PolarHBondContact O-N 3.29Å; L126-H129 PolarHBondContact O-N 3.31Å; L126-L130 HydrophobicContact CD1-CD1 4.07Å; L126-L130 HydrophobicContact CD1-CG 4.16Å; L126-L130 HydrophobicContact CG-CD1 3.99Å; L126-L130 HydrophobicContact CG-CG 4.49Å; L126-L130 WeakPolarHBondContact O-CB 3.41Å; L126-L130 VanDerWaalsContact O-CG 3.31Å; L126-L130 WeakPolarHBondContact O-CG 3.46Å; L126-L130 PolarHBondContact O-N 3.29Å
127R91.6Very high80.6Confident170 Ų170115 Ų11564%0.64256%0.561SS**Hα-helixtrans-57.5-45.4173.1-75.8176.8177.6-172.2-0111.7V123 A124 L130 Q131V123-R127 WeakPolarHBondContact O-CB 3.31Å; V123-R127 VanDerWaalsContact O-CG 3.32Å; V123-R127 WeakPolarHBondContact O-CG 3.33Å; V123-R127 PolarHBondContact O-N 3.08Å; A124-R127 PolarHBondContact O-N 3.04Å; R127-L130 PolarHBondContact O-N 2.92Å; R127-Q131 WeakPolarHBondContact O-CB 3.1Å; R127-Q131 VanDerWaalsContact O-CG 3.29Å; R127-Q131 WeakPolarHBondContact O-CG 3.41Å; R127-Q131 PolarHBondContact O-N 3.26Å
128H92.8Very high79.7Confident120 Ų120117.2 Ų117.256%0.55657%0.57SS**Hα-helixtrans-65.4-40.2177-175.572.7000112.7A124 K125 L126 Q131 K132A124-H128 WeakPolarHBondContact O-CB 3.5Å; A124-H128 PolarHBondContact O-N 3.06Å; K125-H128 PolarHBondContact O-N 3.01Å; L126-H128 VanDerWaalsContact C-N 3.34Å; L126-H128 PolarHBondContact O-N 3.29Å; H128-Q131 PolarHBondContact O-N 2.87Å; H128-K132 VanDerWaalsContact O-CB 3.27Å; H128-K132 WeakPolarHBondContact O-CB 3.36Å; H128-K132 PolarHBondContact O-N 3.1Å
129H91.3Very high78.5Confident108 Ų108118.3 Ų118.350%0.559%0.586SS.*Hα-helixtrans-63.3-45.2175-176.697.6000111.6K125 L126 K132 R133K125-H129 WeakPolarHBondContact O-CB 3.11Å; K125-H129 PolarHBondContact O-N 3.34Å; L126-H129 PolarHBondContact O-N 3.31Å; H129-K132 PolarHBondContact O-N 2.84Å; H129-R133 WeakPolarHBondContact O-CB 3.32Å; H129-R133 PolarHBondContact O-N 3.01Å
130L88.1Confident76.8Confident100 Ų100119 Ų11952%0.52460%0.603SS.*Hα-helixtrans-64.5-41.3177.3-71.1171.5000111.8L126 R127 R133 S134L126-L130 HydrophobicContact CD1-CD1 4.07Å; L126-L130 HydrophobicContact CD1-CG 4.16Å; L126-L130 HydrophobicContact CG-CD1 3.99Å; L126-L130 HydrophobicContact CG-CG 4.49Å; L126-L130 WeakPolarHBondContact O-CB 3.41Å; L126-L130 VanDerWaalsContact O-CG 3.31Å; L126-L130 WeakPolarHBondContact O-CG 3.46Å; L126-L130 PolarHBondContact O-N 3.29Å; R127-L130 PolarHBondContact O-N 2.92Å; L130-R133 PolarHBondContact O-N 3.22Å; L130-S134 WeakPolarHBondContact O-CA 3.42Å; L130-S134 WeakPolarHBondContact O-CB 3.29Å; L130-S134 PolarHBondContact O-N 2.79Å
131Q83.4Confident74.7Confident132 Ų132118 Ų11862%0.61761%0.611SS**Hα-helixtrans-63.7-44.1173-75.1172.2-20.600112R127 H128 R133 S134 R135R127-Q131 WeakPolarHBondContact O-CB 3.1Å; R127-Q131 VanDerWaalsContact O-CG 3.29Å; R127-Q131 WeakPolarHBondContact O-CG 3.41Å; R127-Q131 PolarHBondContact O-N 3.26Å; H128-Q131 PolarHBondContact O-N 2.87Å; Q131-R133 VanDerWaalsContact C-N 3.34Å; Q131-R133 PolarHBondContact O-N 2.85Å; Q131-S134 PolarHBondContact O-N 3.47Å; Q131-R135 PolarHBondContact O-N 2.84Å; Q131-R135 VanDerWaalsContact O-N 3.09Å
132K78.2Confident72.3Confident146 Ų146115.1 Ų115.164%0.63562%0.618SS**Hα-helixtrans-62.9-39.7177.2-173.6171.7-179.71760111.9H128 H129 N136H128-K132 VanDerWaalsContact O-CB 3.27Å; H128-K132 WeakPolarHBondContact O-CB 3.36Å; H128-K132 PolarHBondContact O-N 3.1Å; H129-K132 PolarHBondContact O-N 2.84Å; K132-N136 PolarHBondContact O-OD1 2.84Å
133R67.9Low70.2Confident179 Ų179121.6 Ų121.668%0.67564%0.64SS**Hα-helixtrans-76.2-31175.7-172.1172.3177.2170-2.5112.9H129 L130 Q131 R135 N136 A137H129-R133 WeakPolarHBondContact O-CB 3.32Å; H129-R133 PolarHBondContact O-N 3.01Å; L130-R133 PolarHBondContact O-N 3.22Å; Q131-R133 VanDerWaalsContact C-N 3.34Å; Q131-R133 PolarHBondContact O-N 2.85Å; R133-R135 VanDerWaalsContact C-N 3.3Å; R133-R135 PolarHBondContact O-N 3.47Å; R133-N136 WeakPolarHBondContact O-CA 3.35Å; R133-N136 WeakPolarHBondContact O-CB 3.33Å; R133-N136 PolarHBondContact O-N 3.03Å; R133-A137 PolarHBondContact O-N 2.97Å
134S63.8Low68Low81 Ų81128.6 Ų128.657%0.56667%0.67SS**Hα-helixtrans-64.3-34173.6168.60000111.8L130 Q131 N136 A137L130-S134 WeakPolarHBondContact O-CA 3.42Å; L130-S134 WeakPolarHBondContact O-CB 3.29Å; L130-S134 PolarHBondContact O-N 2.79Å; Q131-S134 PolarHBondContact O-N 3.47Å; S134-N136 PolarHBondContact O-N 3.17Å; S134-N136 VanDerWaalsContact O-N 3.12Å; S134-A137 WeakPolarHBondContact O-CB 3.41Å; S134-A137 PolarHBondContact O-N 2.94Å
135R60.2Low65.5Low229 Ų229133.2 Ų133.286%0.86469%0.686SS**THydrogen-bonded Turntrans-67.3-5.5170.7-152.5-176.6-179-158.2-1.1114Q131 R133Q131-R135 PolarHBondContact O-N 2.84Å; Q131-R135 VanDerWaalsContact O-N 3.09Å; R133-R135 VanDerWaalsContact C-N 3.3Å; R133-R135 PolarHBondContact O-N 3.47Å
136N54Low62.9Low136 Ų136132 Ų13273%0.72769%0.686SS**THydrogen-bonded Turntrans-108.15.8171.2-7394.9000113K132 R133 S134K132-N136 PolarHBondContact O-OD1 2.84Å; R133-N136 WeakPolarHBondContact O-CA 3.35Å; R133-N136 WeakPolarHBondContact O-CB 3.33Å; R133-N136 PolarHBondContact O-N 3.03Å; S134-N136 PolarHBondContact O-N 3.17Å; S134-N136 VanDerWaalsContact O-N 3.12Å
137A51.9Low60.4Low62 Ų62135.3 Ų135.351%0.51270%0.698SS.*SBendtrans-69.9138.7162.400000108.9R133 S134R133-A137 PolarHBondContact O-N 2.97Å; S134-A137 WeakPolarHBondContact O-CB 3.41Å; S134-A137 PolarHBondContact O-N 2.94Å
138P54.6Low57.6Low110 Ų110130.8 Ų130.871%0.71470%0.704SS**PPolyproline II helixtrans-60.7148.3168.728.3-34000109.2S140P138-S140 PolarHBondContact O-N 3.1Å; P138-S140 VanDerWaalsContact O-N 3.17Å
139P51.8Low54.7Low124 Ų124129.9 Ų129.981%0.80572%0.718SS**PPolyproline II helixtrans-58.7124.6174.225.7-33.1000108.8A141P139-A141 PolarHBondContact O-N 3.02Å; P139-A141 VanDerWaalsContact O-N 3.07Å
140S48.8Very low52.3Low122 Ų122132.6 Ų132.685%0.85374%0.735SS**PPolyproline II helixtrans-57.2116.9171.2-173.30000107.6P138 G142P138-S140 PolarHBondContact O-N 3.1Å; P138-S140 VanDerWaalsContact O-N 3.17Å; S140-G142 PolarHBondContact O-N 2.96Å; S140-G142 VanDerWaalsContact O-N 3.13Å
141A43.7Very low50.4Low90 Ų90133.5 Ų133.574%0.74475%0.746SS**PPolyproline II helixtrans-58.7120.5-17600000109.3P139 Y143P139-A141 PolarHBondContact O-N 3.02Å; P139-A141 VanDerWaalsContact O-N 3.07Å; A141-Y143 PolarHBondContact O-N 3.09Å
142G38.3Very low48.2Very low69 Ų69132.2 Ų132.271%0.71176%0.758SS**PPolyproline II helixtrans-66.3131.217700000110S140 E144S140-G142 PolarHBondContact O-N 2.96Å; S140-G142 VanDerWaalsContact O-N 3.13Å; G142-E144 PolarHBondContact O-N 3.03Å
143Y44.6Very low46.1Very low226 Ų226128.9 Ų128.989%0.88677%0.765SS**  trans-8069.2171.356-83.6000109.8A141A141-Y143 PolarHBondContact O-N 3.09Å
144E43.4Very low44.6Very low189 Ų189129.7 Ų129.788%0.88378%0.777SS**  trans-99.5114.7162.2-82.8-82.9109.600107.7G142G142-E144 PolarHBondContact O-N 3.03Å
145L40.9Very low43.2Very low154 Ų154130.4 Ų130.481%0.80679%0.788SS**  trans-81.8151.9-176.9-173.969.9000110.1
146L39.1Very low42Very low120 Ų120124.6 Ų124.663%0.62879%0.789SS**  trans122.8129.6132.1-149.370.2000117.3
147H39.4Very low41Very low175 Ų175121.7 Ų121.781%0.8179%0.791SS**  trans61.1125.1164.5-58.8-37.1000121.6
148G33.5Very low40.2Very low74 Ų74125.1 Ų125.176%0.76381%0.805SS**  trans144.4120.8132.800000118.8
149A32.1Very low39.4Very low102 Ų102126.2 Ų126.284%0.84381%0.81SS**  trans57.3111.615300000121.1
150L41.7Very low39.3Very low165 Ų165128.9 Ų128.986%0.86481%0.812SS**  trans-81.7146.2148.7-169.375000108.9
151P47Very low38.8Very low118 Ų118129.3 Ų129.377%0.76681%0.81SS**  -141172.4117.936.1-22.1000114.6
152A36.7Very low39.3Very low105 Ų105130.9 Ų130.987%0.86881%0.81SS**  trans-65.4154.5-169.500000116.6
153G33.8Very low39.7Very low76 Ų76133.1 Ų133.178%0.78481%0.812SS**  trans-148.2148.9164.300000109.9
154Q37.9Very low39.7Very low196 Ų196130.2 Ų130.292%0.91681%0.808SS**  trans-109.7167.7-163.5-63.7167.9-74.300114.6
155A33.9Very low40.1Very low97 Ų97129.1 Ų129.180%0.80281%0.805SS**  trans99107.114500000120.7
156A34.8Very low40.4Very low106 Ų106126.8 Ų126.888%0.87680%0.799SS**  56.9101.5125.700000121.9
157G32.8Very low40.9Very low76 Ų76129 Ų12978%0.78481%0.811SS**  113.8176.7104.300000120
158V36.1Very low41.2Very low133 Ų133126.4 Ų126.481%0.80680%0.803SS**  trans76.190.9162.3-167.80000118.4
159T37.8Very low42.2Very low133 Ų133134.7 Ų134.782%0.81681%0.811SS**  trans84.9138132.9-56.10000120.9
160Q48.1Very low42.8Very low180 Ų180136.5 Ų136.584%0.84181%0.806SS**  trans-69.1142.2175.5-55.3164.7-500112.6
161T40.1Very low43.2Very low132 Ų132132.7 Ų132.781%0.8180%0.798SS**  trans-148.5138.8133.539.20000109.4
162V54.3Low43.1Very low122 Ų122133.4 Ų133.474%0.73980%0.803SS**  trans-113.3111.1171.2176.30000108M164V162-M164 HydrophobicContact CG1-CE 4.43Å; V162-M164 PolarHBondContact O-N 3.45Å
163P44.9Very low43.8Very low117 Ų117139 Ų13976%0.7680%0.802SS**PPolyproline II helixtrans-69117.9172.5-18.732.7000110.5
164M44.5Very low44.8Very low164 Ų164144 Ų14481%0.80881%0.809SS**PPolyproline II helixtrans-66.7133.3176.2-69.6-89.987.700111.2V162V162-M164 HydrophobicContact CG1-CE 4.43Å; V162-M164 PolarHBondContact O-N 3.45Å
165M52.2Low45.5Very low167 Ų167145 Ų14582%0.82380%0.804SS**PPolyproline II helixtrans-75.6124.4173.9-65.7164.168.400110.4L167M165-L167 PolarHBondContact O-N 2.93Å
166P46.8Very low46.4Very low104 Ų104152.4 Ų152.468%0.67581%0.812SS**  trans-80.2111.8179.130.8-33.4000111.5N168P166-N168 VanDerWaalsContact C-N 3.28Å; P166-N168 PolarHBondContact O-N 3.17Å
167L50.8Low47.4Very low167 Ų167150.6 Ų150.687%0.87479%0.793SS**  trans-69.576.7175.5-75.891.8000112.4M165 R169M165-L167 PolarHBondContact O-N 2.93Å; L167-R169 VanDerWaalsContact C-N 3.26Å; L167-R169 PolarHBondContact O-N 3.13Å
168N46.1Very low48.6Very low121 Ų121151.9 Ų151.965%0.64779%0.785SS**  trans-8071.5172.5-81.1-69.5000111.7P166 L170P166-N168 VanDerWaalsContact C-N 3.28Å; P166-N168 PolarHBondContact O-N 3.17Å; N168-L170 PolarHBondContact O-N 3.07Å
169R54.1Low50Low248 Ų248151.4 Ų151.494%0.93677%0.774SS**  trans-76.163.4173.2-160.6-177.9-164.6178.15.9111.1L167L167-R169 VanDerWaalsContact C-N 3.26Å; L167-R169 PolarHBondContact O-N 3.13Å
170L45.3Very low51.1Low140 Ų140146.5 Ų146.573%0.73375%0.75SS**  trans-109.9125179.9-70.9172.2000110.5N168N168-L170 PolarHBondContact O-N 3.07Å
171A48.3Very low51.7Low85 Ų85142.7 Ų142.770%0.70274%0.735SS**  trans-59.9136.2-173.100000112.7R173A171-R173 PolarHBondContact O-N 2.76Å
172P46Very low53Low132 Ų132138.9 Ų138.986%0.85771%0.714SS**  trans-59.7103.6175-24.234.7000111.5L174P172-L174 PolarHBondContact O-N 3.05Å
173R51.9Low53.7Low224 Ų224138.5 Ų138.585%0.84571%0.707SS**  trans-73.2110.8173.1-62.9-171.9-173-153.73.2108.3A171 R175A171-R173 PolarHBondContact O-N 2.76Å; R173-R175 WeakPolarHBondContact O-CB 3.4Å; R173-R175 PolarHBondContact O-N 3.07Å
174L53.4Low55Low181 Ų181138.9 Ų138.995%0.94870%0.699SS**  trans-41.891.6-178-168.676.5000113.4P172P172-L174 PolarHBondContact O-N 3.05Å
175R53.4Low56.3Low215 Ų215135.5 Ų135.581%0.81168%0.683SS**  trans-14868-174.9-76.6-161.3167-158.6-3.2113.5R173 S177R173-R175 WeakPolarHBondContact O-CB 3.4Å; R173-R175 PolarHBondContact O-N 3.07Å; R175-S177 VanDerWaalsContact C-N 3.29Å; R175-S177 PolarHBondContact O-N 3.01Å
176R52.2Low57Low253 Ų253132.8 Ų132.896%0.95567%0.669SS**  trans4740.2151.5-61.3-178.4173.9155.6-2.7116.3V178R176-V178 PolarHBondContact O-N 3.32Å
177S56.3Low57.9Low69 Ų69135.6 Ų135.648%0.48367%0.673SS.*  trans-75.2106.216548.80000108.7R175 E179 G180R175-S177 VanDerWaalsContact C-N 3.29Å; R175-S177 PolarHBondContact O-N 3.01Å; S177-E179 VanDerWaalsContact C-OE2 3.23Å; S177-E179 WeakPolarHBondContact CA-OE2 3.43Å; S177-E179 WeakPolarHBondContact CB-OE2 3.27Å; S177-E179 PolarHBondContact O-N 2.74Å; S177-G180 PolarHBondContact O-N 2.96Å; S177-G180 VanDerWaalsContact O-N 3.08Å
178V57.8Low58.4Low103 Ų103132.5 Ų132.562%0.62466%0.661SS**Hα-helixtrans-63.9-23.6170.6-680000111R176 G180 L181 S182R176-V178 PolarHBondContact O-N 3.32Å; V178-G180 PolarHBondContact O-N 3.3Å; V178-L181 PolarHBondContact O-N 2.75Å; V178-S182 PolarHBondContact O-N 2.99Å
179E65.8Low59Low123 Ų123134.3 Ų134.358%0.57566%0.663SS**Hα-helixtrans-69.1-15.6173.3-49.978.3-172.800113.3S177 S182S177-E179 VanDerWaalsContact C-OE2 3.23Å; S177-E179 WeakPolarHBondContact CA-OE2 3.43Å; S177-E179 WeakPolarHBondContact CB-OE2 3.27Å; S177-E179 PolarHBondContact O-N 2.74Å; E179-S182 WeakPolarHBondContact CA-OG 3.21Å; E179-S182 PolarHBondContact O-OG 3.12Å; E179-S182 VanDerWaalsContact O-OG 3.05Å
180G60.9Low59Low30 Ų30128 Ų12831%0.30965%0.651SS.*Hα-helixtrans-81.7-42.2171.200000111.8S177 V178 S182 L183 E184S177-G180 PolarHBondContact O-N 2.96Å; S177-G180 VanDerWaalsContact O-N 3.08Å; V178-G180 PolarHBondContact O-N 3.3Å; G180-S182 VanDerWaalsContact C-N 3.31Å; G180-S182 PolarHBondContact O-N 3.5Å; G180-L183 PolarHBondContact O-N 3Å; G180-E184 PolarHBondContact O-N 3.11Å; G180-E184 VanDerWaalsContact O-N 3.08Å
181L60.4Low59.4Low100 Ų100126 Ų12652%0.52465%0.649SS.*Hα-helixtrans-66.2-31.9178.7-64.6173.8000112.1V178 L183 L185V178-L181 PolarHBondContact O-N 2.75Å; L181-L183 VanDerWaalsContact C-N 3.35Å; L181-L185 VanDerWaalsContact O-CB 3.3Å; L181-L185 WeakPolarHBondContact O-CB 3.31Å; L181-L185 WeakPolarHBondContact O-CD1 3.41Å; L181-L185 WeakPolarHBondContact O-CG 3.47Å; L181-L185 PolarHBondContact O-N 3.14Å
182S67.8Low59.5Low52 Ų52130.4 Ų130.436%0.36466%0.655SS.*Hα-helixtrans-62.6-40.9173.948.80000112.3V178 E179 G180 L185 E186V178-S182 PolarHBondContact O-N 2.99Å; E179-S182 WeakPolarHBondContact CA-OG 3.21Å; E179-S182 PolarHBondContact O-OG 3.12Å; E179-S182 VanDerWaalsContact O-OG 3.05Å; G180-S182 VanDerWaalsContact C-N 3.31Å; G180-S182 PolarHBondContact O-N 3.5Å; S182-L185 PolarHBondContact O-N 3.26Å; S182-E186 WeakPolarHBondContact O-CB 3.44Å; S182-E186 VanDerWaalsContact O-CG 3.26Å; S182-E186 WeakPolarHBondContact O-CG 3.39Å; S182-E186 PolarHBondContact O-N 3.2Å
183L69.6Low59.5Low113 Ų113132.8 Ų132.859%0.59265%0.652SS**Hα-helixtrans-72.2-40.3179.2-64170.4000111.9G180 L181 L185 E186 E187G180-L183 PolarHBondContact O-N 3Å; L181-L183 VanDerWaalsContact C-N 3.35Å; L183-L185 VanDerWaalsContact C-N 3.31Å; L183-L185 PolarHBondContact O-N 2.95Å; L183-E186 PolarHBondContact O-N 3.18Å; L183-E187 PolarHBondContact O-N 2.87Å
184E72.3Confident59.5Low126 Ų126128 Ų12859%0.58965%0.65SS**Hα-helixtrans-63.3-35.9174.5-171.8174.4-166.700111.9G180 V188G180-E184 PolarHBondContact O-N 3.11Å; G180-E184 VanDerWaalsContact O-N 3.08Å; E184-V188 WeakPolarHBondContact O-CG2 3.38Å; E184-V188 PolarHBondContact O-N 3.39Å
185L70.3Confident58.8Low93 Ų93126.1 Ų126.149%0.48764%0.641SS.*Hα-helixtrans-77.1-35.3174.2-68.6169000112.8L181 S182 L183 E187 V188 F189L181-L185 VanDerWaalsContact O-CB 3.3Å; L181-L185 WeakPolarHBondContact O-CB 3.31Å; L181-L185 WeakPolarHBondContact O-CD1 3.41Å; L181-L185 WeakPolarHBondContact O-CG 3.47Å; L181-L185 PolarHBondContact O-N 3.14Å; S182-L185 PolarHBondContact O-N 3.26Å; L183-L185 VanDerWaalsContact C-N 3.31Å; L183-L185 PolarHBondContact O-N 2.95Å; L185-E187 VanDerWaalsContact C-N 3.31Å; L185-E187 PolarHBondContact O-N 2.79Å; L185-V188 PolarHBondContact O-N 3.4Å; L185-F189 HydrophobicContact CB-CD2 4.37Å; L185-F189 HydrophobicContact CB-CE2 4.47Å; L185-F189 HydrophobicContact CD2-CE2 4.21Å; L185-F189 WeakPolarHBondContact O-CD2 3.34Å; L185-F189 PolarHBondContact O-N 3.25Å
186E67.9Low58.6Low109 Ų109122 Ų12251%0.50964%0.635SS.*Hα-helixtrans-60.6-40.1172.3-80.1167-16800111.1S182 L183 V188 F189 V190S182-E186 WeakPolarHBondContact O-CB 3.44Å; S182-E186 VanDerWaalsContact O-CG 3.26Å; S182-E186 WeakPolarHBondContact O-CG 3.39Å; S182-E186 PolarHBondContact O-N 3.2Å; L183-E186 PolarHBondContact O-N 3.18Å; E186-V188 VanDerWaalsContact C-N 3.29Å; E186-V188 PolarHBondContact O-N 2.86Å; E186-F189 PolarHBondContact O-N 2.84Å; E186-V190 WeakPolarHBondContact O-CB 3.47Å; E186-V190 VanDerWaalsContact O-CG2 3.25Å; E186-V190 WeakPolarHBondContact O-CG2 3.44Å; E186-V190 PolarHBondContact O-N 2.88Å
187E64.8Low58.4Low164 Ų164117.3 Ų117.377%0.76662%0.624SS**Hα-helixtrans-64.1-32.3174.6-167.5165.2-151.800112.8L183 L185L183-E187 PolarHBondContact O-N 2.87Å; L185-E187 VanDerWaalsContact C-N 3.31Å; L185-E187 PolarHBondContact O-N 2.79Å
188V61.9Low57.9Low102 Ų102123.2 Ų123.262%0.61864%0.644SS**Hα-helixtrans-74.4-33.4174.5171.70000113E184 L185 E186E184-V188 WeakPolarHBondContact O-CG2 3.38Å; E184-V188 PolarHBondContact O-N 3.39Å; L185-V188 PolarHBondContact O-N 3.4Å; E186-V188 VanDerWaalsContact C-N 3.29Å; E186-V188 PolarHBondContact O-N 2.86Å
189F57.9Low57.3Low159 Ų159126.2 Ų126.270%0.69765%0.651SS**Hα-helixtrans-102.5-11.7-173.7-69.6-61.4000115.6L185 E186L185-F189 HydrophobicContact CB-CD2 4.37Å; L185-F189 HydrophobicContact CB-CE2 4.47Å; L185-F189 HydrophobicContact CD2-CE2 4.21Å; L185-F189 WeakPolarHBondContact O-CD2 3.34Å; L185-F189 PolarHBondContact O-N 3.25Å; E186-F189 PolarHBondContact O-N 2.84Å
190V55.5Low56.6Low114 Ų114128.5 Ų128.569%0.69167%0.665SS**SBendtrans-105.85.9-176.5-175.70000112.7E186 E192E186-V190 WeakPolarHBondContact O-CB 3.47Å; E186-V190 VanDerWaalsContact O-CG2 3.25Å; E186-V190 WeakPolarHBondContact O-CG2 3.44Å; E186-V190 PolarHBondContact O-N 2.88Å; V190-E192 PolarHBondContact O-N 3.43Å
191S53.5Low56.4Low98 Ų98133.3 Ų133.369%0.68568%0.683SS**  trans-79.735.8173-167.80000114.1K193S191-K193 PolarHBondContact O-N 3.46Å
192E50.7Low56.3Low179 Ų179135.8 Ų135.884%0.83670%0.697SS**  trans-89.193.7168.9-171.8171.6-160.100109.8V190V190-E192 PolarHBondContact O-N 3.43Å
193K46.3Very low55.8Low181 Ų181140.4 Ų140.479%0.78772%0.716SS**  trans-104116.2166.8-67.4179.3-175.91730108.6S191 N195S191-K193 PolarHBondContact O-N 3.46Å; K193-N195 VanDerWaalsContact C-N 3.31Å; K193-N195 PolarHBondContact O-N 3.35Å
194P50.5Low55.4Low123 Ų123140.4 Ų140.480%0.79972%0.723SS**  trans-70.395.416129.8-30.9000107.5
195N38.7Very low55.3Low143 Ų143140 Ų14077%0.76573%0.725SS**  trans-109.6114161.2-171103.8000107K193K193-N195 VanDerWaalsContact C-N 3.31Å; K193-N195 PolarHBondContact O-N 3.35Å
196D48.7Very low54.9Low129 Ų129139 Ų13969%0.6974%0.737SS**  trans-63149.9-177.8-64.8-71.6000113.1
197E49.6Very low54.7Low153 Ų153141.8 Ų141.872%0.71575%0.749SS**  trans69144.4154.6-68.2174.2-170.500121.5
198H45.5Very low55.2Low193 Ų193144.6 Ų144.689%0.89475%0.753SS**  trans88.9142.6160.4-53.9-49000121.2
199E44.7Very low55.2Low166 Ų166144 Ų14478%0.77676%0.759SS**  trans60.4100172.5-130.6161.6-148.700118.1L201E199-L201 VanDerWaalsContact C-N 3.32Å; E199-L201 HydrophobicContact CB-CD1 4.12Å; E199-L201 HydrophobicContact CG-CD1 4.36Å; E199-L201 PolarHBondContact O-N 2.87Å
200I51.1Low55.7Low172 Ų172142.2 Ų142.288%0.88276%0.763SS**  trans-65.196.6155.5-60.4168.1000106.3D202I200-D202 PolarHBondContact O-N 3.33Å
201L56.5Low55.9Low131 Ų131143 Ų14369%0.68677%0.768SS**  trans-63.1119.7170.4-99.172.9000108.9E199 I203E199-L201 VanDerWaalsContact C-N 3.32Å; E199-L201 HydrophobicContact CB-CD1 4.12Å; E199-L201 HydrophobicContact CG-CD1 4.36Å; E199-L201 PolarHBondContact O-N 2.87Å; L201-I203 PolarHBondContact O-N 3.46Å
202D59Low56.6Low151 Ų151143.7 Ų143.781%0.80777%0.77SS**  trans-54.6127.5173.8-171.425.4000109.8I200 P204I200-D202 PolarHBondContact O-N 3.33Å; D202-P204 VanDerWaalsContact O-CD 3.25Å; D202-P204 WeakPolarHBondContact O-CD 3.39Å
203I57.5Low56.7Low149 Ų149139.8 Ų139.876%0.76477%0.768SS**  trans-75.3112.6-170-60.2175.2000107.5L201 D205L201-I203 PolarHBondContact O-N 3.46Å; I203-D205 PolarHBondContact O-N 3.09Å
204P61.1Low56.9Low114 Ų114140.1 Ų140.174%0.7477%0.773SS**  trans-66.1122.8-173.626.8-34000110.1D202 G206D202-P204 VanDerWaalsContact O-CD 3.25Å; D202-P204 WeakPolarHBondContact O-CD 3.39Å; P204-G206 PolarHBondContact O-N 3.43Å; P204-G206 VanDerWaalsContact O-N 3.15Å
205D69.2Low56.8Low118 Ų118145.4 Ų145.463%0.63178%0.777SS**  trans-53119.8-179.7177.123.6000111.3I203 H207I203-D205 PolarHBondContact O-N 3.09Å; D205-H207 PolarHBondContact O-N 3.48Å; D205-H207 IonicContact OD1-CD2 3.79Å; D205-H207 PolarHBondContact OD1-CD2 3.47Å; D205-H207 IonicContact OD1-CG 3.45Å; D205-H207 IonicContact OD1-NE2 3.59Å; D205-H207 IonicContact OD2-CD2 3.01Å; D205-H207 IonicContact OD2-CG 3.96Å
206G63.3Low56.9Low71 Ų71144.5 Ų144.573%0.73278%0.78SS**THydrogen-bonded Turntrans-69.95.9-17200000114.8P204P204-G206 PolarHBondContact O-N 3.43Å; P204-G206 VanDerWaalsContact O-N 3.15Å
207H63.9Low56.7Low168 Ų168144.1 Ų144.178%0.77879%0.787SS**THydrogen-bonded Turntrans-88.16.4-174.4-64.6-36.7000115.3D205D205-H207 PolarHBondContact O-N 3.48Å; D205-H207 IonicContact OD1-CD2 3.79Å; D205-H207 PolarHBondContact OD1-CD2 3.47Å; D205-H207 IonicContact OD1-CG 3.45Å; D205-H207 IonicContact OD1-NE2 3.59Å; D205-H207 IonicContact OD2-CD2 3.01Å; D205-H207 IonicContact OD2-CG 3.96Å
208R74.7Confident56.2Low223 Ų223142.7 Ų142.784%0.84279%0.794SS**SBendtrans-118.6115.6163.8-106.1-174.5175.2-155.4-0.9112.5
209A61.6Low55.6Low90 Ų90136.9 Ų136.974%0.74479%0.787SS**PPolyproline II helixtrans-60.8138.5165.700000110.2
210P68.9Low55.2Low121 Ų121133.9 Ų133.979%0.78678%0.784SS**PPolyproline II helixtrans-62.8138.8179.525.4-33.8000111
211V59.9Low54.6Low130 Ų130134 Ų13479%0.78878%0.781SS**PPolyproline II helixtrans-60.3130.2179.4-179.80000109.3A213V211-A213 PolarHBondContact O-N 3.3Å; V211-A213 VanDerWaalsContact O-N 3.14Å
212P66.3Low53.8Low113 Ų113132.1 Ų132.173%0.73478%0.779SS**PPolyproline II helixtrans-57.3120.7178.4-25.834.7000111.4Q214P212-Q214 PolarHBondContact O-N 2.87Å; P212-Q214 VanDerWaalsContact O-N 3.12Å
213A54.4Low52.7Low96 Ų96133.4 Ų133.479%0.79378%0.78SS**PPolyproline II helixtrans-58.1118.6177.800000110.1V211 R215V211-A213 PolarHBondContact O-N 3.3Å; V211-A213 VanDerWaalsContact O-N 3.14Å; A213-R215 PolarHBondContact O-N 3.37Å
214Q50.4Low52.6Low188 Ų188130.9 Ų130.988%0.87977%0.773SS**  trans-60.2113.6178-76.8-173.6-64.500109.7P212 C216P212-Q214 PolarHBondContact O-N 2.87Å; P212-Q214 VanDerWaalsContact O-N 3.12Å; Q214-C216 PolarHBondContact O-N 2.93Å; Q214-C216 VanDerWaalsContact O-N 3.13Å
215R48Very low51.4Low235 Ų235130.5 Ų130.589%0.88777%0.773SS**  trans-70.4106.7166.7-73.3-176.3175.6172.9-0.6108.2A213 S217A213-R215 PolarHBondContact O-N 3.37Å; R215-S217 VanDerWaalsContact C-N 3.27Å; R215-S217 PolarHBondContact O-N 3.4Å
216C40.1Very low50.6Low123 Ų123130.5 Ų130.583%0.83178%0.78SS**  trans-66.585.1170.2-620000110.2Q214 S218Q214-C216 PolarHBondContact O-N 2.93Å; Q214-C216 VanDerWaalsContact O-N 3.13Å; C216-S218 PolarHBondContact O-N 3.45Å
217S44.2Very low49.1Very low121 Ų121133 Ų13385%0.84679%0.786SS**  trans-61.7120.6164.5-64.20000108.8R215R215-S217 VanDerWaalsContact C-N 3.27Å; R215-S217 PolarHBondContact O-N 3.4Å
218S40.5Very low47.9Very low123 Ų123133 Ų13386%0.8679%0.791SS**  trans-127.8131.7180-171.10000110.8C216C216-S218 PolarHBondContact O-N 3.45Å
219G32.1Very low46.6Very low71 Ų71127.8 Ų127.873%0.73279%0.786SS**  trans95.5137.2-17900000114.4
220S36.2Very low45.5Very low103 Ų103128.7 Ų128.772%0.7279%0.787SS**  cis-170.1136-12.7-138.70000111.3
221Q39.8Very low44.4Very low174 Ų174128.7 Ų128.781%0.81379%0.787SS**  trans61.8157.3161.9-54.2-59.4-17.300116.2
222S38.1Very low43.2Very low93 Ų93127 Ų12765%0.6578%0.781SS**  cis-165.3146.9-12.441.40000109
223E36Very low41.7Very low178 Ų178129.1 Ų129.183%0.83279%0.785SS**  trans166.1149.3130.3-93.3-79.381.300110.7
224P56.1Low41Very low95 Ų95129.4 Ų129.462%0.61778%0.782SS**  trans-115.8179.9-175.840.7-30.8000115.4
225S36.2Very low40.8Very low107 Ų107126.1 Ų126.175%0.74878%0.776SS**  trans95.8164.6161-32.30000116.2
226P51.5Low40.3Very low118 Ų118120.6 Ų120.677%0.76677%0.772SS**  -139.1152.7-93.636-16000116.7
227S31.3Very low40.6Very low124 Ų124120 Ų12087%0.86777%0.767SS**  trans-164.3133.3149.828.20000114.6
228L39Very low40.3Very low167 Ų167121.7 Ų121.787%0.87477%0.766SS**  trans-105.9173.7156.7-81.9164.2000107.2
229P47.6Very low39.8Very low113 Ų113122.1 Ų122.173%0.73476%0.759SS**  cis-130.21793.741.8-26.4000115.1
230S39.6Very low39.8Very low110 Ų110123.3 Ų123.377%0.76976%0.756SS**  trans-76.2157.1162.1-44.40000112.3
231P45.2Very low39.6Very low121 Ų121123.5 Ų123.579%0.78676%0.757SS**  -135.8174.1116.242-32000111
232S35.4Very low39.7Very low95 Ų95123.3 Ų123.366%0.66476%0.76SS**  cis-162.3147.223.351.40000113.4
233L35Very low40Very low156 Ų156124.6 Ų124.682%0.81777%0.767SS**  trans51.5102.3141.8-55.7169.8000119.2
234S39.6Very low39.9Very low103 Ų103122.2 Ų122.272%0.7277%0.77SS**  87.3162.777.779.70000114.7
235P45.6Very low38.7Very low118 Ų118121.3 Ų121.377%0.76678%0.778SS**  cis-128.3174.9-6.841.5-26.6000115.3
236C38.3Very low38.5Very low119 Ų119121.9 Ų121.980%0.80478%0.782SS**  trans-99.8166.2165.4-53.90000111.7
237P46.2Very low38.7Very low112 Ų112121.6 Ų121.673%0.72778%0.78SS**  -117.4144111.5-4.525000110.9
238L37.6Very low38.6Very low155 Ų155120.8 Ų120.881%0.81277%0.773SS**  60.5131.776.6-65.1158.4000112.6
239D30.4Very low38.2Very low133 Ų133121.4 Ų121.471%0.71177%0.771SS**  cis-152.217021.5-150.5-14.7000114.4
240S31.7Very low37.5Very low96 Ų96124.1 Ų124.167%0.67178%0.778SS**  trans6.9153.4148.8-65.50000121.7
241S31.4Very low37.2Very low107 Ų107126.6 Ų126.675%0.74878%0.783SS**  cis-174.6159.4-2.846.70000111.1
242L41.3Very low36.5Very low169 Ų169124.7 Ų124.789%0.88578%0.778SS**  trans-74151.8163.3-78.4160.6000111.5
243P44.6Very low36.2Very low121 Ų121125.8 Ų125.879%0.78679%0.785SS**  -146.2176.1111.638.8-24000115.8
244S35.2Very low36.1Very low127 Ų127128.6 Ų128.689%0.88879%0.785SS**  trans-83.8155.8176.2-1780000113
245G29.9Very low35.7Very low76 Ų76130.5 Ų130.578%0.78479%0.786SS**  trans-178.2128.2171.900000115.7
246S33.2Very low35Very low119 Ų119130.2 Ų130.283%0.83279%0.787SS**  trans-161.6170174.2-167.60000107
247P54.1Low35.2Very low113 Ų113130.7 Ų130.773%0.73479%0.789SS**  cis-123.7-179.2-12.241.7-28.4000112.9
248C29.4Very low34.5Very low106 Ų106130.5 Ų130.572%0.71679%0.79SS**  trans170.3164142.163.60000110.8
249H31Very low35.1Very low180 Ų180128.4 Ų128.483%0.83379%0.786SS**  cis-134.4166.2-2.2-96.1-66.3000110.8
250L33.6Very low36.4Very low170 Ų170127.6 Ų127.689%0.8979%0.788SS**  trans-75.3146.5169.6-59.7161.3000111.8
251N31.8Very low37Very low163 Ų163128.5 Ų128.587%0.87279%0.792SS**  -164.4163.9109.3-149.3-8.5000111.7
252A30.7Very low37.3Very low81 Ų81129.2 Ų129.267%0.66980%0.795SS**  trans-133.9142.1-179.400000112.4
253S30.9Very low37.5Very low118 Ų118127.6 Ų127.683%0.82580%0.795SS**  trans175.2159.3153.6-84.70000111.2
254R32.5Very low36.9Very low214 Ų214130.4 Ų130.481%0.80880%0.8SS**  cis179.7131.7-42.4-120.5-174.1158-165.8-6.7108
255L31.1Very low36.8Very low143 Ų143132.4 Ų132.475%0.74980%0.799SS**  trans69.8125.3152.3-53.1167.7000120.9
256S30.7Very low37Very low113 Ų113135.4 Ų135.479%0.7980%0.797SS**  26.4158.5124.5-770000122.9
257P41.3Very low37.8Very low129 Ų129134.6 Ų134.684%0.83879%0.789SS**  cis-136.9-12929.240.8-18.9000116.7
258S32Very low36.9Very low107 Ų107136.9 Ų136.975%0.74879%0.79SS**  trans-134.6-173.2-142.771.10000115.1
259P50.5Low37.8Very low111 Ų111136.7 Ų136.772%0.72179%0.787SS**  trans-95.8-156.2-161.445.3-42.6000113
260P56.8Low38.2Very low116 Ų116133.1 Ų133.175%0.75379%0.789SS**  cis-120.9-127-6.442.6-21.4000111.6
261P44.5Very low38.1Very low116 Ų116134.4 Ų134.475%0.75379%0.791SS**  cis-120.2-170.5945.1-30.8000115.7
262C38Very low38Very low121 Ų121132.9 Ų132.982%0.81879%0.791SS**  trans-117.5160.4167.1-53.80000111.4
263P44.9Very low38.1Very low136 Ų136137.7 Ų137.788%0.88380%0.8SS**  trans-114.4170.1159.237.6-27.8000113.7
264M33.9Very low38.1Very low180 Ų180135.4 Ų135.489%0.88780%0.795SS**  trans-137.3134.8-167.7170.6-149.6-52.200109.2
265L32.6Very low38.2Very low168 Ų168132.6 Ų132.688%0.8880%0.795SS**  trans-176.2150.6150.554100.9000113.1
266D33.5Very low38.2Very low140 Ų140131.2 Ų131.275%0.74980%0.796SS**  trans-133.2159.4169.6-172.731.6000105.8
267P49.8Very low38.2Very low101 Ų101130.9 Ų130.966%0.65679%0.794SS**  -162.8149.296.340.6-19.3000119.5
268E35.3Very low38Very low161 Ų161130.2 Ų130.275%0.75279%0.793SS**  trans65.9173.4131.1-66.1-74.87700121.5
269P48.8Very low38.3Very low102 Ų102130.8 Ų130.866%0.66280%0.797SS**  cis-134.8174.9-47.537.5-22.6000114.2
270A39.5Very low37.6Very low106 Ų106130.5 Ų130.588%0.87680%0.798SS**  trans-157138.7157.300000112.7
271E30.8Very low36.7Very low196 Ų196129.2 Ų129.292%0.91680%0.796SS**  trans-112150.4-171.3-57.7168.1103.100113.7
272C30.2Very low36.2Very low131 Ų131128.5 Ų128.589%0.88579%0.794SS**  trans-163.5134142.2-158.10000112.9
273E31.7Very low36.3Very low182 Ų182130.7 Ų130.785%0.8580%0.797SS**  trans-70.6157-175.2-74.5-71103.500115.6
274G31.7Very low36.2Very low71 Ų71129.2 Ų129.273%0.73279%0.787SS**  trans-160.96.9-173.400000121.5
275L34.8Very low36.6Very low154 Ų154126.6 Ų126.681%0.80679%0.787SS**  trans64.7115.7170.1-58.8172000120.2
276C30.4Very low37Very low114 Ų114127 Ų12777%0.7778%0.782SS**  40.3131.8125.6-590000121.2
277S31.8Very low37.2Very low107 Ų107124.6 Ų124.675%0.74878%0.781SS**  cis-160.3166.90.3-60.70000107.8
278S37.3Very low36.5Very low115 Ų115128.4 Ų128.480%0.80480%0.795SS**  cis-147.1165.419.6-62.70000112
279S37.4Very low36.6Very low118 Ų118129.1 Ų129.183%0.82580%0.798SS**  trans-58.8168.1171-41.70000113.5
280S36.8Very low36Very low106 Ų106128.3 Ų128.374%0.74180%0.801SS**  cis-160.8154.725.456.30000115.6
281A36.1Very low36.3Very low88 Ų88128.5 Ų128.573%0.72779%0.793SS**  trans48.5115.1146.600000119.5
282S34.5Very low37.2Very low101 Ų101127.6 Ų127.671%0.70679%0.793SS**  cis10191.935.873.90000115.4
283L40.4Very low37.9Very low167 Ų167129.8 Ų129.887%0.87479%0.791SS**  trans64.1176.2145-55.1179000117.9
284P43.1Very low38.7Very low106 Ų106129.3 Ų129.369%0.68879%0.788SS**  -120.7-176.4-5435.7-23.6000111.8
285S43Very low39.2Very low124 Ų124132 Ų13287%0.86779%0.793SS**  trans-85.4121.3178.4-176.60000113.2
286F39.3Very low39.5Very low177 Ų177130 Ų13078%0.77679%0.791SS**  trans-163.1155.7143.758.6-89.8000113.1
287A37.5Very low40Very low89 Ų89130.2 Ų130.274%0.73679%0.793SS**  trans55.596.3162.500000120.4
288L37Very low40.6Very low182 Ų182130.5 Ų130.595%0.95380%0.795SS**  -152146.1121.3-123161.3000109.8
289E36.2Very low40.9Very low175 Ų175129.8 Ų129.882%0.81879%0.79SS**  trans-123.8149.1-163.1-168.9-172.8138.100112.1
290A37.4Very low41.6Very low86 Ų86129.6 Ų129.671%0.71179%0.786SS**  trans67.6160.216500000117.6
291P43.8Very low42.7Very low110 Ų110134.6 Ų134.671%0.71479%0.789SS**  cis-108.7159.9-1.439-30.3000114.7Q293P291-Q293 PolarHBondContact O-N 3.37Å
292L51.5Low43.4Very low177 Ų177136.8 Ų136.893%0.92780%0.796SS**  trans-64.6116.7170.9-63.1171.1000110.7
293Q43.3Very low44.2Very low177 Ų177139.8 Ų139.883%0.82780%0.804SS**  trans-98.1110.3166.4-70.3-165.6-14.900110.2P291 P295P291-Q293 PolarHBondContact O-N 3.37Å; Q293-P295 WeakPolarHBondContact O-CD 3.32Å
294Q48.4Very low44.8Very low171 Ų171140.2 Ų140.280%0.79980%0.799SS**  trans-64125.1171.9-64.4171.7-6600110.2C296Q294-C296 PolarHBondContact O-N 3.26Å; Q294-C296 VanDerWaalsContact O-N 3.1Å
295P43.1Very low45.5Very low129 Ų129142.2 Ų142.284%0.83881%0.809SS**  trans-74.199.2162.4-10.528.2000107.9Q293 S297Q293-P295 WeakPolarHBondContact O-CD 3.32Å; P295-S297 PolarHBondContact O-N 3.25Å
296C40.6Very low46Very low111 Ų111144.7 Ų144.775%0.7580%0.801SS**  trans-52.9139.3179.7-59.50000111.5Q294 S298Q294-C296 PolarHBondContact O-N 3.26Å; Q294-C296 VanDerWaalsContact O-N 3.1Å; C296-S298 VanDerWaalsContact C-N 3.34Å; C296-S298 PolarHBondContact O-N 3.19Å
297S41.1Very low46.8Very low119 Ų119141.1 Ų141.183%0.83280%0.797SS**  trans-66.384.4-176.443.70000112.6P295 S299P295-S297 PolarHBondContact O-N 3.25Å; S297-S299 PolarHBondContact O-N 3.27Å
298S45.7Very low47.7Very low112 Ų112144.8 Ų144.878%0.78380%0.797SS**  trans-73.1106.4175.5-160.70000110.3C296C296-S298 VanDerWaalsContact C-N 3.34Å; C296-S298 PolarHBondContact O-N 3.19Å
299S43.3Very low49Very low101 Ų101144.9 Ų144.971%0.70679%0.792SS**PPolyproline II helixtrans-51.7132178.1-58.20000111.6S297 R301S297-S299 PolarHBondContact O-N 3.27Å; S299-R301 PolarHBondContact O-N 3.2Å; S299-R301 VanDerWaalsContact O-N 3.09Å
300P52.4Low50.6Low113 Ų113147.3 Ų147.373%0.73479%0.794SS**PPolyproline II helixtrans-63.5116.5-174.424.7-33.6000110.7
301R60Low52.4Low212 Ų212149.4 Ų149.480%0.880%0.798SS**PPolyproline II helixtrans-60.5141.5172.7-66.9-176.3-179.7-178.10.5109.1S299 N303 K304S299-R301 PolarHBondContact O-N 3.2Å; S299-R301 VanDerWaalsContact O-N 3.09Å; R301-N303 PolarHBondContact O-N 3.08Å; R301-K304 PolarHBondContact O-N 2.9Å
302P48.9Very low54Low134 Ų134148.1 Ų148.187%0.8779%0.79SS**THydrogen-bonded Turntrans-7428.1-162.331.2-39000115.6
303N52.7Low55.3Low163 Ų163144.3 Ų144.387%0.87278%0.775SS**THydrogen-bonded Turntrans-152.135.1174.3-122.1-27.7000113R301R301-N303 PolarHBondContact O-N 3.08Å
304K52.8Low56.9Low177 Ų177145.6 Ų145.677%0.7778%0.781SS**  trans-134.4102.8163.5-72.7-164.1175.5-168.50109.8R301 Y306R301-K304 PolarHBondContact O-N 2.9Å; K304-Y306 PolarHBondContact O-N 3.25Å
305T56.8Low57.9Low148 Ų148141.4 Ų141.491%0.90878%0.784SS**  trans-70.293.1171.230.60000109.9S307T305-S307 PolarHBondContact O-N 3.4Å; T305-S307 VanDerWaalsContact O-N 3.1Å
306Y54.3Low59Low176 Ų176138.9 Ų138.969%0.6977%0.769SS**  trans-68.6104.6166.4-176.7-97.9000108.6K304 F308K304-Y306 PolarHBondContact O-N 3.25Å; Y306-F308 HydrophobicContact CD1-CD1 4.04Å; Y306-F308 AromaticContact CD1-CD2 3.88Å; Y306-F308 HydrophobicContact CD1-CD2 3.88Å; Y306-F308 HydrophobicContact CD1-CE1 4.01Å; Y306-F308 AromaticContact CD1-CE2 3.86Å; Y306-F308 HydrophobicContact CD1-CE2 3.86Å; Y306-F308 AromaticContact CD1-CG 3.98Å; Y306-F308 HydrophobicContact CD1-CG 3.98Å; Y306-F308 AromaticContact CD1-CZ 3.92Å; Y306-F308 HydrophobicContact CD1-CZ 3.92Å; Y306-F308 AromaticContact CE1-CD1 3.75Å; Y306-F308 HydrophobicContact CE1-CD1 3.75Å; Y306-F308 HydrophobicContact CE1-CD2 4.42Å; Y306-F308 AromaticContact CE1-CE1 3.82Å; Y306-F308 HydrophobicContact CE1-CE1 3.82Å; Y306-F308 HydrophobicContact CE1-CE2 4.49Å; Y306-F308 HydrophobicContact CE1-CG 4.07Å; Y306-F308 HydrophobicContact CE1-CZ 4.2Å; Y306-F308 PolarHBondContact O-N 2.96Å
307S56.9Low60.7Low101 Ų101141.5 Ų141.571%0.70677%0.77SS**  trans-70.696.5173.853.50000109.1T305 Q309T305-S307 PolarHBondContact O-N 3.4Å; T305-S307 VanDerWaalsContact O-N 3.1Å; S307-Q309 VanDerWaalsContact C-N 3.34Å; S307-Q309 PolarHBondContact O-N 3.11Å
308F56.3Low61.9Low167 Ų167147 Ų14773%0.73277%0.772SS**  trans-56.998.7167.2-75.2-84.8000108.9Y306 R310Y306-F308 HydrophobicContact CD1-CD1 4.04Å; Y306-F308 AromaticContact CD1-CD2 3.88Å; Y306-F308 HydrophobicContact CD1-CD2 3.88Å; Y306-F308 HydrophobicContact CD1-CE1 4.01Å; Y306-F308 AromaticContact CD1-CE2 3.86Å; Y306-F308 HydrophobicContact CD1-CE2 3.86Å; Y306-F308 AromaticContact CD1-CG 3.98Å; Y306-F308 HydrophobicContact CD1-CG 3.98Å; Y306-F308 AromaticContact CD1-CZ 3.92Å; Y306-F308 HydrophobicContact CD1-CZ 3.92Å; Y306-F308 AromaticContact CE1-CD1 3.75Å; Y306-F308 HydrophobicContact CE1-CD1 3.75Å; Y306-F308 HydrophobicContact CE1-CD2 4.42Å; Y306-F308 AromaticContact CE1-CE1 3.82Å; Y306-F308 HydrophobicContact CE1-CE1 3.82Å; Y306-F308 HydrophobicContact CE1-CE2 4.49Å; Y306-F308 HydrophobicContact CE1-CG 4.07Å; Y306-F308 HydrophobicContact CE1-CZ 4.2Å; Y306-F308 PolarHBondContact O-N 2.96Å; F308-R310 PolarHBondContact O-N 2.81Å
309Q63.4Low62.8Low183 Ų183147.1 Ų147.186%0.85577%0.768SS**  trans-7582.4-179.7-167.9170.773.400108.1S307 V311S307-Q309 VanDerWaalsContact C-N 3.34Å; S307-Q309 PolarHBondContact O-N 3.11Å; Q309-V311 PolarHBondContact O-N 3.02Å
310R70.8Confident63.4Low227 Ų227153.3 Ų153.386%0.85778%0.776SS**  trans-61.8109175.5-70-175.9175.5-171.8-2.9108.3F308 P312F308-R310 PolarHBondContact O-N 2.81Å; R310-P312 WeakPolarHBondContact O-CD 3.49Å
311V73.9Confident63.3Low129 Ų129154.3 Ų154.378%0.78278%0.78SS**PPolyproline II helixtrans-56.2124.4164.6-177.10000106.8Q309Q309-V311 PolarHBondContact O-N 3.02Å
312P77.5Confident62.3Low84 Ų84149.8 Ų149.855%0.54578%0.779SS.*PPolyproline II helixtrans-57.8141.5173.5-23.634.6000109.9R310 C316R310-P312 WeakPolarHBondContact O-CD 3.49Å; P312-C316 HydrophobicContact CB-CB 3.54Å
313P78.1Confident62.3Low96 Ų96152.4 Ų152.462%0.62378%0.78SS**PPolyproline II helixtrans-59.6151.1177.826-33.7000110.9G315 C316P313-G315 PolarHBondContact O-N 3.33Å; P313-C316 VanDerWaalsContact O-CB 3.31Å; P313-C316 WeakPolarHBondContact O-CB 3.48Å; P313-C316 PolarHBondContact O-N 3.11Å
314E78.5Confident62Low205 Ų205153.3 Ų153.396%0.95878%0.779SS**THydrogen-bonded Turntrans-56.6133.9179.2-62.2-169.2146.200110.6
315G68.1Low61.4Low83 Ų83148.8 Ų148.886%0.85677%0.774SS**THydrogen-bonded Turntrans98.5-15.2-168.300000114.9P313 E317P313-G315 PolarHBondContact O-N 3.33Å; G315-E317 VanDerWaalsContact C-N 3.31Å; G315-E317 PolarHBondContact O-N 3.28Å
316C66.6Low60.8Low76 Ų76149.8 Ų149.851%0.51477%0.773SS.*  trans-7482167-76.50000111.2P312 P313P312-C316 HydrophobicContact CB-CB 3.54Å; P313-C316 VanDerWaalsContact O-CB 3.31Å; P313-C316 WeakPolarHBondContact O-CB 3.48Å; P313-C316 PolarHBondContact O-N 3.11Å
317E76.7Confident60.1Low165 Ų165146.5 Ų146.577%0.77178%0.775SS**  trans-58.9141.1170.166.5171.1177.400111.3G315 V319G315-E317 VanDerWaalsContact C-N 3.31Å; G315-E317 PolarHBondContact O-N 3.28Å; E317-V319 VanDerWaalsContact C-N 3.29Å; E317-V319 PolarHBondContact O-N 3.48Å
318R66.4Low59.2Low235 Ų235146.4 Ų146.489%0.88778%0.78SS**  trans-74.688.1171.5-73.1177.860.7-162.2-3.6108.3R320R318-R320 PolarHBondContact O-N 2.87Å
319V63.3Low58.1Low115 Ų115143.9 Ų143.970%0.69778%0.782SS**  trans-46.2116.9169.5178.60000107.9E317 V321E317-V319 VanDerWaalsContact C-N 3.29Å; E317-V319 PolarHBondContact O-N 3.48Å; V319-V321 PolarHBondContact O-N 3.01Å
320R57.4Low57.2Low231 Ų231140.6 Ų140.687%0.87278%0.777SS**  trans-68.998.4177.6-72.8-176.6-74.7-179.6-3.7107.4R318 C322R318-R320 PolarHBondContact O-N 2.87Å; R320-C322 PolarHBondContact O-N 2.94Å
321V49.8Very low56Low134 Ų134136.2 Ų136.281%0.81277%0.771SS**  trans-48.1125.9159.5177.90000106.1V319 E323V319-V321 PolarHBondContact O-N 3.01Å; V321-E323 PolarHBondContact O-N 3.11Å
322C38.4Very low54.5Low116 Ų116138.6 Ų138.678%0.78477%0.773SS**  trans-56.1114.2-177.6-63.30000108.9R320 E324R320-C322 PolarHBondContact O-N 2.94Å; C322-E324 VanDerWaalsContact C-N 3.3Å; C322-E324 PolarHBondContact O-N 2.67Å
323E50.1Low52.9Low190 Ų190141.7 Ų141.789%0.88878%0.78SS**  trans-6796.5168-172.3170.1176.900106V321 A325V321-E323 PolarHBondContact O-N 3.11Å; E323-A325 VanDerWaalsContact C-N 3.31Å; E323-A325 PolarHBondContact O-N 3.03Å
324E45.4Very low51.4Low181 Ų181144.1 Ų144.185%0.84679%0.787SS**  trans-63.896.7179.1-173.7171.5-178.100107.5C322 I326C322-E324 VanDerWaalsContact C-N 3.3Å; C322-E324 PolarHBondContact O-N 2.67Å; E324-I326 PolarHBondContact O-N 2.85Å; E324-I326 VanDerWaalsContact O-N 3.07Å
325A40.1Very low50.2Low82 Ų82142.5 Ų142.568%0.67878%0.784SS**  trans-60.3117-166.500000109.8E323 S327E323-A325 VanDerWaalsContact C-N 3.31Å; E323-A325 PolarHBondContact O-N 3.03Å; A325-S327 PolarHBondContact O-N 3.11Å
326I45Very low49.4Very low170 Ų170146.1 Ų146.187%0.87278%0.779SS**  trans-68.881.6176.1-55.2169.9000107.5E324 A328E324-I326 PolarHBondContact O-N 2.85Å; E324-I326 VanDerWaalsContact O-N 3.07Å; I326-A328 PolarHBondContact O-N 2.96Å
327S39.8Very low48.3Very low106 Ų106148.1 Ų148.174%0.74179%0.791SS**  trans-69.5111.617457.80000108A325 C329A325-S327 PolarHBondContact O-N 3.11Å; S327-C329 PolarHBondContact O-N 3.01Å
328A38.1Very low47Very low99 Ų99145.7 Ų145.782%0.81879%0.792SS**  trans-68.593.4-178.100000110.6I326I326-A328 PolarHBondContact O-N 2.96Å
329C31.5Very low46.3Very low115 Ų115139.9 Ų139.978%0.77779%0.786SS**  trans-95.1113.6161.9-1620000108.3S327S327-C329 PolarHBondContact O-N 3.01Å
330P45.9Very low46.3Very low113 Ų113139.3 Ų139.373%0.73479%0.785SS**  trans-75.8144.3170.332-32.5000110.5
331D45.8Very low46.6Very low136 Ų136131.2 Ų131.273%0.72776%0.759SS**  trans66.895.5171.8-154.121.6000117
332E42.5Very low47.1Very low178 Ų178130.1 Ų130.183%0.83275%0.754SS**  trans-163.1128.8135.7-106-77.865.500109.4L334E332-L334 PolarHBondContact O-N 2.97Å
333Q42.3Very low48.3Very low150 Ų150131.3 Ų131.370%0.70175%0.753SS**  trans-72.2107.6-154.3-65.51603200115.4L335Q333-L335 PolarHBondContact O-N 2.97Å
334L48.7Very low49.3Very low147 Ų147129.9 Ų129.977%0.7774%0.744SS**  trans32.959.1138.5-141.3176000116.6E332 Q336E332-L334 PolarHBondContact O-N 2.97Å; L334-Q336 HydrophobicContact CD2-CG 3.77Å; L334-Q336 PolarHBondContact O-N 2.87Å
335L51.3Low50.3Low170 Ų170124 Ų12489%0.8972%0.72SS**  trans-69.487.2175.8-67.1-179000111.5Q333Q333-L335 PolarHBondContact O-N 2.97Å
336Q52.8Low51.4Low159 Ų159126.9 Ų126.974%0.74372%0.724SS**  trans-60.8128.1170-69-169.2-41.300110.3L334 S338L334-Q336 HydrophobicContact CD2-CG 3.77Å; L334-Q336 PolarHBondContact O-N 2.87Å; Q336-S338 PolarHBondContact O-N 2.77Å
337P42Very low52.4Low118 Ų118127.3 Ų127.377%0.76672%0.72SS**  trans-66.6107.8164.927.9-31.9000108.2C339P337-C339 VanDerWaalsContact C-N 3.33Å; P337-C339 PolarHBondContact O-N 2.9Å
338S49.9Very low53.2Low115 Ų115127 Ų12780%0.80471%0.714SS**  trans-72.784-176.350.90000111.5Q336Q336-S338 PolarHBondContact O-N 2.77Å
339C52Low54.5Low112 Ų112128 Ų12876%0.75771%0.712SS**  trans-51.4126.9170.9-66.50000109.9P337 D341P337-C339 VanDerWaalsContact C-N 3.33Å; P337-C339 PolarHBondContact O-N 2.9Å; C339-D341 PolarHBondContact O-N 3.03Å
340P62.8Low55.6Low103 Ų103130.3 Ų130.367%0.66971%0.711SS**  trans-64.4129.1-179.726-33.7000110.2P342 V345P340-P342 WeakPolarHBondContact O-CD 3.17Å; P340-P342 VanDerWaalsContact O-N 3.13Å; P340-V345 HydrophobicContact CB-CG2 4Å
341D64Low56.4Low61 Ų61129.3 Ų129.333%0.32672%0.721SS.*  trans-52.8115.1179.9172.28.2000110.6C339 N343 K344 V345C339-D341 PolarHBondContact O-N 3.03Å; D341-N343 PolarHBondContact O-N 3.41Å; D341-N343 WeakPolarHBondContact OD1-CB 3.47Å; D341-N343 PolarHBondContact OD1-N 2.83Å; D341-N343 PolarHBondContact OD1-ND2 3.19Å; D341-K344 HydrophobicContact CB-CB 4.32Å; D341-K344 HydrophobicContact CB-CD 4.28Å; D341-K344 HydrophobicContact CB-CG 4.37Å; D341-K344 PolarHBondContact O-N 2.86Å; D341-K344 WeakPolarHBondContact OD2-CD 3.14Å; D341-K344 VanDerWaalsContact OD2-CE 3.28Å; D341-K344 WeakPolarHBondContact OD2-CE 3.34Å; D341-K344 WeakPolarHBondContact OD2-CG 3.05Å; D341-V345 PolarHBondContact O-N 2.28Å
342P60.6Low57.2Low111 Ų111125.9 Ų125.972%0.72172%0.718SS**THydrogen-bonded Turntrans-63-15.9-175.626.1-35000112.9P340 K344P340-P342 WeakPolarHBondContact O-CD 3.17Å; P340-P342 VanDerWaalsContact O-N 3.13Å; P342-K344 VanDerWaalsContact C-N 3.34Å
343N64Low58.1Low142 Ų142121.2 Ų121.276%0.75971%0.705SS**THydrogen-bonded Turntrans-83.7-7.7175.7-51.2-81.3000113.2D341D341-N343 PolarHBondContact O-N 3.41Å; D341-N343 WeakPolarHBondContact OD1-CB 3.47Å; D341-N343 PolarHBondContact OD1-N 2.83Å; D341-N343 PolarHBondContact OD1-ND2 3.19Å
344K70.6Confident59.1Low160 Ų160118.9 Ų118.970%0.69671%0.711SS**THydrogen-bonded Turntrans-112.4-16-179.4-70.3-179.9-174.2-179.80114.3D341 P342 N346D341-K344 HydrophobicContact CB-CB 4.32Å; D341-K344 HydrophobicContact CB-CD 4.28Å; D341-K344 HydrophobicContact CB-CG 4.37Å; D341-K344 PolarHBondContact O-N 2.86Å; D341-K344 WeakPolarHBondContact OD2-CD 3.14Å; D341-K344 VanDerWaalsContact OD2-CE 3.28Å; D341-K344 WeakPolarHBondContact OD2-CE 3.34Å; D341-K344 WeakPolarHBondContact OD2-CG 3.05Å; P342-K344 VanDerWaalsContact C-N 3.34Å; K344-N346 PolarHBondContact O-N 3.17Å
345V67.7Low59.4Low56 Ų56120.9 Ų120.934%0.33971%0.714SS.*  trans-79.886.8178.8-161.70000110.8P340 D341 F347P340-V345 HydrophobicContact CB-CG2 4Å; D341-V345 PolarHBondContact O-N 2.28Å; V345-F347 VanDerWaalsContact C-N 3.31Å; V345-F347 HydrophobicContact CB-CD2 4.22Å; V345-F347 HydrophobicContact CB-CE2 3.79Å; V345-F347 HydrophobicContact CB-CZ 4.35Å; V345-F347 HydrophobicContact CG1-CD1 4.49Å; V345-F347 HydrophobicContact CG1-CD2 3.86Å; V345-F347 HydrophobicContact CG1-CE1 4.1Å; V345-F347 HydrophobicContact CG1-CE2 3.41Å; V345-F347 VanDerWaalsContact CG1-CE2 3.41Å; V345-F347 HydrophobicContact CG1-CG 4.38Å; V345-F347 HydrophobicContact CG1-CZ 3.55Å; V345-F347 WeakPolarHBondContact O-CD2 3.33Å; V345-F347 PolarHBondContact O-N 3.38Å
346N62.7Low59.5Low144 Ų144116.1 Ų116.177%0.7769%0.694SS**  trans-71.884172-81.7-82.6000110.9K344 T348K344-N346 PolarHBondContact O-N 3.17Å; N346-T348 PolarHBondContact O-N 3.05Å
347F65Low59.7Low179 Ų179114.1 Ų114.179%0.78570%0.695SS**  trans-63.4103.1167.8-68.6-81.9000109.6V345 P349V345-F347 VanDerWaalsContact C-N 3.31Å; V345-F347 HydrophobicContact CB-CD2 4.22Å; V345-F347 HydrophobicContact CB-CE2 3.79Å; V345-F347 HydrophobicContact CB-CZ 4.35Å; V345-F347 HydrophobicContact CG1-CD1 4.49Å; V345-F347 HydrophobicContact CG1-CD2 3.86Å; V345-F347 HydrophobicContact CG1-CE1 4.1Å; V345-F347 HydrophobicContact CG1-CE2 3.41Å; V345-F347 VanDerWaalsContact CG1-CE2 3.41Å; V345-F347 HydrophobicContact CG1-CG 4.38Å; V345-F347 HydrophobicContact CG1-CZ 3.55Å; V345-F347 WeakPolarHBondContact O-CD2 3.33Å; V345-F347 PolarHBondContact O-N 3.38Å; F347-P349 WeakPolarHBondContact O-CD 3.45Å
348T57.9Low60.1Low99 Ų99114.1 Ų114.161%0.60769%0.693SS**  trans-88.9104.6166.743.10000108.3N346 H350N346-T348 PolarHBondContact O-N 3.05Å; T348-H350 PolarHBondContact O-N 3.23Å; T348-H350 PolarHBondContact O-ND1 3.02Å; T348-H350 PolarHBondContact OG1-CE1 2.56Å
349P64.1Low60.5Low120 Ų120113.3 Ų113.378%0.77969%0.687SS**  trans-70.296.7178.728.7-34.5000109.4F347 G351F347-P349 WeakPolarHBondContact O-CD 3.45Å; P349-G351 PolarHBondContact O-N 2.98Å; P349-G351 VanDerWaalsContact O-N 3.14Å
350H55.9Low60.7Low163 Ų163114.6 Ų114.676%0.75569%0.686SS**  trans-57.7118.6170.8-55-27.9000108.2T348 G352T348-H350 PolarHBondContact O-N 3.23Å; T348-H350 PolarHBondContact O-ND1 3.02Å; T348-H350 PolarHBondContact OG1-CE1 2.56Å; H350-G352 PolarHBondContact O-N 2.94Å
351G62.7Low60.2Low92 Ų92118 Ų11895%0.94870%0.697SS**SBendtrans-67.492.8-15600000114.9P349P349-G351 PolarHBondContact O-N 2.98Å; P349-G351 VanDerWaalsContact O-N 3.14Å
352G61.5Low59.9Low64 Ų64123.4 Ų123.466%0.6672%0.718SS**  trans-168.7106.7173.600000112.3H350H350-G352 PolarHBondContact O-N 2.94Å
353S62Low59.4Low81 Ų81123.1 Ų123.157%0.56672%0.716SS**  trans-69.7134165.6173.50000109.3F355 C356S353-F355 PolarHBondContact O-N 2.99Å; S353-F355 VanDerWaalsContact O-N 3.08Å; S353-F355 PolarHBondContact OG-N 2.99Å; S353-C356 WeakPolarHBondContact O-CB 3.34Å; S353-C356 PolarHBondContact O-N 2.87Å
354A62.2Low59.1Low100 Ų100124.5 Ų124.583%0.82672%0.722SS**THydrogen-bonded Turntrans-61.2-15173.200000113.4
355F56.4Low58.6Low190 Ų190123.6 Ų123.683%0.83373%0.725SS**THydrogen-bonded Turntrans-109.617.7173.5-59.1-75.2000113S353 P357S353-F355 PolarHBondContact O-N 2.99Å; S353-F355 VanDerWaalsContact O-N 3.08Å; S353-F355 PolarHBondContact OG-N 2.99Å; F355-P357 WeakPolarHBondContact O-CD 3.19Å
356C52.4Low57.8Low70 Ų70125.6 Ų125.647%0.47374%0.739SS.*SBendtrans-69.3116.4162.2-166.30000107.7S353 V358S353-C356 WeakPolarHBondContact O-CB 3.34Å; S353-C356 PolarHBondContact O-N 2.87Å; C356-V358 PolarHBondContact O-N 3.17Å; C356-V358 VanDerWaalsContact O-N 3.14Å
357P57Low57.4Low116 Ų116122 Ų12275%0.75373%0.725SS**  trans-61.3122.1173.226.8-32.8000107.4F355 S359F355-P357 WeakPolarHBondContact O-CD 3.19Å; P357-S359 PolarHBondContact O-N 2.91Å
358V50.1Low57Low118 Ų118118.6 Ų118.672%0.71571%0.713SS**  trans-42.4114.5-164.3-175.80000110.9C356 L360C356-V358 PolarHBondContact O-N 3.17Å; C356-V358 VanDerWaalsContact O-N 3.14Å; V358-L360 HydrophobicContact CB-CD2 4.41Å; V358-L360 HydrophobicContact CG1-CD2 4.02Å; V358-L360 PolarHBondContact O-N 3.09Å
359S59.6Low57Low99 Ų99119.3 Ų119.369%0.69271%0.713SS**  trans-69.579.7172.439.70000108.5P357 L361P357-S359 PolarHBondContact O-N 2.91Å; S359-L361 PolarHBondContact O-N 2.86Å
360L56Low56.6Low139 Ų139119.2 Ų119.273%0.72871%0.705SS**  trans-50.5107-174.7-68.2175.8000109.7V358 K362V358-L360 HydrophobicContact CB-CD2 4.41Å; V358-L360 HydrophobicContact CG1-CD2 4.02Å; V358-L360 PolarHBondContact O-N 3.09Å; L360-K362 PolarHBondContact O-N 3.04Å
361L53Low56.7Low173 Ų173116.9 Ų116.991%0.90670%0.697SS**  trans-60.7100.2175.4-79.2168000108.3S359S359-L361 PolarHBondContact O-N 2.86Å
362K57.3Low56.3Low176 Ų176119.5 Ų119.577%0.76568%0.683SS**  trans37.5103.1173.5-91.7169.7171.6169.10114.3L360 L364L360-K362 PolarHBondContact O-N 3.04Å; K362-L364 PolarHBondContact O-N 2.86Å
363P49.5Very low55.9Low105 Ų105126.4 Ų126.468%0.68269%0.689SS**  trans-56.5110.317125.1-33.5000109.5L365P363-L365 HydrophobicContact CB-CD1 4.4Å; P363-L365 HydrophobicContact CB-CG 4.29Å; P363-L365 PolarHBondContact O-N 3.32Å
364L57.7Low55.4Low170 Ų170125.6 Ų125.689%0.8969%0.694SS**  trans-75.553.3174.7-70174.5000110.1K362K362-L364 PolarHBondContact O-N 2.86Å
365L59.6Low54.9Low142 Ų142127.5 Ų127.574%0.74369%0.69SS**PPolyproline II helixtrans-75.4123.1164-65.6173000107P363 S367P363-L365 HydrophobicContact CB-CD1 4.4Å; P363-L365 HydrophobicContact CB-CG 4.29Å; P363-L365 PolarHBondContact O-N 3.32Å; L365-S367 PolarHBondContact O-N 3.37Å
366P51.7Low54.5Low98 Ų98123 Ų12364%0.63668%0.682SS**PPolyproline II helixtrans-60.1133.7166.526.4-32.2000108.4L370P366-L370 HydrophobicContact CB-CD1 3.74Å
367S53.8Low54.3Low69 Ų69126.1 Ų126.148%0.48370%0.698SS.*PPolyproline II helixtrans-59.9151.4179.6-169.30000111.1L365 D369 L370L365-S367 PolarHBondContact O-N 3.37Å; S367-D369 WeakPolarHBondContact CB-OD2 3.33Å; S367-D369 PolarHBondContact O-N 2.89Å; S367-D369 PolarHBondContact OG-OD2 3.14Å; S367-L370 PolarHBondContact O-N 3.3Å
368M56.9Low53.8Low107 Ų107125.7 Ų125.753%0.52770%0.698SS.*THydrogen-bonded Turntrans-55.2-21.8177.8-89.8-14372.500113.6L370 L371 F372M368-L370 PolarHBondContact O-N 3.36Å; M368-L370 VanDerWaalsContact O-N 3.17Å; M368-L371 HydrophobicContact CE-CD1 4.11Å; M368-L371 HydrophobicContact CG-CD1 4.46Å; M368-L371 WeakPolarHBondContact O-CB 3.36Å; M368-L371 PolarHBondContact O-N 2.96Å; M368-F372 HydrophobicContact CB-CE2 4.35Å; M368-F372 HydrophobicContact CE-CD2 4.3Å; M368-F372 HydrophobicContact CE-CE2 3.51Å; M368-F372 HydrophobicContact CE-CZ 3.72Å; M368-F372 WeakPolarHBondContact O-CD2 3.28Å; M368-F372 PolarHBondContact O-N 3.02Å; M368-F372 HydrophobicContact SD-CE2 4.34Å
369D56.9Low53.6Low113 Ų113125.6 Ų125.660%0.60470%0.7SS**Hα-helixtrans-54.5-30.8174.8-48.8-63.3000113.2S367 R373S367-D369 WeakPolarHBondContact CB-OD2 3.33Å; S367-D369 PolarHBondContact O-N 2.89Å; S367-D369 PolarHBondContact OG-OD2 3.14Å; D369-R373 PolarHBondContact O-N 2.82Å
370L57Low52.9Low118 Ų118127.6 Ų127.662%0.61871%0.708SS**Hα-helixtrans-72.3-31.7174.9-89.8159.8000112.9P366 S367 M368 G374P366-L370 HydrophobicContact CB-CD1 3.74Å; S367-L370 PolarHBondContact O-N 3.3Å; M368-L370 PolarHBondContact O-N 3.36Å; M368-L370 VanDerWaalsContact O-N 3.17Å; L370-G374 PolarHBondContact O-N 2.9Å
371L56.5Low52.4Low114 Ų114127.6 Ų127.660%0.59771%0.714SS**Hα-helixtrans-73.3-39.2178.6-61.8175.9000111.3M368 G374M368-L371 HydrophobicContact CE-CD1 4.11Å; M368-L371 HydrophobicContact CG-CD1 4.46Å; M368-L371 WeakPolarHBondContact O-CB 3.36Å; M368-L371 PolarHBondContact O-N 2.96Å; L371-G374 PolarHBondContact O-N 3.45Å
372F54.4Low51.5Low147 Ų147122.6 Ų122.665%0.64570%0.703SS**Hα-helixtrans-70.2-33.6176.2-69.6-65.3000113.1M368 G374 L375M368-F372 HydrophobicContact CB-CE2 4.35Å; M368-F372 HydrophobicContact CE-CD2 4.3Å; M368-F372 HydrophobicContact CE-CE2 3.51Å; M368-F372 HydrophobicContact CE-CZ 3.72Å; M368-F372 WeakPolarHBondContact O-CD2 3.28Å; M368-F372 PolarHBondContact O-N 3.02Å; M368-F372 HydrophobicContact SD-CE2 4.34Å; F372-G374 VanDerWaalsContact C-N 3.26Å; F372-G374 PolarHBondContact O-N 3.02Å; F372-L375 PolarHBondContact O-N 2.91Å
373R54.3Low50.6Low209 Ų209120.4 Ų120.479%0.78971%0.709SS**Hα-helixtrans-71.8-17.9175.9-167.8171.2-70-109.71.7113.4D369D369-R373 PolarHBondContact O-N 2.82Å
374G50.5Low50.3Low65 Ų65121 Ų12167%0.6772%0.715SS**THydrogen-bonded Turntrans-81.3-8.1176.300000115.6L370 L371 F372L370-G374 PolarHBondContact O-N 2.9Å; L371-G374 PolarHBondContact O-N 3.45Å; F372-G374 VanDerWaalsContact C-N 3.26Å; F372-G374 PolarHBondContact O-N 3.02Å
375L52.8Low49.4Very low140 Ų140116.4 Ų116.473%0.73371%0.709SS**  trans-113.910.2-171.8-63.9177.4000114.4F372 V377F372-L375 PolarHBondContact O-N 2.91Å; L375-V377 PolarHBondContact O-N 3.41Å
376S47.6Very low48.5Very low96 Ų96119 Ų11967%0.67172%0.718SS**  trans-73.687.2172.859.30000111S378S376-S378 PolarHBondContact O-N 3.01Å
377V48.1Very low47.8Very low135 Ų135118.3 Ų118.382%0.81872%0.72SS**  trans-58.8114.7171.1178.20000109.3L375L375-V377 PolarHBondContact O-N 3.41Å
378S46.3Very low47.3Very low107 Ų107120.5 Ų120.575%0.74874%0.736SS**  trans-68.3130.4166.4-77.30000109.7S376S376-S378 PolarHBondContact O-N 3.01Å
379P45.8Very low47.4Very low116 Ų116121.2 Ų121.275%0.75375%0.748SS**  trans-68.4146.2176.729.3-34.6000111
380V45.9Very low46.7Very low141 Ų141122.9 Ų122.986%0.85576%0.762SS**  trans-86112.4-17854.10000112.2
381T44.4Very low46.2Very low139 Ų139128.2 Ų128.285%0.85377%0.774SS**  trans-146.7141.7159.452.10000108.6
382G35.2Very low45.4Very low67 Ų67131.3 Ų131.369%0.69179%0.785SS**  cis164.3109.1-1300000111.5
383C38.3Very low45Very low130 Ų130132 Ų13288%0.87880%0.795SS**  trans61.8166.6177.1-69.60000116.3
384S43.6Very low44.4Very low117 Ų117124.7 Ų124.782%0.81879%0.785SS**  cis-165.6158.4-36.7570000109.4
385G37.3Very low44.1Very low74 Ų74130.2 Ų130.276%0.76380%0.795SS**  trans109.9139.3157.200000118.3
386Q42.3Very low43.4Very low198 Ų198136.4 Ų136.493%0.92582%0.821SS**  trans-14.9154.6160.7-43.8-179.915.600118.2
387A36.5Very low43.2Very low83 Ų83138.4 Ų138.469%0.68683%0.828SS**  cis-158.6153.628.900000115.3
388S43.5Very low43Very low115 Ų115138.6 Ų138.680%0.80483%0.829SS**  trans41.3146.4140.8-57.60000123.6
389P57.3Low42.8Very low121 Ų121140.3 Ų140.379%0.78683%0.833SS**  trans-91.5159.8-17437.7-37.1000114.5
390T42.1Very low42.6Very low148 Ų148141.8 Ų141.891%0.90884%0.838SS**  trans-146.6152.8159.8-68.10000110.8
391R47.6Very low42.4Very low231 Ų231141.8 Ų141.887%0.87284%0.837SS**  trans-81.8153.4-172.8-52.6164.1174.6139.3-4.8111.8
392H39.3Very low42.3Very low178 Ų178142 Ų14282%0.82484%0.836SS**  -162.6162.4102.2-146.4-102.1000113
393L45.6Very low42.8Very low161 Ų161147.4 Ų147.484%0.84385%0.846SS**  trans-137.3134174.1-171.993000108.1
394G41.8Very low43.1Very low57 Ų57148.7 Ų148.759%0.58884%0.843SS**  trans134.9119.5-173.800000109.4
395M43.9Very low43.1Very low180 Ų180151.3 Ų151.389%0.88785%0.846SS**  cis73.674.441.1-49.1-69.394.400113.5
396Q39.7Very low43.6Very low270 Ų270158.4 Ų158.4100%1.26285%0.853SS**  -1610109.7-173.114379.200110.1

Retrieved 396 of 396 residues in 52.6 ms (Link to these results)