A0A3Q0KJL5_SCHMA Loading...

Srf homolog, putative

AlphaFold DB , UniProt , Accession A0A3Q0KJL5, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 447 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
1M47.1Very low37.8Very low242 Ų242143.6 Ų143.6100%1.19285%0.847SS**  0133.10-82.7168.3153.400107.7
2G49.2Very low37.7Very low82 Ų82143.2 Ų143.285%0.84584%0.838SS**  trans59.790.7166.600000117.5
3T33.8Very low37.6Very low132 Ų132144.5 Ų144.581%0.8184%0.84SS**  trans-146.1152170.448.50000112.7
4M37.7Very low37.2Very low185 Ų185139.6 Ų139.691%0.91184%0.835SS**  trans91.9130.9159.9-49.8-148.5124.800119.6
5E33.7Very low37.3Very low194 Ų194141.3 Ų141.391%0.90784%0.836SS**  trans-76.2163.3160.8-57.6161.5100.700110.5
6S40.7Very low36.8Very low118 Ų118144.6 Ų144.683%0.82583%0.832SS**  trans-158.2149.6151.6-168.40000111.7
7V33.6Very low36.7Very low141 Ų141148.9 Ų148.986%0.85584%0.839SS**  trans-122.4125.7176.4173.70000108.7
8A35.8Very low36.4Very low85 Ų85146.9 Ų146.970%0.70283%0.831SS**  trans-163.4137.1159.800000114
9H33Very low36.3Very low178 Ų178149.6 Ų149.682%0.82484%0.835SS**  trans-14.3151.6152.5-44.1-82.7000117.6
10S34.7Very low36.1Very low104 Ų104147.5 Ų147.573%0.72783%0.831SS**  175.9146.951.9-135.40000113.6
11V36.8Very low36Very low119 Ų119146.2 Ų146.272%0.72183%0.832SS**  trans32.2135.2156.3-81.90000125.8
12N35.9Very low35.6Very low138 Ų138139.8 Ų139.874%0.73881%0.808SS**  trans101.4142.1132.8-77-3.5000122.5
13N37.5Very low34.8Very low161 Ų161143.4 Ų143.486%0.86180%0.803SS**  trans65.3122.5171.2-54.3-13.3000116.1
14G31.2Very low34.8Very low75 Ų75144.1 Ų144.177%0.77381%0.807SS**  cis128.199.9-3.400000112.3
15I38.2Very low34.3Very low166 Ų166143.2 Ų143.285%0.85179%0.794SS**  trans-134.4147.8173.8-69.1-176.3000109.6
16Y29.3Very low34.2Very low194 Ų194142.7 Ų142.776%0.76179%0.789SS**  trans-71.2144.8-174.1-75.1-123.3000112.8T18Y16-T18 HydrophobicContact CD1-CG2 4.05Å
17F35.6Very low33.6Very low217 Ų217144.5 Ų144.595%0.95278%0.782SS**  trans-134.3113.1142.4-93.8-79.8000109
18T31.1Very low33.6Very low113 Ų113145 Ų14569%0.69378%0.779SS**  trans-117.5108.9176.947.50000108.9Y16Y16-T18 HydrophobicContact CD1-CG2 4.05Å
19E35.1Very low33.3Very low198 Ų198146.7 Ų146.793%0.92578%0.781SS**  trans-154.3147.7148.4-124.8174.6160.300112.7
20S32.1Very low33.5Very low107 Ų107147.3 Ų147.375%0.74878%0.784SS**  trans-79.3144.1-169.449.50000113.6
21S33.8Very low33.3Very low122 Ų122148.2 Ų148.285%0.85379%0.788SS**  trans-130.3102.2157.2-159.50000109.4
22P38.1Very low33.6Very low107 Ų107148.3 Ų148.370%0.69579%0.791SS**  trans-80147-176.331.4-34000112.3V24P22-V24 PolarHBondContact O-N 2.83Å
23H32.6Very low33.5Very low158 Ų158150 Ų15073%0.73180%0.795SS**  trans-63.8125.8177.2-69.3-87.3000112.3Y25H23-Y25 VanDerWaalsContact C-N 3.29Å; H23-Y25 HydrophobicContact CB-CD2 3.55Å; H23-Y25 HydrophobicContact CB-CE2 3.51Å; H23-Y25 AromaticContact CG-CE2 3.92Å; H23-Y25 PolarHBondContact O-N 3.45Å
24V34.3Very low33.5Very low146 Ų146149.7 Ų149.789%0.88579%0.794SS**  trans-77.679.5169.5-175.50000109.9P22P22-V24 PolarHBondContact O-N 2.83Å
25Y28Very low33.6Very low166 Ų166153.3 Ų153.365%0.65179%0.794SS**  trans-81.1109.3164-77.5-82.8000109.5H23 F27H23-Y25 VanDerWaalsContact C-N 3.29Å; H23-Y25 HydrophobicContact CB-CD2 3.55Å; H23-Y25 HydrophobicContact CB-CE2 3.51Å; H23-Y25 AromaticContact CG-CE2 3.92Å; H23-Y25 PolarHBondContact O-N 3.45Å; Y25-F27 HydrophobicContact CG-CE2 4.25Å; Y25-F27 PolarHBondContact O-N 3.1Å; Y25-F27 VanDerWaalsContact O-N 3.1Å
26K31.7Very low33.3Very low183 Ų183151.2 Ų151.280%0.79679%0.794SS**  trans-83.281.4172.6-169.1175.8-178.1175.80110.7
27F27.2Very low33.3Very low157 Ų157149.9 Ų149.969%0.68980%0.8SS**  trans-62.5143.4163.5-67.7-86.7000110.1Y25Y25-F27 HydrophobicContact CG-CE2 4.25Å; Y25-F27 PolarHBondContact O-N 3.1Å; Y25-F27 VanDerWaalsContact O-N 3.1Å
28I32.9Very low33.2Very low151 Ų151145.4 Ų145.477%0.77480%0.796SS**  trans-120.594.6166.9-59.7179.6000106.3
29T29.4Very low33.2Very low121 Ų121143 Ų14374%0.74279%0.794SS**  trans-137.883.7179.449.50000108.8
30E37.4Very low33.1Very low191 Ų191140.4 Ų140.489%0.89379%0.786SS**  trans-125103164-77.1-171.6141.600108.8
31C31.8Very low33.1Very low122 Ų122142.1 Ų142.182%0.82479%0.787SS**  trans-111.3149147.7-61.10000106.2
32P42.2Very low33Very low121 Ų121140 Ų14079%0.78677%0.772SS**  -129.3134.6118.334.4-28.8000111.8
33E34.3Very low32.7Very low173 Ų173145.5 Ų145.581%0.80878%0.781SS**  trans-66.6145.4161.6-57.9177.9160.400109.4
34N37.3Very low32.5Very low156 Ų156145 Ų14583%0.83478%0.784SS**  trans-152.4137.9154.2-100.5-68.3000109.2
35L32.4Very low32.3Very low151 Ų151148.1 Ų148.179%0.79179%0.786SS**  trans-94.1150.2-168-62.375.9000111.7
36S33.9Very low32.2Very low121 Ų121145.2 Ų145.285%0.84679%0.785SS**  179.3149.4119.837.10000112.3
37N29Very low32.4Very low166 Ų166142.3 Ų142.389%0.88879%0.788SS**  trans-106.4139.6-177.9-69.8-25.4000112.3
38S32.2Very low32.6Very low124 Ų124141.5 Ų141.587%0.86779%0.791SS**  trans-178.5140.5139.141.60000107
39G31.5Very low32.9Very low62 Ų62140.3 Ų140.364%0.63980%0.796SS**  97.1126.263.100000107.6
40D34.2Very low33.1Very low143 Ų143143.4 Ų143.477%0.76580%0.802SS**  cis-159.3164.411.8-91.6-46.7000112.3
41N32.1Very low33.2Very low144 Ų144141.4 Ų141.477%0.7780%0.796SS**  trans29.8139.6138.3-53.6-41.3000120.3
42S30.8Very low33.3Very low78 Ų78143 Ų14355%0.54580%0.797SS.*  cis-158.6-178.86.6550000109.1
43Y31.9Very low32.9Very low222 Ų222142.2 Ų142.287%0.87179%0.794SS**  -163.8158.774.3-84.2-80.7000111.7
44N27.8Very low33Very low148 Ų148142.6 Ų142.679%0.79180%0.796SS**  trans-80.8155.2-173.8-55.2-38.5000114
45F30.4Very low32.8Very low211 Ų211143.8 Ų143.893%0.92580%0.801SS**  trans-148.4131.5130.8-122.8-78.5000111
46T26.5Very low32.8Very low104 Ų104139.1 Ų139.164%0.63879%0.789SS**  trans-85.9145.7-173.72.70000112.8
47S35.8Very low32.7Very low122 Ų122141.4 Ų141.485%0.85379%0.792SS**  trans-167.7116.4154.5-76.90000108.6
48D31.3Very low33Very low141 Ų141138.6 Ų138.675%0.75478%0.777SS**  trans-89.5141.2-164.5-44-85.5000113.2
49S39Very low32.9Very low126 Ų126138.2 Ų138.288%0.88178%0.775SS**  trans-167.4109.8157.1-72.10000109
50E34.4Very low33Very low186 Ų186141.2 Ų141.287%0.86978%0.78SS**  trans-77.4142.9172.8-64.8165.4105.900110.8
51L37.7Very low33Very low148 Ų148142.6 Ų142.678%0.77578%0.782SS**  -177.2138.1108.1-95.7166.1000113
52D34.8Very low32.8Very low156 Ų156143.4 Ų143.483%0.83479%0.785SS**  trans53.3127.1159.4-62.9-17.8000122.8
53S33.5Very low32.9Very low104 Ų104146.3 Ų146.373%0.72779%0.793SS**  trans-99.8149.8178.364.70000111.7
54Q35.8Very low32.8Very low182 Ų182141.9 Ų141.985%0.8579%0.785SS**  -177.3117.9109-97.7-171.257.600110.3
55L33.8Very low33.3Very low181 Ų181141.3 Ų141.395%0.94878%0.78SS**  trans-112.996.6168.8-134.381.6000109.2
56G32.9Very low33.2Very low52 Ų52134.6 Ų134.654%0.53676%0.76SS.*  trans-69.3140.617900000113.1N58G56-N58 PolarHBondContact O-N 2.8Å; G56-N58 VanDerWaalsContact O-N 3.14Å; G56-N58 PolarHBondContact O-ND2 2.96Å
57N32.3Very low33.5Very low170 Ų170137.6 Ų137.691%0.90977%0.766SS**  trans-65.7110-176.4-63.8-44000111.9S59N57-S59 PolarHBondContact O-N 2.99Å
58N34.3Very low33.4Very low107 Ų107136.3 Ų136.357%0.57275%0.753SS**  trans-89.886.8177.7-78.9-120.7000110.4G56 V60 R175G56-N58 PolarHBondContact O-N 2.8Å; G56-N58 VanDerWaalsContact O-N 3.14Å; G56-N58 PolarHBondContact O-ND2 2.96Å; N58-V60 PolarHBondContact O-N 3.19Å; N58-R175 PolarHBondContact OD1-NH1 3.16Å; N58-R175 PolarHBondContact OD1-NH2 3.2Å
59S31.2Very low33.4Very low116 Ų116135.9 Ų135.981%0.81175%0.751SS**  trans-74.6117.2170.9-1700000110.5N57 Q61N57-S59 PolarHBondContact O-N 2.99Å; S59-Q61 PolarHBondContact O-N 2.94Å
60V32.2Very low33.5Very low125 Ų125135.4 Ų135.476%0.75874%0.739SS**  trans-86.989.3-179.9-178.20000109.4N58 L62N58-V60 PolarHBondContact O-N 3.19Å; V60-L62 PolarHBondContact O-N 3.34Å
61Q34.9Very low33.3Very low172 Ų172134.6 Ų134.680%0.80474%0.74SS**  trans-78.9110.4179.7-161.9169.116.200110.7S59 I63S59-Q61 PolarHBondContact O-N 2.94Å; Q61-I63 PolarHBondContact O-N 2.85Å
62L27.4Very low33.5Very low160 Ų160132.9 Ų132.984%0.83874%0.736SS**  trans-73.595.8175.7-70.1172.7000110.2V60 N64V60-L62 PolarHBondContact O-N 3.34Å; L62-N64 PolarHBondContact O-N 3.03Å
63I33.5Very low33.3Very low140 Ų140131.2 Ų131.272%0.71874%0.736SS**  trans-70.5102.5175.4-56.1178.2000109.2Q61 I65Q61-I63 PolarHBondContact O-N 2.85Å; I63-I65 HydrophobicContact CG2-CG1 4.17Å; I63-I65 PolarHBondContact O-N 3.17Å
64N30.2Very low33.4Very low129 Ų129134.6 Ų134.669%0.6974%0.738SS**  trans-78.8107.6172.6-170.123.1000109.2L62 S66L62-N64 PolarHBondContact O-N 3.03Å; N64-S66 PolarHBondContact ND2-OG 3.11Å; N64-S66 PolarHBondContact O-N 2.75Å
65I37Very low33.5Very low135 Ų135130.7 Ų130.769%0.69273%0.727SS**  trans-82.868.3-175.7-47.8179.2000110.5I63 V68I63-I65 HydrophobicContact CG2-CG1 4.17Å; I63-I65 PolarHBondContact O-N 3.17Å; I65-V68 HydrophobicContact CG2-CG2 3.76Å
66S29.3Very low33.6Very low71 Ų71129.4 Ų129.450%0.49772%0.721SS.*  trans-122.4139.2161.651.50000107.2N64N64-S66 PolarHBondContact ND2-OG 3.11Å; N64-S66 PolarHBondContact O-N 2.75Å
67E32Very low33.9Very low167 Ų167134.2 Ų134.278%0.7873%0.733SS**  trans69.672.1-171.9-55.8177.3-156.900114.2
68V34.4Very low34.4Very low94 Ų94133.8 Ų133.857%0.5773%0.725SS**  trans-105.382.2157.6-158.80000107.7I65 D70I65-V68 HydrophobicContact CG2-CG2 3.76Å; V68-D70 VanDerWaalsContact C-N 3.27Å; V68-D70 VanDerWaalsContact CG1-OD2 3.32Å; V68-D70 WeakPolarHBondContact CG1-OD2 3.31Å; V68-D70 PolarHBondContact O-N 3.02Å; V68-D70 VanDerWaalsContact O-N 3.12Å
69N30.6Very low35.1Very low133 Ų133133.9 Ų133.971%0.71173%0.731SS**  trans-86.261.6-176.1-67.8-29.2000111.3D71N69-D71 PolarHBondContact O-N 2.76Å
70D41.9Very low35.3Very low116 Ų116134.1 Ų134.162%0.6273%0.73SS**  trans-88.580.1-179.6-70.9-27.3000111.9V68 T72V68-D70 VanDerWaalsContact C-N 3.27Å; V68-D70 VanDerWaalsContact CG1-OD2 3.32Å; V68-D70 WeakPolarHBondContact CG1-OD2 3.31Å; V68-D70 PolarHBondContact O-N 3.02Å; V68-D70 VanDerWaalsContact O-N 3.12Å; D70-T72 HydrophobicContact CB-CG2 4.46Å; D70-T72 PolarHBondContact O-N 2.84Å
71D30.2Very low35.7Very low168 Ų168131.8 Ų131.890%0.89873%0.731SS**  trans-73.661.7163-85.6-44000110.8N69N69-D71 PolarHBondContact O-N 2.76Å
72T41.9Very low35.9Very low113 Ų113129.3 Ų129.369%0.69373%0.733SS**  trans-10283.4176.361.30000111.1D70 F74D70-T72 HydrophobicContact CB-CG2 4.46Å; D70-T72 PolarHBondContact O-N 2.84Å; T72-F74 PolarHBondContact O-N 3.02Å
73S30.4Very low36.7Very low120 Ų120131.6 Ų131.684%0.83974%0.736SS**  trans-68.3112160.2460000109.5
74F36.1Very low37.2Very low176 Ų176136.3 Ų136.377%0.77275%0.745SS**  trans-123.1123166.3-161.2-91.5000110.5T72 I77T72-F74 PolarHBondContact O-N 3.02Å; F74-I77 HydrophobicContact CE1-CD1 4.45Å
75T38.2Very low37.9Very low100 Ų100141.3 Ų141.361%0.61375%0.754SS**  trans-92.3142.7-174.944.90000112.2
76D34.1Very low38Very low153 Ų153141.9 Ų141.982%0.81876%0.758SS**  trans48.382.3145-54.1-39.6000119.3
77I39.5Very low38.3Very low153 Ų153144.5 Ų144.579%0.78578%0.775SS**  trans-131.9121.4145.4-55.7-179.2000108.8F74F74-I77 HydrophobicContact CE1-CD1 4.45Å
78H42.6Very low38.8Very low161 Ų161141.6 Ų141.675%0.74577%0.769SS**  trans-123.3111.8-176.7171.6-73.2000111.7
79P49.2Very low38.8Very low109 Ų109144 Ų14471%0.70878%0.779SS**  trans-83.9130.6168.932.2-31.1000111.2
80P36.7Very low39.6Very low121 Ų121144.2 Ų144.279%0.78678%0.778SS**  trans-77.2128.1179.230.7-33.6000112.2
81G39Very low39.7Very low76 Ų76146.1 Ų146.178%0.78479%0.788SS**  trans-147.398.7178.700000112.9
82S40.5Very low40.3Very low121 Ų121141 Ų14185%0.84678%0.776SS**  trans-76.3124.3-170.4-54.10000114.5
83K43.7Very low40.6Very low207 Ų207142.9 Ų142.990%0.978%0.78SS**  trans-137.880.6151.7-71.5-165.9178.41800111.4R85K83-R85 PolarHBondContact O-N 2.98Å
84R43.1Very low41.4Very low239 Ų239143.7 Ų143.790%0.90278%0.78SS**PPolyproline II helixtrans-66.2119.7162.4-78.4178.9170.4155.4-4108.2
85R45.4Very low41.8Very low234 Ų234141.9 Ų141.988%0.88378%0.778SS**PPolyproline II helixtrans-80.1116.3162.2-108.9-174.6174.9-177.7-1.7107.9K83K83-R85 PolarHBondContact O-N 2.98Å
86L38.8Very low42.5Very low148 Ų148144.6 Ų144.678%0.77579%0.787SS**PPolyproline II helixtrans-68.8134.5164.2-112.268.5000108.9T88L86-T88 PolarHBondContact O-N 3.5Å
87C35.6Very low43.1Very low126 Ų126144 Ų14485%0.85178%0.783SS**  trans-8689.7166.440.90000109.1N89C87-N89 PolarHBondContact O-N 3.21Å
88T43.2Very low43.3Very low106 Ų106142.9 Ų142.965%0.6578%0.783SS**  trans-73.891.7171.849.50000109.8L86 I90L86-T88 PolarHBondContact O-N 3.5Å; T88-I90 PolarHBondContact O-N 3.5Å
89N35Very low43.7Very low144 Ų144143.8 Ų143.877%0.7779%0.788SS**  trans-77.6102.9170.9-170.113.9000108.9C87C87-N89 PolarHBondContact O-N 3.21Å
90I46.9Very low43.2Very low137 Ų137148 Ų14870%0.70380%0.798SS**  trans-125.160-179.7-45.4-179.2000109.6T88T88-I90 PolarHBondContact O-N 3.5Å
91N44.7Very low43.7Very low156 Ų156146.9 Ų146.983%0.83479%0.791SS**  trans-99.5120.9145-70-11.6000105.7
92G42.7Very low43.8Very low61 Ų61148.6 Ų148.663%0.62979%0.791SS**  cis139.418.811.700000113.7
93I47.3Very low44.4Very low152 Ų152152 Ų15278%0.77979%0.791SS**  trans40.985.8165.2-47178.3000114.7
94T47.3Very low44.8Very low138 Ų138147.8 Ų147.885%0.84778%0.782SS**  trans-129.5109.3143.854.40000107.8
95D43.8Very low45.1Very low137 Ų137141.6 Ų141.673%0.73377%0.767SS**  trans-64179.5167.1-65-73.3000111.4
96I52.7Low45.5Very low158 Ų158138.6 Ų138.681%0.8176%0.763SS**  trans102.2125.7169.8-56.3160.6000115
97I47.2Very low46.1Very low141 Ų141140.9 Ų140.972%0.72376%0.762SS**  trans7379.4174.3-59.2153.5000116.8Q99I97-Q99 PolarHBondContact O-N 3.21Å
98T44.4Very low47Very low129 Ų129142.5 Ų142.579%0.79176%0.762SS**  24.288.9113.4-40.30000118.8
99Q50.6Low47.8Very low179 Ų179141.3 Ų141.384%0.83676%0.758SS**  trans-163134.9134.1-111153104.500110I97 P101I97-Q99 PolarHBondContact O-N 3.21Å; Q99-P101 WeakPolarHBondContact O-CD 3.24Å
100Q39.1Very low49.2Very low198 Ų198141 Ų14193%0.92577%0.765SS**  trans-96125.8177.7-68.8-179.8-8.700110.8
101P45.9Very low50.7Low98 Ų98141.5 Ų141.564%0.63677%0.765SS**  trans-99.7132.6145.5-3.423.2000109.1Q99 F103Q99-P101 WeakPolarHBondContact O-CD 3.24Å; P101-F103 PolarHBondContact O-N 3.26Å; P101-F103 VanDerWaalsContact O-N 3.14Å
102S41.5Very low52.6Low112 Ų112143.3 Ų143.378%0.78377%0.765SS**  trans-71.2103.8175.853.20000111.1T104S102-T104 PolarHBondContact O-N 3.15Å
103F53.1Low54.8Low193 Ų193149 Ų14985%0.84678%0.78SS**  trans-76.9101.5167.4-77.2-87.5000109.8P101P101-F103 PolarHBondContact O-N 3.26Å; P101-F103 VanDerWaalsContact O-N 3.14Å
104T53.3Low57Low117 Ų117146.8 Ų146.872%0.71877%0.774SS**  trans-69.8138.5170.445.60000110.8S102 E106S102-T104 PolarHBondContact O-N 3.15Å; T104-E106 PolarHBondContact O-N 2.94Å
105D49Very low59.1Low110 Ų110149.1 Ų149.159%0.58877%0.772SS**  trans-89.661.1-157.1-156.12.6000113.7R107D105-R107 PolarHBondContact O-N 3.27Å; D105-R107 WeakPolarHBondContact OD1-CG 3.36Å; D105-R107 IonicContact OD1-CZ 2.59Å; D105-R107 IonicContact OD1-NE 3.39Å; D105-R107 PolarHBondContact OD1-NE 2.91Å; D105-R107 IonicContact OD1-NH2 3.46Å; D105-R107 PolarHBondContact OD1-NH2 2.99Å; D105-R107 IonicContact OD2-CZ 3.66Å; D105-R107 IonicContact OD2-NE 2.68Å; D105-R107 IonicContact OD2-NH2 3.51Å; D105-R107 PolarHBondContact OD2-NH2 3.22Å
106E53.4Low61.5Low171 Ų171145.1 Ų145.180%0.79976%0.763SS**  trans-71.457.2-179.5-79.3-66.4135.200113.4T104 N108T104-E106 PolarHBondContact O-N 2.94Å; E106-N108 PolarHBondContact O-N 3.14Å
107R51.4Low63.4Low196 Ų196147.8 Ų147.874%0.7477%0.769SS**  trans-8956.5178.4-77.4-170.2-79.8164.1-7113D105D105-R107 PolarHBondContact O-N 3.27Å; D105-R107 WeakPolarHBondContact OD1-CG 3.36Å; D105-R107 IonicContact OD1-CZ 2.59Å; D105-R107 IonicContact OD1-NE 3.39Å; D105-R107 PolarHBondContact OD1-NE 2.91Å; D105-R107 IonicContact OD1-NH2 3.46Å; D105-R107 PolarHBondContact OD1-NH2 2.99Å; D105-R107 IonicContact OD2-CZ 3.66Å; D105-R107 IonicContact OD2-NE 2.68Å; D105-R107 IonicContact OD2-NH2 3.51Å; D105-R107 PolarHBondContact OD2-NH2 3.22Å
108N55.2Low65.8Low160 Ų160147.1 Ų147.186%0.85676%0.763SS**  trans-143.836.7-176.6-101.8-36.9000118.3E106E106-N108 PolarHBondContact O-N 3.14Å
109S59.6Low68.2Low81 Ų81151 Ų15157%0.56677%0.768SS**  trans-134.8115.2153.677.50000112.4E111S109-E111 WeakPolarHBondContact CB-OE1 2.83Å; S109-E111 PolarHBondContact O-N 2.86Å; S109-E111 VanDerWaalsContact O-N 3.13Å; S109-E111 PolarHBondContact OG-OE1 3.48Å
110C63.5Low70.4Confident136 Ų136146.2 Ų146.292%0.91975%0.748SS**  trans-87.262.4170.6-174.50000109.7K112C110-K112 PolarHBondContact O-N 3.47Å
111E78.3Confident73.2Confident149 Ų149140.4 Ų140.470%0.69673%0.728SS**  trans-63.6133.8-176.8-78.9171.8-129.500112.1S109 L113S109-E111 WeakPolarHBondContact CB-OE1 2.83Å; S109-E111 PolarHBondContact O-N 2.86Å; S109-E111 VanDerWaalsContact O-N 3.13Å; S109-E111 PolarHBondContact OG-OE1 3.48Å; E111-L113 PolarHBondContact O-N 2.85Å; E111-L113 VanDerWaalsContact O-N 3.13Å
112K84.9Confident75.6Confident194 Ų194143.2 Ų143.284%0.84374%0.736SS**  trans-69.2112.7-179.3-67.1177.6-178.6174.40108.9C110 T114C110-K112 PolarHBondContact O-N 3.47Å; K112-T114 PolarHBondContact O-N 3.41Å
113L90Very high78.3Confident179 Ų179144.4 Ų144.494%0.93773%0.729SS**SBendtrans-49.5-20.7-178.7-58.9178.3000115.1E111E111-L113 PolarHBondContact O-N 2.85Å; E111-L113 VanDerWaalsContact O-N 3.13Å
114T92.2Very high80.4Confident107 Ų107142.4 Ų142.466%0.65672%0.72SS**SBendtrans-139.8157.4169.674.80000111K112 G116K112-T114 PolarHBondContact O-N 3.41Å; T114-G116 PolarHBondContact O-N 3.33Å; T114-G116 VanDerWaalsContact O-N 3.16Å; T114-G116 PolarHBondContact OG1-N 3.33Å
115K92.2Very high82.6Confident187 Ų187138.8 Ų138.881%0.81370%0.696SS**  trans-71.63.5171.8-58.4-174.6179.4-175.20113.8Q118K115-Q118 PolarHBondContact O-NE2 3.27Å
116G94.1Very high84.9Confident53 Ų53138.6 Ų138.655%0.54670%0.703SS.*  trans65.2-164.3-176.600000114.5T114 Q118T114-G116 PolarHBondContact O-N 3.33Å; T114-G116 VanDerWaalsContact O-N 3.16Å; T114-G116 PolarHBondContact OG1-N 3.33Å; G116-Q118 PolarHBondContact O-N 3.2Å
117K93.5Very high87Confident214 Ų214133 Ų13393%0.9368%0.679SS**SBendtrans-72.3120.5176-179.7-173175-170.20109.7
118Q95.9Very high89.2Confident126 Ų126131.1 Ų131.159%0.58967%0.672SS**PPolyproline II helixtrans-98148.2177.5-65.6-64.8-49.300111.3K115 G116K115-Q118 PolarHBondContact O-NE2 3.27Å; G116-Q118 PolarHBondContact O-N 3.2Å
119K96.2Very high91.2Very high210 Ų210128.8 Ų128.891%0.91366%0.663SS**PPolyproline II helixtrans-72.5139.9169.7-172.1173-179.3175.70108.7
120I96.3Very high93Very high79 Ų79131 Ų13141%0.40566%0.663SS.*  trans-131.9149.9174.359.2173.7000109I125I120-I125 HydrophobicContact CD1-CD1 4.46Å
121P97.8Very high94.6Very high77 Ų77126.8 Ų126.850%0.563%0.627SS.*  trans-61.6156.2173.925.5-34.2000111.9E123P121-E123 VanDerWaalsContact C-N 3.32Å; P121-E123 HydrophobicContact CB-CG 3.94Å; P121-E123 HydrophobicContact CG-CG 3.86Å; P121-E123 WeakPolarHBondContact CG-OE1 3.11Å; P121-E123 PolarHBondContact O-N 3.37Å
122I97.1Very high95.5Very high156 Ų156123 Ų12380%0.861%0.607SS**SBendtrans-94.869.5176.1-52.8-57.2000108.3
123E97.7Very high96.1Very high138 Ų138116.5 Ų116.565%0.64559%0.586SS**SBendtrans-136.8177.7-178.370-172.9177.600110.7P121 I125P121-E123 VanDerWaalsContact C-N 3.32Å; P121-E123 HydrophobicContact CB-CG 3.94Å; P121-E123 HydrophobicContact CG-CG 3.86Å; P121-E123 WeakPolarHBondContact CG-OE1 3.11Å; P121-E123 PolarHBondContact O-N 3.37Å; E123-I125 PolarHBondContact O-N 3.23Å
124F97.5Very high96.5Very high150 Ų150109.5 Ų109.566%0.65855%0.551SS**  trans-72.8111175.8-178.1-101000111.4S126F124-S126 PolarHBondContact O-N 2.52Å
125I97.9Very high96.8Very high41 Ų41107 Ų10721%0.2153%0.531CS..  trans-63.3108.6178.5-56.8173.7000109.5I120 E123 D127 K130 R131 T134I120-I125 HydrophobicContact CD1-CD1 4.46Å; E123-I125 PolarHBondContact O-N 3.23Å; I125-D127 HydrophobicContact CG2-CB 4.48Å; I125-K130 HydrophobicContact CG2-CB 3.94Å; I125-R131 HydrophobicContact CB-CB 4.21Å; I125-R131 HydrophobicContact CB-CG 4.42Å; I125-R131 HydrophobicContact CG2-CB 4.16Å; I125-R131 VanDerWaalsContact O-CZ 3.25Å; I125-R131 PolarHBondContact O-NE 2.96Å; I125-R131 PolarHBondContact O-NH2 2.97Å; I125-T134 HydrophobicContact CD1-CG2 3.85Å
126S97.8Very high97Very high107 Ų107101 Ų10175%0.74851%0.513SS*.  trans-65.9-37.7-178.555.60000113.6F124 R128 R131F124-S126 PolarHBondContact O-N 2.52Å; S126-R128 PolarHBondContact O-N 3.02Å; S126-R131 PolarHBondContact O-NH2 2.92Å
127D97.4Very high97.1Very high52 Ų52105.7 Ų105.728%0.27852%0.518SS..  trans-69.5112.2176.2177.6-30.8000111.6I125 T129 K130 R131I125-D127 HydrophobicContact CG2-CB 4.48Å; D127-T129 VanDerWaalsContact C-N 3.32Å; D127-T129 PolarHBondContact O-N 3.27Å; D127-T129 WeakPolarHBondContact OD1-CA 3.19Å; D127-T129 WeakPolarHBondContact OD1-CB 3.22Å; D127-T129 PolarHBondContact OD1-N 3.14Å; D127-K130 HydrophobicContact CB-CB 4.01Å; D127-K130 HydrophobicContact CB-CD 4.09Å; D127-K130 HydrophobicContact CB-CG 4.15Å; D127-K130 PolarHBondContact O-N 2.94Å; D127-K130 PolarHBondContact OD1-N 3.13Å; D127-K130 WeakPolarHBondContact OD2-CD 3.08Å; D127-K130 WeakPolarHBondContact OD2-CE 3.17Å; D127-K130 WeakPolarHBondContact OD2-CG 3.18Å; D127-K130 IonicContact OD2-NZ 2.7Å; D127-K130 PolarHBondContact OD2-NZ 3.17Å; D127-R131 VanDerWaalsContact O-CB 3.25Å; D127-R131 WeakPolarHBondContact O-CB 3.42Å; D127-R131 PolarHBondContact O-N 3.41Å
128R97.2Very high97.4Very high157 Ų157102 Ų10259%0.59250%0.499SS*.Hα-helixtrans-57.4-38.4-178.9-169.8177.6-172.2-160.5-2.6113.4S126 R131 Y132S126-R128 PolarHBondContact O-N 3.02Å; R128-R131 PolarHBondContact O-N 3.39Å; R128-Y132 HydrophobicContact CG-CD2 4.1Å; R128-Y132 HydrophobicContact CG-CE2 3.51Å; R128-Y132 PolarHBondContact NE-OH 3.48Å; R128-Y132 PolarHBondContact NH2-OH 2.94Å; R128-Y132 VanDerWaalsContact NH2-OH 3.08Å; R128-Y132 WeakPolarHBondContact O-CD2 3.49Å; R128-Y132 PolarHBondContact O-N 3.25Å
129T97.6Very high97.5Very high111 Ų11197.6 Ų97.668%0.68148%0.477SS*.Hα-helixtrans-73-45.2-178.4-57.40000110.9D127 R131 S133D127-T129 VanDerWaalsContact C-N 3.32Å; D127-T129 PolarHBondContact O-N 3.27Å; D127-T129 WeakPolarHBondContact OD1-CA 3.19Å; D127-T129 WeakPolarHBondContact OD1-CB 3.22Å; D127-T129 PolarHBondContact OD1-N 3.14Å; T129-R131 VanDerWaalsContact C-N 3.3Å; T129-R131 PolarHBondContact O-N 3.19Å; T129-S133 WeakPolarHBondContact O-CB 3.27Å; T129-S133 PolarHBondContact O-N 3.28Å
130K97.2Very high97.5Very high127 Ų12791.8 Ų91.855%0.55246%0.459SS*.Hα-helixtrans-63.4-37.5172.3-68.7-177.9-172.997.50111.4I125 D127 T134I125-K130 HydrophobicContact CG2-CB 3.94Å; D127-K130 HydrophobicContact CB-CB 4.01Å; D127-K130 HydrophobicContact CB-CD 4.09Å; D127-K130 HydrophobicContact CB-CG 4.15Å; D127-K130 PolarHBondContact O-N 2.94Å; D127-K130 PolarHBondContact OD1-N 3.13Å; D127-K130 WeakPolarHBondContact OD2-CD 3.08Å; D127-K130 WeakPolarHBondContact OD2-CE 3.17Å; D127-K130 WeakPolarHBondContact OD2-CG 3.18Å; D127-K130 IonicContact OD2-NZ 2.7Å; D127-K130 PolarHBondContact OD2-NZ 3.17Å; K130-T134 VanDerWaalsContact O-CB 3.24Å; K130-T134 WeakPolarHBondContact O-CB 3.43Å; K130-T134 PolarHBondContact O-N 3.37Å; K130-T134 PolarHBondContact O-OG1 3.2Å
131R98Very high97.6Very high48 Ų4889.9 Ų89.918%0.18146%0.46CS..Hα-helixtrans-62.6-51.2177-168-167.6-55.1141.89.2111.6I125 S126 D127 R128 T129 T134 F135 E164I125-R131 HydrophobicContact CB-CB 4.21Å; I125-R131 HydrophobicContact CB-CG 4.42Å; I125-R131 HydrophobicContact CG2-CB 4.16Å; I125-R131 VanDerWaalsContact O-CZ 3.25Å; I125-R131 PolarHBondContact O-NE 2.96Å; I125-R131 PolarHBondContact O-NH2 2.97Å; S126-R131 PolarHBondContact O-NH2 2.92Å; D127-R131 VanDerWaalsContact O-CB 3.25Å; D127-R131 WeakPolarHBondContact O-CB 3.42Å; D127-R131 PolarHBondContact O-N 3.41Å; R128-R131 PolarHBondContact O-N 3.39Å; T129-R131 VanDerWaalsContact C-N 3.3Å; T129-R131 PolarHBondContact O-N 3.19Å; R131-T134 PolarHBondContact O-N 2.59Å; R131-F135 VanDerWaalsContact O-CB 3.31Å; R131-F135 WeakPolarHBondContact O-CB 3.48Å; R131-F135 PolarHBondContact O-N 2.64Å; R131-E164 WeakPolarHBondContact CD-OE1 3.34Å; R131-E164 IonicContact CZ-OE1 3.47Å; R131-E164 IonicContact NE-OE1 2.64Å; R131-E164 PolarHBondContact NE-OE1 3.24Å; R131-E164 IonicContact NH1-OE1 3.54Å; R131-E164 PolarHBondContact NH1-OE1 3.05Å; R131-E164 IonicContact NH1-OE2 3.52Å
132Y97.3Very high97.6Very high70 Ų7090.1 Ų90.128%0.27546%0.456SS..Hα-helixtrans-64.5-41.5177-66.3-33.3000112.9R128 T134 F135 S136 E164R128-Y132 HydrophobicContact CG-CD2 4.1Å; R128-Y132 HydrophobicContact CG-CE2 3.51Å; R128-Y132 PolarHBondContact NE-OH 3.48Å; R128-Y132 PolarHBondContact NH2-OH 2.94Å; R128-Y132 VanDerWaalsContact NH2-OH 3.08Å; R128-Y132 WeakPolarHBondContact O-CD2 3.49Å; R128-Y132 PolarHBondContact O-N 3.25Å; Y132-T134 VanDerWaalsContact C-N 3.29Å; Y132-T134 PolarHBondContact O-N 2.89Å; Y132-F135 PolarHBondContact O-N 2.91Å; Y132-S136 PolarHBondContact O-N 3.32Å; Y132-S136 PolarHBondContact O-OG 3.25Å; Y132-E164 HydrophobicContact CE1-CB 4.26Å; Y132-E164 HydrophobicContact CE1-CG 4.32Å; Y132-E164 WeakPolarHBondContact CE1-OE2 3.27Å; Y132-E164 PolarHBondContact OH-OE2 3.09Å
133S97.2Very high97.7Very high57 Ų5783.1 Ų83.140%0.39942%0.42SS..Hα-helixtrans-60-40.6175-164.10000112T129 K137T129-S133 WeakPolarHBondContact O-CB 3.27Å; T129-S133 PolarHBondContact O-N 3.28Å; S133-K137 VanDerWaalsContact O-CG 3.31Å; S133-K137 WeakPolarHBondContact O-CG 3.25Å; S133-K137 PolarHBondContact O-N 3.1Å
134T97.8Very high97.7Very high33 Ų3382.8 Ų82.820%0.20242%0.417CS..Hα-helixtrans-73.2-40.2178.2-57.80000112I125 K130 R131 Y132 K137 R138I125-T134 HydrophobicContact CD1-CG2 3.85Å; K130-T134 VanDerWaalsContact O-CB 3.24Å; K130-T134 WeakPolarHBondContact O-CB 3.43Å; K130-T134 PolarHBondContact O-N 3.37Å; K130-T134 PolarHBondContact O-OG1 3.2Å; R131-T134 PolarHBondContact O-N 2.59Å; Y132-T134 VanDerWaalsContact C-N 3.29Å; Y132-T134 PolarHBondContact O-N 2.89Å; T134-K137 PolarHBondContact O-N 3.37Å; T134-R138 HydrophobicContact CG2-CG 4.02Å; T134-R138 VanDerWaalsContact O-CB 3.3Å; T134-R138 WeakPolarHBondContact O-CB 3.47Å; T134-R138 WeakPolarHBondContact O-CG 3.27Å; T134-R138 PolarHBondContact O-N 2.97Å
135F98.2Very high97.7Very high53 Ų5382.6 Ų82.623%0.23242%0.416CS..Hα-helixtrans-57.8-52.9174.8174.1-93.7000110.6R131 Y132 K137 R138 K139 V161 Y169R131-F135 VanDerWaalsContact O-CB 3.31Å; R131-F135 WeakPolarHBondContact O-CB 3.48Å; R131-F135 PolarHBondContact O-N 2.64Å; Y132-F135 PolarHBondContact O-N 2.91Å; F135-K137 VanDerWaalsContact C-N 3.35Å; F135-K137 PolarHBondContact O-N 3.23Å; F135-R138 PolarHBondContact O-N 3.34Å; F135-K139 HydrophobicContact CE1-CD 3.94Å; F135-K139 HydrophobicContact CZ-CD 4.08Å; F135-K139 WeakPolarHBondContact O-CB 3.23Å; F135-K139 PolarHBondContact O-N 3.05Å; F135-V161 HydrophobicContact CE2-CG1 3.66Å; F135-V161 HydrophobicContact CZ-CG1 3.84Å; F135-Y169 AromaticContact CE1-CE2 3.95Å; F135-Y169 HydrophobicContact CE1-CE2 3.95Å; F135-Y169 HydrophobicContact CZ-CD2 4.24Å; F135-Y169 HydrophobicContact CZ-CE2 4.01Å
136S96.9Very high97.7Very high62 Ų6281 Ų8143%0.43441%0.409SS..Hα-helixtrans-59.5-43.8-179.7-64.90000112.2Y132 T140Y132-S136 PolarHBondContact O-N 3.32Å; Y132-S136 PolarHBondContact O-OG 3.25Å; S136-T140 PolarHBondContact O-N 3Å; S136-T140 VanDerWaalsContact O-N 3.17Å; S136-T140 PolarHBondContact O-OG1 2.86Å
137K97.5Very high97.7Very high151 Ų15177.6 Ų77.666%0.65738%0.383SS*.Hα-helixtrans-67.6-47.3178.3-70.8171.9-177.6172.90112.7S133 T134 F135 T140 G141S133-K137 VanDerWaalsContact O-CG 3.31Å; S133-K137 WeakPolarHBondContact O-CG 3.25Å; S133-K137 PolarHBondContact O-N 3.1Å; T134-K137 PolarHBondContact O-N 3.37Å; F135-K137 VanDerWaalsContact C-N 3.35Å; F135-K137 PolarHBondContact O-N 3.23Å; K137-T140 PolarHBondContact O-N 3.43Å; K137-G141 PolarHBondContact O-N 2.88Å; K137-G141 VanDerWaalsContact O-N 3.1Å
138R98.2Very high97.7Very high138 Ų13878.4 Ų78.452%0.52139%0.385SS..Hα-helixtrans-65.9-40.9178.3-72.8-172.1-177.9-168.42.7111.6T134 F135 T140 G141 L142T134-R138 HydrophobicContact CG2-CG 4.02Å; T134-R138 VanDerWaalsContact O-CB 3.3Å; T134-R138 WeakPolarHBondContact O-CB 3.47Å; T134-R138 WeakPolarHBondContact O-CG 3.27Å; T134-R138 PolarHBondContact O-N 2.97Å; F135-R138 PolarHBondContact O-N 3.34Å; R138-T140 PolarHBondContact O-N 3.21Å; R138-G141 PolarHBondContact O-N 2.93Å; R138-L142 VanDerWaalsContact O-CB 3.26Å; R138-L142 WeakPolarHBondContact O-CB 3.09Å; R138-L142 PolarHBondContact O-N 2.91Å
139K98Very high97.8Very high32 Ų3275.2 Ų75.214%0.13938%0.38CS..Hα-helixtrans-55.6-51.9174.9179.9-176.768.768.50111.2F135 L142 M143 Y169F135-K139 HydrophobicContact CE1-CD 3.94Å; F135-K139 HydrophobicContact CZ-CD 4.08Å; F135-K139 WeakPolarHBondContact O-CB 3.23Å; F135-K139 PolarHBondContact O-N 3.05Å; K139-L142 PolarHBondContact O-N 2.87Å; K139-M143 HydrophobicContact CG-CG 4.36Å; K139-M143 WeakPolarHBondContact O-CB 3.46Å; K139-M143 WeakPolarHBondContact O-CG 3.49Å; K139-M143 PolarHBondContact O-N 2.85Å; K139-Y169 HydrophobicContact CD-CD1 3.77Å; K139-Y169 HydrophobicContact CD-CD2 3.59Å; K139-Y169 HydrophobicContact CD-CE1 4.02Å; K139-Y169 HydrophobicContact CD-CE2 3.88Å; K139-Y169 HydrophobicContact CD-CG 3.54Å
140T97.7Very high97.8Very high88 Ų8870.6 Ų70.654%0.5435%0.353SS..Hα-helixtrans-64.3-42-179.6-60.60000111.8S136 K137 R138 K144S136-T140 PolarHBondContact O-N 3Å; S136-T140 VanDerWaalsContact O-N 3.17Å; S136-T140 PolarHBondContact O-OG1 2.86Å; K137-T140 PolarHBondContact O-N 3.43Å; R138-T140 PolarHBondContact O-N 3.21Å; T140-K144 PolarHBondContact O-N 3.38Å
141G97.9Very high97.8Very high40 Ų4069.8 Ų69.841%0.41235%0.351SS..Hα-helixtrans-63.7-39.5175.100000113.9K137 R138 K145K137-G141 PolarHBondContact O-N 2.88Å; K137-G141 VanDerWaalsContact O-N 3.1Å; R138-G141 PolarHBondContact O-N 2.93Å; G141-K145 PolarHBondContact O-N 3.3Å
142L98.1Very high97.8Very high82 Ų8274.6 Ų74.643%0.42938%0.38SS..Hα-helixtrans-71.5-39.5178.5-173.463.9000112R138 K139 K145 A146 L159R138-L142 VanDerWaalsContact O-CB 3.26Å; R138-L142 WeakPolarHBondContact O-CB 3.09Å; R138-L142 PolarHBondContact O-N 2.91Å; K139-L142 PolarHBondContact O-N 2.87Å; L142-K145 PolarHBondContact O-N 2.93Å; L142-A146 PolarHBondContact O-N 2.93Å; L142-L159 HydrophobicContact CD2-CD1 3.89Å; L142-L159 HydrophobicContact CD2-CD2 4.27Å; L142-L159 HydrophobicContact CG-CD1 4.26Å; L142-L159 HydrophobicContact CG-CD2 3.86Å
143M97.7Very high97.8Very high9 Ų975.5 Ų75.54%0.04439%0.393CS..Hα-helixtrans-62.5-43173.1-69.7-77.8165.800111.1K139 A146 V147 L159 V161 F171K139-M143 HydrophobicContact CG-CG 4.36Å; K139-M143 WeakPolarHBondContact O-CB 3.46Å; K139-M143 WeakPolarHBondContact O-CG 3.49Å; K139-M143 PolarHBondContact O-N 2.85Å; M143-A146 PolarHBondContact O-N 2.68Å; M143-V147 WeakPolarHBondContact O-CG2 3.49Å; M143-V147 PolarHBondContact O-N 3.45Å; M143-V147 VanDerWaalsContact O-N 3.1Å; M143-L159 HydrophobicContact CE-CD2 3.74Å; M143-L159 HydrophobicContact CE-CG 3.86Å; M143-L159 HydrophobicContact CG-CD2 4.19Å; M143-L159 HydrophobicContact SD-CD2 3.68Å; M143-L159 HydrophobicContact SD-CG 4.29Å; M143-V161 HydrophobicContact CE-CB 4.26Å; M143-V161 HydrophobicContact CE-CG2 3.86Å; M143-F171 HydrophobicContact SD-CB 3.8Å
144K98.1Very high97.7Very high130 Ų13075.8 Ų75.857%0.56541%0.405SS*.Hα-helixtrans-61-45.1174.4-166.6176.3-167.2-80.40111.7T140 A146 V147 E148T140-K144 PolarHBondContact O-N 3.38Å; K144-A146 VanDerWaalsContact C-N 3.3Å; K144-A146 PolarHBondContact O-N 3.42Å; K144-V147 WeakPolarHBondContact O-CB 3.19Å; K144-V147 PolarHBondContact O-N 3.2Å; K144-E148 HydrophobicContact CG-CG 4.41Å; K144-E148 IonicContact NZ-OE1 2.7Å; K144-E148 PolarHBondContact NZ-OE1 3.38Å; K144-E148 VanDerWaalsContact O-CG 3.31Å; K144-E148 WeakPolarHBondContact O-CG 3.41Å; K144-E148 PolarHBondContact O-N 3.2Å
145K98.2Very high97.7Very high146 Ų14676.3 Ų76.364%0.63541%0.412SS*.Hα-helixtrans-60.7-35175-80.3-164.8167.8-154.10113.7G141 L142 L149G141-K145 PolarHBondContact O-N 3.3Å; L142-K145 PolarHBondContact O-N 2.93Å; K145-L149 VanDerWaalsContact O-CB 3.25Å; K145-L149 WeakPolarHBondContact O-CB 3.43Å; K145-L149 PolarHBondContact O-N 3.04Å
146A97.9Very high97.6Very high9 Ų977.2 Ų77.27%0.07442%0.417CS..Hα-helixtrans-70.6-36.4177.800000112.3L142 M143 K144 A150 V157 L159 F171L142-A146 PolarHBondContact O-N 2.93Å; M143-A146 PolarHBondContact O-N 2.68Å; K144-A146 VanDerWaalsContact C-N 3.3Å; K144-A146 PolarHBondContact O-N 3.42Å; A146-A150 WeakPolarHBondContact O-CB 3.42Å; A146-A150 PolarHBondContact O-N 2.84Å; A146-V157 HydrophobicContact CB-CG1 4.12Å; A146-L159 HydrophobicContact CB-CB 4.3Å; A146-L159 HydrophobicContact CB-CD2 3.82Å; A146-F171 HydrophobicContact CB-CD1 3.6Å; A146-F171 HydrophobicContact CB-CE1 3.94Å; A146-F171 HydrophobicContact CB-CG 4.35Å; A146-F171 VanDerWaalsContact O-CE1 3.25Å; A146-F171 WeakPolarHBondContact O-CE1 3.26Å
147V97.9Very high97.6Very high34 Ų3475.4 Ų75.421%0.20640%0.403CS..Hα-helixtrans-63.3-55.1169.8174.40000110.2M143 K144 L149 A150 E151 F171M143-V147 WeakPolarHBondContact O-CG2 3.49Å; M143-V147 PolarHBondContact O-N 3.45Å; M143-V147 VanDerWaalsContact O-N 3.1Å; K144-V147 WeakPolarHBondContact O-CB 3.19Å; K144-V147 PolarHBondContact O-N 3.2Å; V147-L149 VanDerWaalsContact C-N 3.3Å; V147-L149 PolarHBondContact O-N 3.11Å; V147-A150 PolarHBondContact O-N 2.91Å; V147-A150 VanDerWaalsContact O-N 3.15Å; V147-E151 VanDerWaalsContact CG1-CD 3.45Å; V147-E151 HydrophobicContact CG1-CG 4.32Å; V147-E151 VanDerWaalsContact CG1-OE1 3.27Å; V147-E151 WeakPolarHBondContact CG1-OE1 3.48Å; V147-E151 WeakPolarHBondContact O-CB 3.33Å; V147-E151 WeakPolarHBondContact O-CG 3.21Å; V147-E151 PolarHBondContact O-N 3.33Å; V147-F171 HydrophobicContact CB-CE2 4.39Å; V147-F171 HydrophobicContact CB-CZ 4.49Å; V147-F171 HydrophobicContact CG2-CD2 3.82Å; V147-F171 HydrophobicContact CG2-CE2 3.54Å; V147-F171 HydrophobicContact CG2-CZ 4.06Å
148E97.9Very high97.6Very high69 Ų6971.5 Ų71.532%0.32239%0.389SS..Hα-helixtrans-54.2-43.6178.8-71.6166.6167.700112.2K144 L152K144-E148 HydrophobicContact CG-CG 4.41Å; K144-E148 IonicContact NZ-OE1 2.7Å; K144-E148 PolarHBondContact NZ-OE1 3.38Å; K144-E148 VanDerWaalsContact O-CG 3.31Å; K144-E148 WeakPolarHBondContact O-CG 3.41Å; K144-E148 PolarHBondContact O-N 3.2Å; E148-L152 HydrophobicContact CB-CD1 4.44Å; E148-L152 WeakPolarHBondContact O-CB 3.2Å; E148-L152 WeakPolarHBondContact O-CD1 3.31Å; E148-L152 WeakPolarHBondContact O-CG 3.48Å; E148-L152 PolarHBondContact O-N 3.1Å
149L97.8Very high97.6Very high90 Ų9066.3 Ų66.347%0.47137%0.372SS..Hα-helixtrans-63.2-47.6178.2178.461.8000112K145 V147 T153 V157K145-L149 VanDerWaalsContact O-CB 3.25Å; K145-L149 WeakPolarHBondContact O-CB 3.43Å; K145-L149 PolarHBondContact O-N 3.04Å; V147-L149 VanDerWaalsContact C-N 3.3Å; V147-L149 PolarHBondContact O-N 3.11Å; L149-T153 HydrophobicContact CD1-CG2 4.05Å; L149-T153 WeakPolarHBondContact O-CB 3.25Å; L149-T153 PolarHBondContact O-N 3.34Å; L149-T153 PolarHBondContact O-OG1 3.35Å; L149-V157 HydrophobicContact CD2-CG2 3.99Å; L149-V157 HydrophobicContact CG-CG2 4.14Å
150A97.7Very high97.5Very high15 Ų1568.1 Ų68.112%0.12438%0.382CS..Hα-helixtrans-65.3-39-18000000112.2A146 V147 G154 V157 F171 T173A146-A150 WeakPolarHBondContact O-CB 3.42Å; A146-A150 PolarHBondContact O-N 2.84Å; V147-A150 PolarHBondContact O-N 2.91Å; V147-A150 VanDerWaalsContact O-N 3.15Å; A150-G154 VanDerWaalsContact O-CA 3.27Å; A150-G154 WeakPolarHBondContact O-CA 3.26Å; A150-G154 PolarHBondContact O-N 3.34Å; A150-V157 HydrophobicContact CB-CB 4.42Å; A150-V157 HydrophobicContact CB-CG2 4.2Å; A150-F171 HydrophobicContact CB-CE1 4.23Å; A150-F171 HydrophobicContact CB-CZ 4.02Å; A150-T173 HydrophobicContact CB-CG2 3.6Å
151E97.1Very high97.5Very high110 Ų11065.1 Ų65.151%0.51436%0.364SS..Hα-helixtrans-74.7-41.9-179.5-70.5173.9174.500112.7V147V147-E151 VanDerWaalsContact CG1-CD 3.45Å; V147-E151 HydrophobicContact CG1-CG 4.32Å; V147-E151 VanDerWaalsContact CG1-OE1 3.27Å; V147-E151 WeakPolarHBondContact CG1-OE1 3.48Å; V147-E151 WeakPolarHBondContact O-CB 3.33Å; V147-E151 WeakPolarHBondContact O-CG 3.21Å; V147-E151 PolarHBondContact O-N 3.33Å
152L97.9Very high97.4Very high149 Ų14965.3 Ų65.378%0.7836%0.362SS*.Hα-helixtrans-77.8-20.1-177.3-67.2171.2000114.1E148E148-L152 HydrophobicContact CB-CD1 4.44Å; E148-L152 WeakPolarHBondContact O-CB 3.2Å; E148-L152 WeakPolarHBondContact O-CD1 3.31Å; E148-L152 WeakPolarHBondContact O-CG 3.48Å; E148-L152 PolarHBondContact O-N 3.1Å
153T97.9Very high97.2Very high89 Ų8962.1 Ų62.155%0.54635%0.346SS..Hα-helixtrans-121.4-13.5-175.668.60000114.6L149 A155L149-T153 HydrophobicContact CD1-CG2 4.05Å; L149-T153 WeakPolarHBondContact O-CB 3.25Å; L149-T153 PolarHBondContact O-N 3.34Å; L149-T153 PolarHBondContact O-OG1 3.35Å; T153-A155 PolarHBondContact O-N 3.07Å; T153-A155 VanDerWaalsContact OG1-CB 3.22Å; T153-A155 WeakPolarHBondContact OG1-CB 3.22Å; T153-A155 PolarHBondContact OG1-N 3.18Å
154G95.6Very high97Very high63 Ų6365.9 Ų65.965%0.64936%0.364SS*.  trans68.86.1-170.200000114.4A150A150-G154 VanDerWaalsContact O-CA 3.27Å; A150-G154 WeakPolarHBondContact O-CA 3.26Å; A150-G154 PolarHBondContact O-N 3.34Å
155A96.5Very high96.7Very high43 Ų4363.4 Ų63.436%0.35536%0.36SS..  trans-67.5143.4-179.300000112.3T153 V157T153-A155 PolarHBondContact O-N 3.07Å; T153-A155 VanDerWaalsContact OG1-CB 3.22Å; T153-A155 WeakPolarHBondContact OG1-CB 3.22Å; T153-A155 PolarHBondContact OG1-N 3.18Å; A155-V157 HydrophobicContact CB-CG2 4.45Å; A155-V157 PolarHBondContact O-N 3.17Å
156E96.9Very high96.3Very high73 Ų7360.3 Ų60.334%0.34135%0.35SS..  trans-77.1120.1170.9-71.8-75.4156.500110T173 R175 L176E156-T173 VanDerWaalsContact CA-OG1 3.23Å; E156-T173 WeakPolarHBondContact CA-OG1 3.16Å; E156-T173 VanDerWaalsContact CD-OG1 3.31Å; E156-T173 WeakPolarHBondContact OE2-CB 3.41Å; E156-T173 PolarHBondContact OE2-OG1 2.96Å; E156-R175 HydrophobicContact CG-CB 4.28Å; E156-R175 HydrophobicContact CG-CG 4.47Å; E156-R175 VanDerWaalsContact OE1-CD 3.24Å; E156-R175 WeakPolarHBondContact OE1-CD 3.32Å; E156-R175 VanDerWaalsContact OE1-CG 3.27Å; E156-R175 WeakPolarHBondContact OE1-CG 3.38Å; E156-R175 PolarHBondContact OE1-N 3.5Å; E156-R175 WeakPolarHBondContact OE2-CB 3.48Å; E156-R175 PolarHBondContact OE2-N 3.38Å; E156-L176 HydrophobicContact CB-CD1 3.93Å; E156-L176 HydrophobicContact CB-CG 4.13Å; E156-L176 PolarHBondContact OE2-N 3.31Å
157V97Very high96.1Very high23 Ų2363.4 Ų63.414%0.13936%0.363CS..  trans-127.2128.7-172.6177.30000109.9A146 L149 A150 A155 F171 A172 T173A146-V157 HydrophobicContact CB-CG1 4.12Å; L149-V157 HydrophobicContact CD2-CG2 3.99Å; L149-V157 HydrophobicContact CG-CG2 4.14Å; A150-V157 HydrophobicContact CB-CB 4.42Å; A150-V157 HydrophobicContact CB-CG2 4.2Å; A155-V157 HydrophobicContact CB-CG2 4.45Å; A155-V157 PolarHBondContact O-N 3.17Å; V157-F171 HydrophobicContact CB-CE1 4.11Å; V157-F171 HydrophobicContact CG1-CD1 4.25Å; V157-F171 HydrophobicContact CG1-CE1 4.04Å; V157-A172 WeakPolarHBondContact O-CA 3.1Å; V157-T173 HydrophobicContact CB-CG2 4.09Å; V157-T173 VanDerWaalsContact N-CG2 3.3Å; V157-T173 PolarHBondContact N-OG1 3.49Å; V157-T173 PolarHBondContact O-N 3.46Å; V157-T173 PolarHBondContact O-OG1 3.13Å
158L97.4Very high96Very high70 Ų7062.3 Ų62.337%0.36636%0.356SS..EExtended strand (participates in β ladder)trans-120.9120.5170.5173.764.1000109.2A172 L176 I179 I180L158-A172 HydrophobicContact CD1-CB 3.86Å; L158-L176 HydrophobicContact CB-CB 4.29Å; L158-L176 HydrophobicContact CB-CD1 3.74Å; L158-I179 HydrophobicContact CD2-CB 4.38Å; L158-I179 HydrophobicContact CD2-CD1 4.01Å; L158-I179 HydrophobicContact CD2-CG2 4.06Å; L158-I180 HydrophobicContact CD1-CG2 3.99Å
159L97.6Very high95.9Very high29 Ų2961 Ų6115%0.15235%0.349CS..EExtended strand (participates in β ladder)trans-120.7122.8174.3172.362.5000109.1L142 M143 A146 V161 T170 F171L142-L159 HydrophobicContact CD2-CD1 3.89Å; L142-L159 HydrophobicContact CD2-CD2 4.27Å; L142-L159 HydrophobicContact CG-CD1 4.26Å; L142-L159 HydrophobicContact CG-CD2 3.86Å; M143-L159 HydrophobicContact CE-CD2 3.74Å; M143-L159 HydrophobicContact CE-CG 3.86Å; M143-L159 HydrophobicContact CG-CD2 4.19Å; M143-L159 HydrophobicContact SD-CD2 3.68Å; M143-L159 HydrophobicContact SD-CG 4.29Å; A146-L159 HydrophobicContact CB-CB 4.3Å; A146-L159 HydrophobicContact CB-CD2 3.82Å; L159-V161 HydrophobicContact CD1-CG2 3.87Å; L159-V161 HydrophobicContact CG-CG2 4.17Å; L159-T170 WeakPolarHBondContact O-CA 3.43Å; L159-F171 HydrophobicContact CB-CB 4.38Å; L159-F171 PolarHBondContact N-O 3.46Å; L159-F171 PolarHBondContact O-N 3.02Å
160L97.1Very high95.9Very high69 Ų6956.9 Ų56.936%0.36133%0.327SS..EExtended strand (participates in β ladder)trans-123.3125.5174.8-173.8153.5000109.1V168 T170 I189L160-V168 HydrophobicContact CD1-CG1 4.09Å; L160-V168 HydrophobicContact CD2-CG1 3.89Å; L160-V168 HydrophobicContact CG-CG1 3.74Å; L160-T170 HydrophobicContact CD1-CG2 4.37Å; L160-T170 HydrophobicContact CG-CG2 4.21Å; L160-I189 HydrophobicContact CD1-CD1 3.85Å; L160-I189 HydrophobicContact CD1-CG1 4.06Å; L160-I189 HydrophobicContact CD1-CG2 3.99Å
161V96.9Very high95.8Very high25 Ų2556.6 Ų56.615%0.15232%0.323CS..EExtended strand (participates in β ladder)trans-126.2108.2179.2-179.50000109.1F135 M143 L159 Y169F135-V161 HydrophobicContact CE2-CG1 3.66Å; F135-V161 HydrophobicContact CZ-CG1 3.84Å; M143-V161 HydrophobicContact CE-CB 4.26Å; M143-V161 HydrophobicContact CE-CG2 3.86Å; L159-V161 HydrophobicContact CD1-CG2 3.87Å; L159-V161 HydrophobicContact CG-CG2 4.17Å; V161-Y169 PolarHBondContact N-O 3.04Å; V161-Y169 PolarHBondContact O-N 2.89Å
162A95.7Very high95.8Very high45 Ų4551.7 Ų51.737%0.37230%0.301SS..EExtended strand (participates in β ladder)trans-83.6144.8168.400000110.6L193A162-L193 HydrophobicContact CB-CD2 4.01Å
163S94.5Very high95.8Very high15 Ų1545 Ų4511%0.10527%0.267CS..  trans-106.7161.5174.856.70000111.6T165 N166 H167S163-T165 PolarHBondContact O-N 2.83Å; S163-T165 PolarHBondContact OG-OG1 2.9Å; S163-N166 WeakPolarHBondContact O-CA 3.37Å; S163-N166 PolarHBondContact O-N 3.24Å; S163-H167 PolarHBondContact N-O 2.94Å; S163-H167 WeakPolarHBondContact OG-CA 3.34Å; S163-H167 WeakPolarHBondContact OG-CB 3.33Å; S163-H167 PolarHBondContact OG-N 2.8Å; S163-H167 PolarHBondContact OG-O 3.29Å
164E92.4Very high95.7Very high88 Ų8846.7 Ų46.741%0.41127%0.268SS..THydrogen-bonded Turntrans-56.6-36171.5-60-175.2166.500112.3R131 Y132 N166R131-E164 WeakPolarHBondContact CD-OE1 3.34Å; R131-E164 IonicContact CZ-OE1 3.47Å; R131-E164 IonicContact NE-OE1 2.64Å; R131-E164 PolarHBondContact NE-OE1 3.24Å; R131-E164 IonicContact NH1-OE1 3.54Å; R131-E164 PolarHBondContact NH1-OE1 3.05Å; R131-E164 IonicContact NH1-OE2 3.52Å; Y132-E164 HydrophobicContact CE1-CB 4.26Å; Y132-E164 HydrophobicContact CE1-CG 4.32Å; Y132-E164 WeakPolarHBondContact CE1-OE2 3.27Å; Y132-E164 PolarHBondContact OH-OE2 3.09Å; E164-N166 PolarHBondContact O-N 2.86Å
165T92.2Very high95.7Very high77 Ų7751.5 Ų51.547%0.47227%0.267SS..THydrogen-bonded Turntrans-76.119.3174.257.80000112.4S163 H167S163-T165 PolarHBondContact O-N 2.83Å; S163-T165 PolarHBondContact OG-OG1 2.9Å; T165-H167 PolarHBondContact O-N 2.95Å; T165-H167 PolarHBondContact O-ND1 2.77Å; T165-H167 PolarHBondContact OG1-ND1 2.77Å
166N90.7Very high95.6Very high81 Ų8151.6 Ų51.643%0.43326%0.261SS..  trans63.1-1.9174.6-104-81.8000116.7S163 E164 K289S163-N166 WeakPolarHBondContact O-CA 3.37Å; S163-N166 PolarHBondContact O-N 3.24Å; E164-N166 PolarHBondContact O-N 2.86Å; N166-K289 HydrophobicContact CB-CD 4.04Å; N166-K289 WeakPolarHBondContact O-CD 3.45Å; N166-K289 VanDerWaalsContact O-CE 3.32Å; N166-K289 WeakPolarHBondContact O-CE 3.11Å; N166-K289 PolarHBondContact O-NZ 3.03Å; N166-K289 PolarHBondContact OD1-NZ 3.1Å
167H93.2Very high95.5Very high74 Ų7451.5 Ų51.534%0.34326%0.26SS..  trans-67.6137.6173.8-63.174.9000110.2S163 T165 Y169S163-H167 PolarHBondContact N-O 2.94Å; S163-H167 WeakPolarHBondContact OG-CA 3.34Å; S163-H167 WeakPolarHBondContact OG-CB 3.33Å; S163-H167 PolarHBondContact OG-N 2.8Å; S163-H167 PolarHBondContact OG-O 3.29Å; T165-H167 PolarHBondContact O-N 2.95Å; T165-H167 PolarHBondContact O-ND1 2.77Å; T165-H167 PolarHBondContact OG1-ND1 2.77Å; H167-Y169 HydrophobicContact CB-CE2 4.02Å
168V95.1Very high95.4Very high11 Ų1151.7 Ų51.77%0.06727%0.266CS..EExtended strand (participates in β ladder)trans-111.4120.9178.7-173.10000108.7L160 T170 L193 I287L160-V168 HydrophobicContact CD1-CG1 4.09Å; L160-V168 HydrophobicContact CD2-CG1 3.89Å; L160-V168 HydrophobicContact CG-CG1 3.74Å; V168-T170 HydrophobicContact CG1-CG2 4.04Å; V168-L193 HydrophobicContact CG2-CD1 3.74Å; V168-I287 PolarHBondContact O-N 3.23Å
169Y96.9Very high95.3Very high43 Ų4352 Ų5217%0.16927%0.267CS..EExtended strand (participates in β ladder)trans-104.2132.2176.2-56.1-94.8000108.6F135 K139 V161 H167 I286F135-Y169 AromaticContact CE1-CE2 3.95Å; F135-Y169 HydrophobicContact CE1-CE2 3.95Å; F135-Y169 HydrophobicContact CZ-CD2 4.24Å; F135-Y169 HydrophobicContact CZ-CE2 4.01Å; K139-Y169 HydrophobicContact CD-CD1 3.77Å; K139-Y169 HydrophobicContact CD-CD2 3.59Å; K139-Y169 HydrophobicContact CD-CE1 4.02Å; K139-Y169 HydrophobicContact CD-CE2 3.88Å; K139-Y169 HydrophobicContact CD-CG 3.54Å; V161-Y169 PolarHBondContact N-O 3.04Å; V161-Y169 PolarHBondContact O-N 2.89Å; H167-Y169 HydrophobicContact CB-CE2 4.02Å; Y169-I286 HydrophobicContact CD1-CD1 4.25Å; Y169-I286 HydrophobicContact CD1-CG1 4.08Å; Y169-I286 HydrophobicContact CD1-CG2 4.47Å; Y169-I286 HydrophobicContact CE1-CD1 4.18Å; Y169-I286 HydrophobicContact CE1-CG1 4.45Å; Y169-I286 HydrophobicContact CE1-CG2 4.45Å
170T96.9Very high95.1Very high2 Ų251.4 Ų51.41%0.01226%0.264CS..EExtended strand (participates in β ladder)trans-131146.4-175.757.70000112.8L159 L160 V168 I180 G285L159-T170 WeakPolarHBondContact O-CA 3.43Å; L160-T170 HydrophobicContact CD1-CG2 4.37Å; L160-T170 HydrophobicContact CG-CG2 4.21Å; V168-T170 HydrophobicContact CG1-CG2 4.04Å; T170-I180 HydrophobicContact CG2-CG2 3.95Å; T170-I180 WeakPolarHBondContact OG1-CD1 3.3Å; T170-G285 PolarHBondContact N-O 3.29Å; T170-G285 PolarHBondContact OG1-O 2.64Å; T170-G285 VanDerWaalsContact OG1-O 3.14Å
171F97.1Very high95Very high10 Ų1053 Ų534%0.04427%0.27CS..EExtended strand (participates in β ladder)trans-130.1132.5160.1167.6-97.7000107.7M143 A146 V147 A150 V157 L159 T173M143-F171 HydrophobicContact SD-CB 3.8Å; A146-F171 HydrophobicContact CB-CD1 3.6Å; A146-F171 HydrophobicContact CB-CE1 3.94Å; A146-F171 HydrophobicContact CB-CG 4.35Å; A146-F171 VanDerWaalsContact O-CE1 3.25Å; A146-F171 WeakPolarHBondContact O-CE1 3.26Å; V147-F171 HydrophobicContact CB-CE2 4.39Å; V147-F171 HydrophobicContact CB-CZ 4.49Å; V147-F171 HydrophobicContact CG2-CD2 3.82Å; V147-F171 HydrophobicContact CG2-CE2 3.54Å; V147-F171 HydrophobicContact CG2-CZ 4.06Å; A150-F171 HydrophobicContact CB-CE1 4.23Å; A150-F171 HydrophobicContact CB-CZ 4.02Å; V157-F171 HydrophobicContact CB-CE1 4.11Å; V157-F171 HydrophobicContact CG1-CD1 4.25Å; V157-F171 HydrophobicContact CG1-CE1 4.04Å; L159-F171 HydrophobicContact CB-CB 4.38Å; L159-F171 PolarHBondContact N-O 3.46Å; L159-F171 PolarHBondContact O-N 3.02Å; F171-T173 HydrophobicContact CE1-CG2 4.34Å; F171-T173 HydrophobicContact CZ-CG2 4.35Å
172A97Very high94.9Very high6 Ų656.7 Ų56.75%0.0529%0.288CS..EExtended strand (participates in β ladder)trans-143.7132.1179.300000111V157 L158 I180 R283V157-A172 WeakPolarHBondContact O-CA 3.1Å; L158-A172 HydrophobicContact CD1-CB 3.86Å; A172-I180 HydrophobicContact CB-CD1 3.7Å; A172-I180 HydrophobicContact CB-CG1 4.2Å; A172-R283 PolarHBondContact O-NH2 2.8Å
173T97Very high94.9Very high10 Ų1060.5 Ų60.56%0.06130%0.298CS..  trans-67.2167.916750.90000111.5A150 E156 V157 F171 R175 L176 K177A150-T173 HydrophobicContact CB-CG2 3.6Å; E156-T173 VanDerWaalsContact CA-OG1 3.23Å; E156-T173 WeakPolarHBondContact CA-OG1 3.16Å; E156-T173 VanDerWaalsContact CD-OG1 3.31Å; E156-T173 WeakPolarHBondContact OE2-CB 3.41Å; E156-T173 PolarHBondContact OE2-OG1 2.96Å; V157-T173 HydrophobicContact CB-CG2 4.09Å; V157-T173 VanDerWaalsContact N-CG2 3.3Å; V157-T173 PolarHBondContact N-OG1 3.49Å; V157-T173 PolarHBondContact O-N 3.46Å; V157-T173 PolarHBondContact O-OG1 3.13Å; F171-T173 HydrophobicContact CE1-CG2 4.34Å; F171-T173 HydrophobicContact CZ-CG2 4.35Å; T173-R175 PolarHBondContact O-N 2.83Å; T173-L176 PolarHBondContact O-N 2.89Å; T173-K177 PolarHBondContact O-N 3.45Å
174Q95.7Very high94.9Very high123 Ų12364.4 Ų64.458%0.57532%0.324SS*.THydrogen-bonded Turntrans-67.9-33.2-161-178.758.915.800113.5
175R95.1Very high95Very high165 Ų16560.6 Ų60.662%0.62331%0.308SS*.THydrogen-bonded Turntrans-76.6-31.3176.6-58.8164.864.9-160.53.6111.5N58 E156 T173N58-R175 PolarHBondContact OD1-NH1 3.16Å; N58-R175 PolarHBondContact OD1-NH2 3.2Å; E156-R175 HydrophobicContact CG-CB 4.28Å; E156-R175 HydrophobicContact CG-CG 4.47Å; E156-R175 VanDerWaalsContact OE1-CD 3.24Å; E156-R175 WeakPolarHBondContact OE1-CD 3.32Å; E156-R175 VanDerWaalsContact OE1-CG 3.27Å; E156-R175 WeakPolarHBondContact OE1-CG 3.38Å; E156-R175 PolarHBondContact OE1-N 3.5Å; E156-R175 WeakPolarHBondContact OE2-CB 3.48Å; E156-R175 PolarHBondContact OE2-N 3.38Å; T173-R175 PolarHBondContact O-N 2.83Å
176L96.3Very high95.1Very high45 Ų4561 Ų6124%0.23630%0.304CS..THydrogen-bonded Turntrans-84.8-16.1-179.7-57.9-178.3000114.2E156 L158 T173 G178 I179E156-L176 HydrophobicContact CB-CD1 3.93Å; E156-L176 HydrophobicContact CB-CG 4.13Å; E156-L176 PolarHBondContact OE2-N 3.31Å; L158-L176 HydrophobicContact CB-CB 4.29Å; L158-L176 HydrophobicContact CB-CD1 3.74Å; T173-L176 PolarHBondContact O-N 2.89Å; L176-G178 PolarHBondContact O-N 3.06Å; L176-G178 VanDerWaalsContact O-N 3.11Å; L176-I179 HydrophobicContact CB-CD1 4.41Å; L176-I179 HydrophobicContact CD2-CD1 4.02Å; L176-I179 WeakPolarHBondContact O-CB 3.35Å; L176-I179 WeakPolarHBondContact O-CG1 3.38Å; L176-I179 PolarHBondContact O-N 3.38Å
177K94.5Very high95.3Very high71 Ų7163 Ų6331%0.30931%0.308SS..THydrogen-bonded Turntrans-51-34.3179-172.9172.7174.7-179.10113.9T173 I179 I180 E181T173-K177 PolarHBondContact O-N 3.45Å; K177-I179 PolarHBondContact O-N 3.26Å; K177-I180 WeakPolarHBondContact O-CG1 3.37Å; K177-I180 PolarHBondContact O-N 3.36Å; K177-E181 WeakPolarHBondContact CE-OE1 3.31Å; K177-E181 WeakPolarHBondContact CE-OE2 3.38Å; K177-E181 HydrophobicContact CG-CG 4.27Å; K177-E181 IonicContact NZ-OE1 3.43Å; K177-E181 PolarHBondContact O-N 3.37Å; K177-E181 VanDerWaalsContact O-N 3.13Å
178G94.1Very high95.4Very high27 Ų2764.6 Ų64.628%0.27832%0.319SS..Hα-helixtrans-58.6-27.6175.500000114.5L176 I180 L182L176-G178 PolarHBondContact O-N 3.06Å; L176-G178 VanDerWaalsContact O-N 3.11Å; G178-I180 VanDerWaalsContact C-N 3.29Å; G178-I180 PolarHBondContact O-N 3.37Å; G178-L182 WeakPolarHBondContact O-CB 3.06Å; G178-L182 VanDerWaalsContact O-CG 3.22Å; G178-L182 WeakPolarHBondContact O-CG 3.47Å; G178-L182 PolarHBondContact O-N 2.83Å
179I95.2Very high95.4Very high76 Ų7665.6 Ų65.639%0.3932%0.324SS..Hα-helixtrans-68.4-28.6-179.7-59.9169.7000111.7L158 L176 K177 G185L158-I179 HydrophobicContact CD2-CB 4.38Å; L158-I179 HydrophobicContact CD2-CD1 4.01Å; L158-I179 HydrophobicContact CD2-CG2 4.06Å; L176-I179 HydrophobicContact CB-CD1 4.41Å; L176-I179 HydrophobicContact CD2-CD1 4.02Å; L176-I179 WeakPolarHBondContact O-CB 3.35Å; L176-I179 WeakPolarHBondContact O-CG1 3.38Å; L176-I179 PolarHBondContact O-N 3.38Å; K177-I179 PolarHBondContact O-N 3.26Å; I179-G185 CarbonylContact O-C 3.46Å; I179-G185 VanDerWaalsContact O-CA 3.26Å; I179-G185 WeakPolarHBondContact O-CA 3.49Å
180I94.5Very high95.2Very high16 Ų1669.8 Ų69.88%0.08235%0.345CS..Hα-helixtrans-101.7-22.9-179.358.8166.2000113.3L158 T170 A172 K177 G178 K186 I189L158-I180 HydrophobicContact CD1-CG2 3.99Å; T170-I180 HydrophobicContact CG2-CG2 3.95Å; T170-I180 WeakPolarHBondContact OG1-CD1 3.3Å; A172-I180 HydrophobicContact CB-CD1 3.7Å; A172-I180 HydrophobicContact CB-CG1 4.2Å; K177-I180 WeakPolarHBondContact O-CG1 3.37Å; K177-I180 PolarHBondContact O-N 3.36Å; G178-I180 VanDerWaalsContact C-N 3.29Å; G178-I180 PolarHBondContact O-N 3.37Å; I180-K186 WeakPolarHBondContact O-CE 3.31Å; I180-K186 WeakPolarHBondContact O-CG 3.24Å; I180-I189 HydrophobicContact CG2-CD1 4.25Å
181E94.7Very high95.1Very high104 Ų10473.5 Ų73.549%0.48637%0.368SS..Hα-helixtrans-97.5-34.1-178.5-71.2-172.716600114.6K177 K186K177-E181 WeakPolarHBondContact CE-OE1 3.31Å; K177-E181 WeakPolarHBondContact CE-OE2 3.38Å; K177-E181 HydrophobicContact CG-CG 4.27Å; K177-E181 IonicContact NZ-OE1 3.43Å; K177-E181 PolarHBondContact O-N 3.37Å; K177-E181 VanDerWaalsContact O-N 3.13Å; E181-K186 WeakPolarHBondContact O-CE 3.47Å; E181-K186 PolarHBondContact O-NZ 3.43Å
182L95.2Very high94.9Very high102 Ų10276.5 Ų76.553%0.53439%0.389SS..SBendtrans-74.1144.3-179.6-61.4173.1000111.2G178 C184 G185 K186G178-L182 WeakPolarHBondContact O-CB 3.06Å; G178-L182 VanDerWaalsContact O-CG 3.22Å; G178-L182 WeakPolarHBondContact O-CG 3.47Å; G178-L182 PolarHBondContact O-N 2.83Å; L182-C184 VanDerWaalsContact C-N 3.26Å; L182-C184 PolarHBondContact O-N 3.39Å; L182-G185 PolarHBondContact O-N 2.97Å; L182-K186 PolarHBondContact O-N 3.28Å
183E95.6Very high94.7Very high125 Ų12578.7 Ų78.758%0.58440%0.4SS*.Hα-helixtrans-62.6-32.4-175.3-168.152-14300113.1G185 K187E183-G185 VanDerWaalsContact C-N 3.35Å; E183-G185 PolarHBondContact O-N 2.77Å; E183-K187 WeakPolarHBondContact O-CB 3.48Å; E183-K187 PolarHBondContact O-N 3.33Å
184C94.1Very high94.4Very high96 Ų9681.2 Ų81.265%0.64942%0.418SS*.Hα-helixtrans-62.9-38.9172.453.60000112.8L182 L188L182-C184 VanDerWaalsContact C-N 3.26Å; L182-C184 PolarHBondContact O-N 3.39Å; C184-L188 WeakPolarHBondContact O-CB 3.4Å; C184-L188 PolarHBondContact O-N 2.62Å; C184-L188 VanDerWaalsContact O-N 3.11Å
185G94.6Very high93.5Very high8 Ų878.9 Ų78.98%0.08242%0.415CS..Hα-helixtrans-73.7-45.4177.700000112.4I179 L182 E183 K187 L188 I189I179-G185 CarbonylContact O-C 3.46Å; I179-G185 VanDerWaalsContact O-CA 3.26Å; I179-G185 WeakPolarHBondContact O-CA 3.49Å; L182-G185 PolarHBondContact O-N 2.97Å; E183-G185 VanDerWaalsContact C-N 3.35Å; E183-G185 PolarHBondContact O-N 2.77Å; G185-K187 PolarHBondContact O-N 3.06Å; G185-L188 WeakPolarHBondContact O-CB 3.32Å; G185-L188 PolarHBondContact O-N 3.37Å; G185-I189 WeakPolarHBondContact O-CG1 3.25Å; G185-I189 PolarHBondContact O-N 2.71Å
186K93.9Very high92Very high86 Ų8675.1 Ų75.137%0.37441%0.414SS..Hα-helixtrans-54.4-49.4172-73.3167.6171.91580112I180 E181 L182 L188 I189 Q190I180-K186 WeakPolarHBondContact O-CE 3.31Å; I180-K186 WeakPolarHBondContact O-CG 3.24Å; E181-K186 WeakPolarHBondContact O-CE 3.47Å; E181-K186 PolarHBondContact O-NZ 3.43Å; L182-K186 PolarHBondContact O-N 3.28Å; K186-L188 VanDerWaalsContact C-N 3.35Å; K186-L188 PolarHBondContact O-N 2.92Å; K186-I189 PolarHBondContact O-N 3.34Å; K186-Q190 WeakPolarHBondContact O-CB 3.47Å; K186-Q190 PolarHBondContact O-N 3.42Å
187K94.7Very high90.2Very high122 Ų12277.7 Ų77.753%0.5343%0.431SS..Hα-helixtrans-64.1-36.5178.6-171.8168.5-174.9168.60112.8E183 G185 T191E183-K187 WeakPolarHBondContact O-CB 3.48Å; E183-K187 PolarHBondContact O-N 3.33Å; G185-K187 PolarHBondContact O-N 3.06Å; K187-T191 WeakPolarHBondContact O-CB 3.24Å; K187-T191 PolarHBondContact O-N 3.08Å; K187-T191 PolarHBondContact O-OG1 2.89Å
188L95.3Very high88.2Confident108 Ų10880.7 Ų80.757%0.56545%0.451SS*.Hα-helixtrans-62.5-52.3172.2178.361.4000111.2C184 G185 K186 Q190 T191 C192C184-L188 WeakPolarHBondContact O-CB 3.4Å; C184-L188 PolarHBondContact O-N 2.62Å; C184-L188 VanDerWaalsContact O-N 3.11Å; G185-L188 WeakPolarHBondContact O-CB 3.32Å; G185-L188 PolarHBondContact O-N 3.37Å; K186-L188 VanDerWaalsContact C-N 3.35Å; K186-L188 PolarHBondContact O-N 2.92Å; L188-Q190 VanDerWaalsContact C-N 3.33Å; L188-Q190 PolarHBondContact O-N 3.22Å; L188-T191 WeakPolarHBondContact O-CB 3.43Å; L188-T191 PolarHBondContact O-N 3.03Å; L188-T191 VanDerWaalsContact O-N 3.13Å; L188-C192 PolarHBondContact O-N 2.68Å; L188-C192 PolarHBondContact O-SG 3.28Å; L188-C192 VanDerWaalsContact O-SG 3.38Å
189I94.4Very high86.1Confident32 Ų3283.6 Ų83.616%0.16447%0.467CS..Hα-helixtrans-57.4-45.4178.2-67162.3000110.8L160 I180 G185 K186 C192 L193L160-I189 HydrophobicContact CD1-CD1 3.85Å; L160-I189 HydrophobicContact CD1-CG1 4.06Å; L160-I189 HydrophobicContact CD1-CG2 3.99Å; I180-I189 HydrophobicContact CG2-CD1 4.25Å; G185-I189 WeakPolarHBondContact O-CG1 3.25Å; G185-I189 PolarHBondContact O-N 2.71Å; K186-I189 PolarHBondContact O-N 3.34Å; I189-C192 PolarHBondContact O-N 3.39Å; I189-L193 HydrophobicContact CG2-CD1 3.9Å; I189-L193 WeakPolarHBondContact O-CG 2.93Å; I189-L193 PolarHBondContact O-N 3.13Å
190Q92.7Very high83.9Confident131 Ų13186.6 Ų86.661%0.61248%0.484SS*.Hα-helixtrans-62.6-42.4176.8-175.3-178.96.400111.9K186 L188 L193 S194K186-Q190 WeakPolarHBondContact O-CB 3.47Å; K186-Q190 PolarHBondContact O-N 3.42Å; L188-Q190 VanDerWaalsContact C-N 3.33Å; L188-Q190 PolarHBondContact O-N 3.22Å; Q190-L193 PolarHBondContact O-N 2.84Å; Q190-S194 VanDerWaalsContact O-CB 3.24Å; Q190-S194 WeakPolarHBondContact O-CB 3.39Å; Q190-S194 PolarHBondContact O-N 3.33Å; Q190-S194 PolarHBondContact O-OG 3.44Å
191T94.5Very high81.5Confident80 Ų8093.3 Ų93.349%0.49152%0.52SS..Hα-helixtrans-61.1-50.6177.7-58.30000110.4K187 L188 L193 S194 S195K187-T191 WeakPolarHBondContact O-CB 3.24Å; K187-T191 PolarHBondContact O-N 3.08Å; K187-T191 PolarHBondContact O-OG1 2.89Å; L188-T191 WeakPolarHBondContact O-CB 3.43Å; L188-T191 PolarHBondContact O-N 3.03Å; L188-T191 VanDerWaalsContact O-N 3.13Å; T191-L193 PolarHBondContact O-N 3.3Å; T191-S194 PolarHBondContact O-N 3.22Å; T191-S194 PolarHBondContact O-OG 3.49Å; T191-S195 PolarHBondContact O-N 3.32Å
192C94.4Very high78.9Confident73 Ų7393.5 Ų93.549%0.49353%0.532SS..Hα-helixtrans-55.7-51.7176.9-660000112L188 I189 S194 S195L188-C192 PolarHBondContact O-N 2.68Å; L188-C192 PolarHBondContact O-SG 3.28Å; L188-C192 VanDerWaalsContact O-SG 3.38Å; I189-C192 PolarHBondContact O-N 3.39Å; C192-S194 VanDerWaalsContact C-N 3.34Å; C192-S194 PolarHBondContact O-N 2.7Å; C192-S195 PolarHBondContact O-N 3.47Å; C192-S195 PolarHBondContact O-OG 2.9Å
193L92.5Very high76.2Confident53 Ų5393.8 Ų93.828%0.27754%0.543SS..Hα-helixtrans-68.7-29.1-178-66.5174.7000113.5A162 V168 I189 Q190 T191A162-L193 HydrophobicContact CB-CD2 4.01Å; V168-L193 HydrophobicContact CG2-CD1 3.74Å; I189-L193 HydrophobicContact CG2-CD1 3.9Å; I189-L193 WeakPolarHBondContact O-CG 2.93Å; I189-L193 PolarHBondContact O-N 3.13Å; Q190-L193 PolarHBondContact O-N 2.84Å; T191-L193 PolarHBondContact O-N 3.3Å
194S90.3Very high73.8Confident63 Ų6395.2 Ų95.244%0.44155%0.553SS.*Hα-helixtrans-72.7-30.4177.2700000113.1Q190 T191 C192 S196 V197Q190-S194 VanDerWaalsContact O-CB 3.24Å; Q190-S194 WeakPolarHBondContact O-CB 3.39Å; Q190-S194 PolarHBondContact O-N 3.33Å; Q190-S194 PolarHBondContact O-OG 3.44Å; T191-S194 PolarHBondContact O-N 3.22Å; T191-S194 PolarHBondContact O-OG 3.49Å; C192-S194 VanDerWaalsContact C-N 3.34Å; C192-S194 PolarHBondContact O-N 2.7Å; S194-S196 VanDerWaalsContact C-N 3.26Å; S194-S196 PolarHBondContact O-N 2.76Å; S194-V197 PolarHBondContact O-N 3.16Å
195S77.2Confident71.2Confident74 Ų74102.1 Ų102.152%0.51757%0.565SS.*Hα-helixtrans-59.8-32.9-174.671.20000114.1T191 C192 V197T191-S195 PolarHBondContact O-N 3.32Å; C192-S195 PolarHBondContact O-N 3.47Å; C192-S195 PolarHBondContact O-OG 2.9Å; S195-V197 VanDerWaalsContact C-N 3.31Å; S195-V197 PolarHBondContact O-N 2.9Å
196S63Low68.5Low86 Ų86106.3 Ų106.360%0.60159%0.594SS**THydrogen-bonded Turntrans-78.1-8.1-174.3-46.30000115S194S194-S196 VanDerWaalsContact C-N 3.26Å; S194-S196 PolarHBondContact O-N 2.76Å
197V58.1Low66Low99 Ų99108.6 Ų108.660%0.661%0.61SS**THydrogen-bonded Turntrans-86.5-25.7-174-169.20000112.3S194 S195S194-V197 PolarHBondContact O-N 3.16Å; S195-V197 VanDerWaalsContact C-N 3.31Å; S195-V197 PolarHBondContact O-N 2.9Å
198N52.3Low63.8Low134 Ų134111 Ų11172%0.71762%0.623SS**SBendtrans-92.8-9.8-167.3-66.7-13.2000114.9N200N198-N200 PolarHBondContact O-N 3.36Å
199S51.4Low61.1Low87 Ų87110.5 Ų110.561%0.60863%0.626SS**THydrogen-bonded Turntrans-81.4-9.4-170.2-600000115.8
200N47.4Very low58.1Low140 Ų140116.1 Ų116.175%0.74966%0.657SS**THydrogen-bonded Turntrans-104-2-165-66.63.7000115.2N198N198-N200 PolarHBondContact O-N 3.36Å
201N44.9Very low55.7Low156 Ų156117.6 Ų117.683%0.83467%0.668SS**SBendtrans-114.14.1-174.7-74.7-3.2000114.6
202S40.4Very low52.8Low108 Ų108118.2 Ų118.276%0.75568%0.676SS**  trans-106.363.1-178.363.30000112.5
203S37.6Very low49.7Very low109 Ų109120.1 Ų120.176%0.76269%0.69SS**  trans-143.5155.9166.9-167.80000109.4
204I45.9Very low46.9Very low155 Ų155122.9 Ų122.980%0.79571%0.713SS**SBendtrans68.481.6-170.8-45.5168.7000113.8
205R40.7Very low44.4Very low240 Ų240128.5 Ų128.591%0.90673%0.733SS**  -178.699.4129.2-98.7161.7-164.8-79.4-1.7110.4
206S36.5Very low42.3Very low97 Ų97130.1 Ų130.168%0.67874%0.739SS**  trans-75146.8156.856.90000109.3
207D41Very low40.8Very low134 Ų134132.9 Ų132.972%0.71775%0.748SS**  164.2131.2120.5-81.6-3.3000112.8
208Q48.5Very low39.8Very low171 Ų171137.3 Ų137.380%0.79976%0.759SS**  trans72.5155.9155.1-64.6-48.8-57.700119
209P39.3Very low39Very low98 Ų98137.5 Ų137.564%0.63676%0.76SS**  -129.3-175.4-127.245.7-33.4000116.4
210D32Very low38.1Very low150 Ų150140 Ų14080%0.80277%0.771SS**  trans32.9110.6154.7-69.3-16.6000120
211L41.6Very low37.5Very low163 Ų163139 Ų13985%0.85377%0.766SS**  -159140.2128.7-134.773.7000114
212S34.9Very low36.8Very low93 Ų93138.2 Ų138.265%0.6577%0.77SS**  trans41.589.6152.161.60000120.4
213S29Very low36.5Very low112 Ų112142.1 Ų142.178%0.78377%0.769SS**  28.198.9126.160.60000120
214S33.8Very low36.3Very low111 Ų111146 Ų14678%0.77677%0.767SS**  trans-162.7127.9139.6-900000114.5
215Q37.1Very low35.7Very low181 Ų181145.8 Ų145.885%0.84677%0.766SS**  trans33.7113.2144.3-50.5-176.7-7.600119.7
216V32.8Very low35.3Very low109 Ų109140.3 Ų140.366%0.66176%0.762SS**  170.4117.493.6164.40000109.1K218V216-K218 HydrophobicContact CG1-CG 4.22Å; V216-K218 PolarHBondContact O-N 3.47Å
217N32.5Very low35.4Very low144 Ų144144.6 Ų144.677%0.7777%0.769SS**  trans-72.7106.9170.9-72-17.7000110.7N219N217-N219 PolarHBondContact O-N 2.83Å
218K35.6Very low35Very low192 Ų192146.9 Ų146.984%0.83577%0.773SS**  trans-82.565.6172.3-70.2-178.8179.41720111.1V216V216-K218 HydrophobicContact CG1-CG 4.22Å; V216-K218 PolarHBondContact O-N 3.47Å
219N35.9Very low34.3Very low138 Ų138147.6 Ų147.674%0.73878%0.776SS**  trans-66.3137.1179.3-77.42.6000111.9N217 N221N217-N219 PolarHBondContact O-N 2.83Å; N219-N221 PolarHBondContact O-N 3.45Å
220V33Very low33.9Very low140 Ų140150 Ų15085%0.84878%0.783SS**  trans-73116.7-176.7179.70000110.7
221N34.4Very low34Very low119 Ų119146 Ų14664%0.63678%0.778SS**  trans-146.368.4172.1-16913.3000111.8N219 R223N219-N221 PolarHBondContact O-N 3.45Å; N221-R223 VanDerWaalsContact C-N 3.28Å; N221-R223 PolarHBondContact O-N 2.85Å
222C31Very low33.3Very low138 Ų138144.9 Ų144.993%0.93278%0.778SS**  trans-73.278.4172.6-820000111.3
223R33.8Very low33Very low191 Ų191146.7 Ų146.772%0.72179%0.785SS**  trans-115.4106.2178-163.5-179.7-61.8-152.5-0.6111.7N221N221-R223 VanDerWaalsContact C-N 3.28Å; N221-R223 PolarHBondContact O-N 2.85Å
224R32.2Very low32.8Very low190 Ų190147.8 Ų147.872%0.71778%0.781SS**  trans21.6103159.4-69.9-175.4-94.3143.8-11.9117.4Y324R224-Y324 PolarHBondContact NH1-OH 2.88Å; R224-Y324 VanDerWaalsContact NH1-OH 3.09Å
225I34.2Very low32.6Very low151 Ų151147.9 Ų147.977%0.77478%0.776SS**  trans-159.9130.9135.1-93.1138.1000107.9
226C32.2Very low32.2Very low124 Ų124144.8 Ų144.884%0.83877%0.766SS**  trans-138.395.4161.4-670000106.8
227K37.7Very low32Very low188 Ų188145 Ų14582%0.81777%0.768SS**  trans-90.7150.1163.2-72.8-177.4174.2-175.90107.7
228K33.1Very low31.7Very low182 Ų182144.5 Ų144.579%0.79177%0.765SS**  trans-71.5135171.2-76-172.9170.7-166.90109.9
229E35Very low31.3Very low186 Ų186142 Ų14287%0.86977%0.765SS**  trans-130.9130.8149.1-68.8-178.9174.500105.4G231E229-G231 PolarHBondContact O-N 3.33Å
230D30.6Very low31Very low147 Ų147140.4 Ų140.479%0.78676%0.764SS**  trans-83.284.6-163.8-63.6-64.9000111.7
231G34.3Very low30.8Very low68 Ų68136.7 Ų136.770%0.70174%0.744SS**  trans-98.199.6176.500000113E229 V233E229-G231 PolarHBondContact O-N 3.33Å; G231-V233 PolarHBondContact O-N 2.97Å
232T25.4Very low30.9Very low139 Ų139139.2 Ų139.285%0.85375%0.749SS**  trans-58.4112.6-178.2-54.30000113.6
233V29Very low31.1Very low130 Ų130139.8 Ų139.879%0.78874%0.736SS**  trans-134.2136.5160-1760000108.8G231 V235G231-V233 PolarHBondContact O-N 2.97Å; V233-V235 PolarHBondContact O-N 2.7Å
234I26.2Very low31Very low136 Ų136135.5 Ų135.570%0.69773%0.728SS**  trans-74.7126-166.6-60.8165.4000111.1N236I234-N236 WeakPolarHBondContact CG2-OD1 3.43Å
235V29.2Very low31.1Very low113 Ų113135.8 Ų135.869%0.68573%0.73SS**  trans-117100.1167.2-178.50000107.9V233 T237V233-V235 PolarHBondContact O-N 2.7Å; V235-T237 HydrophobicContact CG1-CG2 4.32Å; V235-T237 PolarHBondContact O-N 3.47Å
236N28.4Very low31.2Very low116 Ų116134.9 Ų134.962%0.6272%0.721SS**  trans-69.198.6176.1-76.26.9000109.8I234 D238I234-N236 WeakPolarHBondContact CG2-OD1 3.43Å; N236-D238 PolarHBondContact O-N 2.8Å
237T28Very low31.4Very low114 Ų114131.7 Ų131.770%0.69970%0.7SS**  trans-81.162.8172.555.50000110.4V235 T239V235-T237 HydrophobicContact CG1-CG2 4.32Å; V235-T237 PolarHBondContact O-N 3.47Å; T237-T239 PolarHBondContact O-N 3.37Å
238D27.6Very low31.3Very low133 Ų133130.1 Ų130.171%0.71170%0.7SS**  trans-67.2100.8175-73-42.3000109.4N236 C240N236-D238 PolarHBondContact O-N 2.8Å; D238-C240 PolarHBondContact O-N 3.46Å
239T27.1Very low31.6Very low138 Ų138129 Ų12985%0.84770%0.702SS**  trans-75.663.7178.4420000110.6T237 S241T237-T239 PolarHBondContact O-N 3.37Å; T239-S241 VanDerWaalsContact C-N 3.32Å; T239-S241 PolarHBondContact O-N 2.91Å
240C29.3Very low31.5Very low105 Ų105128.1 Ų128.171%0.70970%0.695SS**  trans-66.791.7178.1-1610000111D238D238-C240 PolarHBondContact O-N 3.46Å
241S28.4Very low31.6Very low62 Ų62128.2 Ų128.243%0.43470%0.696SS.*  trans25.5120.6162.4-71.90000119.6T239 K243T239-S241 VanDerWaalsContact C-N 3.32Å; T239-S241 PolarHBondContact O-N 2.91Å; S241-K243 PolarHBondContact O-N 3Å
242K36.6Very low31.5Very low172 Ų172132.1 Ų132.175%0.74870%0.699SS**THydrogen-bonded Turntrans-59.634.5158.3-142.2-174.3-152.7-175.40114.3H282K242-H282 VanDerWaalsContact CE-NE2 3.31Å; K242-H282 WeakPolarHBondContact CE-NE2 3.39Å; K242-H282 PolarHBondContact NZ-CD2 3.23Å; K242-H282 PolarHBondContact NZ-NE2 3.14Å
243K34.1Very low31.8Very low151 Ų151130.5 Ų130.566%0.65769%0.693SS**THydrogen-bonded Turntrans-129.4-30.4-167.4-62.7-179.1176.3176.10114.2S241 Y245 F246S241-K243 PolarHBondContact O-N 3Å; K243-Y245 PolarHBondContact O-N 2.81Å; K243-F246 PolarHBondContact O-N 3.24Å
244D33.1Very low31.9Very low101 Ų101131.4 Ų131.454%0.5469%0.694SS.*THydrogen-bonded Turntrans-76.8-7.4-166.4-60.9-23.6000114.8
245Y33.8Very low32.2Very low195 Ų195134.5 Ų134.577%0.76570%0.703SS**THydrogen-bonded Turntrans-82.2-7.5171.9-84.7-72.5000114.6K243K243-Y245 PolarHBondContact O-N 2.81Å
246F35.5Very low32.5Very low133 Ų133137 Ų13758%0.58371%0.712SS**SBendtrans-100.2-13.1177.2-111.8-91.1000114.2K243K243-F246 PolarHBondContact O-N 3.24Å
247S36.3Very low32.7Very low56 Ų56137.4 Ų137.439%0.39272%0.724SS.*G310 helixtrans-65.4-42.8-171.9-49.90000113.8L249 N251S247-L249 VanDerWaalsContact C-N 3.27Å; S247-L249 PolarHBondContact O-N 3.13Å; S247-N251 PolarHBondContact O-ND2 3.25Å
248D36.6Very low33.1Very low155 Ų155141.3 Ų141.383%0.82973%0.731SS**G310 helixtrans-79.9-5.3-172.8-72.1-12.5000113.8
249L39.4Very low33.3Very low159 Ų159140.5 Ų140.583%0.83273%0.731SS**G310 helixtrans-119.215-177.5-73.6172000114.2S247S247-L249 VanDerWaalsContact C-N 3.27Å; S247-L249 PolarHBondContact O-N 3.13Å
250K33.6Very low33.5Very low167 Ų167141.5 Ų141.573%0.72673%0.731SS**  trans-140.134.7176.6-144169.1-174.5173.90116.2
251N31.9Very low33.5Very low150 Ų150141.3 Ų141.380%0.80273%0.731SS**  trans-10454171.9-86-68.9000113S247S247-N251 PolarHBondContact O-ND2 3.25Å
252I32Very low33.6Very low149 Ų149146 Ų14676%0.76475%0.748SS**SBendtrans-136.5139.8166.4-61.8-178.7000107.6
253S31.7Very low33.6Very low105 Ų105144 Ų14473%0.73475%0.745SS**SBendtrans82.5151-171.2-149.50000115.4
254N30.5Very low33.7Very low149 Ų149144.5 Ų144.580%0.79775%0.749SS**  trans71.450.9167.6-55.215.4000117.1
255K32.8Very low33.7Very low202 Ų202146 Ų14688%0.87876%0.757SS**  trans-117.578.2144.7-85.7-172.1175.6179.50109.4
256D35.3Very low33.7Very low165 Ų165143.2 Ų143.288%0.88276%0.756SS**  trans-166.3102.2162.3-92.9-38.5000108.3
257S33Very low33.7Very low125 Ų125142.6 Ų142.687%0.87476%0.763SS**  trans-153.265-179.353.80000112.3
258K36Very low33.7Very low195 Ų195146.4 Ų146.485%0.84878%0.783SS**  trans-144.7136.9165.4-151-177.4-179.3179.90110.7
259V31.7Very low33.7Very low117 Ų117144.2 Ų144.271%0.70978%0.778SS**  trans63.791.2174.9-161.80000115.3
260N32Very low33.1Very low159 Ų159142.5 Ų142.585%0.8577%0.774SS**  -163.3169.1108.8-98.8-47.9000110.8
261S29.5Very low33Very low101 Ų101142.2 Ų142.271%0.70678%0.78SS**  trans-126.5-176.9-166.861.60000112.9
262M30.6Very low32.9Very low159 Ų159139.1 Ų139.178%0.78377%0.77SS**  trans83.8138.3165.6-75.9171.85100119.5
263L35.7Very low32.8Very low131 Ų131138.7 Ų138.769%0.68677%0.769SS**  trans69.9118.9167.5-55.9165000115.1
264Q37.1Very low33.1Very low162 Ų162141 Ų14176%0.75777%0.768SS**  61.7131.364.4-64.8178.2-0.800112.5
265N32.3Very low33.4Very low132 Ų132140.3 Ų140.371%0.70677%0.765SS**  cis-171.3-177.9-13.7-123.329.5000107.7
266D33.6Very low33.4Very low136 Ų136139.3 Ų139.373%0.72776%0.763SS**  trans72114.7150.1-58-18.4000123.1
267T35.9Very low33.3Very low120 Ų120137.7 Ų137.774%0.73676%0.759SS**  9593126.2-56.30000122.8
268V36.8Very low33.2Very low136 Ų136140 Ų14082%0.82476%0.761SS**  70.3144.3127.61780000120.8
269P36.8Very low33.2Very low110 Ų110139.8 Ų139.871%0.71476%0.763SS**  trans-122.6-175.3-165.244.4-30.4000115.7
270T26.3Very low33.5Very low122 Ų122140 Ų14075%0.74876%0.76SS**  trans155.3160.8135.3-61.90000111.2
271L31.7Very low33.5Very low161 Ų161140.3 Ų140.384%0.84376%0.756SS**  trans77.7145.4-179.4-55.5153.1000115.3
272S30Very low34.2Very low86 Ų86141.9 Ų141.960%0.60175%0.752SS**  cis-170.7141.3-20.652.50000111.5
273N30.6Very low34.8Very low140 Ų140140.1 Ų140.175%0.74974%0.736SS**  trans64.7154.1167.7-45.4-28.5000115.6
274Q37.1Very low35.1Very low152 Ų152139 Ų13971%0.7173%0.73SS**  cis-172.5151.335.3-157107.62900111.4
275N36.7Very low35.5Very low135 Ų135132.9 Ų132.972%0.72271%0.711SS**  trans65.295.7153.9-62.7-9.4000123.9
276H32.3Very low35.8Very low182 Ų182130 Ų13084%0.84369%0.694SS**  4890.4110.6-170.3-67.8000120.5
277V34.2Very low35.9Very low131 Ų131126.6 Ų126.679%0.79468%0.676SS**  trans-164.487.6145.6-102.80000110.1
278D29.8Very low35.9Very low174 Ų174126 Ų12693%0.9367%0.674SS**  trans-165.840.2179.8-110.5-28.4000116.7
279E36.2Very low36.1Very low189 Ų189124.4 Ų124.488%0.88366%0.656SS**SBendtrans-147.832.2-179.1-140.5-177.1159.400119.5
280L37.4Very low35.7Very low123 Ų123124.9 Ų124.964%0.64466%0.657SS**  trans-129.9-10.8179-76.4172.9000118.3H282L280-H282 VanDerWaalsContact C-N 3.3Å; L280-H282 PolarHBondContact O-N 3.12Å
281E33.1Very low35.9Very low164 Ų164125.6 Ų125.677%0.76666%0.661SS**  trans-82.141.1-170.5-61.8-153.6130.400116.1
282H43.4Very low35.9Very low134 Ų134125.4 Ų125.462%0.6266%0.659SS**  trans-128.316.8-166.2-8415000116.9K242 L280K242-H282 VanDerWaalsContact CE-NE2 3.31Å; K242-H282 WeakPolarHBondContact CE-NE2 3.39Å; K242-H282 PolarHBondContact NZ-CD2 3.23Å; K242-H282 PolarHBondContact NZ-NE2 3.14Å; L280-H282 VanDerWaalsContact C-N 3.3Å; L280-H282 PolarHBondContact O-N 3.12Å
283R43.6Very low35.9Very low122 Ų122128.4 Ų128.446%0.4667%0.669SS.*  trans-120.8-0.1-167.3-66.4-17364.6159.54.8118.6A172 G285A172-R283 PolarHBondContact O-NH2 2.8Å; R283-G285 PolarHBondContact O-N 2.68Å
284I43Very low35.8Very low107 Ų107126.9 Ų126.955%0.54967%0.669SS.*  trans-87.3102.6-178.8-58.7178.6000110.5
285G44Very low35.5Very low34 Ų34123.1 Ų123.135%0.35167%0.671SS.*EExtended strand (participates in β ladder)trans-84.8122.9175.200000112.4T170 R283T170-G285 PolarHBondContact N-O 3.29Å; T170-G285 PolarHBondContact OG1-O 2.64Å; T170-G285 VanDerWaalsContact OG1-O 3.14Å; R283-G285 PolarHBondContact O-N 2.68Å
286I40.4Very low35.3Very low71 Ų71124.9 Ų124.936%0.36468%0.675SS.*EExtended strand (participates in β ladder)trans-104.1125.5165.5-56.8179.9000107.3Y169 P288Y169-I286 HydrophobicContact CD1-CD1 4.25Å; Y169-I286 HydrophobicContact CD1-CG1 4.08Å; Y169-I286 HydrophobicContact CD1-CG2 4.47Å; Y169-I286 HydrophobicContact CE1-CD1 4.18Å; Y169-I286 HydrophobicContact CE1-CG1 4.45Å; Y169-I286 HydrophobicContact CE1-CG2 4.45Å; I286-P288 WeakPolarHBondContact O-CD 3.34Å
287I35.2Very low35.3Very low66 Ų66124 Ų12434%0.33868%0.677SS.*EExtended strand (participates in β ladder)trans-95.3113.4177.6-56.6177.4000108.4V168V168-I287 PolarHBondContact O-N 3.23Å
288P36Very low34.9Very low108 Ų108121.1 Ų121.170%0.70167%0.673SS**  trans-68.9156.7174-15.731.2000111.4I286I286-P288 WeakPolarHBondContact O-CD 3.34Å
289K39.4Very low35Very low102 Ų102124.3 Ų124.344%0.44367%0.672SS.*  trans-116129.9167.7-84.2179.4170.8165.60109.9N166N166-K289 HydrophobicContact CB-CD 4.04Å; N166-K289 WeakPolarHBondContact O-CD 3.45Å; N166-K289 VanDerWaalsContact O-CE 3.32Å; N166-K289 WeakPolarHBondContact O-CE 3.11Å; N166-K289 PolarHBondContact O-NZ 3.03Å; N166-K289 PolarHBondContact OD1-NZ 3.1Å
290T29.3Very low34.5Very low120 Ų120121 Ų12174%0.73667%0.665SS**  trans-79.4139.7165.143.50000109.9
291T31.5Very low34.1Very low137 Ų137121.4 Ų121.484%0.8467%0.673SS**  trans-75.7135.4175.4-530000110
292I30.1Very low33.9Very low156 Ų156118.5 Ų118.580%0.867%0.67SS**  trans-97.3115.3164-62177.9000107.3
293D31Very low32.9Very low149 Ų149121.4 Ų121.480%0.79768%0.682SS**  trans-84.8151.5169.9-169.217.9000110.8G295D293-G295 PolarHBondContact O-N 3.27Å
294S27.7Very low32.3Very low108 Ų108121.6 Ų121.676%0.75570%0.7SS**  trans-94.464.8-166.8-62.20000112.9
295G31.1Very low31.6Very low74 Ų74123.3 Ų123.376%0.76371%0.71SS**  trans-73.9122.4174.400000113.2D293D293-G295 PolarHBondContact O-N 3.27Å
296Q32.6Very low31.1Very low171 Ų171128.7 Ų128.780%0.79973%0.731SS**  trans-83.2173.9172.1-64.5-176.8-400112.1
297N32.8Very low30.5Very low165 Ų165132.1 Ų132.188%0.88275%0.749SS**  trans80.5130.7-179.6-43.7-53.4000114.9
298G26.3Very low30.2Very low69 Ų69133.6 Ų133.671%0.71177%0.765SS**  cis133.861.6-9.800000115.2
299R30Very low30Very low241 Ų241137.5 Ų137.591%0.90977%0.774SS**  trans-163.1149.8153.8-113.7161.1-175.1174.30.9113.8
300T26.4Very low29.5Very low121 Ų121139.1 Ų139.174%0.74279%0.792SS**  trans-39165154.424.10000114.1
301V28.6Very low29.6Very low131 Ų131138.9 Ų138.979%0.79479%0.79SS**  cis-157.6164.544.1-142.30000114.3
302S28.8Very low29.4Very low103 Ų103139.2 Ų139.272%0.7279%0.787SS**  trans78.1109148-143.60000120.6
303F22.9Very low29.5Very low195 Ų195140.3 Ų140.386%0.85579%0.792SS**  trans-75.6156.9150.7-70.8-107.5000110.3
304C32.4Very low29.4Very low125 Ų125137.7 Ų137.785%0.84579%0.786SS**  trans-148.2131.4150.2-88.90000109.9
305N27.5Very low29.3Very low144 Ų144140.4 Ų140.477%0.7779%0.792SS**  trans-94.3144.2168.4-66.6-43000109.8
306N34.2Very low29.3Very low147 Ų147142.8 Ų142.879%0.78680%0.797SS**  trans-175.7119.3141.8-89.9-32.3000107.5
307I27.2Very low29.2Very low143 Ų143140.6 Ų140.673%0.73380%0.801SS**  77.5102.575.1-74.6-179.7000113
308S27.7Very low29.2Very low97 Ų97141.7 Ų141.768%0.67880%0.8SS**  trans61.6146144.7-58.10000121.6
309Q31.9Very low29.3Very low190 Ų190144.7 Ų144.789%0.88881%0.809SS**  trans72.8148178.9-43.4173.347.900111.7
310V30.4Very low29.4Very low135 Ų135143 Ų14382%0.81881%0.808SS**  cis-129.8167.314.5175.60000110.6
311T30.1Very low29.5Very low115 Ų115146.7 Ų146.771%0.70681%0.814SS**  trans-94.9166.3-178.544.90000115
312N27Very low29.7Very low145 Ų145146.8 Ų146.878%0.77582%0.815SS**  trans57.3102.4156.6-63-13.8000120
313I32.9Very low29.6Very low178 Ų178148.3 Ų148.391%0.91382%0.819SS**  trans-129.9147.3136.7-63.4-174.6000108.1
314S29.3Very low30Very low94 Ų94147 Ų14766%0.65781%0.81SS**  trans-102.5166.9-156.9-41.70000115.3
315N26.3Very low30Very low165 Ų165146.2 Ų146.288%0.88280%0.801SS**  trans63.193.4150.1-57.4-10.6000118.9
316S29.3Very low30.1Very low124 Ų124144.9 Ų144.987%0.86780%0.8SS**  trans-139.7135.6140.9-175.70000109.4
317S31.9Very low30.1Very low126 Ų126143.8 Ų143.888%0.88180%0.799SS**  trans-106.639.5-149.257.70000116
318E31.8Very low30.2Very low187 Ų187142.6 Ų142.687%0.87480%0.803SS**  trans-143.130.4-179.3-144.3166.4-165.100116.5
319C28.7Very low30.4Very low132 Ų132144.2 Ų144.289%0.89281%0.808SS**  trans-128.684.3174.6-82.70000112.4
320K31.7Very low30.5Very low205 Ų205140.1 Ų140.189%0.89180%0.801SS**  trans-93.4131.6172.9-78-178.6178.2173.40111.9
321K29.3Very low30.5Very low200 Ų200139.9 Ų139.987%0.8780%0.802SS**  trans66.273.9165.1-58.3-176.1179.1-177.60118.4
322V31.9Very low30.8Very low133 Ų133140 Ų14081%0.80681%0.807SS**  trans-135115.2131.3-1770000108.6
323V28.4Very low30.9Very low135 Ų135138 Ų13882%0.81881%0.805SS**  trans-110.1130.2167.2177.50000106.9
324Y29.5Very low31.1Very low166 Ų166138 Ų13865%0.65180%0.801SS**  trans-129.4107.9-178.2-147.7-73.4000109.4R224R224-Y324 PolarHBondContact NH1-OH 2.88Å; R224-Y324 VanDerWaalsContact NH1-OH 3.09Å
325V32.4Very low31.1Very low110 Ų110140.6 Ų140.667%0.66781%0.808SS**  trans-86.7123.1177.1-179.10000108.8V327V325-V327 PolarHBondContact O-N 2.83Å
326P31.3Very low31.3Very low116 Ų116139.8 Ų139.875%0.75381%0.808SS**  trans-81.4118.1176.131.3-31.4000110.5
327V32.2Very low31Very low124 Ų124142 Ų14275%0.75281%0.81SS**  trans-107.1114.8165.9-178.80000108.3V325 V329V325-V327 PolarHBondContact O-N 2.83Å; V327-V329 HydrophobicContact CG1-CG2 4.29Å
328S30Very low30.9Very low117 Ų117141.4 Ų141.482%0.81881%0.805SS**  trans-88.8129.9174.153.80000110.6
329V32.9Very low30.5Very low131 Ų131140.5 Ų140.579%0.79481%0.806SS**  trans-127.7121.8169.8-1690000108.4V327V327-V329 HydrophobicContact CG1-CG2 4.29Å
330S32.6Very low30.8Very low104 Ų104140.4 Ų140.473%0.72780%0.801SS**  trans-92.8124.9-177.251.40000111.7S332S330-S332 PolarHBondContact O-N 3.37Å
331P31.2Very low30.9Very low131 Ų131136.3 Ų136.385%0.85180%0.795SS**  trans-83.5101.7173.931.9-31.4000110.9
332S35.5Very low31.2Very low116 Ų116134.8 Ų134.881%0.81180%0.796SS**  trans-90.2110.617254.20000111.1S330S330-S332 PolarHBondContact O-N 3.37Å
333S30.6Very low31.5Very low104 Ų104133.5 Ų133.573%0.72779%0.793SS**  trans-94.4110.8-178.555.70000113.3
334Q36Very low32Very low177 Ų177133.3 Ų133.383%0.82779%0.794SS**  trans-163.2120.2156.5-99.5137.591.900105.7
335N29.4Very low32.3Very low150 Ų150130.8 Ų130.880%0.80280%0.801SS**  70.6133.373.7-78-13.2000114.3
336V30.2Very low32.4Very low148 Ų148133.1 Ų133.190%0.89781%0.809SS**  trans78.2139.9174-1610000116.2
337L24.6Very low32.3Very low171 Ų171134.6 Ų134.690%0.89581%0.81SS**  trans-84.6134.5-178.2-65.7152.8000112
338S28Very low32.1Very low112 Ų112135.7 Ų135.778%0.78381%0.811SS**  trans-165.5152.4148.751.70000111.6
339L24.3Very low32.1Very low169 Ų169135.9 Ų135.989%0.88581%0.807SS**  trans-112.4117.8177.8-74.1166.3000109.7
340T35Very low31.7Very low129 Ų129134 Ų13479%0.79181%0.805SS**  trans-144.392.5171.544.10000112.3
341P33.8Very low31.6Very low119 Ų119138.1 Ų138.177%0.77381%0.813SS**  trans-99.4113.4176.434.4-27.9000112.4
342L35.8Very low31.5Very low168 Ų168140.9 Ų140.988%0.8882%0.817SS**  trans-146.1140.3173.2-71.4174.3000110
343S38.8Very low31.3Very low107 Ų107139.3 Ų139.375%0.74881%0.811SS**  cis-152.9160.2-9.852.20000111
344P37.8Very low31.9Very low130 Ų130140.9 Ų140.984%0.84482%0.816SS**  trans-109.7159.4-165.839.9-33.9000115.8
345S35.3Very low31.6Very low113 Ų113139.8 Ų139.879%0.7982%0.816SS**  trans-150.1134.615548.80000107
346L34.4Very low31.7Very low160 Ų160140.7 Ų140.784%0.83882%0.815SS**  cis-122.1143.410.3-55.4153.4000107.7
347L30.3Very low31.4Very low147 Ų147140.3 Ų140.377%0.7781%0.807SS**  62.8114.250.9-162.9156.6000111
348L27.4Very low31.4Very low147 Ų147138.9 Ų138.977%0.7780%0.8SS**  cis-154.8173.1-2.6-148.554.2000105.9
349T29.5Very low31.3Very low120 Ų120141.7 Ų141.774%0.73681%0.805SS**  cis-156167.521.1-470000109.6
350A25Very low31.6Very low93 Ų93139.1 Ų139.177%0.76980%0.796SS**  trans-131.9152.8167.900000111.4
351Q31.5Very low31.6Very low190 Ų190139.1 Ų139.189%0.88880%0.798SS**  trans-143.8118.2172.4-167.2164.4-29.800111.3
352M27.8Very low31.4Very low189 Ų189141 Ų14193%0.93180%0.797SS**  trans-95.6135176.1-73.4-82.9-75.700109.8
353A32.9Very low31.3Very low82 Ų82138.9 Ų138.968%0.67879%0.786SS**  trans-153.2150169.300000112.4
354T42.2Very low31Very low137 Ų137140.7 Ų140.784%0.8479%0.787SS**  trans54.4104.5165.652.10000118.7
355N29.8Very low30.9Very low154 Ų154140.1 Ų140.182%0.82479%0.786SS**  trans-55.7166.8149.9-46-78.1000111.7
356Q32.2Very low31Very low170 Ų170141.2 Ų141.279%0.79478%0.782SS**  trans115.9119.4160.2-61.8-78.624.400116.2
357L23.7Very low31Very low139 Ų139139.4 Ų139.473%0.72878%0.78SS**  trans11.7132.9148.5-72.2159.8000121.8
358L25Very low31Very low142 Ų142140.6 Ų140.674%0.74378%0.775SS**  trans61.6116.7143.2-70.1168.5000119.5
359L25.7Very low31.2Very low170 Ų170140.5 Ų140.589%0.8978%0.78SS**  -156.1141.9121.2-133.669000110.8
360V30.5Very low31.1Very low115 Ų115140.1 Ų140.170%0.69778%0.778SS**  trans-109.3123.7178.3173.60000109.6
361P35Very low31.6Very low129 Ų129140.6 Ų140.684%0.83878%0.776SS**  trans-74.8128.3161.8-10.527.7000109.5
362Q30.2Very low31.8Very low160 Ų160136.8 Ų136.875%0.74877%0.77SS**  trans-117.9165-168.9-168.3-171.3-22.700110.9
363L32.8Very low32.3Very low122 Ų122133.6 Ų133.664%0.63977%0.767SS**  trans99.2111.7156.8-54.4172000118.8
364N32.2Very low32.3Very low145 Ų145132.8 Ų132.878%0.77577%0.766SS**  68.8139.7127.3-54.3-4.3000118.9
365S35.7Very low31.9Very low118 Ų118134.4 Ų134.483%0.82577%0.769SS**  cis-152.2163.429.537.80000113.8
366I37.3Very low31.8Very low137 Ų137133.3 Ų133.370%0.70377%0.768SS**  trans-123.8156.8175.5-19.2176.4000108.1
367P35.6Very low31.9Very low122 Ų122130.7 Ų130.779%0.79277%0.769SS**  -139.6147.890.433.8-17.6000113.8
368Y28.7Very low32Very low171 Ų171131.5 Ų131.567%0.67177%0.774SS**  77.4111.355.5-113.7-75.4000115.8T370Y368-T370 HydrophobicContact CD1-CG2 4.1Å; Y368-T370 HydrophobicContact CE1-CG2 3.78Å
369V32.3Very low32.5Very low145 Ų145129.7 Ų129.788%0.87977%0.773SS**  trans-143128.2149-179.60000108
370T27.5Very low32.7Very low112 Ų112126.5 Ų126.569%0.68777%0.765SS**  trans-152145.7176.452.90000111.2Y368Y368-T370 HydrophobicContact CD1-CG2 4.1Å; Y368-T370 HydrophobicContact CE1-CG2 3.78Å
371S36.1Very low32.9Very low104 Ų104128.1 Ų128.173%0.72777%0.769SS**  trans-149.4107.8170520000107.8
372S35.4Very low32.9Very low110 Ų110128.8 Ų128.877%0.76977%0.766SS**  61.1131.992.1700000113.7
373S36.7Very low33Very low122 Ų122127.6 Ų127.685%0.85377%0.769SS**  cis-174.8162.50.137.20000107.6
374G34.8Very low33.2Very low64 Ų64126.8 Ų126.866%0.6677%0.771SS**  cis168.8-169.8-0.500000112.3
375N32.9Very low33.3Very low171 Ų171128.1 Ų128.191%0.91478%0.775SS**  trans73.2143.9168.3-64.80000120.4
376V28.2Very low33.2Very low131 Ų131127.1 Ų127.179%0.79477%0.768SS**  trans-139.7146.8-175.2171.10000107.8
377S34.1Very low32.9Very low116 Ų116127.9 Ų127.981%0.81177%0.773SS**  trans-151.7120.8164.857.70000111.6
378N26.2Very low32.7Very low155 Ų155127.8 Ų127.883%0.82978%0.776SS**  trans-103.5128.1176.6-72.8-29.3000111.3
379S34.6Very low33Very low105 Ų105130.5 Ų130.573%0.73479%0.786SS**  trans-167.2109.3156.443.70000108.6
380S30.4Very low32.9Very low103 Ų103131.4 Ų131.472%0.7279%0.786SS**  63.9103.771.876.80000114.4
381L35.3Very low33.2Very low148 Ų148131.6 Ų131.678%0.77579%0.79SS**  -174.3132.2126.7-120.166.4000113.6
382N34.8Very low32.8Very low144 Ų144137.5 Ų137.577%0.7780%0.797SS**  trans66.9142.9147.1-58.7-11.3000123.4
383T32.2Very low32.7Very low134 Ų134140 Ų14082%0.82280%0.801SS**  trans-117.9-165.4174.459.60000108
384P36.5Very low32.3Very low105 Ų105141 Ų14168%0.68279%0.794SS**  cis-138-171.3-5.939.8-19.6000115.6
385M33.5Very low32Very low173 Ų173141.5 Ų141.585%0.85280%0.799SS**  trans64.7124.6160.1-61.3-15675.700118.3
386S34.6Very low31.8Very low97 Ų97142 Ų14268%0.67879%0.794SS**  cis-177.4159.837.145.40000112.3
387N29.8Very low32Very low153 Ų153144.5 Ų144.582%0.81880%0.801SS**  trans32.4102.6154.7-57.8-4.2000120.6
388S31Very low31.6Very low121 Ų121145.2 Ų145.285%0.84680%0.796SS**  176.9174.3102.549.40000112.9
389Y35.3Very low31.9Very low227 Ų227144.4 Ų144.489%0.8980%0.797SS**PPolyproline II helixtrans-53147.1-165.5-81.1-103.8000117.1
390N31.4Very low31.7Very low165 Ų165143.4 Ų143.488%0.88279%0.79SS**PPolyproline II helixtrans-57.4130.2-176.7-74.3-38.6000114.8
391P33.6Very low31.9Very low116 Ų116145.2 Ų145.275%0.75380%0.797SS**PPolyproline II helixtrans-91.7163.6160.136.7-32.9000112.4
392Y28.3Very low31.8Very low227 Ų227145.4 Ų145.489%0.8980%0.798SS**PPolyproline II helixtrans-72130161.3-80.5-111.6000110.4
393L31.5Very low31.7Very low162 Ų162147 Ų14785%0.84881%0.807SS**  -168.3147128.8-133.873.2000115
394M29Very low31.6Very low144 Ų144144.1 Ų144.171%0.70980%0.804SS**  trans11.2126.8152.4-75.6-76.9104.300121.3F396M394-F396 HydrophobicContact SD-CZ 4.5Å
395G29.3Very low31.5Very low74 Ų74144.6 Ų144.676%0.76381%0.81SS**  trans-139.9129.3149.900000109.7
396F28Very low31.6Very low182 Ų182142.3 Ų142.380%0.79881%0.811SS**  trans-86.3156.9-175.7-60.6-97.5000112.4M394M394-F396 HydrophobicContact SD-CZ 4.5Å
397L32.5Very low31.6Very low183 Ų183146.5 Ų146.596%0.95882%0.82SS**  -166.6156.9127.4-103.6158.9000111.1
398N26.1Very low31.5Very low131 Ų131146.6 Ų146.670%0.70182%0.819SS**  trans-122.5139.4-171.4-178.827.8000110.4
399V33Very low31.6Very low138 Ų138148.8 Ų148.884%0.83682%0.82SS**  trans-138.6113173.3-179.50000109.2
400S29.5Very low31.5Very low85 Ų85143 Ų14359%0.59481%0.809SS**  trans-80.6150.1178.8-50.40000112.6
401T35.8Very low31.6Very low141 Ų141142.4 Ų142.487%0.86581%0.805SS**  trans-119.9134.1149.647.50000109
402N33.1Very low31.5Very low151 Ų151142.9 Ų142.981%0.80781%0.81SS**  trans-88.9117.6-171-64.1-31.4000111.1
403N32.7Very low31.7Very low177 Ų177138.8 Ų138.895%0.94781%0.808SS**  trans-104.3100.7156.2-84.2-9.6000107.8
404G30Very low31.8Very low74 Ų74137.3 Ų137.376%0.76381%0.806SS**  trans-163.160.5-169.900000113.1
405S34.5Very low32.1Very low115 Ų115138.6 Ų138.680%0.80481%0.808SS**  trans-157.776.4178.456.70000112.1
406S34.7Very low32.3Very low126 Ų126143 Ų14388%0.88181%0.809SS**  trans-145.390.2162.1-54.40000108.1
407E34.1Very low32.7Very low184 Ų184138.9 Ų138.986%0.8680%0.803SS**  trans-72.8132.4177.4-66.5-176.6131.800110.8L409E407-L409 PolarHBondContact O-N 2.95Å
408I28.6Very low33Very low155 Ų155135 Ų13580%0.79579%0.791SS**  trans23.998.9137.7-47.4173.3000115.4
409L33.4Very low33.5Very low168 Ų168136 Ų13688%0.8880%0.796SS**  trans-146130.5135.6-114.5170.6000110.4E407E407-L409 PolarHBondContact O-N 2.95Å
410T33.4Very low33.7Very low105 Ų105138.4 Ų138.464%0.64480%0.795SS**  trans-79.2138.2-174.647.90000111.8
411N33.4Very low34.3Very low153 Ų153139.2 Ų139.282%0.81880%0.799SS**  -173.2141.5110.7-88-22.7000112
412C30.4Very low34.3Very low125 Ų125137 Ų13785%0.84579%0.789SS**  trans-93.4145.2178.1-53.90000110.8
413V32.3Very low34.6Very low141 Ų141138.8 Ų138.886%0.85579%0.793SS**  trans-140.8104162.7-177.70000110.4
414T34.1Very low34.8Very low132 Ų132135.9 Ų135.981%0.8179%0.786SS**  trans-152.6114.2154.917.20000111.4
415K34.4Very low34.9Very low171 Ų171137 Ų13774%0.74378%0.782SS**  trans72.9146.1155.8-67.4-176.3160.1-159.90121
416E33.8Very low35.2Very low166 Ų166138.3 Ų138.378%0.77679%0.786SS**  trans65.6137.5159.2-69.9147.9-129.500116.4
417S36.6Very low35.1Very low96 Ų96139.4 Ų139.467%0.67178%0.781SS**  cis-165.7165.4-9.653.20000109.9
418S38.4Very low35.3Very low101 Ų101139.8 Ų139.871%0.70678%0.783SS**  trans63.3155.9172.78.40000116.3
419D37.9Very low35.7Very low151 Ų151136.8 Ų136.881%0.80778%0.776SS**  cis-151.6177-4.5-113.3-32.6000112.4
420F37.5Very low35.9Very low190 Ų190135.1 Ų135.183%0.83377%0.772SS**  trans-75.3179179.8-89.3-120.9000114.2
421P40.4Very low36.1Very low102 Ų102135.4 Ų135.466%0.66277%0.774SS**  cis-147.9-176.1-4242-23.9000116.8
422S37.5Very low36Very low95 Ų95134.9 Ų134.966%0.66477%0.771SS**  trans102.8144.713178.90000124.1
423Q39.4Very low36.4Very low188 Ų188137.8 Ų137.888%0.87977%0.772SS**  trans68.7152.9164.1-41.3-158.126.700117.3
424S35.5Very low36.6Very low115 Ų115136.7 Ų136.780%0.80477%0.766SS**  cis-142.7167.34.557.60000113
425S32.8Very low37Very low98 Ų98138.8 Ų138.869%0.68577%0.769SS**  trans-101.6157.8-176.557.20000115.3
426T40.9Very low37.1Very low143 Ų143137.9 Ų137.988%0.87777%0.772SS**  trans-152.1156.3143.419.60000111
427N31.6Very low37.6Very low148 Ų148138 Ų13879%0.79178%0.778SS**  trans-123158.7-175.3-50.6-71.8000111
428E40Very low37.7Very low192 Ų192138.8 Ų138.890%0.89778%0.784SS**  trans170.2164.7142.5-98.1168.3-167.100109
429S35.2Very low37.6Very low93 Ų93140.4 Ų140.465%0.6579%0.793SS**  -175.8178-7160.90000107.1
430V39.3Very low37.8Very low132 Ų132141.6 Ų141.680%0.879%0.791SS**  trans76.5141.8172.4-1780000116.8
431T37.1Very low38.3Very low111 Ų111143.6 Ų143.668%0.68180%0.795SS**  cis-165142.1-29.7-85.10000110.7
432N30.9Very low38.2Very low142 Ų142145.5 Ų145.576%0.75980%0.8SS**  trans7.5131.3159.2-52.7-23.4000123.6
433Q37.9Very low38.8Very low186 Ų186149.8 Ų149.887%0.86981%0.814SS**  -164.2126.4126.2-10117517.500107.2
434V37.1Very low39.6Very low118 Ų118150 Ų15072%0.71581%0.812SS**  cis79.191.249.4-177.50000114.3
435M42.3Very low40.8Very low177 Ų177149.7 Ų149.787%0.87281%0.807SS**  -170.5141.4126.7-109.1177.7-74.800112.7
436N36Very low42.7Very low151 Ų151150.5 Ų150.581%0.80781%0.81SS**  trans-94.6158.2166.8-71.2-43.6000109.9
437N44.3Very low43.6Very low169 Ų169155.1 Ų155.190%0.90483%0.83SS**  trans-163.7148.1136.9-99.7-35.1000111.8
438S38.7Very low44.2Very low113 Ų113155.5 Ų155.579%0.7983%0.832SS**  trans-113.8150.5-174.8-53.90000112
439C38Very low44.4Very low134 Ų134153.6 Ų153.691%0.90583%0.828SS**  trans-130.4136.4156.6-94.40000110
440K40.8Very low44.9Very low177 Ų177156.9 Ų156.977%0.7784%0.838SS**  trans-107.8147.5177.1-65.8176.2177.9175.40109.9
441Y48Very low45.3Very low231 Ų231158.4 Ų158.491%0.90684%0.84SS**  trans-138.1138.2144.1-81.9-73.4000109.9
442N38.6Very low45.8Very low143 Ų143161.4 Ų161.477%0.76585%0.85SS**  trans-106.5144.8176.4-76.8-46.5000109.4
443L50.9Low46.8Very low185 Ų185162.7 Ų162.797%0.96986%0.856SS**  trans-150.9143.6150.2-96.5128.5000108.7
444K55Low47.4Very low192 Ų192161 Ų16184%0.83586%0.855SS**  trans-136.1139-179.8-173.9-170.5176-165.20107.8
445P61.1Low48.2Very low109 Ų109164.3 Ų164.371%0.70887%0.866SS**  trans-70.2157.4176.330.3-36.1000112.1
446P73.5Confident48.7Very low114 Ų114163.3 Ų163.374%0.7487%0.866SS**  trans-79.4154.3173.234.4-34.9000112.6
447D59Low49.8Very low241 Ų241164.4 Ų164.4100%1.28987%0.871SS**  trans37.50158.5-53.1-5.6000119.3

Retrieved 447 of 447 residues in 69.6 ms (Link to these results)