A0A5K4EZZ0_SCHMA Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A5K4EZZ0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 368 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M30.1Very low29.2Very low238 Ų238167.3 Ų167.3100%1.17288%0.878SS**  0119.10-77.1178.3173.700107.6
2T30.6Very low29.2Very low135 Ų135165.3 Ų165.383%0.82887%0.868SS**  trans-74.4123.6-175.739.30000110.7N4T2-N4 PolarHBondContact O-N 3.09Å; T2-N4 VanDerWaalsContact O-N 3.16Å
3F30.9Very low29.3Very low206 Ų206163.2 Ų163.290%0.90486%0.858SS**  trans-76.191.5173.7-83.7-90.8000110
4N28.2Very low29.3Very low138 Ų138162.5 Ų162.574%0.73886%0.855SS**  trans-118.4144.4159-76.7-17.5000107.3T2T2-N4 PolarHBondContact O-N 3.09Å; T2-N4 VanDerWaalsContact O-N 3.16Å
5N28.4Very low29.3Very low157 Ų157163.2 Ų163.284%0.8485%0.852SS**  trans107.771.6174.7-52.3-10.9000114.7
6T33.1Very low29.2Very low148 Ų148163.1 Ų163.191%0.90885%0.853SS**  trans-136.453.4148.834.70000109.6
7E28.9Very low29.3Very low182 Ų182162.3 Ų162.385%0.8585%0.848SS**  trans-109.984.2158.6-72.9-173173.800106.7
8H29.5Very low29.4Very low187 Ų187161.8 Ų161.887%0.86685%0.845SS**  trans-172.856.3162.8-97.3-60.8000110.5
9L28.4Very low29.3Very low175 Ų175158.3 Ų158.392%0.91684%0.836SS**  trans-140.350.8159-71.8177.9000109.1
10N25.3Very low29.4Very low168 Ų168158.3 Ų158.390%0.89883%0.834SS**  trans-118.783.1166.3-78.8-21.1000107
11S28.2Very low29.3Very low106 Ų106156.6 Ų156.674%0.74183%0.826SS**  trans169.786.9162167.70000109.7
12L29.4Very low29.3Very low143 Ų143155.1 Ų155.175%0.74981%0.813SS**SBend-175.2101.3125.7-129.175.2000108.4D14L12-D14 PolarHBondContact O-N 2.73Å
13D30.2Very low29.1Very low138 Ų138155.7 Ų155.774%0.73881%0.81SS**  trans48.462.4139.9-56.3-25000119.2Q15D13-Q15 PolarHBondContact O-N 2.74Å
14D28.6Very low29.1Very low154 Ų154150.7 Ų150.782%0.82480%0.799SS**  trans-74.465.2153.1-75.9-34.7000110.1L12L12-D14 PolarHBondContact O-N 2.73Å
15Q29.3Very low29.3Very low173 Ų173151.4 Ų151.481%0.80880%0.801SS**  trans-94.712.2170.5-97.4-168.99.500114D13 I17D13-Q15 PolarHBondContact O-N 2.74Å; Q15-I17 PolarHBondContact O-N 3.23Å
16D28.2Very low29.2Very low162 Ų162152 Ų15287%0.86680%0.798SS**  trans-90.846.6169.1-75-18.6000111.8L18D16-L18 PolarHBondContact O-N 3Å
17I30.6Very low29.2Very low149 Ų149151.7 Ų151.776%0.76479%0.791SS**  trans-76.284.4166.9-58.1178.4000107.5Q15 S19Q15-I17 PolarHBondContact O-N 3.23Å; I17-S19 PolarHBondContact O-N 3.37Å
18L30.8Very low29.3Very low153 Ų153154 Ų15480%0.80179%0.792SS**  trans15.281.5149.1-74156.9000113.1D16 I20D16-L18 PolarHBondContact O-N 3Å; L18-I20 VanDerWaalsContact C-N 3.32Å; L18-I20 PolarHBondContact O-N 3.03Å
19S28.3Very low29.5Very low95 Ų95153.2 Ų153.266%0.66479%0.786SS**  trans-56.2102.3158.845.70000106.9I17 N21I17-S19 PolarHBondContact O-N 3.37Å; S19-N21 PolarHBondContact O-N 2.94Å
20I31.1Very low29.3Very low158 Ų158154.1 Ų154.181%0.8179%0.786SS**  trans-64.991.3170.6-60.7173.2000105.2L18 K22L18-I20 VanDerWaalsContact C-N 3.32Å; L18-I20 PolarHBondContact O-N 3.03Å; I20-K22 PolarHBondContact O-N 2.83Å
21N28.1Very low29.5Very low124 Ų124155.1 Ų155.166%0.66378%0.778SS**  trans-51.6114.7171.2-79.4-31.5000106.9S19 L23S19-N21 PolarHBondContact O-N 2.94Å; N21-L23 PolarHBondContact O-N 2.8Å
22K28.4Very low29.3Very low206 Ų206159.5 Ų159.590%0.89679%0.787SS**  trans-59.981.5167.2-73.2177.1178.3175.30107.3I20 P24I20-K22 PolarHBondContact O-N 2.83Å; K22-P24 WeakPolarHBondContact O-CD 3.35Å
23L27Very low29.4Very low147 Ų147161.2 Ų161.277%0.7779%0.788SS**  trans-66120.4169.5-84.9162.4000106.8N21 I25N21-L23 PolarHBondContact O-N 2.8Å; L23-I25 PolarHBondContact O-N 3.05Å; L23-I25 VanDerWaalsContact O-N 3.17Å
24P30.8Very low29.2Very low102 Ų102161.7 Ų161.766%0.66279%0.791SS**  trans-65.4118177.325.4-29.6000108.1K22 H26K22-P24 WeakPolarHBondContact O-CD 3.35Å; P24-H26 PolarHBondContact O-N 2.95Å; P24-H26 VanDerWaalsContact O-N 3.09Å
25I33.5Very low29.1Very low153 Ų153159.7 Ų159.779%0.78579%0.787SS**  trans-66.3108.5172.8-62.2170.1000106L23 D27L23-I25 PolarHBondContact O-N 3.05Å; L23-I25 VanDerWaalsContact O-N 3.17Å; I25-D27 PolarHBondContact O-N 3.03Å
26H26.3Very low28.9Very low169 Ų169156.9 Ų156.978%0.78279%0.785SS**  trans-64102.5167.8-80.5-79.8000108.2P24 R28P24-H26 PolarHBondContact O-N 2.95Å; P24-H26 VanDerWaalsContact O-N 3.09Å; H26-R28 PolarHBondContact O-N 3.17Å
27D32.8Very low28.8Very low141 Ų141156.6 Ų156.675%0.75478%0.783SS**  trans-59.699.7166.2-92.8-26.3000108.5I25 F29I25-D27 PolarHBondContact O-N 3.03Å; D27-F29 PolarHBondContact O-N 3.01Å
28R30.5Very low28.6Very low232 Ų232156.5 Ų156.588%0.87578%0.783SS**  trans-77.331.1176.7-102.6-171.2-163.5-174.15.2113.3H26H26-R28 PolarHBondContact O-N 3.17Å
29F33.2Very low28.3Very low170 Ų170154.4 Ų154.475%0.74678%0.782SS**  trans-12580.8172.7-65.2-72.8000108.1D27 Y31D27-F29 PolarHBondContact O-N 3.01Å; F29-Y31 PolarHBondContact O-N 2.86Å
30E25.4Very low28.3Very low194 Ų194156.8 Ų156.891%0.90779%0.786SS**  trans-61.683.5158.8-72.3-174.5169.300107.8
31Y28.8Very low28.1Very low188 Ų188158.3 Ų158.374%0.73779%0.787SS**  trans-86.4102.4160.3-112.1-88.4000106.3F29 K33F29-Y31 PolarHBondContact O-N 2.86Å; Y31-K33 VanDerWaalsContact C-N 3.27Å; Y31-K33 PolarHBondContact O-N 2.9Å
32E24.9Very low28.3Very low198 Ų198160.6 Ų160.693%0.92580%0.798SS**  trans-55.294.4161.1-78-171.8146.400108.5
33K30.2Very low28.2Very low179 Ų179159.5 Ų159.578%0.77879%0.793SS**  trans-110.6104.9165.3-91.3-177.3176.4175.30107.8Y31Y31-K33 VanDerWaalsContact C-N 3.27Å; Y31-K33 PolarHBondContact O-N 2.9Å
34N26.3Very low28.3Very low149 Ų149161.3 Ų161.380%0.79780%0.795SS**  trans-35.1130.5168.7-92.4-39.3000112.1C36N34-C36 PolarHBondContact O-N 2.8Å
35P27.3Very low28.3Very low112 Ų112162.8 Ų162.873%0.72780%0.797SS**  trans-78.287.6-175.332.6-33.3000109.7N37P35-N37 VanDerWaalsContact C-N 3.31Å; P35-N37 PolarHBondContact O-N 3.3Å
36C25.4Very low28.1Very low114 Ų114161.7 Ų161.777%0.7779%0.793SS**  trans-73.594.2160.6-75.30000108.2N34 L38N34-C36 PolarHBondContact O-N 2.8Å; C36-L38 PolarHBondContact O-N 2.93Å
37N24.5Very low28.4Very low155 Ų155162.3 Ų162.383%0.82979%0.794SS**  trans-46.9100.1167.5-85-42.5000111.2P35P35-N37 VanDerWaalsContact C-N 3.31Å; P35-N37 PolarHBondContact O-N 3.3Å
38L27.9Very low28.2Very low147 Ų147162.9 Ų162.977%0.7780%0.797SS**  trans-126.179.8161.8-81.4166.4000108.5C36 L40C36-L38 PolarHBondContact O-N 2.93Å; L38-L40 VanDerWaalsContact C-N 3.32Å; L38-L40 PolarHBondContact O-N 2.98Å
39S24Very low28.2Very low110 Ų110162.7 Ų162.777%0.76980%0.796SS**  trans-64.889.9164.3179.60000109
40L28.5Very low27.9Very low144 Ų144162.8 Ų162.875%0.75480%0.799SS**  trans-111.895.4167.7-97.3154.1000108.3L38 L42L38-L40 VanDerWaalsContact C-N 3.32Å; L38-L40 PolarHBondContact O-N 2.98Å; L40-L42 PolarHBondContact O-N 2.9Å
41K27.3Very low28.2Very low190 Ų190160.6 Ų160.683%0.82679%0.792SS**  trans-50.396.6171.7-71.2174.4175.51750110.2K43K41-K43 PolarHBondContact O-N 2.76Å
42L31Very low28.3Very low173 Ų173160.4 Ų160.491%0.90680%0.795SS**  trans-69.295.6167.5-101.6143.4000108.6L40 K44L40-L42 PolarHBondContact O-N 2.9Å; L42-K44 PolarHBondContact O-N 2.77Å
43K27.7Very low28.6Very low182 Ų182155.8 Ų155.879%0.79179%0.785SS**  trans-59.4120.5168.2-89.4178.4172.3177.60108.9K41 N45K41-K43 PolarHBondContact O-N 2.76Å; K43-N45 PolarHBondContact O-N 3.28Å
44K28.8Very low28.7Very low186 Ų186154.7 Ų154.781%0.80979%0.786SS**  trans-55.3101.4168.6-77.5175.3172.1176.10110L42 N46L42-K44 PolarHBondContact O-N 2.77Å; K44-N46 PolarHBondContact O-N 3.07Å
45N31.2Very low28.9Very low132 Ų132153 Ų15371%0.70679%0.785SS**  trans-90.593.9163-78.3-5.9000108.2K43 F47K43-N45 PolarHBondContact O-N 3.28Å; N45-F47 HydrophobicContact CB-CD2 4.26Å; N45-F47 HydrophobicContact CB-CE2 4.2Å; N45-F47 PolarHBondContact O-N 2.96Å; N45-F47 VanDerWaalsContact O-N 3.1Å
46N28.7Very low29.1Very low130 Ų130152 Ų15270%0.69578%0.781SS**  trans-68.293.8169.8-72.5-21.9000109.3K44 N48K44-N46 PolarHBondContact O-N 3.07Å; N46-N48 PolarHBondContact O-N 2.99Å
47F32.9Very low29.3Very low183 Ų183154.9 Ų154.980%0.80379%0.789SS**  trans-96.870.7162.9-78.3-75000109.5N45 R49N45-F47 HydrophobicContact CB-CD2 4.26Å; N45-F47 HydrophobicContact CB-CE2 4.2Å; N45-F47 PolarHBondContact O-N 2.96Å; N45-F47 VanDerWaalsContact O-N 3.1Å; F47-R49 VanDerWaalsContact C-N 3.32Å; F47-R49 PolarHBondContact O-N 2.91Å; F47-R49 VanDerWaalsContact O-N 3.14Å
48N27.9Very low29.6Very low153 Ų153152.3 Ų152.382%0.81878%0.779SS**  trans-78.387162.9-74.2-12.3000107.7N46N46-N48 PolarHBondContact O-N 2.99Å
49R30.3Very low29.6Very low228 Ų228151.6 Ų151.686%0.8679%0.785SS**  trans-105.494.6166.7-147.1175.9-172.7179.91.4107.6F47 I51F47-R49 VanDerWaalsContact C-N 3.32Å; F47-R49 PolarHBondContact O-N 2.91Å; F47-R49 VanDerWaalsContact O-N 3.14Å; R49-I51 PolarHBondContact O-N 3.08Å
50E27.7Very low29.9Very low172 Ų172152 Ų15280%0.80478%0.782SS**  trans-59102.9173.1-71.6178.4166.300109.4K52E50-K52 PolarHBondContact O-N 2.87Å
51I31.1Very low29.8Very low148 Ų148153.2 Ų153.276%0.75979%0.789SS**  trans-77.9101167-60.8173.9000105.9R49 S53R49-I51 PolarHBondContact O-N 3.08Å; I51-S53 PolarHBondContact O-N 2.9Å
52K30Very low29.9Very low183 Ų183149.2 Ų149.280%0.79679%0.785SS**  trans-66.683.7164.4-73.6-178178.8178.20108.1E50 I54E50-K52 PolarHBondContact O-N 2.87Å; K52-I54 PolarHBondContact O-N 2.82Å
53S32.5Very low29.8Very low102 Ų102146.6 Ų146.671%0.71378%0.781SS**  trans-72.396173520000108.8I51 S55I51-S53 PolarHBondContact O-N 2.9Å; S53-S55 PolarHBondContact O-N 3.16Å
54I31.4Very low29.9Very low155 Ų155145.9 Ų145.980%0.79578%0.784SS**  trans-66.5124.7160.5-64.5169.8000106K52 S56K52-I54 PolarHBondContact O-N 2.82Å; I54-S56 PolarHBondContact O-N 3.11Å
55S31.2Very low30.1Very low113 Ų113142.2 Ų142.279%0.7978%0.782SS**  trans-59.9101.9-176.355.90000111.1S53S53-S55 PolarHBondContact O-N 3.16Å
56S30.9Very low30.2Very low92 Ų92145.9 Ų145.964%0.64379%0.792SS**  trans-127.3122153.857.60000107.1I54 V58I54-S56 PolarHBondContact O-N 3.11Å; S56-V58 PolarHBondContact O-N 3.29Å
57D29.7Very low30.2Very low174 Ų174148.7 Ų148.793%0.9380%0.8SS**  trans-72.443.6-176-73.3-33.6000112.5
58V31.2Very low30.1Very low101 Ų101149.1 Ų149.161%0.61280%0.802SS**  trans-124.693.4-179.7-171.20000107.7S56 T60S56-V58 PolarHBondContact O-N 3.29Å; V58-T60 VanDerWaalsContact C-N 3.34Å; V58-T60 HydrophobicContact CG1-CG2 4.27Å; V58-T60 PolarHBondContact O-N 2.83Å
59C28Very low30.2Very low133 Ų133148.7 Ų148.790%0.89980%0.798SS**  trans-68.192.4168.8-73.90000109L61C59-L61 PolarHBondContact O-N 3.05Å
60T29.4Very low30.1Very low117 Ų117143.4 Ų143.472%0.71879%0.792SS**  trans-78.3109.8166.335.20000109V58 S62V58-T60 VanDerWaalsContact C-N 3.34Å; V58-T60 HydrophobicContact CG1-CG2 4.27Å; V58-T60 PolarHBondContact O-N 2.83Å; T60-S62 PolarHBondContact O-N 3.04Å; T60-S62 VanDerWaalsContact O-N 3.08Å
61L27.5Very low30.3Very low171 Ų171143.9 Ų143.990%0.89579%0.791SS**  trans-72.594.7167.3-75.2163.5000108C59 S63C59-L61 PolarHBondContact O-N 3.05Å; L61-S63 PolarHBondContact O-N 2.69Å
62S28.7Very low30.1Very low105 Ų105144.4 Ų144.473%0.73480%0.795SS**  trans-77.8110.417048.10000109.5T60 I64T60-S62 PolarHBondContact O-N 3.04Å; T60-S62 VanDerWaalsContact O-N 3.08Å; S62-I64 PolarHBondContact O-N 2.95Å
63S28.8Very low30Very low119 Ų119140.3 Ų140.383%0.83279%0.79SS**  trans-65.5113.9169.9-58.40000109.2L61 S65L61-S63 PolarHBondContact O-N 2.69Å; S63-S65 PolarHBondContact O-N 3.31Å; S63-S65 VanDerWaalsContact O-N 3.15Å
64I30.2Very low29.6Very low166 Ų166141.3 Ų141.385%0.85179%0.792SS**  trans-63.9111.4175.1-62.6164.4000107.9S62S62-I64 PolarHBondContact O-N 2.95Å
65S32.6Very low29.5Very low110 Ų110141 Ų14177%0.76979%0.792SS**PPolyproline II helixtrans-73.9143.3172.951.30000110.4S63 E67S63-S65 PolarHBondContact O-N 3.31Å; S63-S65 VanDerWaalsContact O-N 3.15Å; S65-E67 PolarHBondContact O-N 3.33Å
66K32.8Very low29.2Very low208 Ų208142.7 Ų142.790%0.90479%0.792SS**PPolyproline II helixtrans-51.2125.1-169.3-68.2171177.2176.10112.7K68K66-K68 PolarHBondContact O-N 2.71Å
67E29.6Very low29.2Very low189 Ų189145.7 Ų145.788%0.88380%0.799SS**PPolyproline II helixtrans-58.1128.2172.2-158.6168.4-166.600110.3S65 I69S65-E67 PolarHBondContact O-N 3.33Å; E67-I69 PolarHBondContact O-N 2.93Å
68K31.3Very low29Very low193 Ų193144.3 Ų144.384%0.83979%0.792SS**  trans-70107.5-172.9-159.7176.7-173.2-178.70108.6K66 T70K66-K68 PolarHBondContact O-N 2.71Å; K68-T70 PolarHBondContact O-N 2.99Å
69I29.1Very low29Very low143 Ų143150 Ų15073%0.73380%0.804SS**  trans-65.1103.8173-58.4172.2000107.7E67 K71E67-I69 PolarHBondContact O-N 2.93Å; I69-K71 VanDerWaalsContact C-N 3.32Å; I69-K71 HydrophobicContact CG2-CG 3.82Å; I69-K71 PolarHBondContact O-N 3.31Å
70T28.2Very low28.9Very low118 Ų118153.2 Ų153.272%0.72481%0.806SS**  trans-69.988.7167.150.50000108.4K68 N72K68-T70 PolarHBondContact O-N 2.99Å; T70-N72 PolarHBondContact O-N 3.04Å
71K31.6Very low28.8Very low181 Ų181151.2 Ų151.279%0.78781%0.808SS**  trans-78.897.1165.5-71.2-172.3178.6-179.10107.8I69 S73I69-K71 VanDerWaalsContact C-N 3.32Å; I69-K71 HydrophobicContact CG2-CG 3.82Å; I69-K71 PolarHBondContact O-N 3.31Å; K71-S73 PolarHBondContact O-N 3.43Å
72N26.6Very low28.7Very low159 Ų159150.3 Ų150.385%0.8580%0.804SS**  trans-72.2102.7155.7-67.3-14.5000106.5T70T70-N72 PolarHBondContact O-N 3.04Å
73S28.9Very low28.7Very low97 Ų97151.6 Ų151.668%0.67880%0.801SS**  trans-145.294.5155.6-157.30000106.1K71 D75K71-S73 PolarHBondContact O-N 3.43Å; S73-D75 PolarHBondContact O-N 2.87Å
74T24Very low28.5Very low123 Ų123153.3 Ų153.376%0.75580%0.801SS**  trans-36.4125.214511.60000108.8
75D29Very low28.6Very low150 Ų150150.3 Ų150.380%0.80280%0.801SS**  trans-163.6125.8133.9-85-26.6000108.7S73S73-D75 PolarHBondContact O-N 2.87Å
76N24.6Very low28.5Very low147 Ų147150.3 Ų150.379%0.78680%0.801SS**  trans-60.6130.4-176.4-62-42.4000111.4
77I30.9Very low28.2Very low155 Ų155148.6 Ų148.680%0.79580%0.796SS**  trans-140.5112.5146.1-56.7-178.3000107.5Y79I77-Y79 PolarHBondContact O-N 2.75Å
78D25.6Very low28.2Very low145 Ų145150.8 Ų150.878%0.77580%0.797SS**  trans-59.9124.9172.4-62.7-50.9000110.9
79Y32.1Very low28Very low222 Ų222149.3 Ų149.387%0.87180%0.796SS**  trans-147.3107.7149.7-99.5-77.6000109I77I77-Y79 PolarHBondContact O-N 2.75Å
80E24.8Very low28Very low200 Ų200149.2 Ų149.294%0.93580%0.796SS**  trans-62137.3163.8-71.5-174.8136.700110.5
81G29Very low28.3Very low74 Ų74148.8 Ų148.876%0.76380%0.796SS**  trans-179.937.7-179.100000116.7
82N24.9Very low28.5Very low153 Ų153150.9 Ų150.982%0.81880%0.8SS**  trans50130.8137.8-128.6-1.1000122.9
83I28.2Very low28.8Very low131 Ų131151.6 Ų151.667%0.67280%0.798SS**  trans89.294.7148.4-35.8178.1000120.5
84N25.6Very low29.3Very low155 Ų155152.7 Ų152.783%0.82980%0.801SS**  34111129.2-55.4-22.5000120.3
85A32Very low29.8Very low104 Ų104153.5 Ų153.586%0.8680%0.801SS**  trans-167.1108.8130.100000110.5
86S29.2Very low30.4Very low109 Ų109151.5 Ų151.576%0.76279%0.794SS**  trans-60.7142174.8-39.90000112.7
87E26.8Very low30.7Very low172 Ų172152.4 Ų152.480%0.80480%0.795SS**  trans49.795.4137.6-64.4179.6153.800118.5
88R29.9Very low30.9Very low236 Ų236152.8 Ų152.889%0.89179%0.794SS**  trans-136.392.8134.7-89.4-168.1-176.4179.41.6110.1L90R88-L90 PolarHBondContact O-N 3.14Å
89I26.7Very low31.6Very low162 Ų162150.9 Ų150.983%0.83179%0.788SS**  trans-70.1104.3159.9-62.2165.9000106.2
90L29.6Very low31.9Very low141 Ų141146.2 Ų146.274%0.73878%0.782SS**  trans-102.5127161.8-102.4150.9000107.1R88 Y92R88-L90 PolarHBondContact O-N 3.14Å; L90-Y92 PolarHBondContact O-N 2.88Å
91P34.8Very low32.3Very low109 Ų109146 Ų14671%0.70877%0.774SS**  trans-70.4124.1-173.328.8-31.7000109.5E93P91-E93 PolarHBondContact O-N 2.92Å
92Y34.8Very low32.5Very low224 Ų224147.4 Ų147.488%0.87877%0.772SS**  trans-63.6102.7170.4-110-93000108.5L90 T94L90-Y92 PolarHBondContact O-N 2.88Å; Y92-T94 PolarHBondContact O-N 2.99Å
93E34.6Very low33.2Very low175 Ų175150.9 Ų150.982%0.81877%0.774SS**  trans-57.8103.4164.9-77.2179.2145.200108.3P91 D95P91-E93 PolarHBondContact O-N 2.92Å; E93-D95 PolarHBondContact O-N 2.87Å
94T38.2Very low33.5Very low120 Ų120151.7 Ų151.774%0.73678%0.78SS**  trans-74.3102.7164.542.50000107.5Y92 V96Y92-T94 PolarHBondContact O-N 2.99Å; T94-V96 VanDerWaalsContact C-N 3.29Å; T94-V96 WeakPolarHBondContact O-CG2 3.12Å; T94-V96 PolarHBondContact O-N 2.86Å
95D34.6Very low34.1Very low139 Ų139153 Ų15374%0.74378%0.778SS**  trans-57.790.7167.3-82.4-31000109.8E93 M97E93-D95 PolarHBondContact O-N 2.87Å; D95-M97 PolarHBondContact O-N 3.28Å
96V41.1Very low34.6Very low108 Ų108152.9 Ų152.966%0.65577%0.769SS**  trans-74.695.5174.1-177.90000107.4T94 Q98T94-V96 VanDerWaalsContact C-N 3.29Å; T94-V96 WeakPolarHBondContact O-CG2 3.12Å; T94-V96 PolarHBondContact O-N 2.86Å; V96-Q98 VanDerWaalsContact C-N 3.31Å; V96-Q98 HydrophobicContact CG1-CG 4.24Å; V96-Q98 PolarHBondContact O-N 3.17Å
97M32.4Very low35Very low166 Ų166155.5 Ų155.582%0.81877%0.774SS**  trans-61.690.6169-71.8-79.8148.100109.5D95 T99D95-M97 PolarHBondContact O-N 3.28Å; M97-T99 PolarHBondContact O-N 3.04Å
98Q34.5Very low35.6Very low163 Ų163156 Ų15676%0.76277%0.774SS**  trans-76111.5172.7-81-177.3-8.400109.8V96 T100V96-Q98 VanDerWaalsContact C-N 3.31Å; V96-Q98 HydrophobicContact CG1-CG 4.24Å; V96-Q98 PolarHBondContact O-N 3.17Å; Q98-T100 PolarHBondContact O-N 2.84Å
99T39.8Very low36.2Very low106 Ų106153.2 Ų153.265%0.6577%0.771SS**  trans-88.697.4166.755.50000109.2M97 Y101M97-T99 PolarHBondContact O-N 3.04Å; T99-Y101 WeakPolarHBondContact O-CD2 3.17Å; T99-Y101 PolarHBondContact O-N 3.38Å
100T37.7Very low37.1Very low123 Ų123150.7 Ų150.776%0.75577%0.768SS**  trans-77115.4175.8-54.10000109.9Q98Q98-T100 PolarHBondContact O-N 2.84Å
101Y34.9Very low37.7Very low197 Ų197148.8 Ų148.877%0.77377%0.766SS**  trans-89.1107.7173.1-66.8-87.3000109.7T99 R103T99-Y101 WeakPolarHBondContact O-CD2 3.17Å; T99-Y101 PolarHBondContact O-N 3.38Å; Y101-R103 PolarHBondContact O-N 2.83Å
102S32Very low38.3Very low102 Ų102148.9 Ų148.971%0.71376%0.764SS**  trans-67.2117.2167.4-810000109.9D104S102-D104 PolarHBondContact O-N 3.36Å
103R40.9Very low38.6Very low226 Ų226146.2 Ų146.285%0.85377%0.765SS**  trans-86.878.1176.3-74.9-174.3176.81711.1110.4Y101 F105Y101-R103 PolarHBondContact O-N 2.83Å; R103-F105 PolarHBondContact O-N 2.98Å
104D34.4Very low39.1Very low149 Ų149144 Ų14480%0.79776%0.757SS**  trans-80.766.2164.4-64.8-29.1000109.6S102S102-D104 PolarHBondContact O-N 3.36Å
105F38Very low39.2Very low183 Ų183142.7 Ų142.780%0.80376%0.758SS**  trans-106.1109.3169.9-80.6-77.6000109.3R103 N107R103-F105 PolarHBondContact O-N 2.98Å; F105-N107 PolarHBondContact O-N 2.61Å
106P41.1Very low39.5Very low101 Ų101143.7 Ų143.766%0.65676%0.763SS**  trans-62.7133.4173.725.3-31.2000108.8K108P106-K108 PolarHBondContact O-N 2.83Å
107N37.9Very low39.8Very low164 Ų164149.2 Ų149.288%0.87777%0.772SS**  trans-58.771.1-174-158.82.9000112.2F105F105-N107 PolarHBondContact O-N 2.61Å
108K40.4Very low40.5Very low182 Ų182147.2 Ų147.279%0.79177%0.771SS**  trans-88107171.1-69.8-174-179-175.70106.8P106P106-K108 PolarHBondContact O-N 2.83Å
109Q42.4Very low41Very low177 Ų177149.8 Ų149.883%0.82777%0.774SS**  trans-43.4140.3174-69.1179.7-15.600110.5S111Q109-S111 VanDerWaalsContact C-N 3.35Å; Q109-S111 PolarHBondContact O-N 3.43Å
110S46.2Very low41.2Very low110 Ų110150.3 Ų150.377%0.76978%0.782SS**  trans-52.690.7-171.454.20000111.9T112S110-T112 PolarHBondContact O-N 3.46Å
111S42.3Very low41.7Very low100 Ų100148.6 Ų148.670%0.69977%0.771SS**  trans-68.9100.2173.751.80000107Q109 L113Q109-S111 VanDerWaalsContact C-N 3.35Å; Q109-S111 PolarHBondContact O-N 3.43Å; S111-L113 PolarHBondContact O-N 3.29Å
112T47Very low42.4Very low111 Ų111149.5 Ų149.568%0.68177%0.773SS**  trans-68.899.1178-55.90000107.1S110 I114S110-T112 PolarHBondContact O-N 3.46Å; T112-I114 HydrophobicContact CG2-CD1 4.37Å; T112-I114 HydrophobicContact CG2-CG1 3.85Å; T112-I114 PolarHBondContact O-N 3.13Å
113L41.3Very low42.9Very low169 Ų169152.4 Ų152.489%0.88578%0.775SS**  trans-68.599.4172.2-72.6170.2000108.3S111S111-L113 PolarHBondContact O-N 3.29Å
114I44.3Very low43.3Very low129 Ų129144.6 Ų144.666%0.66276%0.759SS**  trans-92.8115.2173.9-56.6174.1000108T112 L116T112-I114 HydrophobicContact CG2-CD1 4.37Å; T112-I114 HydrophobicContact CG2-CG1 3.85Å; T112-I114 PolarHBondContact O-N 3.13Å; I114-L116 PolarHBondContact O-N 2.88Å; I114-L116 VanDerWaalsContact O-N 3.14Å
115A40Very low43.8Very low91 Ų91146.1 Ų146.175%0.75276%0.759SS**  trans-68.6106.816900000109.3R117A115-R117 PolarHBondContact O-N 3.5Å
116L41Very low43.7Very low161 Ų161144.5 Ų144.584%0.84376%0.757SS**  trans-68.7103.1171.7-65.6174000108.3I114I114-L116 PolarHBondContact O-N 2.88Å; I114-L116 VanDerWaalsContact O-N 3.14Å
117R47.6Very low43.6Very low224 Ų224143.2 Ų143.285%0.84576%0.755SS**PPolyproline II helixtrans-58.2136.6168.4-70.5-172.5177.4102.2-0.3108.1A115 R119A115-R117 PolarHBondContact O-N 3.5Å; R117-R119 PolarHBondContact O-N 3.27Å
118P47.2Very low43.7Very low123 Ų123141.1 Ų141.180%0.79975%0.75SS**PPolyproline II helixtrans-52.1116.8179.6-23.332.7000108.8S120P118-S120 PolarHBondContact O-N 3.04Å; P118-S120 VanDerWaalsContact O-N 3.16Å
119R44Very low43.5Very low218 Ų218138.4 Ų138.482%0.82375%0.749SS**PPolyproline II helixtrans-52.4125.4177.9-82.3179163.3159.7-6.9107.7R117 T121R117-R119 PolarHBondContact O-N 3.27Å; R119-T121 PolarHBondContact O-N 3.02Å
120S44.6Very low43.3Very low116 Ų116136.2 Ų136.281%0.81175%0.752SS**  trans-32.6104.1173.6174.90000110P118 R122P118-S120 PolarHBondContact O-N 3.04Å; P118-S120 VanDerWaalsContact O-N 3.16Å; S120-R122 PolarHBondContact O-N 3.19Å
121T49Very low42.5Very low87 Ų87139.8 Ų139.853%0.53475%0.753SS.*  trans-76.976.3-176.644.30000107.7R119 H123 A124R119-T121 PolarHBondContact O-N 3.02Å; T121-H123 PolarHBondContact O-N 3.24Å; T121-A124 VanDerWaalsContact CB-CB 3.4Å; T121-A124 HydrophobicContact CG2-CB 4.18Å; T121-A124 PolarHBondContact O-N 3.29Å; T121-A124 VanDerWaalsContact OG1-CB 3.26Å; T121-A124 WeakPolarHBondContact OG1-CB 3.46Å
122R49.4Very low42.1Very low216 Ų216140.8 Ų140.882%0.81576%0.76SS**THydrogen-bonded Turntrans-54.7-10.4172.3-142.4-178.4-166.7-144.1-0.8112.3S120S120-R122 PolarHBondContact O-N 3.19Å
123H42.6Very low41.6Very low164 Ų164142.9 Ų142.976%0.75977%0.766SS**THydrogen-bonded Turntrans-123.69.3179.8-59.61.9000114T121 F125T121-H123 PolarHBondContact O-N 3.24Å; H123-F125 VanDerWaalsContact C-N 3.28Å
124A49.5Very low41.2Very low62 Ų62139.7 Ų139.751%0.51276%0.757SS.*THydrogen-bonded Turntrans-75.1-20.6172.900000112.8T121T121-A124 VanDerWaalsContact CB-CB 3.4Å; T121-A124 HydrophobicContact CG2-CB 4.18Å; T121-A124 PolarHBondContact O-N 3.29Å; T121-A124 VanDerWaalsContact OG1-CB 3.26Å; T121-A124 WeakPolarHBondContact OG1-CB 3.46Å
125F43.1Very low40.6Very low181 Ų181138.7 Ų138.779%0.79476%0.757SS**  trans-110.980175.6-56.1-74.6000108.5H123 A127H123-F125 VanDerWaalsContact C-N 3.28Å; F125-A127 PolarHBondContact O-N 3.19Å
126I35.9Very low40.6Very low149 Ų149140.4 Ų140.476%0.76476%0.761SS**  trans-66.495.5155.2-62.1173.7000104.5
127A40.4Very low40.3Very low74 Ų74140.1 Ų140.161%0.61276%0.761SS**  trans-58.2128.6171.200000107.3F125 T129F125-A127 PolarHBondContact O-N 3.19Å; A127-T129 PolarHBondContact O-N 3.16Å; A127-T129 VanDerWaalsContact O-N 3.1Å
128P40Very low39.5Very low119 Ų119134.6 Ų134.677%0.77376%0.756SS**  trans-54.9121.5179.3-21.730.6000109.2C130P128-C130 PolarHBondContact O-N 3.26Å; P128-C130 VanDerWaalsContact O-N 3.12Å
129T36.5Very low39.1Very low125 Ų125134.6 Ų134.677%0.76776%0.758SS**  trans-62.6115.1175.141.20000108.2A127 K131A127-T129 PolarHBondContact O-N 3.16Å; A127-T129 VanDerWaalsContact O-N 3.1Å; T129-K131 PolarHBondContact O-N 2.94Å
130C37.2Very low38.6Very low131 Ų131136 Ų13689%0.88576%0.763SS**  trans-58.3102.7179.2-57.60000109.5P128 S132P128-C130 PolarHBondContact O-N 3.26Å; P128-C130 VanDerWaalsContact O-N 3.12Å; C130-S132 PolarHBondContact O-N 3.1Å
131K30.5Very low38.1Very low186 Ų186135.9 Ų135.981%0.80976%0.758SS**  trans-74.5122.7161.6-71.1-172.4178.1-176.80107.2T129 I133T129-K131 PolarHBondContact O-N 2.94Å; K131-I133 PolarHBondContact O-N 3.02Å
132S33.8Very low37.9Very low120 Ų120139.1 Ų139.184%0.83977%0.771SS**  trans-62100.3177.749.70000110.2C130 S134C130-S132 PolarHBondContact O-N 3.1Å; S132-S134 PolarHBondContact O-N 3.07Å
133I35.3Very low37.6Very low155 Ų155133 Ų13380%0.79576%0.761SS**  trans-88.4103.6168.2-69173.2000106.9K131 T135K131-I133 PolarHBondContact O-N 3.02Å; I133-T135 PolarHBondContact O-N 3.11Å
134S32.5Very low37.3Very low102 Ų102132.2 Ų132.271%0.71376%0.762SS**  trans-62.9115.1163.353.30000109.5S132S132-S134 PolarHBondContact O-N 3.07Å
135T32.6Very low36.8Very low108 Ų108136 Ų13666%0.66377%0.773SS**  trans167.4120131.431.90000108.8I133 N137I133-T135 PolarHBondContact O-N 3.11Å; T135-N137 PolarHBondContact O-N 3.35Å
136P40.3Very low36.5Very low128 Ų128135.5 Ų135.583%0.83177%0.773SS**  trans-92.1100.1-174.134.1-27.9000109.6S138P136-S138 PolarHBondContact O-N 3.1Å
137N33.5Very low36.5Very low155 Ų155135 Ų13583%0.82977%0.771SS**  trans-88.896174.3-76.8-17.1000110.9T135T135-N137 PolarHBondContact O-N 3.35Å
138S32.5Very low36.5Very low107 Ų107139.7 Ų139.775%0.74879%0.785SS**  trans56.7102.7139.9-161.50000117.8P136 R140P136-S138 PolarHBondContact O-N 3.1Å; S138-R140 PolarHBondContact O-N 3.5Å
139C37.6Very low36.4Very low124 Ų124140.3 Ų140.384%0.83878%0.782SS**  trans-45.9120.7166.9-53.10000111.7
140R33.1Very low36.6Very low246 Ų246139.7 Ų139.793%0.92878%0.782SS**  trans-73.3130163-73.1-174.7178.8-177.3-0.5108.4S138S138-R140 PolarHBondContact O-N 3.5Å
141T34.8Very low36.9Very low115 Ų115139.7 Ų139.771%0.70678%0.778SS**  trans-61.6143.5-174.333.20000112.7S143T141-S143 PolarHBondContact O-N 3.45Å
142L46Very low37.3Very low155 Ų155138.4 Ų138.481%0.81278%0.78SS**G310 helixtrans-63.76.2-171.6-142.5101.9000115.9
143S41.1Very low37.3Very low87 Ų87134.2 Ų134.261%0.60876%0.756SS**G310 helixtrans-80.1-12.9-171.445.40000114.6T141T141-S143 PolarHBondContact O-N 3.45Å
144D37.6Very low38.1Very low147 Ų147132.6 Ų132.679%0.78676%0.756SS**G310 helixtrans-95.43.6-179.3-62.9-7.8000113.2E146D144-E146 PolarHBondContact O-N 2.97Å; D144-E146 VanDerWaalsContact O-N 3.14Å
145L39.7Very low38.5Very low141 Ų141137.9 Ų137.974%0.73876%0.761SS**  trans-8571.3162.4-86.7134.1000107.9I147L145-I147 PolarHBondContact O-N 3.47Å
146E35.2Very low38.7Very low171 Ų171140.7 Ų140.780%0.79977%0.767SS**  trans-57.790.8159.8-71.8-175.4168.200107.8D144 L148D144-E146 PolarHBondContact O-N 2.97Å; D144-E146 VanDerWaalsContact O-N 3.14Å; E146-L148 PolarHBondContact O-N 3.41Å
147I37.5Very low38.9Very low140 Ų140138.6 Ų138.672%0.71876%0.755SS**  trans8.482.4144.4-52.3171.1000110.9L145 N149L145-I147 PolarHBondContact O-N 3.47Å; I147-N149 PolarHBondContact O-N 3.36Å
148L39.5Very low39.7Very low171 Ų171138.1 Ų138.190%0.89576%0.758SS**  trans-64.297160.3-81.8163.4000105.4E146 S150E146-L148 PolarHBondContact O-N 3.41Å; L148-S150 PolarHBondContact O-N 2.89Å; L148-S150 VanDerWaalsContact O-N 3.16Å
149N37.6Very low40Very low133 Ų133142.5 Ų142.571%0.71176%0.76SS**  trans-40.6120.3177.2-68.8-44.2000109.6I147 V151I147-N149 PolarHBondContact O-N 3.36Å; N149-V151 PolarHBondContact O-N 2.87Å
150S40.6Very low40.2Very low111 Ų111140.7 Ų140.778%0.77675%0.748SS**  trans-59.799.9173.6-55.60000108.1L148 D152L148-S150 PolarHBondContact O-N 2.89Å; L148-S150 VanDerWaalsContact O-N 3.16Å; S150-D152 PolarHBondContact O-N 3.46Å; S150-D152 VanDerWaalsContact O-N 3.08Å
151V44.1Very low41Very low131 Ų131135.2 Ų135.279%0.79474%0.742SS**  trans-70.1103.4172.5176.60000106.4N149 G153N149-V151 PolarHBondContact O-N 2.87Å; V151-G153 VanDerWaalsContact C-N 3.34Å; V151-G153 PolarHBondContact O-N 2.97Å
152D38.7Very low41.3Very low159 Ų159135.5 Ų135.585%0.8574%0.74SS**  trans-60.194.4170.7-90.3-27.4000109.2S150S150-D152 PolarHBondContact O-N 3.46Å; S150-D152 VanDerWaalsContact O-N 3.08Å
153G34.4Very low41.1Very low32 Ų32138.3 Ų138.333%0.3374%0.741SS.*  trans-143.9145.9172.500000109.7V151 Y155V151-G153 VanDerWaalsContact C-N 3.34Å; V151-G153 PolarHBondContact O-N 2.97Å; G153-Y155 PolarHBondContact O-N 3.18Å
154P50.5Low41Very low122 Ų122139.9 Ų139.979%0.79275%0.747SS**SBendtrans-70.211.4-171.730-35.7000114.2
155Y42.4Very low41Very low212 Ų212135.9 Ų135.983%0.83174%0.74SS**  trans-11357178.9-54.8-70.9000110G153 S157G153-Y155 PolarHBondContact O-N 3.18Å; Y155-S157 PolarHBondContact O-N 3.4Å; Y155-S157 VanDerWaalsContact O-N 3.11Å
156Q35.6Very low40.9Very low168 Ų168134.3 Ų134.379%0.78574%0.74SS**  trans-70.7104.2164.2-79.4-169.3-3.100108.6T158Q156-T158 PolarHBondContact O-N 2.9Å
157S46Very low41.1Very low84 Ų84137.2 Ų137.259%0.58774%0.744SS**  trans-63.4121.5173.164.40000109.4Y155 Y159Y155-S157 PolarHBondContact O-N 3.4Å; Y155-S157 VanDerWaalsContact O-N 3.11Å; S157-Y159 PolarHBondContact O-N 3.41Å
158T49.1Very low41.3Very low144 Ų144137 Ų13788%0.88375%0.749SS**  trans-70.322-178.6-27.80000113.8Q156 S160Q156-T158 PolarHBondContact O-N 2.9Å; T158-S160 PolarHBondContact O-N 3.25Å
159Y39.5Very low41.3Very low199 Ų199134.3 Ų134.378%0.7874%0.741SS**  trans-75.1100.3172.6-63.4-67.8000107.4S157 T161S157-Y159 PolarHBondContact O-N 3.41Å; Y159-T161 PolarHBondContact O-N 3.47Å
160S41.8Very low41.5Very low86 Ų86136.3 Ų136.360%0.60175%0.747SS**  trans-40.9117.3168.2-123.70000108.4T158 D162T158-S160 PolarHBondContact O-N 3.25Å; S160-D162 WeakPolarHBondContact CB-OD2 3.45Å; S160-D162 PolarHBondContact O-N 2.81Å; S160-D162 PolarHBondContact OG-OD2 3.21Å
161T48.6Very low41.8Very low131 Ų131134.9 Ų134.980%0.80474%0.735SS**THydrogen-bonded Turntrans-66.39.117343.40000112.6Y159 Y163Y159-T161 PolarHBondContact O-N 3.47Å; T161-Y163 PolarHBondContact O-N 3.32Å
162D42.9Very low41.9Very low122 Ų122137 Ų13765%0.65274%0.741SS**THydrogen-bonded Turntrans-78.82.2179.8-51.2-41.4000113.2S160 V164S160-D162 WeakPolarHBondContact CB-OD2 3.45Å; S160-D162 PolarHBondContact O-N 2.81Å; S160-D162 PolarHBondContact OG-OD2 3.21Å; D162-V164 PolarHBondContact O-N 3.33Å
163Y40Very low42Very low213 Ų213133.2 Ų133.284%0.83573%0.728SS**  trans-76.256.7162.1-122-87.6000110.1T161 G165T161-Y163 PolarHBondContact O-N 3.32Å; Y163-G165 PolarHBondContact O-N 3.02Å
164V39.2Very low42.3Very low121 Ų121137.2 Ų137.273%0.73375%0.748SS**  trans-60.1108.1159.6177.90000105.1D162 C166D162-V164 PolarHBondContact O-N 3.33Å; V164-C166 PolarHBondContact O-N 2.98Å
165G39Very low42Very low63 Ų63138.2 Ų138.265%0.64975%0.745SS**  trans-45.6104.3-171.100000111.5Y163 W167Y163-G165 PolarHBondContact O-N 3.02Å; G165-W167 PolarHBondContact O-N 3.24Å
166C36.7Very low41.9Very low107 Ų107139.3 Ų139.372%0.72375%0.748SS**  trans-60.195.6159.5-760000106.5V164 T168V164-C166 PolarHBondContact O-N 2.98Å; C166-T168 PolarHBondContact O-N 3.06Å
167W40.2Very low42.1Very low233 Ų233137.2 Ų137.288%0.88375%0.747SS**  trans36.278147.8-5486.1000112.1G165 P169G165-W167 PolarHBondContact O-N 3.24Å; W167-P169 VanDerWaalsContact C-N 3.34Å; W167-P169 WeakPolarHBondContact O-CD 3.42Å; W167-P169 VanDerWaalsContact O-N 3.12Å
168T40.4Very low41.9Very low135 Ų135137.7 Ų137.783%0.82876%0.756SS**  trans-64.9105.315142.60000104.7C166 Q170C166-T168 PolarHBondContact O-N 3.06Å; T168-Q170 PolarHBondContact O-N 3.42Å
169P39.9Very low41.5Very low114 Ų114136.1 Ų136.174%0.7475%0.746SS**  trans-58116172.725.8-32.6000105.6W167 P171W167-P169 VanDerWaalsContact C-N 3.34Å; W167-P169 WeakPolarHBondContact O-CD 3.42Å; W167-P169 VanDerWaalsContact O-N 3.12Å; P169-P171 WeakPolarHBondContact O-CD 3.47Å
170Q41.8Very low41.6Very low175 Ų175132.7 Ų132.782%0.81875%0.751SS**  trans-55.7114.4171.5-150.8171.913.700104.7T168 D172T168-Q170 PolarHBondContact O-N 3.42Å; Q170-D172 PolarHBondContact O-N 3.32Å
171P47.1Very low41.5Very low81 Ų81133 Ų13353%0.52675%0.753SS.*  trans-64.6117.2-177.124.4-31000107P169 S173P169-P171 WeakPolarHBondContact O-CD 3.47Å; P171-S173 CarbonylContact O-C 3.57Å; P171-S173 PolarHBondContact O-N 2.94Å
172D47Very low40.7Very low175 Ų175130 Ų13094%0.93675%0.749SS**SBendtrans-61.39.2176.1-78.6-29.2000113.7Q170Q170-D172 PolarHBondContact O-N 3.32Å
173S40.4Very low40.6Very low81 Ų81130.8 Ų130.857%0.56676%0.758SS**SBendtrans-135.2122.8166.741.10000107.9P171 I175P171-S173 CarbonylContact O-C 3.57Å; P171-S173 PolarHBondContact O-N 2.94Å; S173-I175 PolarHBondContact O-N 2.84Å; S173-I175 VanDerWaalsContact O-N 3.11Å
174P40.4Very low40.7Very low116 Ų116131.9 Ų131.975%0.75376%0.761SS**  trans-53.2127.8171.620.9-29.8000107R176P174-R176 VanDerWaalsContact C-N 3.32Å; P174-R176 PolarHBondContact O-N 2.93Å
175I44.7Very low40.8Very low143 Ų143130.2 Ų130.273%0.73376%0.76SS**  trans-48.5105.4173.6-63.6169.6000105S173 T177S173-I175 PolarHBondContact O-N 2.84Å; S173-I175 VanDerWaalsContact O-N 3.11Å; I175-T177 VanDerWaalsContact C-N 3.25Å; I175-T177 PolarHBondContact O-N 2.93Å
176R39.2Very low41.2Very low234 Ų234134.4 Ų134.488%0.88377%0.767SS**  trans-60.7101.1176.7-79.3-176.5175.4-132.71.4104.8P174 A178P174-R176 VanDerWaalsContact C-N 3.32Å; P174-R176 PolarHBondContact O-N 2.93Å; R176-A178 VanDerWaalsContact C-N 3.31Å; R176-A178 PolarHBondContact O-N 3.22Å
177T41.4Very low41.2Very low124 Ų124138 Ų13876%0.76177%0.77SS**  trans-51.4106.2168.1-37.50000104.1I175 T179I175-T177 VanDerWaalsContact C-N 3.25Å; I175-T177 PolarHBondContact O-N 2.93Å; T177-T179 PolarHBondContact O-N 2.92Å
178A41.2Very low41.6Very low94 Ų94132.3 Ų132.378%0.77776%0.764SS**  trans-67.385.8-177.100000106.5R176 S180R176-A178 VanDerWaalsContact C-N 3.31Å; R176-A178 PolarHBondContact O-N 3.22Å; A178-S180 PolarHBondContact O-N 2.72Å; A178-S180 VanDerWaalsContact O-N 3.09Å
179T41.1Very low41.8Very low112 Ų112134.4 Ų134.469%0.68776%0.764SS**  trans-55.2118.4163.747.20000104.9T177 S181T177-T179 PolarHBondContact O-N 2.92Å; T179-S181 PolarHBondContact O-N 3.16Å
180S41.7Very low42.2Very low127 Ų127133.6 Ų133.689%0.88876%0.758SS**  trans-6943.1-177.862.60000112.1A178 G182A178-S180 PolarHBondContact O-N 2.72Å; A178-S180 VanDerWaalsContact O-N 3.09Å; S180-G182 PolarHBondContact O-N 3.4Å
181S38.5Very low42.5Very low91 Ų91136.3 Ų136.364%0.63676%0.761SS**  trans-87.4103.9168.668.60000107.3T179 T183T179-S181 PolarHBondContact O-N 3.16Å; S181-T183 PolarHBondContact O-N 3.43Å
182G33.3Very low42.3Very low70 Ų70139.9 Ų139.972%0.72277%0.768SS**  trans-54.4136.4-178.300000112.9S180S180-G182 PolarHBondContact O-N 3.4Å
183T39.6Very low42.2Very low137 Ų137137.5 Ų137.584%0.8476%0.756SS**  trans-16611.3150.226.10000112.2S181 A185S181-T183 PolarHBondContact O-N 3.43Å; T183-A185 PolarHBondContact O-N 3Å
184R42.2Very low42.6Very low237 Ų237141.6 Ų141.689%0.89476%0.763SS**  trans-78.385.6160.8-71.3-171.9178.4-137.7-0.7106.7N186R184-N186 PolarHBondContact O-N 3.15Å
185A41.8Very low42.6Very low86 Ų86143.4 Ų143.471%0.71177%0.766SS**  trans-46.497.9163.900000107T183 K187T183-A185 PolarHBondContact O-N 3Å; A185-K187 PolarHBondContact O-N 3.37Å
186N46.2Very low42.6Very low150 Ų150142 Ų14280%0.80276%0.764SS**  trans-62.983.2167.7-74.5-31.7000104.8R184 P188R184-N186 PolarHBondContact O-N 3.15Å; N186-P188 VanDerWaalsContact C-N 3.33Å; N186-P188 WeakPolarHBondContact O-CD 3.47Å
187K38.3Very low42.7Very low182 Ų182140.2 Ų140.279%0.79176%0.759SS**  trans-63104.3157.7-73-173.7176.9-178.50103.3A185 H189A185-K187 PolarHBondContact O-N 3.37Å; K187-H189 PolarHBondContact O-N 3.32Å
188P48.8Very low42.7Very low114 Ų114143.1 Ų143.174%0.7476%0.756SS**PPolyproline II helixtrans-57.9123.9177.926.3-32.1000105.8N186 P190N186-P188 VanDerWaalsContact C-N 3.33Å; N186-P188 WeakPolarHBondContact O-CD 3.47Å; P188-P190 VanDerWaalsContact O-N 3.07Å
189H43.6Very low42.8Very low180 Ų180143.5 Ų143.583%0.83375%0.745SS**PPolyproline II helixtrans-49.1124175-78.8-75.8000107.3K187 R191K187-H189 PolarHBondContact O-N 3.32Å; H189-R191 PolarHBondContact O-N 3.4Å; H189-R191 VanDerWaalsContact O-N 3.15Å
190P48.2Very low43.2Very low96 Ų96146.1 Ų146.162%0.62375%0.749SS**PPolyproline II helixtrans-53.5130.2179.518.7-28.4000107P188 K192P188-P190 VanDerWaalsContact O-N 3.07Å; P190-K192 PolarHBondContact O-N 3.46Å
191R48.4Very low43.4Very low232 Ų232148 Ų14888%0.87575%0.746SS**  trans-57.275.8-178.2-74.2173.3148.1166.7-7.3109.9H189H189-R191 PolarHBondContact O-N 3.4Å; H189-R191 VanDerWaalsContact O-N 3.15Å
192K42.1Very low43.9Very low157 Ų157149.5 Ų149.568%0.68375%0.747SS**  trans-106.6100.8174.8-67.9-167.7177.2-169.90106.9P190 F194P190-K192 PolarHBondContact O-N 3.46Å; K192-F194 PolarHBondContact O-N 3.48Å
193D44.7Very low44.5Very low125 Ų125150.9 Ų150.967%0.66874%0.735SS**  trans6927136.3-42.3-29.9000119.3L195 T196D193-L195 PolarHBondContact O-N 3.38Å; D193-T196 PolarHBondContact O-OG1 2.69Å
194F50.2Low44.7Very low166 Ų166152.2 Ų152.273%0.72873%0.733SS**SBendtrans-69.8-5.716047.2-95.9000113.2K192K192-F194 PolarHBondContact O-N 3.48Å
195L39.5Very low44.9Very low154 Ų154145 Ų14581%0.80672%0.719SS**  trans-102.664.1171.3-75.4154.7000109.5D193 Y197D193-L195 PolarHBondContact O-N 3.38Å; L195-Y197 PolarHBondContact O-N 3.37Å
196T45.8Very low45Very low114 Ų114149.1 Ų149.170%0.69972%0.718SS**  trans-73.7111.5167.8-280000107.9D193 R198D193-T196 PolarHBondContact O-OG1 2.69Å; T196-R198 PolarHBondContact O-N 3.44Å
197Y39.5Very low45Very low197 Ų197150 Ų15077%0.77372%0.715SS**  trans-61.799.8172.9-162-98.1000108.2L195 N199L195-Y197 PolarHBondContact O-N 3.37Å; Y197-N199 VanDerWaalsContact CE1-OD1 3.25Å; Y197-N199 WeakPolarHBondContact CE1-OD1 3.34Å; Y197-N199 PolarHBondContact O-N 3.15Å
198R42.1Very low44.8Very low185 Ų185148.2 Ų148.270%0.69871%0.714SS**  trans-76.992.1174.6-82.6-172.8166.8-174.6-7.4108.1T196 E200T196-R198 PolarHBondContact O-N 3.44Å; R198-E200 PolarHBondContact O-N 2.95Å; R198-E200 VanDerWaalsContact O-N 3.16Å
199N43Very low44.2Very low102 Ų102149.9 Ų149.955%0.54571%0.712SS.*  trans-67.4107.7162.2-102.1-15.3000107.9Y197 M201 N202Y197-N199 VanDerWaalsContact CE1-OD1 3.25Å; Y197-N199 WeakPolarHBondContact CE1-OD1 3.34Å; Y197-N199 PolarHBondContact O-N 3.15Å; N199-M201 PolarHBondContact O-N 3.46Å; N199-M201 VanDerWaalsContact O-N 3.13Å; N199-N202 PolarHBondContact O-N 3.42Å
200E49Very low43.9Very low167 Ų167147.5 Ų147.578%0.7871%0.712SS**G310 helixtrans-60.5-21.2-177.6-52.6-176.9-175.100112.1R198 N202 Q203R198-E200 PolarHBondContact O-N 2.95Å; R198-E200 VanDerWaalsContact O-N 3.16Å; E200-N202 VanDerWaalsContact C-N 3.29Å; E200-N202 PolarHBondContact O-N 3.47Å; E200-Q203 PolarHBondContact O-N 3.4Å
201M47.6Very low43.4Very low166 Ų166148.6 Ų148.682%0.81872%0.722SS**G310 helixtrans-58.9-32.1-178.3-144.287.9133.800114.2N199N199-M201 PolarHBondContact O-N 3.46Å; N199-M201 VanDerWaalsContact O-N 3.13Å
202N48.4Very low42.6Very low123 Ų123142.3 Ų142.366%0.65871%0.714SS**G310 helixtrans-90.9-3.7-174.5-76.6-7.6000114.6N199 E200N199-N202 PolarHBondContact O-N 3.42Å; E200-N202 VanDerWaalsContact C-N 3.29Å; E200-N202 PolarHBondContact O-N 3.47Å
203Q46.2Very low42.7Very low99 Ų99140.7 Ų140.746%0.46372%0.719SS.*SBendtrans-87.7-14.5177.3-75.2-173.747.500113.5E200 S205 F207E200-Q203 PolarHBondContact O-N 3.4Å; Q203-S205 VanDerWaalsContact C-N 3.27Å; Q203-S205 PolarHBondContact O-N 3.36Å; Q203-F207 WeakPolarHBondContact O-CD2 3.37Å
204M43.9Very low42.3Very low164 Ų164141 Ų14181%0.80873%0.725SS**THydrogen-bonded Turntrans-71.3-21.8179.9-146.382.776.900112.9
205S46.2Very low41.5Very low85 Ų85138.2 Ų138.259%0.59473%0.726SS**THydrogen-bonded Turntrans-91.2-6.5-176.455.60000115.2Q203Q203-S205 VanDerWaalsContact C-N 3.27Å; Q203-S205 PolarHBondContact O-N 3.36Å
206Y42.8Very low41.4Very low174 Ų174136.9 Ų136.968%0.68273%0.725SS**SBendtrans-100.9-0.4-176-98.6-84.3000115
207F46.1Very low40.8Very low168 Ų168137.7 Ų137.774%0.73773%0.729SS**THydrogen-bonded Turntrans-86.5-10.2178.4-77.5-76.1000114.5Q203Q203-F207 WeakPolarHBondContact O-CD2 3.37Å
208D35Very low40.5Very low145 Ų145133.8 Ų133.878%0.77573%0.731SS**THydrogen-bonded Turntrans-92.59.7-178.4-73-21.5000114.4P210D208-P210 WeakPolarHBondContact O-CD 3.26Å
209Q36.1Very low40Very low149 Ų149134 Ų13470%0.69674%0.739SS**SBendtrans-100109.9171-77.6-173.3-7.400111.1S211Q209-S211 PolarHBondContact O-N 3.12Å
210P37Very low39.5Very low129 Ų129134 Ų13484%0.83875%0.748SS**  trans-65.8107175.326.2-31.7000108.9D208 S212D208-P210 WeakPolarHBondContact O-CD 3.26Å; P210-S212 PolarHBondContact O-N 3.26Å
211S37.2Very low38.7Very low119 Ų119133.6 Ų133.683%0.83275%0.75SS**  trans-70.6126.2176.640.50000110.1Q209Q209-S211 PolarHBondContact O-N 3.12Å
212S33Very low38Very low101 Ų101131.3 Ų131.371%0.70675%0.746SS**  trans-54.2141.4-178.2-179.10000113.3P210 V214P210-S212 PolarHBondContact O-N 3.26Å; S212-V214 PolarHBondContact O-N 3.31Å; S212-V214 VanDerWaalsContact O-N 3.16Å
213P43.2Very low37.3Very low122 Ų122133.3 Ų133.379%0.79275%0.751SS**  trans-75.7105.9-172.530.1-32.9000111.1S215P213-S215 PolarHBondContact O-N 3.13Å
214V36.8Very low36.9Very low132 Ų132138.5 Ų138.580%0.877%0.766SS**  trans-75.6119.3169.7178.30000108.6S212 T216S212-V214 PolarHBondContact O-N 3.31Å; S212-V214 VanDerWaalsContact O-N 3.16Å; V214-T216 PolarHBondContact O-N 3.06Å
215S32.2Very low36.5Very low107 Ų107138.1 Ų138.175%0.74877%0.768SS**  trans-54.7110.2-178.7-1730000112.2P213 V217P213-S215 PolarHBondContact O-N 3.13Å; S215-V217 PolarHBondContact O-N 3.14Å
216T37.9Very low36.5Very low127 Ų127142 Ų14278%0.77977%0.774SS**  trans-78.7105.2174.6-45.60000108.9V214 S218V214-T216 PolarHBondContact O-N 3.06Å; T216-S218 PolarHBondContact O-N 2.74Å
217V33.4Very low36.5Very low130 Ų130140 Ų14079%0.78878%0.78SS**  trans-58.2121.1171.9179.50000108.9S215 E219S215-V217 PolarHBondContact O-N 3.14Å; V217-E219 PolarHBondContact O-N 3.25Å
218S33.5Very low36.4Very low115 Ų115140.8 Ų140.880%0.80478%0.784SS**  trans-7895.5-174-27.50000109.4T216T216-S218 PolarHBondContact O-N 2.74Å
219E31.2Very low36.5Very low189 Ų189138.2 Ų138.288%0.88378%0.776SS**  trans-80.1122.1172.8-156.1171.8-166.400109.4V217V217-E219 PolarHBondContact O-N 3.25Å
220S32.2Very low37.3Very low103 Ų103136.3 Ų136.372%0.7278%0.776SS**  trans-59.4137.2-16748.80000114.6T222S220-T222 PolarHBondContact O-N 3.28Å
221L32.9Very low38Very low158 Ų158138.3 Ų138.383%0.82777%0.774SS**  trans-51.787.4178.3-16976.8000113Q223L221-Q223 PolarHBondContact O-N 3.14Å; L221-Q223 VanDerWaalsContact O-N 3.07Å
222T33.6Very low38.5Very low118 Ų118143.3 Ų143.372%0.72478%0.775SS**  trans-75.796.9160.632.30000108.3S220 R224S220-T222 PolarHBondContact O-N 3.28Å; T222-R224 PolarHBondContact O-N 3.4Å
223Q33.9Very low39.4Very low166 Ų166144.9 Ų144.978%0.77677%0.771SS**  trans-63.669.7177.7-157.7175.927.900110.5L221 N225L221-Q223 PolarHBondContact O-N 3.14Å; L221-Q223 VanDerWaalsContact O-N 3.07Å; Q223-N225 PolarHBondContact O-N 2.74Å
224R36.2Very low40.4Very low207 Ų207141.8 Ų141.878%0.78175%0.752SS**  trans-79.6106.5169.6-72.4-171.6178.7165.51.7107.5T222 K226T222-R224 PolarHBondContact O-N 3.4Å; R224-K226 VanDerWaalsContact C-N 3.26Å; R224-K226 PolarHBondContact O-N 3.18Å
225N36.9Very low41.5Very low157 Ų157142.8 Ų142.884%0.8475%0.748SS**  trans-45.289.4166-85.3-38.6000110Q223 T227Q223-N225 PolarHBondContact O-N 2.74Å; N225-T227 PolarHBondContact O-N 3.01Å
226K45.1Very low43Very low165 Ų165145 Ų14572%0.71774%0.744SS**  trans-85.198.8167.8-73.1177.5-175.9175.20105.1R224 F228R224-K226 VanDerWaalsContact C-N 3.26Å; R224-K226 PolarHBondContact O-N 3.18Å; K226-F228 WeakPolarHBondContact O-CD2 3.45Å; K226-F228 PolarHBondContact O-N 3.32Å
227T43.2Very low44.3Very low133 Ų133142.1 Ų142.182%0.81672%0.724SS**  trans-48.997.3159.5-31.20000106.3N225 C229N225-T227 PolarHBondContact O-N 3.01Å; T227-C229 PolarHBondContact O-N 2.89Å
228F43.4Very low45.7Very low185 Ų185140.4 Ų140.481%0.81171%0.709SS**  trans-64.7101.1178.8-80.8-89.5000106.3K226 P230K226-F228 WeakPolarHBondContact O-CD2 3.45Å; K226-F228 PolarHBondContact O-N 3.32Å; F228-P230 WeakPolarHBondContact O-CD 3.13Å
229C38.3Very low46.9Very low90 Ų90139.1 Ų139.161%0.60869%0.693SS**  trans-65.1109.8158.2-71.60000105.8T227 H231 R232T227-C229 PolarHBondContact O-N 2.89Å; C229-H231 PolarHBondContact O-N 2.96Å; C229-R232 PolarHBondContact O-N 2.99Å
230P53Low48.2Very low109 Ų109135.6 Ų135.671%0.70868%0.676SS**THydrogen-bonded Turntrans-66-2.5-170.324.3-31.6000113.9F228F228-P230 WeakPolarHBondContact O-CD 3.13Å
231H50.8Low49.6Very low172 Ų172134.4 Ų134.480%0.79667%0.665SS**THydrogen-bonded Turntrans-118.19.8-174.6-76.464.1000114.7C229C229-H231 PolarHBondContact O-N 2.96Å
232R47.9Very low50.8Low224 Ų224132.5 Ų132.585%0.84566%0.655SS**  trans-11187167.7-85.5-172.9175.1174.6-0.2109.7C229 S234C229-R232 PolarHBondContact O-N 2.99Å; R232-S234 PolarHBondContact O-N 2.93Å
233H52.8Low52Low134 Ų134130.6 Ų130.662%0.6264%0.643SS**  trans-55129.3161.3-61-62.2000108.2D237H233-D237 HydrophobicContact CB-CB 4.27Å
234S63.2Low52.7Low56 Ų56131.1 Ų131.139%0.39264%0.639SS.*  trans-63.3149.4175.675.10000108.3R232 K236 D237 L238R232-S234 PolarHBondContact O-N 2.93Å; S234-K236 PolarHBondContact O-N 3.45Å; S234-D237 WeakPolarHBondContact CB-OD2 3.14Å; S234-D237 PolarHBondContact N-OD2 3.4Å; S234-D237 WeakPolarHBondContact O-CB 3.36Å; S234-D237 PolarHBondContact O-N 2.93Å; S234-D237 PolarHBondContact OG-OD2 2.89Å; S234-L238 PolarHBondContact O-N 3.19Å
235E60.3Low53.2Low153 Ų153126.9 Ų126.972%0.71563%0.632SS**Hα-helixtrans-51.9-30.9179.4-173.1-176.1175.500111.9L238 I239E235-L238 WeakPolarHBondContact O-CB 3.26Å; E235-L238 PolarHBondContact O-N 3.14Å; E235-I239 HydrophobicContact CG-CD1 4.03Å; E235-I239 VanDerWaalsContact O-CG1 3.25Å; E235-I239 WeakPolarHBondContact O-CG1 3.33Å; E235-I239 PolarHBondContact O-N 3.39Å
236K63.8Low53.7Low155 Ų155128.4 Ų128.467%0.67463%0.626SS**Hα-helixtrans-61.8-43.8174.1-65.3-174.6178.6-176.40112.7S234 L238 I239 Q240S234-K236 PolarHBondContact O-N 3.45Å; K236-L238 VanDerWaalsContact C-N 3.33Å; K236-I239 PolarHBondContact O-N 3Å; K236-Q240 WeakPolarHBondContact O-CB 3.44Å; K236-Q240 PolarHBondContact O-N 3.49Å
237D64.2Low53.7Low65 Ų65125.7 Ų125.735%0.34863%0.625SS.*Hα-helixtrans-67.2-39.5178.7-52.8-40.1000110.3H233 S234 Q240 T241H233-D237 HydrophobicContact CB-CB 4.27Å; S234-D237 WeakPolarHBondContact CB-OD2 3.14Å; S234-D237 PolarHBondContact N-OD2 3.4Å; S234-D237 WeakPolarHBondContact O-CB 3.36Å; S234-D237 PolarHBondContact O-N 2.93Å; S234-D237 PolarHBondContact OG-OD2 2.89Å; D237-Q240 PolarHBondContact O-N 3.12Å; D237-T241 WeakPolarHBondContact O-CB 3.47Å; D237-T241 PolarHBondContact O-N 3.38Å; D237-T241 PolarHBondContact O-OG1 3.28Å
238L62.9Low54.2Low94 Ų94129 Ų12949%0.49263%0.628SS.*Hα-helixtrans-60.4-46.4174.5-111151.2000111.6S234 E235 K236 T241 L242S234-L238 PolarHBondContact O-N 3.19Å; E235-L238 WeakPolarHBondContact O-CB 3.26Å; E235-L238 PolarHBondContact O-N 3.14Å; K236-L238 VanDerWaalsContact C-N 3.33Å; L238-T241 PolarHBondContact O-N 3.12Å; L238-L242 HydrophobicContact CD2-CD1 4.27Å; L238-L242 WeakPolarHBondContact O-CB 3.44Å; L238-L242 WeakPolarHBondContact O-CD1 3.5Å; L238-L242 PolarHBondContact O-N 2.91Å
239I58.8Low54.6Low89 Ų89125.2 Ų125.246%0.45662%0.62SS.*Hα-helixtrans-65.1-43.3175.9-67166.2000110.4E235 K236 T241 L242 V243E235-I239 HydrophobicContact CG-CD1 4.03Å; E235-I239 VanDerWaalsContact O-CG1 3.25Å; E235-I239 WeakPolarHBondContact O-CG1 3.33Å; E235-I239 PolarHBondContact O-N 3.39Å; K236-I239 PolarHBondContact O-N 3Å; I239-T241 VanDerWaalsContact C-N 3.32Å; I239-T241 PolarHBondContact O-N 2.93Å; I239-L242 PolarHBondContact O-N 2.82Å; I239-V243 HydrophobicContact CG2-CG2 3.92Å; I239-V243 VanDerWaalsContact O-CB 3.3Å; I239-V243 WeakPolarHBondContact O-CB 3.46Å; I239-V243 VanDerWaalsContact O-CG2 3.23Å; I239-V243 WeakPolarHBondContact O-CG2 3.48Å; I239-V243 PolarHBondContact O-N 3.44Å
240Q58.1Low55.2Low114 Ų114130.3 Ų130.353%0.53363%0.632SS.*Hα-helixtrans-63.1-41.3179.8-163.5173.8-2.100111.1K236 D237 V243 Y244K236-Q240 WeakPolarHBondContact O-CB 3.44Å; K236-Q240 PolarHBondContact O-N 3.49Å; D237-Q240 PolarHBondContact O-N 3.12Å; Q240-V243 PolarHBondContact O-N 3Å; Q240-Y244 HydrophobicContact CB-CD2 4.36Å; Q240-Y244 HydrophobicContact CG-CD2 3.62Å; Q240-Y244 HydrophobicContact CG-CE2 4.15Å; Q240-Y244 WeakPolarHBondContact O-CB 3.47Å; Q240-Y244 WeakPolarHBondContact O-CD2 3.5Å; Q240-Y244 PolarHBondContact O-N 2.82Å
241T61.4Low55.3Low78 Ų78133.2 Ų133.248%0.47964%0.636SS.*Hα-helixtrans-64.4-43.3174.7-44.90000111D237 L238 I239 N245D237-T241 WeakPolarHBondContact O-CB 3.47Å; D237-T241 PolarHBondContact O-N 3.38Å; D237-T241 PolarHBondContact O-OG1 3.28Å; L238-T241 PolarHBondContact O-N 3.12Å; I239-T241 VanDerWaalsContact C-N 3.32Å; I239-T241 PolarHBondContact O-N 2.93Å; T241-N245 HydrophobicContact CG2-CB 4.34Å; T241-N245 WeakPolarHBondContact O-CA 3.41Å; T241-N245 VanDerWaalsContact O-CB 3.26Å; T241-N245 WeakPolarHBondContact O-CB 3.48Å; T241-N245 PolarHBondContact O-N 2.76Å; T241-N245 VanDerWaalsContact O-N 3.13Å
242L58.4Low55.5Low118 Ų118136.4 Ų136.462%0.61864%0.641SS**Hα-helixtrans-69.6-33.2179.2-89.4155.9000114.4L238 I239L238-L242 HydrophobicContact CD2-CD1 4.27Å; L238-L242 WeakPolarHBondContact O-CB 3.44Å; L238-L242 WeakPolarHBondContact O-CD1 3.5Å; L238-L242 PolarHBondContact O-N 2.91Å; I239-L242 PolarHBondContact O-N 2.82Å
243V58.6Low56.4Low79 Ų79129.1 Ų129.148%0.47962%0.619SS.*Hα-helixtrans-89.5-45.1-175.2174.60000111.1I239 Q240I239-V243 HydrophobicContact CG2-CG2 3.92Å; I239-V243 VanDerWaalsContact O-CB 3.3Å; I239-V243 WeakPolarHBondContact O-CB 3.46Å; I239-V243 VanDerWaalsContact O-CG2 3.23Å; I239-V243 WeakPolarHBondContact O-CG2 3.48Å; I239-V243 PolarHBondContact O-N 3.44Å; Q240-V243 PolarHBondContact O-N 3Å
244Y49.1Very low57Low177 Ų177125.2 Ų125.269%0.69461%0.606SS**Hα-helixtrans-98.9-28.7-171.4-62.2-79.7000113.7Q240 R246Q240-Y244 HydrophobicContact CB-CD2 4.36Å; Q240-Y244 HydrophobicContact CG-CD2 3.62Å; Q240-Y244 HydrophobicContact CG-CE2 4.15Å; Q240-Y244 WeakPolarHBondContact O-CB 3.47Å; Q240-Y244 WeakPolarHBondContact O-CD2 3.5Å; Q240-Y244 PolarHBondContact O-N 2.82Å; Y244-R246 PolarHBondContact O-N 3.35Å
245N46.7Very low57.5Low118 Ų118133.6 Ų133.663%0.63163%0.629SS**  trans-91.136.6172.8-59.4-24000111.7T241 P247T241-N245 HydrophobicContact CG2-CB 4.34Å; T241-N245 WeakPolarHBondContact O-CA 3.41Å; T241-N245 VanDerWaalsContact O-CB 3.26Å; T241-N245 WeakPolarHBondContact O-CB 3.48Å; T241-N245 PolarHBondContact O-N 2.76Å; T241-N245 VanDerWaalsContact O-N 3.13Å; N245-P247 WeakPolarHBondContact O-CD 3.25Å
246R48Very low58.1Low189 Ų189134 Ų13471%0.71363%0.631SS**  trans-71.7112159.4-77.6-170.8-178.1-179.1-0.3106.7Y244 K248Y244-R246 PolarHBondContact O-N 3.35Å; R246-K248 PolarHBondContact O-N 3.49Å
247P45.6Very low58.6Low107 Ų107131.3 Ų131.370%0.69562%0.621SS**  trans-54.6122172.821-29.8000107.7N245 V249N245-P247 WeakPolarHBondContact O-CD 3.25Å; P247-V249 PolarHBondContact O-N 3.03Å
248K52.7Low58.9Low204 Ų204134.5 Ų134.589%0.88763%0.629SS**SBendtrans-62.9-9.3-178.5-72.8-178177.4178.70112.8R246R246-K248 PolarHBondContact O-N 3.49Å
249V52.6Low59.1Low104 Ų104133.6 Ų133.663%0.6363%0.631SS**SBendtrans-92.2103.4172.1-168.80000107P247 Q251P247-V249 PolarHBondContact O-N 3.03Å; V249-Q251 HydrophobicContact CG1-CG 4.08Å; V249-Q251 PolarHBondContact O-N 3.2Å
250F49.6Very low60Low198 Ų198135 Ų13587%0.86863%0.634SS**  trans-63.770.4163.4-70.2-88.9000109R252F250-R252 VanDerWaalsContact C-N 3.26Å; F250-R252 PolarHBondContact O-N 2.87Å
251Q54.8Low60.4Low169 Ų169133.4 Ų133.479%0.7963%0.629SS**  trans-64.3101.6158.8-88-177.3-4.900105.2V249 L253V249-Q251 HydrophobicContact CG1-CG 4.08Å; V249-Q251 PolarHBondContact O-N 3.2Å; Q251-L253 PolarHBondContact O-N 3.03Å
252R56.7Low60.6Low239 Ų239133.1 Ų133.190%0.90262%0.624SS**  trans-51.6111.5166.9-76.3-179.6173.7172.6-1.3106F250 S254F250-R252 VanDerWaalsContact C-N 3.26Å; F250-R252 PolarHBondContact O-N 2.87Å; R252-S254 PolarHBondContact O-N 3.16Å
253L65.4Low60.9Low72 Ų72132.9 Ų132.938%0.37762%0.62SS.*  trans-51134.1172.9-68.9169.7000107.8Q251 Q257 Y258 L261Q251-L253 PolarHBondContact O-N 3.03Å; L253-Q257 VanDerWaalsContact CA-OE1 3.31Å; L253-Q257 HydrophobicContact CB-CB 4.1Å; L253-Q257 HydrophobicContact CD2-CB 4.26Å; L253-Q257 VanDerWaalsContact CD2-OE1 3.3Å; L253-Y258 HydrophobicContact CB-CD2 3.57Å; L253-Y258 HydrophobicContact CB-CE2 3.81Å; L253-Y258 HydrophobicContact CD1-CD2 4.16Å; L253-Y258 HydrophobicContact CD1-CE2 3.95Å; L253-Y258 HydrophobicContact CG-CD2 4.49Å; L253-Y258 HydrophobicContact CG-CE2 4.38Å; L253-L261 HydrophobicContact CD1-CD1 3.79Å
254S66.2Low61Low52 Ų52134 Ų13436%0.36462%0.621SS.*  trans-58.9154.3176.877.30000109.4R252 E256 Q257 Y258R252-S254 PolarHBondContact O-N 3.16Å; S254-E256 PolarHBondContact O-N 3.1Å; S254-Q257 WeakPolarHBondContact O-CB 3.3Å; S254-Q257 PolarHBondContact O-N 2.83Å; S254-Q257 WeakPolarHBondContact OG-CG 3.35Å; S254-Q257 PolarHBondContact OG-N 2.84Å; S254-Y258 PolarHBondContact O-N 2.89Å
255R74.5Confident61.6Low232 Ų232134.7 Ų134.788%0.87562%0.622SS**Hα-helixtrans-51.4-35178.4-176.8178.3178.5-176.6-0.3111.8S259R255-S259 WeakPolarHBondContact O-CB 3.31Å; R255-S259 PolarHBondContact O-N 3.37Å
256E72.4Confident61.9Low160 Ų160136.9 Ų136.975%0.74863%0.626SS**Hα-helixtrans-68.9-43.8178-62.8178.6-179.500112.3S254 Y258 S259 F260S254-E256 PolarHBondContact O-N 3.1Å; E256-Y258 VanDerWaalsContact C-N 3.34Å; E256-Y258 PolarHBondContact O-N 2.96Å; E256-S259 WeakPolarHBondContact O-CB 3.23Å; E256-S259 PolarHBondContact O-N 3.01Å; E256-F260 WeakPolarHBondContact O-CB 3.37Å; E256-F260 PolarHBondContact O-N 3.28Å
257Q73.7Confident61.9Low99 Ų99133.8 Ų133.846%0.46362%0.618SS.*Hα-helixtrans-63-41.2175.7-71.3171.4-20.400111.7L253 S254 F260 L261L253-Q257 VanDerWaalsContact CA-OE1 3.31Å; L253-Q257 HydrophobicContact CB-CB 4.1Å; L253-Q257 HydrophobicContact CD2-CB 4.26Å; L253-Q257 VanDerWaalsContact CD2-OE1 3.3Å; S254-Q257 WeakPolarHBondContact O-CB 3.3Å; S254-Q257 PolarHBondContact O-N 2.83Å; S254-Q257 WeakPolarHBondContact OG-CG 3.35Å; S254-Q257 PolarHBondContact OG-N 2.84Å; Q257-F260 PolarHBondContact O-N 3.23Å; Q257-L261 WeakPolarHBondContact O-CG 3.39Å; Q257-L261 PolarHBondContact O-N 3.13Å
258Y71.3Confident62Low133 Ų133132.2 Ų132.252%0.52261%0.61SS.*Hα-helixtrans-64.1-41.7174.7-110.9-72.7000112.2L253 S254 E256 L261 N262L253-Y258 HydrophobicContact CB-CD2 3.57Å; L253-Y258 HydrophobicContact CB-CE2 3.81Å; L253-Y258 HydrophobicContact CD1-CD2 4.16Å; L253-Y258 HydrophobicContact CD1-CE2 3.95Å; L253-Y258 HydrophobicContact CG-CD2 4.49Å; L253-Y258 HydrophobicContact CG-CE2 4.38Å; S254-Y258 PolarHBondContact O-N 2.89Å; E256-Y258 VanDerWaalsContact C-N 3.34Å; E256-Y258 PolarHBondContact O-N 2.96Å; Y258-L261 PolarHBondContact O-N 2.98Å; Y258-N262 WeakPolarHBondContact O-CB 3.42Å; Y258-N262 VanDerWaalsContact O-CG 3.31Å; Y258-N262 PolarHBondContact O-N 3.45Å; Y258-N262 PolarHBondContact O-ND2 2.98Å
259S67.4Low61.9Low75 Ų75128 Ų12852%0.52460%0.601SS.*Hα-helixtrans-61.4-45.5176-169.70000111.3R255 E256 N262 Q263R255-S259 WeakPolarHBondContact O-CB 3.31Å; R255-S259 PolarHBondContact O-N 3.37Å; E256-S259 WeakPolarHBondContact O-CB 3.23Å; E256-S259 PolarHBondContact O-N 3.01Å; S259-N262 PolarHBondContact O-N 2.77Å; S259-Q263 WeakPolarHBondContact O-CB 2.94Å; S259-Q263 PolarHBondContact O-N 3.07Å
260F76.2Confident61.4Low117 Ų117131.8 Ų131.851%0.51361%0.606SS.*Hα-helixtrans-61.3-47.6176.8178.7-101.3000112.2E256 Q257 N262 Q263 M264E256-F260 WeakPolarHBondContact O-CB 3.37Å; E256-F260 PolarHBondContact O-N 3.28Å; Q257-F260 PolarHBondContact O-N 3.23Å; F260-N262 VanDerWaalsContact C-N 3.32Å; F260-N262 PolarHBondContact O-N 3Å; F260-Q263 WeakPolarHBondContact O-CB 3.34Å; F260-Q263 PolarHBondContact O-N 2.72Å; F260-M264 HydrophobicContact CD1-CG 4.27Å; F260-M264 HydrophobicContact CE1-CG 3.87Å; F260-M264 HydrophobicContact CE2-CG 4.15Å; F260-M264 HydrophobicContact CE2-SD 4.34Å; F260-M264 HydrophobicContact CZ-CE 4.48Å; F260-M264 HydrophobicContact CZ-CG 3.8Å; F260-M264 HydrophobicContact CZ-SD 4.11Å; F260-M264 WeakPolarHBondContact O-CG 3.39Å; F260-M264 PolarHBondContact O-N 3.14Å
261L67.9Low61.2Low82 Ų82127.3 Ų127.343%0.42959%0.587SS.*Hα-helixtrans-62.9-38177.5-74.6173.9000112.6L253 Q257 Y258 M264 R265L253-L261 HydrophobicContact CD1-CD1 3.79Å; Q257-L261 WeakPolarHBondContact O-CG 3.39Å; Q257-L261 PolarHBondContact O-N 3.13Å; Y258-L261 PolarHBondContact O-N 2.98Å; L261-M264 PolarHBondContact O-N 3.47Å; L261-R265 WeakPolarHBondContact O-CB 2.98Å; L261-R265 PolarHBondContact O-N 3.06Å
262N64.8Low60.8Low71 Ų71124.5 Ų124.538%0.3858%0.578SS.*Hα-helixtrans-64.8-44.8174-77.3-21.2000110.8Y258 S259 F260 M264 R265 F266Y258-N262 WeakPolarHBondContact O-CB 3.42Å; Y258-N262 VanDerWaalsContact O-CG 3.31Å; Y258-N262 PolarHBondContact O-N 3.45Å; Y258-N262 PolarHBondContact O-ND2 2.98Å; S259-N262 PolarHBondContact O-N 2.77Å; F260-N262 VanDerWaalsContact C-N 3.32Å; F260-N262 PolarHBondContact O-N 3Å; N262-M264 VanDerWaalsContact C-N 3.28Å; N262-M264 PolarHBondContact O-N 3.13Å; N262-R265 PolarHBondContact O-N 3.33Å; N262-F266 HydrophobicContact CB-CE2 4.34Å; N262-F266 WeakPolarHBondContact O-CD2 3.47Å; N262-F266 PolarHBondContact O-N 3.4Å
263Q65.4Low60.2Low114 Ų114117 Ų11753%0.53356%0.562SS.*Hα-helixtrans-59.6-40.4176.4-161.5177.32400111.7S259 F260 K267S259-Q263 WeakPolarHBondContact O-CB 2.94Å; S259-Q263 PolarHBondContact O-N 3.07Å; F260-Q263 WeakPolarHBondContact O-CB 3.34Å; F260-Q263 PolarHBondContact O-N 2.72Å; Q263-K267 WeakPolarHBondContact O-CG 3.32Å; Q263-K267 PolarHBondContact O-N 3Å
264M60.4Low59.1Low102 Ų102119.9 Ų119.950%0.50257%0.571SS.*Hα-helixtrans-69.4-38.1175.7-66.9-63.2-81.600112.5F260 L261 N262 F266 K267F260-M264 HydrophobicContact CD1-CG 4.27Å; F260-M264 HydrophobicContact CE1-CG 3.87Å; F260-M264 HydrophobicContact CE2-CG 4.15Å; F260-M264 HydrophobicContact CE2-SD 4.34Å; F260-M264 HydrophobicContact CZ-CE 4.48Å; F260-M264 HydrophobicContact CZ-CG 3.8Å; F260-M264 HydrophobicContact CZ-SD 4.11Å; F260-M264 WeakPolarHBondContact O-CG 3.39Å; F260-M264 PolarHBondContact O-N 3.14Å; L261-M264 PolarHBondContact O-N 3.47Å; N262-M264 VanDerWaalsContact C-N 3.28Å; N262-M264 PolarHBondContact O-N 3.13Å; M264-F266 VanDerWaalsContact C-N 3.35Å; M264-F266 PolarHBondContact O-N 3.23Å; M264-K267 PolarHBondContact O-N 3.23Å; M264-K267 VanDerWaalsContact O-N 3.14Å
265R60.2Low58.1Low192 Ų192122 Ų12273%0.72558%0.578SS**Hα-helixtrans-62.2-40.3174.9-88.3-173.8-180-170.81.7112.5L261 N262 K267 S268L261-R265 WeakPolarHBondContact O-CB 2.98Å; L261-R265 PolarHBondContact O-N 3.06Å; N262-R265 PolarHBondContact O-N 3.33Å; R265-K267 PolarHBondContact O-N 3.46Å; R265-S268 WeakPolarHBondContact O-CB 3.21Å; R265-S268 PolarHBondContact O-N 3.4Å; R265-S268 PolarHBondContact O-OG 2.82Å
266F53.2Low56.8Low163 Ų163117.2 Ų117.272%0.71557%0.57SS**Hα-helixtrans-72.6-15.9176.8-68.7-63.9000113.1N262 M264 S268N262-F266 HydrophobicContact CB-CE2 4.34Å; N262-F266 WeakPolarHBondContact O-CD2 3.47Å; N262-F266 PolarHBondContact O-N 3.4Å; M264-F266 VanDerWaalsContact C-N 3.35Å; M264-F266 PolarHBondContact O-N 3.23Å; F266-S268 VanDerWaalsContact C-N 3.29Å
267K49.4Very low55.4Low124 Ų124115.4 Ų115.454%0.53957%0.565SS.*THydrogen-bonded Turntrans-88.315.8170.8-70.2-174.4177.3-170.50113.7Q263 M264 R265 T269Q263-K267 WeakPolarHBondContact O-CG 3.32Å; Q263-K267 PolarHBondContact O-N 3Å; M264-K267 PolarHBondContact O-N 3.23Å; M264-K267 VanDerWaalsContact O-N 3.14Å; R265-K267 PolarHBondContact O-N 3.46Å; K267-T269 PolarHBondContact O-N 3.15Å
268S46.4Very low53.9Low75 Ų75114.9 Ų114.952%0.52457%0.572SS.*SBendtrans-70.598.3177.352.30000112.1R265 F266 Y270R265-S268 WeakPolarHBondContact O-CB 3.21Å; R265-S268 PolarHBondContact O-N 3.4Å; R265-S268 PolarHBondContact O-OG 2.82Å; F266-S268 VanDerWaalsContact C-N 3.29Å; S268-Y270 PolarHBondContact O-N 3.21Å
269T50.9Low52.2Low114 Ų114113.5 Ų113.570%0.69958%0.58SS**SBendtrans61.9-24.5151.8-26.10000119.4K267K267-T269 PolarHBondContact O-N 3.15Å
270Y42.3Very low50.8Low185 Ų185114.5 Ų114.573%0.72559%0.587SS**SBendtrans-101.3-19.7179.7-67.6-77.9000113.3S268 F274S268-Y270 PolarHBondContact O-N 3.21Å; Y270-F274 VanDerWaalsContact O-CD2 3.32Å; Y270-F274 WeakPolarHBondContact O-CD2 3.26Å
271Q45.6Very low48.9Very low103 Ų103115.8 Ų115.848%0.48160%0.599SS.*Hα-helixtrans-80.1-30.4-174.8-151.874.728.900113.4S273 F274 N275Q271-S273 PolarHBondContact O-N 2.95Å; Q271-F274 PolarHBondContact O-N 2.77Å; Q271-N275 PolarHBondContact O-N 3.11Å; Q271-N275 VanDerWaalsContact O-N 3.13Å
272D45.9Very low47.6Very low111 Ų111118.8 Ų118.859%0.59461%0.611SS**Hα-helixtrans-64.4-31178.3-73.4-17.3000111.7F274D272-F274 VanDerWaalsContact C-N 3.32Å; D272-F274 PolarHBondContact O-N 3.08Å
273S45.2Very low46.2Very low80 Ų80123.2 Ų123.256%0.55963%0.633SS**Hα-helixtrans-68.4-28.6174.1-38.50000113.2Q271Q271-S273 PolarHBondContact O-N 2.95Å
274F42.2Very low44.7Very low133 Ų133127.3 Ų127.358%0.58364%0.644SS**Hα-helixtrans-94.3-19.8-176.3-80.6-74000114.1Y270 Q271 D272 L276 L277Y270-F274 VanDerWaalsContact O-CD2 3.32Å; Y270-F274 WeakPolarHBondContact O-CD2 3.26Å; Q271-F274 PolarHBondContact O-N 2.77Å; D272-F274 VanDerWaalsContact C-N 3.32Å; D272-F274 PolarHBondContact O-N 3.08Å; F274-L276 PolarHBondContact O-N 2.76Å; F274-L277 PolarHBondContact O-N 3.04Å; F274-L277 VanDerWaalsContact O-N 3.12Å
275N43.9Very low43.5Very low96 Ų96129.7 Ų129.751%0.51366%0.659SS.*Hα-helixtrans-67.4-18.4173.7-77.2-20.9000112.9Q271 L277 S278Q271-N275 PolarHBondContact O-N 3.11Å; Q271-N275 VanDerWaalsContact O-N 3.13Å; N275-L277 PolarHBondContact O-N 2.93Å; N275-S278 PolarHBondContact O-N 2.74Å
276L47.8Very low42.5Very low132 Ų132126 Ų12669%0.69165%0.652SS**THydrogen-bonded Turntrans-68-20.9172.8-122.8147.9000112.9F274F274-L276 PolarHBondContact O-N 2.76Å
277L43.2Very low41.8Very low122 Ų122124.9 Ų124.964%0.63965%0.654SS**THydrogen-bonded Turntrans-82-22.7179.2-108.578.2000113.9F274 N275 C279 C280F274-L277 PolarHBondContact O-N 3.04Å; F274-L277 VanDerWaalsContact O-N 3.12Å; N275-L277 PolarHBondContact O-N 2.93Å; L277-C279 VanDerWaalsContact C-N 3.29Å; L277-C279 PolarHBondContact O-N 2.93Å; L277-C280 PolarHBondContact O-N 3.38Å
278S41.7Very low41.6Very low88 Ų88127.6 Ų127.662%0.61567%0.668SS**G310 helixtrans-76-16.1-178.5-170.50000113.7N275 C280N275-S278 PolarHBondContact O-N 2.74Å; S278-C280 VanDerWaalsContact C-N 3.31Å
279C36.8Very low41.2Very low104 Ų104131 Ų13170%0.70368%0.681SS**G310 helixtrans-82.4-7.6176.7-57.30000113.3L277L277-C279 VanDerWaalsContact C-N 3.29Å; L277-C279 PolarHBondContact O-N 2.93Å
280C37.3Very low40.5Very low97 Ų97129.8 Ų129.866%0.65568%0.676SS**G310 helixtrans-89.53.8-178.8-66.10000114.4L277 S278 Q282L277-C280 PolarHBondContact O-N 3.38Å; S278-C280 VanDerWaalsContact C-N 3.31Å; C280-Q282 PolarHBondContact O-N 2.94Å; C280-Q282 VanDerWaalsContact O-N 3.15Å
281N35.4Very low40.3Very low143 Ų143128.7 Ų128.777%0.76568%0.679SS**G310 helixtrans-74.910.1169.3-73.4-11.8000113.4L283N281-L283 VanDerWaalsContact C-N 3.26Å; N281-L283 PolarHBondContact O-N 3.16Å
282Q40.8Very low40.1Very low146 Ų146130.2 Ų130.268%0.68268%0.684SS**SBendtrans-66.898.2155.7-83.3-174.5-4.600107.8C280 R284C280-Q282 PolarHBondContact O-N 2.94Å; C280-Q282 VanDerWaalsContact O-N 3.15Å; Q282-R284 PolarHBondContact O-N 3.05Å
283L37.2Very low40.2Very low163 Ų163129 Ų12985%0.85368%0.682SS**  trans-49.576.7167.9-155.990.3000109.6N281 N285N281-L283 VanDerWaalsContact C-N 3.26Å; N281-L283 PolarHBondContact O-N 3.16Å; L283-N285 PolarHBondContact O-N 2.58Å
284R33.3Very low40.6Very low200 Ų200130.8 Ų130.876%0.75569%0.69SS**  trans-74.6118.8164.8-69-167.1-172.5-165.73104.9Q282 I286Q282-R284 PolarHBondContact O-N 3.05Å; R284-I286 PolarHBondContact O-N 2.68Å
285N34.3Very low40.7Very low152 Ų152130.7 Ų130.781%0.81369%0.691SS**  trans-55.197.1161.4-83.5-26.2000106.4L283 D287L283-N285 PolarHBondContact O-N 2.58Å; N285-D287 PolarHBondContact O-N 2.94Å; N285-D287 VanDerWaalsContact O-N 3.14Å
286I40.7Very low40.9Very low116 Ų116130.9 Ų130.960%0.59569%0.689SS**  trans-76.499.1172.3-63.7165.9000104R284 Q288R284-I286 PolarHBondContact O-N 2.68Å; I286-Q288 PolarHBondContact O-N 3.37Å
287D37.5Very low41.2Very low138 Ų138129.1 Ų129.174%0.73868%0.679SS**  trans-47.9123161.5-89-30.3000107.4N285 D289N285-D287 PolarHBondContact O-N 2.94Å; N285-D287 VanDerWaalsContact O-N 3.14Å; D287-D289 PolarHBondContact O-N 3.43Å
288Q45.7Very low41.4Very low181 Ų181128.6 Ų128.685%0.84667%0.669SS**G310 helixtrans-66.34.7-169.8-75.9-179.4-19.200114.3I286I286-Q288 PolarHBondContact O-N 3.37Å
289D37.9Very low41.8Very low147 Ų147129.7 Ų129.779%0.78667%0.665SS**G310 helixtrans-87-2.7-176.3-73.2-16.1000114.8D287D287-D289 PolarHBondContact O-N 3.43Å
290C36.6Very low42.6Very low89 Ų89131 Ų13160%0.60167%0.669SS**G310 helixtrans-95.81.2-176.874.40000115.9K292C290-K292 PolarHBondContact O-N 2.69Å
291M38.4Very low43.6Very low161 Ų161134.6 Ų134.679%0.79367%0.673SS**  trans-83.448.6175.5-67.5-68.3176.400112.4
292K40.5Very low44.7Very low136 Ų136130.7 Ų130.759%0.59166%0.655SS**  trans-83123.4166.2-70.9-172.4174-164.40108.9C290 V294 E296C290-K292 PolarHBondContact O-N 2.69Å; K292-V294 PolarHBondContact O-N 2.75Å; K292-E296 WeakPolarHBondContact CD-OE2 3.25Å
293P47.2Very low45.2Very low84 Ų84126.8 Ų126.855%0.54565%0.654SS.*  trans-59.5138.3-176.623.8-31.9000109.9H295 E296P293-H295 PolarHBondContact O-N 3.09Å; P293-E296 PolarHBondContact O-N 2.83Å
294V54.5Low45.6Very low119 Ų119125.7 Ų125.772%0.72164%0.644SS**Hα-helixtrans-47.1-24.5-176.7175.80000113.7K292 I297 Y298K292-V294 PolarHBondContact O-N 2.75Å; V294-I297 PolarHBondContact O-N 2.7Å; V294-Y298 PolarHBondContact O-N 3.25Å
295H43.6Very low46.4Very low130 Ų130120.7 Ų120.760%0.60264%0.638SS**Hα-helixtrans-58.1-42.8173.2-83.6-72.3000114.2P293 I297 Y298 E299P293-H295 PolarHBondContact O-N 3.09Å; H295-I297 VanDerWaalsContact C-N 3.32Å; H295-I297 PolarHBondContact O-N 3.26Å; H295-Y298 PolarHBondContact O-N 3.24Å; H295-E299 PolarHBondContact O-N 2.83Å
296E49.4Very low47.1Very low101 Ų101117.6 Ų117.647%0.47262%0.621SS.*Hα-helixtrans-68.2-34179.8-76.6-172.9171.400111.8K292 P293 Y298 V300K292-E296 WeakPolarHBondContact CD-OE2 3.25Å; P293-E296 PolarHBondContact O-N 2.83Å; E296-Y298 VanDerWaalsContact C-N 3.33Å; E296-Y298 PolarHBondContact O-N 3.5Å; E296-V300 VanDerWaalsContact O-CG2 3.31Å; E296-V300 WeakPolarHBondContact O-CG2 3.39Å; E296-V300 PolarHBondContact O-N 3.05Å
297I52.3Low47.4Very low94 Ų94115.9 Ų115.948%0.48262%0.619SS.*Hα-helixtrans-70.2-33.5-176.5-55.5175.2000111.1V294 H295V294-I297 PolarHBondContact O-N 2.7Å; H295-I297 VanDerWaalsContact C-N 3.32Å; H295-I297 PolarHBondContact O-N 3.26Å
298Y47.7Very low47.8Very low112 Ų112115.7 Ų115.744%0.43962%0.617SS.*Hα-helixtrans-76.6-45.3-179-158.6-87.6000111.8V294 H295 E296 V300 K301 T302 L306V294-Y298 PolarHBondContact O-N 3.25Å; H295-Y298 PolarHBondContact O-N 3.24Å; E296-Y298 VanDerWaalsContact C-N 3.33Å; E296-Y298 PolarHBondContact O-N 3.5Å; Y298-V300 VanDerWaalsContact C-N 3.33Å; Y298-V300 PolarHBondContact O-N 2.78Å; Y298-K301 PolarHBondContact O-N 3.02Å; Y298-K301 VanDerWaalsContact O-N 3.11Å; Y298-T302 VanDerWaalsContact CD1-OG1 3.26Å; Y298-T302 WeakPolarHBondContact CD1-OG1 3.46Å; Y298-T302 HydrophobicContact CE1-CG2 4.15Å; Y298-T302 WeakPolarHBondContact CE1-OG1 3.46Å; Y298-T302 PolarHBondContact O-N 2.64Å; Y298-T302 VanDerWaalsContact O-N 3.07Å; Y298-T302 PolarHBondContact O-OG1 3.15Å; Y298-L306 HydrophobicContact CD1-CD1 3.51Å; Y298-L306 HydrophobicContact CD1-CD2 3.95Å; Y298-L306 HydrophobicContact CD1-CG 3.48Å; Y298-L306 VanDerWaalsContact CD1-CG 3.48Å; Y298-L306 HydrophobicContact CD2-CD1 4.3Å; Y298-L306 HydrophobicContact CE1-CD1 3.86Å; Y298-L306 HydrophobicContact CE1-CD2 3.41Å; Y298-L306 VanDerWaalsContact CE1-CD2 3.41Å; Y298-L306 HydrophobicContact CE1-CG 3.5Å; Y298-L306 VanDerWaalsContact CE1-CG 3.5Å; Y298-L306 HydrophobicContact CG-CD1 3.74Å; Y298-L306 HydrophobicContact CG-CG 4.24Å
299E49.8Very low47.9Very low111 Ų111111.5 Ų111.552%0.51960%0.604SS.*Hα-helixtrans-61.3-39.6179.4-83-173.2158.900112.6H295 K301 G303H295-E299 PolarHBondContact O-N 2.83Å; E299-K301 VanDerWaalsContact C-N 3.27Å; E299-K301 PolarHBondContact O-N 3.35Å; E299-G303 PolarHBondContact O-N 3.37Å; E299-G303 VanDerWaalsContact O-N 3.1Å
300V55.2Low48.1Very low131 Ų131111.6 Ų111.679%0.79460%0.6SS**Hα-helixtrans-66-29.4177.6174.50000112.2E296 Y298E296-V300 VanDerWaalsContact O-CG2 3.31Å; E296-V300 WeakPolarHBondContact O-CG2 3.39Å; E296-V300 PolarHBondContact O-N 3.05Å; Y298-V300 VanDerWaalsContact C-N 3.33Å; Y298-V300 PolarHBondContact O-N 2.78Å
301K57.2Low48.3Very low172 Ų172112.4 Ų112.475%0.74860%0.597SS**Hα-helixtrans-90.8-31.3-175.5-80.4-172.6176.6-177.10114.7Y298 E299Y298-K301 PolarHBondContact O-N 3.02Å; Y298-K301 VanDerWaalsContact O-N 3.11Å; E299-K301 VanDerWaalsContact C-N 3.27Å; E299-K301 PolarHBondContact O-N 3.35Å
302T59.8Low48.2Very low61 Ų61111.6 Ų111.637%0.37460%0.596SS.*Hα-helixtrans-117.3-8-173.254.40000114.1Y298 H304Y298-T302 VanDerWaalsContact CD1-OG1 3.26Å; Y298-T302 WeakPolarHBondContact CD1-OG1 3.46Å; Y298-T302 HydrophobicContact CE1-CG2 4.15Å; Y298-T302 WeakPolarHBondContact CE1-OG1 3.46Å; Y298-T302 PolarHBondContact O-N 2.64Å; Y298-T302 VanDerWaalsContact O-N 3.07Å; Y298-T302 PolarHBondContact O-OG1 3.15Å; T302-H304 PolarHBondContact O-CD2 3.09Å; T302-H304 VanDerWaalsContact O-CD2 3.26Å; T302-H304 PolarHBondContact O-N 3.25Å
303G51.3Low48.2Very low65 Ų65113.8 Ų113.867%0.6761%0.606SS**SBendtrans62.46.7175.900000114.7E299E299-G303 PolarHBondContact O-N 3.37Å; E299-G303 VanDerWaalsContact O-N 3.1Å
304H45Very low47.6Very low140 Ų140114 Ų11465%0.64862%0.615SS**SBendtrans-118.4120.4179.8-68.8-53.7000108.9T302 L306T302-H304 PolarHBondContact O-CD2 3.09Å; T302-H304 VanDerWaalsContact O-CD2 3.26Å; T302-H304 PolarHBondContact O-N 3.25Å; H304-L306 PolarHBondContact O-N 3.25Å; H304-L306 VanDerWaalsContact O-N 3.15Å
305P49Very low46.9Very low95 Ų95117 Ų11762%0.61762%0.618SS**  trans-60.6122.4171.625.5-31.4000107.4S307P305-S307 PolarHBondContact O-N 3.27Å
306L49.2Very low46.7Very low87 Ų87116 Ų11646%0.45562%0.623SS.*  trans-54.9113.3173.5-79.9166.9000107.6Y298 H304 L308Y298-L306 HydrophobicContact CD1-CD1 3.51Å; Y298-L306 HydrophobicContact CD1-CD2 3.95Å; Y298-L306 HydrophobicContact CD1-CG 3.48Å; Y298-L306 VanDerWaalsContact CD1-CG 3.48Å; Y298-L306 HydrophobicContact CD2-CD1 4.3Å; Y298-L306 HydrophobicContact CE1-CD1 3.86Å; Y298-L306 HydrophobicContact CE1-CD2 3.41Å; Y298-L306 VanDerWaalsContact CE1-CD2 3.41Å; Y298-L306 HydrophobicContact CE1-CG 3.5Å; Y298-L306 VanDerWaalsContact CE1-CG 3.5Å; Y298-L306 HydrophobicContact CG-CD1 3.74Å; Y298-L306 HydrophobicContact CG-CG 4.24Å; H304-L306 PolarHBondContact O-N 3.25Å; H304-L306 VanDerWaalsContact O-N 3.15Å; L306-L308 PolarHBondContact O-N 3.27Å; L306-L308 VanDerWaalsContact O-N 3.12Å
307S47.7Very low45.9Very low79 Ų79115.2 Ų115.255%0.55263%0.629SS**  trans-52.2122.8-178.960.40000108.8P305 T309P305-S307 PolarHBondContact O-N 3.27Å; S307-T309 PolarHBondContact O-N 3Å; S307-T309 PolarHBondContact O-OG1 3.1Å; S307-T309 PolarHBondContact OG-OG1 3.34Å
308L46.4Very low45Very low134 Ų134122 Ų12270%0.70265%0.649SS**G310 helixtrans-6314-172.8-127.883000114.7L306 H310 L311L306-L308 PolarHBondContact O-N 3.27Å; L306-L308 VanDerWaalsContact O-N 3.12Å; L308-H310 VanDerWaalsContact C-N 3.26Å; L308-H310 PolarHBondContact O-N 3.02Å; L308-L311 HydrophobicContact CD1-CD1 4.37Å; L308-L311 HydrophobicContact CG-CD1 4.05Å; L308-L311 PolarHBondContact O-N 3.22Å
309T46.6Very low44.2Very low94 Ų94125.1 Ų125.158%0.57767%0.665SS**G310 helixtrans-74.3-13.2-176.152.60000113.3S307 L311S307-T309 PolarHBondContact O-N 3Å; S307-T309 PolarHBondContact O-OG1 3.1Å; S307-T309 PolarHBondContact OG-OG1 3.34Å; T309-L311 VanDerWaalsContact C-N 3.35Å
310H41.9Very low43.3Very low149 Ų149125 Ų12569%0.6968%0.675SS**G310 helixtrans-87.1-2.4173.3-57.3-61.8000113.9L308L308-H310 VanDerWaalsContact C-N 3.26Å; L308-H310 PolarHBondContact O-N 3.02Å
311L41.2Very low42.1Very low106 Ų106126.1 Ų126.156%0.55567%0.672SS**G310 helixtrans-99.53178.9-83.4159.2000114.1L308 T309 F313L308-L311 HydrophobicContact CD1-CD1 4.37Å; L308-L311 HydrophobicContact CG-CD1 4.05Å; L308-L311 PolarHBondContact O-N 3.22Å; T309-L311 VanDerWaalsContact C-N 3.35Å; L311-F313 CarbonylContact O-C 3.5Å; L311-F313 PolarHBondContact O-N 2.76Å; L311-F313 VanDerWaalsContact O-N 3.13Å
312D36.6Very low40.8Very low144 Ų144125.3 Ų125.377%0.7768%0.675SS**  trans-75.911.9172-80.2-14.4000113.9A314D312-A314 PolarHBondContact O-N 3.07Å
313F39.9Very low39.5Very low182 Ų182127.8 Ų127.880%0.79869%0.686SS**SBendtrans-68.983.2147.5-66.4-72.1000107.1L311 K315L311-F313 CarbonylContact O-C 3.5Å; L311-F313 PolarHBondContact O-N 2.76Å; L311-F313 VanDerWaalsContact O-N 3.13Å; F313-K315 VanDerWaalsContact C-N 3.28Å; F313-K315 PolarHBondContact O-N 3.03Å
314A36Very low38.7Very low89 Ų89129.9 Ų129.974%0.73669%0.691SS**  trans-40.6101.1163.300000106.8D312 P316D312-A314 PolarHBondContact O-N 3.07Å; A314-P316 VanDerWaalsContact O-N 3.09Å
315K39.9Very low38.1Very low180 Ų180129.5 Ų129.578%0.78370%0.699SS**  trans-42.5127.1163.1-77.1175.5179173.10103.6F313 S317F313-K315 VanDerWaalsContact C-N 3.28Å; F313-K315 PolarHBondContact O-N 3.03Å; K315-S317 PolarHBondContact O-N 3.41Å
316P38.5Very low37.3Very low109 Ų109134 Ų13471%0.70871%0.709SS**  trans-57.994.4177.1-8.816.9000105.6A314 W318A314-P316 VanDerWaalsContact O-N 3.09Å; P316-W318 PolarHBondContact O-N 3.04Å
317S31.9Very low36.5Very low86 Ų86139 Ų13960%0.60173%0.727SS**  trans-69.8103.1170.758.90000100.3K315 K319K315-S317 PolarHBondContact O-N 3.41Å; S317-K319 PolarHBondContact O-N 2.82Å
318W35.3Very low35.8Very low235 Ų235142.1 Ų142.189%0.8974%0.737SS**  trans-58.886.8161.1-65.567.7000103.6P316 C320P316-W318 PolarHBondContact O-N 3.04Å; W318-C320 PolarHBondContact O-N 3.39Å
319K30.3Very low35.4Very low178 Ų178139.4 Ų139.477%0.77474%0.735SS**  trans-62.598.2165.7-72.1-172.9178.5-176.90102S317 Q321S317-K319 PolarHBondContact O-N 2.82Å; K319-Q321 PolarHBondContact O-N 3.41Å
320C30.9Very low34.8Very low109 Ų109140 Ų14074%0.73673%0.734SS**  trans-51.698.8157.8-73.70000104.1W318 N322W318-C320 PolarHBondContact O-N 3.39Å; C320-N322 PolarHBondContact O-N 2.84Å
321Q28.8Very low34.6Very low155 Ų155140.9 Ų140.972%0.72474%0.738SS**  trans-57117.2165-85177.8-25.200103.5K319 N323K319-Q321 PolarHBondContact O-N 3.41Å; Q321-N323 PolarHBondContact O-N 3.45Å
322N31.5Very low34.1Very low154 Ų154143 Ų14382%0.82474%0.743SS**  trans-63.862.9169.2-66-21.1000108.2C320 S324C320-N322 PolarHBondContact O-N 2.84Å; N322-S324 PolarHBondContact O-N 3.43Å; N322-S324 VanDerWaalsContact O-N 3.13Å
323N32.5Very low34Very low113 Ų113145 Ų14560%0.60475%0.746SS**  trans-81.290.1162.4-70.4-7.8000103.4Q321 T325Q321-N323 PolarHBondContact O-N 3.45Å; N323-T325 PolarHBondContact O-N 2.72Å
324S33.6Very low33.9Very low110 Ų110142.5 Ų142.577%0.76974%0.74SS**SBendtrans-54.979.9170.4530000109.6N322N322-S324 PolarHBondContact O-N 3.43Å; N322-S324 VanDerWaalsContact O-N 3.13Å
325T33.6Very low34.2Very low131 Ų131144.8 Ų144.880%0.80474%0.739SS**  trans-17432164.311.10000110.5N323 K327N323-T325 PolarHBondContact O-N 2.72Å; T325-K327 PolarHBondContact O-N 3.48Å
326F32.2Very low34.3Very low189 Ų189141.4 Ų141.483%0.82975%0.745SS**  trans-8696.3157.4-125.9-95.1000106.3D328F326-D328 PolarHBondContact O-N 3.3Å; F326-D328 VanDerWaalsContact O-N 3.13Å
327K31.2Very low34.3Very low193 Ų193144.9 Ų144.984%0.83975%0.749SS**  trans-57120.6166.2-75.9-154.3171.9-167.60106.5T325 A329T325-K327 PolarHBondContact O-N 3.48Å; K327-A329 PolarHBondContact O-N 2.9Å
328D34.1Very low34.7Very low144 Ų144148.2 Ų148.277%0.7776%0.759SS**  trans-40.2106.3175.8-62.6-52.1000108.7F326 D330F326-D328 PolarHBondContact O-N 3.3Å; F326-D328 VanDerWaalsContact O-N 3.13Å; D328-D330 PolarHBondContact O-N 3.37Å
329A36.3Very low34.8Very low78 Ų78144.8 Ų144.865%0.64575%0.751SS**  trans-70.387.6163.500000103.6K327 E331K327-A329 PolarHBondContact O-N 2.9Å; A329-E331 VanDerWaalsContact C-N 3.34Å; A329-E331 PolarHBondContact O-N 3.48Å
330D34.4Very low35.4Very low107 Ų107143 Ų14357%0.57275%0.749SS**  trans-44.5105.2170.8-68.8-25.6000107D328 K332D328-D330 PolarHBondContact O-N 3.37Å; D330-K332 HydrophobicContact CB-CD 4.31Å; D330-K332 HydrophobicContact CB-CG 3.87Å; D330-K332 PolarHBondContact O-N 3.33Å; D330-K332 VanDerWaalsContact OD2-CE 3.28Å; D330-K332 WeakPolarHBondContact OD2-CE 3.24Å; D330-K332 IonicContact OD2-NZ 3.45Å; D330-K332 PolarHBondContact OD2-NZ 3.49Å
331E37.6Very low35.9Very low166 Ų166143.9 Ų143.978%0.77675%0.751SS**  trans-68.672.1170.4-67.6-168.7160.800107A329 F333A329-E331 VanDerWaalsContact C-N 3.34Å; A329-E331 PolarHBondContact O-N 3.48Å; E331-F333 WeakPolarHBondContact O-CD2 3.03Å; E331-F333 PolarHBondContact O-N 3.29Å
332K32.1Very low36.7Very low150 Ų150142.3 Ų142.365%0.65275%0.752SS**  trans-73.198.5173.8-67.2-175.2-175.9172.90106.7D330 L334D330-K332 HydrophobicContact CB-CD 4.31Å; D330-K332 HydrophobicContact CB-CG 3.87Å; D330-K332 PolarHBondContact O-N 3.33Å; D330-K332 VanDerWaalsContact OD2-CE 3.28Å; D330-K332 WeakPolarHBondContact OD2-CE 3.24Å; D330-K332 IonicContact OD2-NZ 3.45Å; D330-K332 PolarHBondContact OD2-NZ 3.49Å; K332-L334 PolarHBondContact O-N 3.23Å
333F33.8Very low37.3Very low188 Ų188140.2 Ų140.283%0.82575%0.747SS**  trans-5873.9161.6-72.6-91000110E331 N335E331-F333 WeakPolarHBondContact O-CD2 3.03Å; E331-F333 PolarHBondContact O-N 3.29Å; F333-N335 PolarHBondContact O-N 2.92Å
334L36.8Very low37.8Very low129 Ų129140.8 Ų140.868%0.67576%0.758SS**  trans-84.4102168.6-103.2156000108.2K332K332-L334 PolarHBondContact O-N 3.23Å
335N42.6Very low38.2Very low136 Ų136140.7 Ų140.773%0.72775%0.753SS**THydrogen-bonded Turntrans57.760.3162.9-59.5-12.6000115.9F333 K337F333-N335 PolarHBondContact O-N 2.92Å; N335-K337 PolarHBondContact O-N 2.75Å
336A43.2Very low38.9Very low110 Ų110146.2 Ų146.291%0.90976%0.759SS**THydrogen-bonded Turntrans51.227.816300000116.1
337K38.7Very low39.4Very low182 Ų182147.2 Ų147.279%0.79176%0.759SS**  trans-109.497.1172.3-83.9-179179171.80110.2N335 K339N335-K337 PolarHBondContact O-N 2.75Å; K337-K339 PolarHBondContact O-N 3.07Å
338L39Very low39.7Very low155 Ų155141.9 Ų141.981%0.81276%0.759SS**  trans-64.6101.7176-144.7149.3000109L340L338-L340 HydrophobicContact CD2-CD2 4.16Å; L338-L340 HydrophobicContact CD2-CG 4.04Å; L338-L340 PolarHBondContact O-N 2.73Å; L338-L340 VanDerWaalsContact O-N 3.13Å
339K37.3Very low40.1Very low164 Ų164137.6 Ų137.671%0.71374%0.74SS**  trans-8585.9-176.9-161.8180-178.1-174.20108.5K337 T341K337-K339 PolarHBondContact O-N 3.07Å; K339-T341 PolarHBondContact O-N 3.01Å; K339-T341 VanDerWaalsContact O-N 3.07Å
340L43.3Very low40.6Very low141 Ų141141.5 Ų141.574%0.73875%0.75SS**  trans-63.3108.9173.6-77.8164.5000109.9L338 V342L338-L340 HydrophobicContact CD2-CD2 4.16Å; L338-L340 HydrophobicContact CD2-CG 4.04Å; L338-L340 PolarHBondContact O-N 2.73Å; L338-L340 VanDerWaalsContact O-N 3.13Å; L340-V342 PolarHBondContact O-N 2.91Å
341T41.3Very low41Very low127 Ų127144 Ų14478%0.77976%0.756SS**  trans-89.195.1173.3-470000107.1K339K339-T341 PolarHBondContact O-N 3.01Å; K339-T341 VanDerWaalsContact O-N 3.07Å
342V46.6Very low41.4Very low121 Ų121143.7 Ų143.773%0.73376%0.76SS**  trans-69.7126.3179-175.50000108.6L340 C344L340-V342 PolarHBondContact O-N 2.91Å; V342-C344 PolarHBondContact O-N 2.74Å
343P42.3Very low42.1Very low110 Ų110143.1 Ų143.171%0.71476%0.759SS**  trans-63.8131.4179.822.9-31.3000110.8T345P343-T345 PolarHBondContact O-N 3.13Å
344C43.6Very low42.6Very low126 Ų126141.1 Ų141.185%0.85176%0.757SS**  trans-54.8107.2-175.8-161.30000110.7V342V342-C344 PolarHBondContact O-N 2.74Å
345T42.8Very low43Very low107 Ų107144.5 Ų144.566%0.65676%0.761SS**  trans-65.7139175.649.60000110P343 Y347P343-T345 PolarHBondContact O-N 3.13Å; T345-Y347 PolarHBondContact O-N 2.67Å
346R47.3Very low43Very low248 Ų248145.5 Ų145.594%0.93676%0.764SS**SBendtrans-594.8-171.9-150.4-178.7-85.4-161.5-4.3115.9
347Y43.5Very low43.2Very low209 Ų209145.9 Ų145.982%0.8276%0.756SS**SBendtrans-102.2109.4176.9-69-77.4000109.3T345T345-Y347 PolarHBondContact O-N 2.67Å
348G36.8Very low43.2Very low82 Ų82149.2 Ų149.285%0.84576%0.763SS**  trans-57.4132-161.900000115.6
349S42.7Very low43.2Very low53 Ų53145.1 Ų145.137%0.37176%0.758SS.*  trans-158.3105.6133174.20000106.6K351 H353S349-K351 PolarHBondContact O-N 3.13Å; S349-K351 PolarHBondContact OG-N 3Å; S349-H353 WeakPolarHBondContact CB-NE2 3.44Å; S349-H353 PolarHBondContact OG-CE1 3.16Å; S349-H353 PolarHBondContact OG-NE2 2.98Å
350N47.4Very low43.3Very low161 Ų161144.8 Ų144.886%0.86176%0.763SS**  trans-79.914.9171.959.8-22.1000112.1
351K42.5Very low43.3Very low159 Ų159145 Ų14569%0.69176%0.763SS**SBendtrans-89.8128.2172.5-65.7-173.1178.1-176.10107.8S349 H353S349-K351 PolarHBondContact O-N 3.13Å; S349-K351 PolarHBondContact OG-N 3Å; K351-H353 VanDerWaalsContact C-N 3.29Å; K351-H353 PolarHBondContact O-CD2 2.78Å; K351-H353 PolarHBondContact O-N 2.84Å
352N46.6Very low43.4Very low159 Ų159144.2 Ų144.285%0.8576%0.76SS**  trans-54.297.3168.9-66.3-26.8000107.9N354N352-N354 PolarHBondContact O-N 3.03Å; N352-N354 VanDerWaalsContact O-N 3.16Å
353H45.4Very low43.5Very low139 Ų139144.2 Ų144.264%0.64476%0.761SS**  trans-65.4118.2169.8-67.4-72.6000106S349 K351 R355S349-H353 WeakPolarHBondContact CB-NE2 3.44Å; S349-H353 PolarHBondContact OG-CE1 3.16Å; S349-H353 PolarHBondContact OG-NE2 2.98Å; K351-H353 VanDerWaalsContact C-N 3.29Å; K351-H353 PolarHBondContact O-CD2 2.78Å; K351-H353 PolarHBondContact O-N 2.84Å; H353-R355 PolarHBondContact O-N 2.76Å
354N44.2Very low43.7Very low146 Ų146145.1 Ų145.178%0.78176%0.764SS**  trans-51.7120.6168.3-80.5-15.9000106.6N352 I356N352-N354 PolarHBondContact O-N 3.03Å; N352-N354 VanDerWaalsContact O-N 3.16Å; N354-I356 VanDerWaalsContact C-N 3.32Å; N354-I356 WeakPolarHBondContact O-CG1 3.34Å; N354-I356 PolarHBondContact O-N 3.35Å
355R46.7Very low44Very low199 Ų199146 Ų14675%0.75176%0.758SS**  trans-71.486.6-169.6-167.2177.7179.1-1771108.9H353 T357H353-R355 PolarHBondContact O-N 2.76Å; R355-T357 PolarHBondContact O-N 2.88Å
356I42.9Very low44.4Very low157 Ų157147 Ų14781%0.80577%0.765SS**  trans-80.870.6176.7-49.3166.7000108.2N354N354-I356 VanDerWaalsContact C-N 3.32Å; N354-I356 WeakPolarHBondContact O-CG1 3.34Å; N354-I356 PolarHBondContact O-N 3.35Å
357T46.6Very low44.5Very low118 Ų118141.1 Ų141.172%0.72476%0.756SS**  trans177.9109.1154.637.70000109.3R355R355-T357 PolarHBondContact O-N 2.88Å
358R38.1Very low44.9Very low253 Ų253139.3 Ų139.396%0.95578%0.784SS**  trans-96.994.4158.3-76.3-178.8171.8176.6-1.9106.8
359G39.4Very low45.3Very low68 Ų68142.2 Ų142.270%0.70178%0.781SS**PPolyproline II helixtrans-93.9123.9167.200000109.2
360I40.5Very low45.5Very low158 Ų158146.8 Ų146.881%0.8180%0.803SS**PPolyproline II helixtrans-84.6118.6168.9-60.5171.9000106.2P362I360-P362 WeakPolarHBondContact O-CD 3.28Å
361I42.7Very low45.4Very low146 Ų146146.1 Ų146.175%0.74980%0.8SS**PPolyproline II helixtrans-82.5117.6170.2-58173.4000106T363I361-T363 PolarHBondContact O-N 3.13Å; I361-T363 VanDerWaalsContact O-N 3.1Å
362P44.1Very low45.5Very low109 Ų109145.3 Ų145.371%0.70881%0.806SS**  trans-68.2110.3174.126.3-30.6000108.7I360 V364I360-P362 WeakPolarHBondContact O-CD 3.28Å; P362-V364 PolarHBondContact O-N 2.79Å
363T48.7Very low45.5Very low122 Ų122144.4 Ų144.475%0.74880%0.803SS**  trans-67.5113.716633.50000108.2I361 I365I361-T363 PolarHBondContact O-N 3.13Å; I361-T363 VanDerWaalsContact O-N 3.1Å; T363-I365 PolarHBondContact O-N 2.72Å; T363-I365 VanDerWaalsContact O-N 3.09Å
364V46.3Very low45.5Very low129 Ų129144.8 Ų144.878%0.78281%0.814SS**  trans-64.6107.7170.7178.80000107.2P362 T366P362-V364 PolarHBondContact O-N 2.79Å; V364-T366 PolarHBondContact O-N 2.86Å
365I49.4Very low45.5Very low144 Ų144144.7 Ų144.774%0.73882%0.816SS**  trans-75.8106.5169.7-59.6172.5000105.8T363 T367T363-I365 PolarHBondContact O-N 2.72Å; T363-I365 VanDerWaalsContact O-N 3.09Å; I365-T367 HydrophobicContact CG2-CG2 4.31Å; I365-T367 PolarHBondContact O-N 3.34Å
366T50Low45.5Very low129 Ų129140.5 Ų140.579%0.79182%0.821SS**  trans-77.499.5167.9-32.10000106.5V364 A368V364-T366 PolarHBondContact O-N 2.86Å; T366-A368 PolarHBondContact O-N 3.45Å
367T50.2Low45.7Very low124 Ų124139.2 Ų139.276%0.76182%0.823SS**  trans-69.5118.916847.30000107.8I365I365-T367 HydrophobicContact CG2-CG2 4.31Å; I365-T367 PolarHBondContact O-N 3.34Å
368A52.3Low45.6Very low170 Ų170141.1 Ų141.1100%1.40583%0.832SS**  trans-66.40171.600000111.5T366T366-A368 PolarHBondContact O-N 3.45Å

Retrieved 368 of 368 residues in 73.7 ms (Link to these results)