A0A077ZLV9_TRITR Loading...

Nitrate reductase clathrin interactor

AlphaFold DB , UniProt , Accession A0A077ZLV9, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 302 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
1M39Very low38.4Very low249 Ų249144.7 Ų144.7100%1.22780%0.796SS**  0132.40-80.7173.6171.100107.6
2A34.4Very low38.5Very low96 Ų96143.5 Ų143.579%0.79380%0.803SS**  trans-70.5144.2-175.200000112.7
3N31.1Very low38.9Very low159 Ų159138.8 Ų138.885%0.8578%0.784SS**  trans152.6124.8157-88.5-9.5000105
4V39.6Very low39.6Very low105 Ų105135.1 Ų135.164%0.63676%0.762SS**  cis-152.3131.447.8172.80000108.6F6V4-F6 HydrophobicContact CG1-CD2 3.46Å; V4-F6 VanDerWaalsContact CG1-CD2 3.46Å; V4-F6 HydrophobicContact CG1-CE2 3.56Å; V4-F6 HydrophobicContact CG1-CG 4.42Å
5I35Very low40.3Very low145 Ų145140.4 Ų140.474%0.74477%0.765SS**  trans-80115164-65.3168.6000106.7S7I5-S7 VanDerWaalsContact CG2-OG 3.31Å; I5-S7 WeakPolarHBondContact CG2-OG 3.48Å
6F40.8Very low41.2Very low194 Ų194144.1 Ų144.185%0.85177%0.771SS**  trans-110.581.4153-87.7-76.2000107.3V4 S8V4-F6 HydrophobicContact CG1-CD2 3.46Å; V4-F6 VanDerWaalsContact CG1-CD2 3.46Å; V4-F6 HydrophobicContact CG1-CE2 3.56Å; V4-F6 HydrophobicContact CG1-CG 4.42Å; F6-S8 PolarHBondContact O-N 3.03Å
7S40.9Very low42.1Very low87 Ų87145.3 Ų145.361%0.60877%0.768SS**  trans-74.895.9158-60.80000106.8I5 N9I5-S7 VanDerWaalsContact CG2-OG 3.31Å; I5-S7 WeakPolarHBondContact CG2-OG 3.48Å; S7-N9 PolarHBondContact O-N 3.29Å
8S39.9Very low42.3Very low106 Ų106146.6 Ų146.674%0.74177%0.769SS**  trans-72.274.2160.155.20000108.3F6 N10F6-S8 PolarHBondContact O-N 3.03Å; S8-N10 PolarHBondContact O-N 3.05Å
9N40.4Very low42.8Very low127 Ų127146.5 Ų146.568%0.67976%0.764SS**  trans-76.2106.7163.3-82.1-5000106.9S7 E11S7-N9 PolarHBondContact O-N 3.29Å; N9-E11 PolarHBondContact O-N 3.41Å
10N41.4Very low43.3Very low169 Ų169147.5 Ų147.590%0.90477%0.765SS**  trans-64.350.8166.9-87.5-15.6000111.7S8 C12S8-N10 PolarHBondContact O-N 3.05Å; N10-C12 VanDerWaalsContact C-N 3.31Å; N10-C12 PolarHBondContact O-N 3.31Å
11E40.1Very low44.1Very low155 Ų155147.6 Ų147.672%0.72476%0.759SS**  trans-103.654.4174.4-143.3161.8172.400108N9 C13N9-E11 PolarHBondContact O-N 3.41Å; E11-C13 PolarHBondContact O-N 3.37Å
12C39.5Very low45Very low130 Ų130141.4 Ų141.488%0.87874%0.736SS**  trans-73.193.1163.2-165.40000106N10 D14N10-C12 VanDerWaalsContact C-N 3.31Å; N10-C12 PolarHBondContact O-N 3.31Å; C12-D14 PolarHBondContact O-N 3.06Å
13C43.3Very low45.9Very low83 Ų83144.5 Ų144.556%0.56173%0.732SS**  trans-39.6130.9-174.1-540000112.9E11 R15E11-C13 PolarHBondContact O-N 3.37Å; C13-R15 HydrophobicContact CB-CB 4.47Å; C13-R15 PolarHBondContact O-N 3.41Å
14D48.6Very low46.9Very low87 Ų87142.4 Ų142.447%0.46573%0.727SS.*  trans-58.364.8153.2-165.3-10000109.5C12 K16 K17C12-D14 PolarHBondContact O-N 3.06Å; D14-K16 PolarHBondContact O-N 3.19Å; D14-K16 VanDerWaalsContact O-N 3.09Å; D14-K17 PolarHBondContact O-N 3.36Å; D14-K17 WeakPolarHBondContact OD2-CD 3.42Å; D14-K17 WeakPolarHBondContact OD2-CE 3.5Å; D14-K17 IonicContact OD2-NZ 3.18Å; D14-K17 PolarHBondContact OD2-NZ 3.34Å
15R50.9Low47.2Very low214 Ų214142.8 Ų142.881%0.80873%0.733SS**THydrogen-bonded Turntrans-66-10.8-174.7-166.7178.8-82.6-172.9-4.2111.6C13C13-R15 HydrophobicContact CB-CB 4.47Å; C13-R15 PolarHBondContact O-N 3.41Å
16K55.2Low47.7Very low199 Ų199141.4 Ų141.487%0.86574%0.736SS**THydrogen-bonded Turntrans-79.5-25.8172-86.3-175.6170.6176.90113.3D14D14-K16 PolarHBondContact O-N 3.19Å; D14-K16 VanDerWaalsContact O-N 3.09Å
17K55.6Low48.1Very low165 Ų165139.3 Ų139.372%0.71773%0.734SS**THydrogen-bonded Turntrans-89.3-16.7179.8-71.6-169.7-168136.90114.8D14D14-K17 PolarHBondContact O-N 3.36Å; D14-K17 WeakPolarHBondContact OD2-CD 3.42Å; D14-K17 WeakPolarHBondContact OD2-CE 3.5Å; D14-K17 IonicContact OD2-NZ 3.18Å; D14-K17 PolarHBondContact OD2-NZ 3.34Å
18Q45.8Very low48.3Very low168 Ų168139.8 Ų139.879%0.78574%0.737SS**THydrogen-bonded Turntrans-105.734.4176.5-65.1-170.32.500113E20Q18-E20 PolarHBondContact O-N 3.34Å
19Q52.1Low48.4Very low146 Ų146142.8 Ų142.868%0.68275%0.745SS**  trans-72.777155.9-149.8174.938.100106.7F21Q19-F21 VanDerWaalsContact C-N 3.34Å; Q19-F21 WeakPolarHBondContact O-CD2 2.99Å; Q19-F21 PolarHBondContact O-N 3.49Å
20E53.3Low48.8Very low165 Ų165142.2 Ų142.277%0.77175%0.746SS**  trans-60.5102.2169.4-167.2170.8-155.600105.7Q18 T22Q18-E20 PolarHBondContact O-N 3.34Å; E20-T22 PolarHBondContact O-N 3.32Å
21F60.2Low49.3Very low150 Ų150141 Ų14166%0.65874%0.744SS**  trans-67.690.2169.3-79.9-89.7000106.5Q19 F23Q19-F21 VanDerWaalsContact C-N 3.34Å; Q19-F21 WeakPolarHBondContact O-CD2 2.99Å; Q19-F21 PolarHBondContact O-N 3.49Å; F21-F23 VanDerWaalsContact C-N 3.27Å; F21-F23 HydrophobicContact CB-CD2 4.46Å; F21-F23 HydrophobicContact CB-CE2 4.03Å; F21-F23 HydrophobicContact CB-CZ 4.34Å; F21-F23 VanDerWaalsContact O-CD2 3.27Å; F21-F23 WeakPolarHBondContact O-CD2 3.45Å; F21-F23 PolarHBondContact O-N 3.45Å
22T56.9Low49.7Very low119 Ų119136.8 Ų136.873%0.7374%0.743SS**  trans-66.395.6164.9-53.20000106.9E20E20-T22 PolarHBondContact O-N 3.32Å
23F52.8Low50.1Low161 Ų161139 Ų13971%0.70674%0.74SS**PPolyproline II helixtrans-61.8131.9169.4-69.6-86000107.9F21 C25F21-F23 VanDerWaalsContact C-N 3.27Å; F21-F23 HydrophobicContact CB-CD2 4.46Å; F21-F23 HydrophobicContact CB-CE2 4.03Å; F21-F23 HydrophobicContact CB-CZ 4.34Å; F21-F23 VanDerWaalsContact O-CD2 3.27Å; F21-F23 WeakPolarHBondContact O-CD2 3.45Å; F21-F23 PolarHBondContact O-N 3.45Å; F23-C25 PolarHBondContact O-N 3.47Å; F23-C25 VanDerWaalsContact O-N 3.07Å
24P53.6Low50.3Low115 Ų115144.9 Ų144.975%0.74776%0.757SS**PPolyproline II helixtrans-53.4121.3168.7-19.629.5000108.1S26P24-S26 PolarHBondContact O-N 3.46Å
25C44.5Very low50.7Low113 Ų113145.2 Ų145.276%0.76476%0.758SS**PPolyproline II helixtrans-52.8125.5174.5-69.60000108.1F23 D27F23-C25 PolarHBondContact O-N 3.47Å; F23-C25 VanDerWaalsContact O-N 3.07Å; C25-D27 PolarHBondContact O-N 3.17Å
26S46.5Very low50.7Low116 Ų116140.9 Ų140.981%0.81176%0.758SS**SBendtrans-73.626.8-164.8-520000115.2P24P24-S26 PolarHBondContact O-N 3.46Å
27D48.7Very low50.3Low150 Ų150141.8 Ų141.880%0.80276%0.756SS**  trans-105.816.4-172.2-57.1-16.2000112.5C25C25-D27 PolarHBondContact O-N 3.17Å
28S44.4Very low49.8Very low97 Ų97139.1 Ų139.168%0.67876%0.758SS**  trans-135.591174.3-61.40000110.1T30S28-T30 PolarHBondContact O-N 3.05Å
29D43.6Very low49.5Very low170 Ų170135 Ų13591%0.90975%0.748SS**  trans-72.255.2176.2-146.84.9000111.1
30T48.7Very low48.9Very low114 Ų114135.7 Ų135.770%0.69975%0.751SS**  trans-124.1102.716959.60000107.7S28 G32S28-T30 PolarHBondContact O-N 3.05Å; T30-G32 PolarHBondContact O-N 3.31Å
31V51.3Low48.3Very low143 Ų143136.9 Ų136.987%0.86776%0.757SS**  trans-39.7100.1163.6-75.90000109.6Q33V31-Q33 VanDerWaalsContact C-N 3.32Å; V31-Q33 PolarHBondContact O-N 3.12Å
32G47.3Very low47.2Very low67 Ų67136.1 Ų136.169%0.69176%0.759SS**  trans-61.795.7179.500000109T30 F34T30-G32 PolarHBondContact O-N 3.31Å; G32-F34 PolarHBondContact O-N 3.48Å
33Q48Very low46.3Very low178 Ų178140.9 Ų140.983%0.83277%0.77SS**  trans-59103.6172.1-170.4176.92.900107V31 D35V31-Q33 VanDerWaalsContact C-N 3.32Å; V31-Q33 PolarHBondContact O-N 3.12Å; Q33-D35 PolarHBondContact O-N 2.85Å
34F48.9Very low45.5Very low206 Ų206137.6 Ų137.690%0.90477%0.772SS**  trans-60.8102.1169.3-107.6-93000107.5G32 P36G32-F34 PolarHBondContact O-N 3.48Å; F34-P36 VanDerWaalsContact O-CD 3.28Å; F34-P36 WeakPolarHBondContact O-CD 3.4Å
35D56.2Low44.3Very low94 Ų94139.3 Ų139.350%0.50378%0.776SS.*  trans-94.8105.1169.2-167.6-17000109.5Q33 R37 S38Q33-D35 PolarHBondContact O-N 2.85Å; D35-R37 PolarHBondContact O-N 2.75Å; D35-R37 VanDerWaalsContact O-N 3.07Å; D35-R37 PolarHBondContact OD1-N 3.45Å; D35-R37 VanDerWaalsContact OD1-N 3.08Å; D35-S38 PolarHBondContact O-N 2.94Å; D35-S38 PolarHBondContact O-OG 2.75Å
36P50.8Low43.9Very low123 Ų123139.9 Ų139.980%0.79978%0.781SS**THydrogen-bonded Turntrans-70.84.4-178.129-34.6000114.3F34F34-P36 VanDerWaalsContact O-CD 3.28Å; F34-P36 WeakPolarHBondContact O-CD 3.4Å
37R46.5Very low43.3Very low217 Ų217139.4 Ų139.482%0.81978%0.777SS**THydrogen-bonded Turntrans-101.69.6175.9-56.3-156.3-156.6125.21.6115D35 S39D35-R37 PolarHBondContact O-N 2.75Å; D35-R37 VanDerWaalsContact O-N 3.07Å; D35-R37 PolarHBondContact OD1-N 3.45Å; D35-R37 VanDerWaalsContact OD1-N 3.08Å; R37-S39 VanDerWaalsContact C-N 3.26Å; R37-S39 PolarHBondContact O-N 2.94Å
38S44.6Very low42.5Very low110 Ų110136.9 Ų136.977%0.76977%0.771SS**  trans-74.185.4169.147.20000110.1D35D35-S38 PolarHBondContact O-N 2.94Å; D35-S38 PolarHBondContact O-OG 2.75Å
39S39.9Very low42Very low82 Ų82143 Ų14357%0.57378%0.78SS**  trans-69.1160.1166.756.10000111.2R37R37-S39 VanDerWaalsContact C-N 3.26Å; R37-S39 PolarHBondContact O-N 2.94Å
40E40.9Very low41.4Very low160 Ų160143.6 Ų143.675%0.74878%0.776SS**  trans68.294.6151.6-65.1153.9142.300116.9
41H40.2Very low40.5Very low190 Ų190144.4 Ų144.488%0.8878%0.781SS**  trans-127.596.9143.5-99.5-52.4000110.7
42D37.1Very low39.7Very low133 Ų133144.3 Ų144.371%0.71178%0.775SS**  trans-10.8122.4144.1-65.4-58.9000115.9
43F38.5Very low38.9Very low220 Ų220146.4 Ų146.497%0.96577%0.774SS**  trans-136.3122.7137.7-100.1-83.1000109.5
44A34.4Very low38.1Very low91 Ų91146.6 Ų146.675%0.75277%0.772SS**  trans-89.5151.6-17300000113.4
45D28.8Very low37.4Very low152 Ų152145 Ų14581%0.81377%0.774SS**  trans53.9103.1146.7-90-28.3000121.1
46S37.3Very low36.3Very low124 Ų124144.9 Ų144.987%0.86779%0.786SS**  -153.894.8121.1-90.20000112
47S33.4Very low35.2Very low106 Ų106144.3 Ų144.374%0.74178%0.784SS**  trans51.6117.7132.4-160.80000120.7
48S31.7Very low34.8Very low97 Ų97140.4 Ų140.468%0.67879%0.785SS**  trans85.893.3141-146.10000117.2
49R32.9Very low34.3Very low226 Ų226145 Ų14585%0.85379%0.791SS**  171.414688.7-81.5-168.4-172.8-155.91.9110.7
50H32.8Very low33.8Very low182 Ų182144.2 Ų144.284%0.84380%0.796SS**  trans72.575.5165.9-89.6-77.2000118.6
51V28.3Very low33.5Very low131 Ų131142.7 Ų142.779%0.79480%0.803SS**  trans-88.8148.7145177.40000108.3
52L36.1Very low33.5Very low141 Ų141138.4 Ų138.474%0.73880%0.801SS**  trans99.8117.7177.4-58.9166.1000112.4
53T29.1Very low33.8Very low111 Ų111136.6 Ų136.668%0.68180%0.804SS**  cis-172.41574.4-5.70000108.8
54K32.6Very low33.7Very low182 Ų182135 Ų13579%0.79180%0.8SS**  trans63.893.6152.2-75.7176.5173.7176.50117
55N33.9Very low34.6Very low174 Ų174137.8 Ų137.893%0.9380%0.801SS**  -131.3105.8116.4-78.4-31.4000107.5
56A32.8Very low35.5Very low91 Ų91135.9 Ų135.975%0.75280%0.796SS**  trans-77.5152.8169.300000109.5
57S28.4Very low35.9Very low110 Ų110141.8 Ų141.877%0.76980%0.8SS**  trans72.1103.5165.4175.50000116.3
58T36.8Very low37.3Very low136 Ų136144.2 Ų144.283%0.83480%0.803SS**  -160130.7102.3-56.20000109
59F34.3Very low38.3Very low206 Ų206145.3 Ų145.390%0.90481%0.809SS**  trans-56.7157178.2-103.7-113.1000114.1
60G29.6Very low39.3Very low66 Ų66139.9 Ų139.968%0.6881%0.805SS**  trans-61.9161.3-177.400000117.1
61S35.2Very low40.2Very low127 Ų127136.7 Ų136.789%0.88880%0.8SS**  trans-152.769149-83.10000106.5A63S61-A63 PolarHBondContact O-N 3.03Å
62A40.5Very low41.5Very low100 Ų100136.1 Ų136.183%0.82680%0.8SS**  trans-62.3121.2162.700000106.9Q64A62-Q64 PolarHBondContact O-N 3.03Å; A62-Q64 VanDerWaalsContact O-N 3.11Å
63A42.6Very low42.3Very low95 Ų95135.8 Ų135.879%0.78580%0.804SS**  trans-43.7112.5-172.800000112.3S61 I65S61-A63 PolarHBondContact O-N 3.03Å; A63-I65 PolarHBondContact O-N 3.33Å
64Q35.6Very low43.3Very low188 Ų188138 Ų13888%0.87981%0.81SS**  trans-71.497.5173.3-162.6161.57.200107.7A62 P66A62-Q64 PolarHBondContact O-N 3.03Å; A62-Q64 VanDerWaalsContact O-N 3.11Å; Q64-P66 VanDerWaalsContact O-CD 3.31Å; Q64-P66 WeakPolarHBondContact O-CD 3.45Å
65I53.1Low43.7Very low149 Ų149134.1 Ų134.176%0.76481%0.805SS**  trans-59.6119.2172.9-58.8171.7000107.1A63 R67A63-I65 PolarHBondContact O-N 3.33Å; I65-R67 PolarHBondContact O-N 3.35Å
66P48.6Very low44Very low112 Ų112132.6 Ų132.673%0.72780%0.803SS**  trans-61.5112.4177.1-18.430000109.2Q64 L68Q64-P66 VanDerWaalsContact O-CD 3.31Å; Q64-P66 WeakPolarHBondContact O-CD 3.45Å; P66-L68 PolarHBondContact O-N 2.97Å
67R45.7Very low44Very low247 Ų247135 Ų13593%0.93280%0.802SS**PPolyproline II helixtrans-67.6118169.9-101-172.2173.3129-1.7108.3I65I65-R67 PolarHBondContact O-N 3.35Å
68L61.9Low44.5Very low157 Ų157136.8 Ų136.882%0.82281%0.809SS**PPolyproline II helixtrans-63140.7167.8-65.3170.5000109.4P66P66-L68 PolarHBondContact O-N 2.97Å
69P54.3Low44.1Very low121 Ų121138.9 Ų138.979%0.78681%0.806SS**PPolyproline II helixtrans-65.6139.2177.525.5-31.9000111.2
70S53.6Low43.9Very low112 Ų112135.2 Ų135.278%0.78380%0.801SS**PPolyproline II helixtrans-60.4141.5176.7-52.60000111.3
71P51.6Low44.3Very low114 Ų114137.9 Ų137.974%0.7481%0.809SS**PPolyproline II helixtrans-62.5147.6179.825.2-33.2000111.7T73P71-T73 PolarHBondContact O-N 3.43Å
72P54.4Low44.3Very low120 Ų120135.1 Ų135.178%0.77980%0.801SS**PPolyproline II helixtrans-64.5124.3-177.625-32.6000111.2I74P72-I74 PolarHBondContact O-N 2.96Å
73T54.6Low43.9Very low134 Ų134140.8 Ų140.882%0.82281%0.807SS**  trans-60.5107.5169.5-46.60000108.6P71 S75P71-T73 PolarHBondContact O-N 3.43Å; T73-S75 VanDerWaalsContact C-N 3.31Å; T73-S75 PolarHBondContact O-N 3.17Å
74I49.8Very low43.5Very low158 Ų158145.2 Ų145.281%0.8181%0.812SS**  trans-66.797.3170-62.5173.4000106.4P72 T76P72-I74 PolarHBondContact O-N 2.96Å; I74-T76 PolarHBondContact O-N 3.4Å; I74-T76 VanDerWaalsContact O-N 3.16Å
75S41.4Very low43.4Very low100 Ų100144.3 Ų144.370%0.69981%0.808SS**  trans-62.9113.1169.938.40000108T73 N77T73-S75 VanDerWaalsContact C-N 3.31Å; T73-S75 PolarHBondContact O-N 3.17Å; S75-N77 VanDerWaalsContact C-N 3.28Å; S75-N77 PolarHBondContact O-N 2.94Å
76T39.7Very low42.7Very low142 Ų142143.8 Ų143.887%0.87181%0.811SS**  trans-58.688.8169.946.10000109.5I74I74-T76 PolarHBondContact O-N 3.4Å; I74-T76 VanDerWaalsContact O-N 3.16Å
77N31.5Very low42.3Very low140 Ų140144 Ų14475%0.74981%0.81SS**  trans-143.558.6165.4-149.1-13.4000109.7S75S75-N77 VanDerWaalsContact C-N 3.28Å; S75-N77 PolarHBondContact O-N 2.94Å
78V39.7Very low41.9Very low148 Ų148137.6 Ų137.690%0.89780%0.803SS**  trans-102.4105.9157.9-171.40000107T80V78-T80 PolarHBondContact O-N 3.25Å
79K29.1Very low40.7Very low181 Ų181136.7 Ų136.779%0.78780%0.804SS**  trans-68.2121.1176.4-164170-178.3177.60109.2
80T30.4Very low39.8Very low128 Ų128136.8 Ų136.879%0.78581%0.808SS**  trans-1127.3159.650.80000119.1V78V78-T80 PolarHBondContact O-N 3.25Å
81S38.2Very low38.8Very low122 Ų122133.7 Ų133.785%0.85379%0.793SS**  trans-152104.7147166.30000110
82G33.4Very low38.6Very low70 Ų70134.4 Ų134.472%0.72280%0.798SS**  trans67.189.7153.400000117.6Q84G82-Q84 PolarHBondContact O-N 3.11Å; G82-Q84 VanDerWaalsContact O-N 3.11Å
83F32.2Very low38Very low218 Ų218138.1 Ų138.196%0.95680%0.802SS**  trans-56.4110.7145-92.5-100.5000107.7
84Q35.5Very low37.4Very low188 Ų188139.6 Ų139.688%0.87980%0.804SS**  trans-89.299155.8-94.3-169.626.100107.2G82 V86G82-Q84 PolarHBondContact O-N 3.11Å; G82-Q84 VanDerWaalsContact O-N 3.11Å; Q84-V86 PolarHBondContact O-N 2.98Å
85E32.8Very low37Very low170 Ų170139.4 Ų139.479%0.79480%0.804SS**  trans-59.8117.1163-171.9174.817900108.2T87E85-T87 VanDerWaalsContact C-N 3.31Å; E85-T87 PolarHBondContact O-N 3.48Å
86V38Very low37.2Very low137 Ų137140.2 Ų140.283%0.8380%0.804SS**  trans-67.391.4179.4-177.20000107.8Q84 S88Q84-V86 PolarHBondContact O-N 2.98Å; V86-S88 PolarHBondContact O-N 2.8Å
87T40.3Very low37Very low117 Ų117141.2 Ų141.272%0.71880%0.799SS**  trans-77.8115.2164.7-44.50000107.2E85 V89E85-T87 VanDerWaalsContact C-N 3.31Å; E85-T87 PolarHBondContact O-N 3.48Å; T87-V89 PolarHBondContact O-N 2.98Å; T87-V89 VanDerWaalsContact O-N 3.08Å
88S37.3Very low37.6Very low112 Ų112140.9 Ų140.978%0.78380%0.802SS**  trans-40.9106.2176-45.70000112.9V86 S90V86-S88 PolarHBondContact O-N 2.8Å; S88-S90 PolarHBondContact O-N 2.92Å
89V37.5Very low37.2Very low138 Ų138137.8 Ų137.884%0.83679%0.786SS**  trans-92.798.8163.8-175.30000107.8T87T87-V89 PolarHBondContact O-N 2.98Å; T87-V89 VanDerWaalsContact O-N 3.08Å
90S34.2Very low37.5Very low124 Ų124136.9 Ų136.987%0.86779%0.789SS**  trans-67.4123.2169.2167.20000110.2S88S88-S90 PolarHBondContact O-N 2.92Å
91G33.7Very low37.8Very low47 Ų47135.2 Ų135.249%0.48579%0.789SS.*SBendtrans134.3138.3164.600000113.4K93G91-K93 VanDerWaalsContact C-N 3.28Å; G91-K93 PolarHBondContact O-N 2.94Å
92P47.2Very low37.8Very low128 Ų128135.2 Ų135.283%0.83179%0.786SS**SBendtrans-73.683.6-177.732.5-33.3000109.6
93K41.8Very low38Very low198 Ų198136.9 Ų136.986%0.86179%0.793SS**  trans-12715.4168.8-83.5-170.3174.8-177.30112.9G91G91-K93 VanDerWaalsContact C-N 3.28Å; G91-K93 PolarHBondContact O-N 2.94Å
94L42.5Very low38.2Very low165 Ų165130.1 Ų130.186%0.86478%0.777SS**  trans-97.919.9166.7-62.5-179.6000112.7V96L94-V96 PolarHBondContact O-N 3.47Å
95L40Very low38.3Very low155 Ų155131.4 Ų131.481%0.81278%0.78SS**  trans-72.583.1152.3-72.5170.6000106E97L95-E97 PolarHBondContact O-N 2.96Å
96V46.1Very low38.7Very low117 Ų117130.3 Ų130.371%0.70978%0.778SS**  trans-66.896.3162.6175.90000105.2L94 V98L94-V96 PolarHBondContact O-N 3.47Å; V96-V98 HydrophobicContact CG1-CG2 4.02Å; V96-V98 PolarHBondContact O-N 3.41Å
97E36.9Very low38.6Very low162 Ų162126.2 Ų126.276%0.75776%0.764SS**  trans-57.687166.9-170.5176.8-168.800108L95 C99L95-E97 PolarHBondContact O-N 2.96Å; E97-C99 HydrophobicContact CG-CB 3.89Å; E97-C99 PolarHBondContact O-N 2.88Å; E97-C99 VanDerWaalsContact O-N 3.15Å
98V43.4Very low39Very low134 Ų134126.5 Ų126.581%0.81277%0.765SS**  trans-81.873.6159.3-174.70000105.9V96V96-V98 HydrophobicContact CG1-CG2 4.02Å; V96-V98 PolarHBondContact O-N 3.41Å
99C31.8Very low39.2Very low83 Ų83125.1 Ų125.156%0.56176%0.756SS**  trans-93.1133.8166.8-80.70000110E97E97-C99 HydrophobicContact CG-CB 3.89Å; E97-C99 PolarHBondContact O-N 2.88Å; E97-C99 VanDerWaalsContact O-N 3.15Å
100D34.7Very low39.5Very low161 Ų161125.9 Ų125.986%0.86176%0.755SS**  trans78.883.4153.9-59-23.9000120.3
101A37.4Very low39.8Very low94 Ų94130 Ų13078%0.77775%0.752SS**SBendtrans-143.3144.3136.700000109.6
102P37.9Very low40.2Very low122 Ų122134 Ų13479%0.79277%0.769SS**  trans-78.8147.3-136.330.2-34.9000114A104P102-A104 VanDerWaalsContact C-N 3.33Å; P102-A104 PolarHBondContact O-N 3.42Å
103A37.4Very low40Very low105 Ų105131.2 Ų131.287%0.86876%0.764SS**  trans-54.786.5173.700000112.5K105A103-K105 PolarHBondContact O-N 3.16Å
104A35.9Very low40.1Very low76 Ų76128.1 Ų128.163%0.62875%0.753SS**  trans-71.2113.415700000106.9P102 I106P102-A104 VanDerWaalsContact C-N 3.33Å; P102-A104 PolarHBondContact O-N 3.42Å; A104-I106 VanDerWaalsContact C-N 3.27Å; A104-I106 HydrophobicContact CB-CD1 4.45Å; A104-I106 PolarHBondContact O-N 3.48Å
105K37.4Very low40Very low214 Ų214129.6 Ų129.693%0.9375%0.752SS**  trans-56.190.1169.8-74174.6174.8177.70109.1A103A103-K105 PolarHBondContact O-N 3.16Å
106I42.5Very low39.9Very low147 Ų147128.9 Ų128.975%0.75475%0.754SS**  trans-91.9103.5165.3-74.1146000105A104A104-I106 VanDerWaalsContact C-N 3.27Å; A104-I106 HydrophobicContact CB-CD1 4.45Å; A104-I106 PolarHBondContact O-N 3.48Å
107G35.5Very low39.6Very low52 Ų52126.3 Ų126.354%0.53675%0.751SS.*  trans-57.4136.7178.600000110.3S109G107-S109 PolarHBondContact O-N 3.32Å
108T48.5Very low39.8Very low122 Ų122123.9 Ų123.975%0.74875%0.752SS**SBendtrans-68.957.817343.50000111.1
109S41.8Very low39.7Very low83 Ų83122 Ų12258%0.5875%0.745SS**  trans-133.44.4-169.8-53.90000115.9G107G107-S109 PolarHBondContact O-N 3.32Å
110D43.2Very low40.2Very low154 Ų154125.9 Ų125.982%0.82476%0.758SS**  trans-101.425.4177.8-70.5-25.1000113.8
111W40.5Very low40.4Very low210 Ų210121.1 Ų121.180%0.79575%0.747SS**SBendtrans-94.5115.9160.2-80.397.7000109G113 E114W111-G113 PolarHBondContact O-N 3.46Å; W111-E114 PolarHBondContact O-N 2.97Å
112P42.6Very low40.9Very low131 Ų131124.4 Ų124.485%0.85175%0.75SS**THydrogen-bonded Turntrans-68.497.7178.928.3-32.2000108.5
113G43Very low41.8Very low71 Ų71123.3 Ų123.373%0.73274%0.738SS**THydrogen-bonded Turntrans150.7-19.4178.900000114.3W111 K115W111-G113 PolarHBondContact O-N 3.46Å; G113-K115 PolarHBondContact O-N 3.34Å
114E42.3Very low42.7Very low132 Ų132126.7 Ų126.762%0.61774%0.736SS**  trans-82.273.1177.3-158.5172.4176.300110.3W111 V116W111-E114 PolarHBondContact O-N 2.97Å; E114-V116 PolarHBondContact O-N 2.78Å
115K40.8Very low43.5Very low196 Ų196132 Ų13285%0.85275%0.745SS**  trans-62.8103.3165.1-74.5-105-178.6173.50107.5G113 G117G113-K115 PolarHBondContact O-N 3.34Å; K115-G117 PolarHBondContact O-N 3.37Å
116V39.2Very low44.4Very low141 Ų141124.4 Ų124.486%0.85572%0.719SS**  trans-52.5100.6163.9179.60000108.2E114E114-V116 PolarHBondContact O-N 2.78Å
117G38.8Very low44.8Very low63 Ų63122.6 Ų122.665%0.64971%0.71SS**  trans-176.390.3-17400000111.3K115 S119K115-G117 PolarHBondContact O-N 3.37Å; G117-S119 PolarHBondContact O-N 2.97Å
118S40.4Very low45.8Very low110 Ų110128.6 Ų128.677%0.76972%0.722SS**  trans-23.4122.4165.7-165.40000115.6
119S41.9Very low46.1Very low94 Ų94128 Ų12866%0.65772%0.718SS**  trans4786.3142.264.20000119.1G117G117-S119 PolarHBondContact O-N 2.97Å
120I42Very low46.6Very low166 Ų166128.6 Ų128.685%0.85172%0.722SS**  -142.683.3127-63.198.8000106.2
121G39.8Very low46.9Very low61 Ų61126.1 Ų126.163%0.62972%0.717SS**  trans-72.4154.4157.300000108.9
122I48.2Very low47.3Very low163 Ų163120.3 Ų120.384%0.83671%0.708SS**SBendtrans73.487.8177.268.2149.9000116.9
123D55.6Low47.4Very low99 Ų99123.4 Ų123.453%0.52971%0.708SS.*SBend-166.3-4.8121.9-143.517.7000116.2F125 S126D123-F125 PolarHBondContact O-N 3.38Å; D123-S126 PolarHBondContact O-N 3.03Å; D123-S126 WeakPolarHBondContact OD1-CB 3.48Å; D123-S126 PolarHBondContact OD1-OG 2.84Å
124E57.4Low47.9Very low176 Ų176123.8 Ų123.882%0.82270%0.704SS**Hα-helixtrans-72.8-31.6-176.3-152.9164.9-156.900112.6
125F52.8Low48.3Very low188 Ų188123.2 Ų123.283%0.82571%0.712SS**Hα-helixtrans-74.1-25.3173.3-93.5-86.5000113.7D123 N127 F128D123-F125 PolarHBondContact O-N 3.38Å; F125-N127 VanDerWaalsContact C-N 3.3Å; F125-N127 PolarHBondContact O-N 3.49Å; F125-F128 PolarHBondContact O-N 2.97Å
126S54.6Low48.8Very low54 Ų54122.5 Ų122.538%0.37871%0.712SS.*Hα-helixtrans-68.4-32.7176.6-50.20000111.8D123 S130D123-S126 PolarHBondContact O-N 3.03Å; D123-S126 WeakPolarHBondContact OD1-CB 3.48Å; D123-S126 PolarHBondContact OD1-OG 2.84Å; S126-S130 WeakPolarHBondContact O-CB 3.32Å; S126-S130 PolarHBondContact O-N 3.44Å; S126-S130 VanDerWaalsContact O-N 3.16Å; S126-S130 PolarHBondContact O-OG 3.08Å
127N52Low49.5Very low108 Ų108120.5 Ų120.558%0.57870%0.702SS**Hα-helixtrans-70.1-30.5178.3-83.7-26.4000112.9F125 S131F125-N127 VanDerWaalsContact C-N 3.3Å; F125-N127 PolarHBondContact O-N 3.49Å; N127-S131 PolarHBondContact O-N 3.39Å
128F55.4Low50.4Low178 Ų178123.2 Ų123.278%0.78170%0.701SS**Hα-helixtrans-69.2-35.1178.8-162.6-97.3000112.4F125F125-F128 PolarHBondContact O-N 2.97Å
129V56.2Low51.3Low109 Ų109126.2 Ų126.266%0.66170%0.703SS**Hα-helixtrans-80.9-39.1179.6-174.40000111.4S131 S132V129-S131 PolarHBondContact O-N 2.93Å; V129-S132 PolarHBondContact O-OG 2.96Å
130S51Low52.1Low96 Ų96130.9 Ų130.967%0.67171%0.712SS**Hα-helixtrans-74.7-24.6-171.8-55.90000114.4S126 S132S126-S130 WeakPolarHBondContact O-CB 3.32Å; S126-S130 PolarHBondContact O-N 3.44Å; S126-S130 VanDerWaalsContact O-N 3.16Å; S126-S130 PolarHBondContact O-OG 3.08Å; S130-S132 VanDerWaalsContact C-N 3.33Å
131S50.3Low52.7Low103 Ų103129.4 Ų129.472%0.7271%0.705SS**THydrogen-bonded Turntrans-89.45.4-178.7-1480000114.1N127 V129 K133N127-S131 PolarHBondContact O-N 3.39Å; V129-S131 PolarHBondContact O-N 2.93Å; S131-K133 PolarHBondContact O-N 2.87Å
132S48Very low53.2Low87 Ų87134 Ų13461%0.60871%0.708SS**  trans-79.550.2178.167.20000112.9V129 S130 A134V129-S132 PolarHBondContact O-OG 2.96Å; S130-S132 VanDerWaalsContact C-N 3.33Å; S132-A134 PolarHBondContact O-N 3Å
133K45.8Very low53Low197 Ų197131.9 Ų131.986%0.85770%0.699SS**  trans-76.569.8151-161.9145.4-176.3171.70106.7S131 P135S131-K133 PolarHBondContact O-N 2.87Å; K133-P135 WeakPolarHBondContact O-CD 3.48Å
134A53.3Low53Low78 Ų78134.2 Ų134.265%0.64571%0.71SS**PPolyproline II helixtrans-53.3123.6172.600000107S132 E136S132-A134 PolarHBondContact O-N 3Å; A134-E136 PolarHBondContact O-N 2.99Å
135P51.8Low52.4Low120 Ų120128.9 Ų128.978%0.77970%0.702SS**PPolyproline II helixtrans-58.9118.917420.4-26.7000107.2K133K133-P135 WeakPolarHBondContact O-CD 3.48Å
136E49.5Very low52.1Low182 Ų182123.6 Ų123.685%0.8569%0.693SS**PPolyproline II helixtrans-58.3122175.2-162178-159.800107A134 D138A134-E136 PolarHBondContact O-N 2.99Å; E136-D138 PolarHBondContact O-N 2.88Å; E136-D138 VanDerWaalsContact O-N 3.13Å
137P53.8Low51.6Low98 Ų98124.7 Ų124.764%0.63671%0.705SS**PPolyproline II helixtrans-65.3118.1-175.124.4-31.7000109E139P137-E139 PolarHBondContact O-N 3.02Å
138D58Low51.2Low121 Ų121125.6 Ų125.665%0.64772%0.719SS**  trans-69.396.5178.8-135.9-9.8000108.2E136 K140 N141E136-D138 PolarHBondContact O-N 2.88Å; E136-D138 VanDerWaalsContact O-N 3.13Å; D138-K140 PolarHBondContact O-N 3.05Å; D138-N141 PolarHBondContact O-N 3.38Å; D138-N141 VanDerWaalsContact O-N 3.15Å
139E59.4Low50.9Low172 Ų172121 Ų12180%0.80471%0.705SS**G310 helixtrans-57.1-16.4-172.5-61.9-171.9166.200113.3P137 N141 F142P137-E139 PolarHBondContact O-N 3.02Å; E139-N141 VanDerWaalsContact C-N 3.29Å; E139-N141 PolarHBondContact O-N 2.89Å; E139-F142 PolarHBondContact O-N 3.15Å
140K60.2Low50Low193 Ų193122.2 Ų122.284%0.83971%0.708SS**G310 helixtrans-72-16.5179.8-61.6-147.1179-174.30115D138D138-K140 PolarHBondContact O-N 3.05Å
141N54.3Low49.8Very low134 Ų134125.8 Ų125.872%0.71771%0.711SS**G310 helixtrans-103.11.9178.7-63.5-43.5000113D138 E139 D143D138-N141 PolarHBondContact O-N 3.38Å; D138-N141 VanDerWaalsContact O-N 3.15Å; E139-N141 VanDerWaalsContact C-N 3.29Å; E139-N141 PolarHBondContact O-N 2.89Å; N141-D143 PolarHBondContact O-N 2.79Å; N141-D143 VanDerWaalsContact O-N 3.09Å
142F48.8Very low49.3Very low158 Ų158127.2 Ų127.269%0.69372%0.716SS**  trans-88.361.7178.3-124.6-92.3000110.4E139 I144E139-F142 PolarHBondContact O-N 3.15Å; F142-I144 VanDerWaalsContact C-N 3.29Å; F142-I144 HydrophobicContact CD1-CD1 3.77Å; F142-I144 HydrophobicContact CD1-CG1 3.59Å; F142-I144 HydrophobicContact CE1-CD1 4.16Å; F142-I144 HydrophobicContact CE1-CG1 4.11Å; F142-I144 PolarHBondContact O-N 2.87Å
143D44.4Very low48.7Very low118 Ų118127.7 Ų127.763%0.63172%0.72SS**  trans-76.783.1172.2-165-4.4000109.5N141 G145 A146N141-D143 PolarHBondContact O-N 2.79Å; N141-D143 VanDerWaalsContact O-N 3.09Å; D143-G145 PolarHBondContact O-N 2.78Å; D143-G145 PolarHBondContact OD1-N 2.81Å; D143-G145 VanDerWaalsContact OD1-N 3.08Å; D143-A146 WeakPolarHBondContact OD2-CB 3.4Å
144I55.6Low48.5Very low149 Ų149126.6 Ų126.676%0.76472%0.715SS**THydrogen-bonded Turntrans-67.6-10.3173.9-53.8174.4000110.5F142F142-I144 VanDerWaalsContact C-N 3.29Å; F142-I144 HydrophobicContact CD1-CD1 3.77Å; F142-I144 HydrophobicContact CD1-CG1 3.59Å; F142-I144 HydrophobicContact CE1-CD1 4.16Å; F142-I144 HydrophobicContact CE1-CG1 4.11Å; F142-I144 PolarHBondContact O-N 2.87Å
145G45Very low47.8Very low64 Ų64127.4 Ų127.466%0.6672%0.721SS**THydrogen-bonded Turntrans-95-19.4-167.100000116.8D143D143-G145 PolarHBondContact O-N 2.78Å; D143-G145 PolarHBondContact OD1-N 2.81Å; D143-G145 VanDerWaalsContact OD1-N 3.08Å
146A47.4Very low46.9Very low76 Ų76124.8 Ų124.863%0.62872%0.717SS**SBendtrans-98.3-3.7-163.500000116.8D143D143-A146 WeakPolarHBondContact OD2-CB 3.4Å
147A44Very low46.1Very low78 Ų78122.7 Ų122.765%0.64572%0.72SS**  trans-132.364-176.400000112.4V149A147-V149 HydrophobicContact CB-CG2 3.83Å; A147-V149 PolarHBondContact O-N 3.17Å
148C43.7Very low45.3Very low127 Ų127125 Ų12586%0.85873%0.728SS**  trans-65.978.3146.8-68.60000107.2D150C148-D150 PolarHBondContact O-N 2.87Å; C148-D150 VanDerWaalsContact O-N 3.09Å
149V49Very low44.3Very low80 Ų80124.6 Ų124.649%0.48574%0.741SS.*  trans-69.5106.7173.8-1650000106A147 F151A147-V149 HydrophobicContact CB-CG2 3.83Å; A147-V149 PolarHBondContact O-N 3.17Å; V149-F151 WeakPolarHBondContact O-CD2 3.49Å; V149-F151 VanDerWaalsContact O-CE2 3.3Å; V149-F151 WeakPolarHBondContact O-CE2 3.5Å; V149-F151 PolarHBondContact O-N 3.28Å
150D37.6Very low43Very low136 Ų136120.9 Ų120.973%0.72773%0.734SS**  trans-60.3107.8168.3-89.9-32.7000108.2C148 T152C148-D150 PolarHBondContact O-N 2.87Å; C148-D150 VanDerWaalsContact O-N 3.09Å; D150-T152 PolarHBondContact O-N 2.99Å
151F45Very low41.7Very low170 Ų170117.2 Ų117.275%0.74673%0.732SS**THydrogen-bonded Turntrans-71.819.4-174.8-73-83.7000114.4V149 F154V149-F151 WeakPolarHBondContact O-CD2 3.49Å; V149-F151 VanDerWaalsContact O-CE2 3.3Å; V149-F151 WeakPolarHBondContact O-CE2 3.5Å; V149-F151 PolarHBondContact O-N 3.28Å; F151-F154 HydrophobicContact CD1-CE2 4.23Å
152T40.1Very low40.6Very low134 Ų134119.9 Ų119.982%0.82274%0.741SS**THydrogen-bonded Turntrans-99.6-1-178.756.30000113.8D150D150-T152 PolarHBondContact O-N 2.99Å
153S35.3Very low39.7Very low97 Ų97120.4 Ų120.468%0.67875%0.745SS**  trans-121.672.7-179.3-175.40000112.8
154F42.2Very low39.1Very low174 Ų174122.7 Ų122.776%0.76375%0.754SS**  trans-114.668.5159.7-73.7-81000109.2F151F151-F154 HydrophobicContact CD1-CE2 4.23Å
155A39Very low38.1Very low94 Ų94125.3 Ų125.378%0.77776%0.76SS**  trans-96.5112.6164.500000108.5
156G31.8Very low37.4Very low66 Ų66131.3 Ų131.368%0.6877%0.771SS**  trans64.394.3153.300000117.5
157C34.4Very low36.7Very low137 Ų137136.3 Ų136.393%0.92678%0.781SS**  trans-123.492.7145.1-87.60000107.6A159C157-A159 PolarHBondContact O-N 3.13Å
158D35.1Very low36.1Very low148 Ų148139 Ų13979%0.79179%0.789SS**  trans-56.1127.1168.6-75.8-51000110S160D158-S160 VanDerWaalsContact C-N 3.31Å; D158-S160 PolarHBondContact O-N 2.93Å
159A36.9Very low35.7Very low111 Ų111141.5 Ų141.592%0.91779%0.786SS**  trans-68.587.1171.500000109.5C157C157-A159 PolarHBondContact O-N 3.13Å
160S32.8Very low34.8Very low95 Ų95143.5 Ų143.566%0.66480%0.801SS**  trans-147126.415969.30000111.3D158D158-S160 VanDerWaalsContact C-N 3.31Å; D158-S160 PolarHBondContact O-N 2.93Å
161S32.3Very low34.9Very low115 Ų115143.3 Ų143.380%0.80480%0.804SS**  trans86.691.7160.2-45.20000118.6
162Q31.4Very low34.4Very low191 Ų191141.7 Ų141.789%0.89380%0.803SS**  trans160.388133.2-93.7-173.6-18.700107.1
163E31.7Very low34.1Very low169 Ų169140.4 Ų140.479%0.7980%0.797SS**  43.711067.5-122.4-169.8148.200115.1
164M31.6Very low34.3Very low166 Ų166144 Ų14482%0.81881%0.805SS**  trans53.599.9159.4-62.5-160.1-166.500119.7
165K33.5Very low33.9Very low204 Ų204141.5 Ų141.589%0.88781%0.805SS**  -160.4117.9120.7-107.3170.2-173.7-175.80110.8H167K165-H167 PolarHBondContact O-N 3.05Å
166Q30Very low33.7Very low190 Ų190142.2 Ų142.289%0.88880%0.801SS**  trans-53.7117.6166.5-66168.3-19.900109.5
167H33.2Very low33.8Very low180 Ų180145 Ų14583%0.83381%0.805SS**  trans-156121.9147.4-93.5-66.9000109.7K165 F169K165-H167 PolarHBondContact O-N 3.05Å; H167-F169 PolarHBondContact O-N 3.1Å
168T31.4Very low33.4Very low134 Ų134144.1 Ų144.182%0.82280%0.799SS**  trans-50.8109.1170.2-52.90000111.9
169F35.4Very low33.3Very low180 Ų180144.5 Ų144.579%0.78980%0.8SS**  trans-142.7142.5147.9-86.3-80000107.4H167 V171H167-F169 PolarHBondContact O-N 3.1Å; F169-V171 PolarHBondContact O-N 2.71Å
170P31.1Very low32.9Very low123 Ų123148.5 Ų148.580%0.79980%0.8SS**  trans-65.5111.8-177.926.4-30.8000108.9D172P170-D172 PolarHBondContact O-N 3.38Å; P170-D172 VanDerWaalsContact O-N 3.13Å
171V38.7Very low33.1Very low132 Ų132149.6 Ų149.680%0.881%0.808SS**  trans-66.1111167.7171.90000106.6F169F169-V171 PolarHBondContact O-N 2.71Å
172D33.8Very low33.2Very low136 Ų136149.9 Ų149.973%0.72781%0.81SS**  trans-41.8131.7168.2-148.85.7000109.5P170 M174P170-D172 PolarHBondContact O-N 3.38Å; P170-D172 VanDerWaalsContact O-N 3.13Å; D172-M174 PolarHBondContact O-N 3.15Å
173P35.6Very low33.2Very low107 Ų107150.7 Ų150.770%0.69581%0.811SS**  trans-56.6112.3-17521.2-33.5000110.4T175P173-T175 PolarHBondContact O-N 2.9Å
174M37.8Very low33.3Very low171 Ų171147.1 Ų147.184%0.84281%0.809SS**  trans-51.1106.7164-90.7-114.3-82.400108.1D172D172-M174 PolarHBondContact O-N 3.15Å
175T35.2Very low33.4Very low123 Ų123149.9 Ų149.976%0.75582%0.818SS**  trans-59.7139.3172.845.80000109.4P173P173-T175 PolarHBondContact O-N 2.9Å
176P33.1Very low33.3Very low109 Ų109148 Ų14871%0.70881%0.812SS**  trans-67.3135.2-154.924.9-34.6000113.5C178P176-C178 VanDerWaalsContact C-N 3.33Å; P176-C178 PolarHBondContact O-N 3.43Å
177T34.4Very low33.5Very low124 Ų124144.6 Ų144.676%0.76181%0.809SS**  trans-59.587.1166-45.10000110.4L179T177-L179 PolarHBondContact O-N 2.75Å
178C27.6Very low33.7Very low119 Ų119142.8 Ų142.880%0.80481%0.805SS**  trans-83.994.7164.9-81.70000109.5P176 Q180P176-C178 VanDerWaalsContact C-N 3.33Å; P176-C178 PolarHBondContact O-N 3.43Å; C178-Q180 PolarHBondContact O-N 3.11Å
179L32.6Very low34.1Very low155 Ų155141.2 Ų141.281%0.81281%0.806SS**  trans-46.9107.9163.5-72.3158.5000111.7T177T177-L179 PolarHBondContact O-N 2.75Å
180Q28.2Very low34.3Very low196 Ų196135.6 Ų135.692%0.91680%0.799SS**  trans-155.580.9152.5-74.7-154.9-27.400110.8C178C178-Q180 PolarHBondContact O-N 3.11Å
181S36.8Very low34.8Very low118 Ų118136.2 Ų136.283%0.82580%0.8SS**  trans-131.499.7153.765.20000109.5K183S181-K183 PolarHBondContact O-N 3.38Å; S181-K183 VanDerWaalsContact O-N 3.11Å
182S34.5Very low34.8Very low121 Ų121138 Ų13885%0.84681%0.805SS**  trans-46.6107.5168.9-52.70000111.1
183K31.9Very low35Very low208 Ų208136.3 Ų136.390%0.90480%0.803SS**  trans161.778.5139.4-80-121.1-175.11780110.9S181S181-K183 PolarHBondContact O-N 3.38Å; S181-K183 VanDerWaalsContact O-N 3.11Å
184A34Very low35Very low93 Ų93136.1 Ų136.177%0.76980%0.796SS**  trans-162.694.715000000108.3E186A184-E186 PolarHBondContact O-N 3.02Å
185F33.2Very low35.5Very low225 Ų225132.7 Ų132.799%0.98779%0.787SS**  trans-69.689.6159.4-100.9-90.4000106.5
186E31.8Very low35.9Very low165 Ų165135.4 Ų135.477%0.77179%0.788SS**  trans-151.498.9160.4-128.2171.8-177.600109.5A184 N188A184-E186 PolarHBondContact O-N 3.02Å; E186-N188 PolarHBondContact O-N 3.23Å
187S32.4Very low36.5Very low118 Ų118137 Ų13783%0.82579%0.791SS**  trans-64.4108.7171.2136.60000108.6
188N39.3Very low36.7Very low141 Ų141140 Ų14075%0.75479%0.794SS**  trans-119.8116.5155.9-76.3-61.2000107.7E186 G190E186-N188 PolarHBondContact O-N 3.23Å; N188-G190 PolarHBondContact O-N 3.25Å
189A38.6Very low37.1Very low101 Ų101137.8 Ų137.884%0.83579%0.791SS**  trans-58.391.2-17700000111.5V191A189-V191 PolarHBondContact O-N 2.92Å
190G39.9Very low37.4Very low63 Ų63135.7 Ų135.765%0.64979%0.789SS**  trans-80.3109.1160.700000108.1N188 L192N188-G190 PolarHBondContact O-N 3.25Å; G190-L192 PolarHBondContact O-N 3.23Å
191V40.6Very low37.8Very low136 Ų136133.4 Ų133.482%0.82478%0.782SS**  trans-53.7102.9174.21750000108.9A189 S193A189-V191 PolarHBondContact O-N 2.92Å; V191-S193 PolarHBondContact O-N 3.32Å
192L40.6Very low37.5Very low170 Ų170133.5 Ų133.589%0.8978%0.781SS**  trans-77.8105.8166-79163.8000106.7G190 D194G190-L192 PolarHBondContact O-N 3.23Å; L192-D194 PolarHBondContact O-N 3.07Å
193S37.8Very low37.2Very low99 Ų99133.7 Ų133.769%0.69278%0.783SS**  trans-55.1133.9171.7-4.80000109.6V191 P195V191-S193 PolarHBondContact O-N 3.32Å; S193-P195 WeakPolarHBondContact O-CD 3.29Å
194D35.5Very low37.2Very low104 Ų104131.1 Ų131.156%0.55678%0.778SS**  trans-59122.1175.9-144.9-14.5000108.5L192 F196 D197L192-D194 PolarHBondContact O-N 3.07Å; D194-F196 PolarHBondContact O-N 3.09Å; D194-F196 WeakPolarHBondContact OD1-CD2 3.43Å; D194-D197 PolarHBondContact O-N 2.99Å; D194-D197 VanDerWaalsContact O-N 3.12Å
195P47.6Very low37.5Very low98 Ų98133.1 Ų133.164%0.63678%0.783SS**G310 helixtrans-64.7-3.4-178.623.4-32.2000113.8S193 D197S193-P195 WeakPolarHBondContact O-CD 3.29Å; P195-D197 PolarHBondContact O-N 2.75Å
196F43.8Very low37.7Very low181 Ų181127.3 Ų127.379%0.79477%0.771SS**G310 helixtrans-75.1-4.7171.3-66.9-76.5000114.2D194 F198D194-F196 PolarHBondContact O-N 3.09Å; D194-F196 WeakPolarHBondContact OD1-CD2 3.43Å; F196-F198 VanDerWaalsContact C-N 3.33Å
197D45.2Very low37.5Very low141 Ų141128 Ų12875%0.75477%0.774SS**G310 helixtrans-89.214.8174.2-85.7-25.6000114.7D194 P195 G199D194-D197 PolarHBondContact O-N 2.99Å; D194-D197 VanDerWaalsContact O-N 3.12Å; P195-D197 PolarHBondContact O-N 2.75Å; D197-G199 PolarHBondContact O-N 2.98Å
198F39.8Very low37.5Very low187 Ų187128.6 Ų128.682%0.8277%0.772SS**SBendtrans-90.183.6165.9-75.7-80000111.3F196F196-F198 VanDerWaalsContact C-N 3.33Å
199G35Very low37.3Very low73 Ų73127 Ų12775%0.75377%0.77SS**  trans45.489141.500000117D197D197-G199 PolarHBondContact O-N 2.98Å
200S39.6Very low36.8Very low111 Ų111128.2 Ų128.278%0.77677%0.77SS**  trans-142.994.2144.2-144.30000110
201I35.7Very low36.4Very low149 Ų149132.3 Ų132.376%0.76478%0.776SS**  trans2.3139.4136.252.3167.3000115.7
202C29.9Very low36.3Very low120 Ų120131.5 Ų131.581%0.81177%0.773SS**  trans104.850.2170.1-53.30000116.5
203S28.7Very low36Very low125 Ų125129.6 Ų129.687%0.87477%0.769SS**  trans-74.7138.3134.8-78.40000109.8
204L31.4Very low35.8Very low154 Ų154128.8 Ų128.881%0.80677%0.767SS**  trans-37.9152.7-178.4-91.567.4000116.5S206L204-S206 PolarHBondContact O-N 2.98Å
205P40.8Very low35.7Very low135 Ų135130 Ų13088%0.87778%0.779SS**SBendtrans-78.992.3171.133.2-29.8000109.6
206S36.9Very low35.1Very low103 Ų103134.2 Ų134.272%0.7279%0.79SS**  trans-153.991.4165.7-171.80000111.7L204L204-S206 PolarHBondContact O-N 2.98Å
207Q29.3Very low34.8Very low180 Ų180132.1 Ų132.184%0.84179%0.793SS**  trans23.5131.1140.3-74.9-166.411.600121.6
208V32.4Very low34.4Very low129 Ų129132 Ų13278%0.78280%0.797SS**  trans82.3149.2150.4-124.90000119
209P34.9Very low34.4Very low109 Ų109127.7 Ų127.771%0.70879%0.79SS**  -125.4171.8-83.240.4-26000113.5
210C26.8Very low34.6Very low125 Ų125130.8 Ų130.885%0.84579%0.794SS**  trans-47.8133.8172.7-59.50000114.3
211I32.6Very low34.8Very low150 Ų150132.5 Ų132.577%0.76979%0.794SS**  trans-121.5118.6151.8-51.5176.4000106.6V213I211-V213 HydrophobicContact CG2-CG2 4.43Å
212P37.1Very low35.3Very low118 Ų118134.6 Ų134.677%0.76680%0.798SS**  trans-82.7129.2177.931.8-29.2000109.2
213V34.8Very low36.5Very low131 Ų131134.1 Ų134.179%0.79479%0.793SS**  trans-136104.4165.6-177.40000110.4I211I211-V213 HydrophobicContact CG2-CG2 4.43Å
214A33Very low37.7Very low81 Ų81133.6 Ų133.667%0.66979%0.787SS**  trans59.8106.2142.700000119E216A214-E216 PolarHBondContact O-N 2.91Å
215T35.3Very low39.2Very low130 Ų130135.7 Ų135.780%0.79879%0.792SS**  -8.4109.713034.90000114.7
216E34.6Very low40.4Very low186 Ų186140.7 Ų140.787%0.86979%0.794SS**  36.1102.3129.1-59-175.8173.400116.7A214A214-E216 PolarHBondContact O-N 2.91Å
217T36.6Very low42Very low138 Ų138145.6 Ų145.685%0.84780%0.802SS**  trans-129113.2139.411.50000108.4S219T217-S219 PolarHBondContact O-N 2.96Å
218T36.5Very low44Very low139 Ų139144.7 Ų144.785%0.85380%0.802SS**  trans-39.1115.116732.30000112.7
219S39.7Very low45.3Very low95 Ų95143.4 Ų143.466%0.66480%0.796SS**  trans-125.5103.8154.6177.60000108T217 L221T217-S219 PolarHBondContact O-N 2.96Å; S219-L221 PolarHBondContact O-N 3.13Å
220T40.8Very low47Very low138 Ų138143.6 Ų143.685%0.84779%0.791SS**  trans-65.171.4176.8-39.50000110.4K222T220-K222 PolarHBondContact O-N 3.07Å
221L43.9Very low48.8Very low147 Ų147141.8 Ų141.877%0.7778%0.777SS**  trans-86.1106.6165.7-82.3158000107.2S219 P223S219-L221 PolarHBondContact O-N 3.13Å; L221-P223 VanDerWaalsContact O-N 3.13Å
222K45.6Very low50.2Low193 Ų193143.7 Ų143.784%0.83977%0.774SS**  trans-45.7121.7172.6-88.5-174.4173.8-177.90108.8T220T220-K222 PolarHBondContact O-N 3.07Å
223P54.1Low51.5Low111 Ų111141.7 Ų141.772%0.72176%0.763SS**  trans-61138.3174.123.7-30.7000108.6L221 E225L221-P223 VanDerWaalsContact O-N 3.13Å; P223-E225 PolarHBondContact O-N 3.24Å
224P55.7Low52.8Low113 Ų113139 Ų13973%0.73475%0.745SS**  trans-58.5128.517523.4-31.5000108.8R226P224-R226 PolarHBondContact O-N 3.29Å
225E61.5Low54.3Low199 Ų199138.9 Ų138.993%0.9373%0.732SS**  trans-52.4104176.4-77.8-176.4152.600109.6P223 K227P223-E225 PolarHBondContact O-N 3.24Å; E225-K227 PolarHBondContact O-N 3.26Å
226R66.5Low55.6Low239 Ų239141.1 Ų141.190%0.90273%0.733SS**  trans-73.199.6169.9-65.7-171.2-170.2141.90.5106.8P224 L228P224-R226 PolarHBondContact O-N 3.29Å; R226-L228 PolarHBondContact O-N 3.08Å; R226-L228 VanDerWaalsContact O-N 3.08Å
227K71.3Confident57.1Low206 Ų206139.8 Ų139.890%0.89672%0.724SS**  trans-57.8113.5172.3-138.7167-174.71760107.6E225E225-K227 PolarHBondContact O-N 3.26Å
228L69.8Low58.6Low161 Ų161138.2 Ų138.284%0.84371%0.709SS**  trans-57.3130175.9-72.1165.2000108.1R226 D230R226-L228 PolarHBondContact O-N 3.08Å; R226-L228 VanDerWaalsContact O-N 3.08Å; L228-D230 PolarHBondContact O-N 3.23Å
229P60.9Low60Low102 Ų102134.8 Ų134.866%0.66270%0.701SS**  trans-60.4134.4173.624.3-30.8000108.8T231P229-T231 HydrophobicContact CG-CG2 4.35Å; P229-T231 PolarHBondContact O-N 3.17Å
230D69.1Low61.5Low113 Ų113136.2 Ų136.260%0.60470%0.701SS**  trans-72.276.7178.2-168.317000109.5L228 W232 S233L228-D230 PolarHBondContact O-N 3.23Å; D230-W232 PolarHBondContact O-N 3.31Å; D230-S233 PolarHBondContact O-N 2.88Å; D230-S233 PolarHBondContact OD2-OG 2.95Å
231T65.6Low63Low87 Ų87133.8 Ų133.853%0.53468%0.683SS.*THydrogen-bonded Turntrans-63.4-19.8-171.147.30000113.6P229 D234P229-T231 HydrophobicContact CG-CG2 4.35Å; P229-T231 PolarHBondContact O-N 3.17Å; T231-D234 PolarHBondContact O-N 3.37Å
232W61.3Low64.2Low191 Ų191132.3 Ų132.372%0.72368%0.675SS**THydrogen-bonded Turntrans-72.6-31.8-179.5-6797.8000112.8D230 D234 I235D230-W232 PolarHBondContact O-N 3.31Å; W232-D234 PolarHBondContact O-N 2.82Å; W232-I235 HydrophobicContact CD2-CD1 4.25Å; W232-I235 HydrophobicContact CE3-CD1 3.38Å; W232-I235 HydrophobicContact CZ3-CD1 3.61Å; W232-I235 PolarHBondContact O-N 3.42Å
233S65.9Low65.5Low76 Ų76129.3 Ų129.353%0.53167%0.669SS.*THydrogen-bonded Turntrans-65.7-23.6177.2-70.50000112.6D230D230-S233 PolarHBondContact O-N 2.88Å; D230-S233 PolarHBondContact OD2-OG 2.95Å
234D62.3Low66Low75 Ų75127.9 Ų127.940%0.40166%0.66SS.*THydrogen-bonded Turntrans-93.8-4.5-178.1-74.3-16.1000113.8T231 W232 H236 K237 I238T231-D234 PolarHBondContact O-N 3.37Å; W232-D234 PolarHBondContact O-N 2.82Å; D234-H236 PolarHBondContact O-N 3.12Å; D234-K237 HydrophobicContact CB-CD 4.26Å; D234-K237 WeakPolarHBondContact O-CA 3.34Å; D234-K237 VanDerWaalsContact O-CB 3.24Å; D234-K237 WeakPolarHBondContact O-CB 3.42Å; D234-K237 PolarHBondContact O-N 2.85Å; D234-K237 WeakPolarHBondContact OD1-CD 3.18Å; D234-K237 WeakPolarHBondContact OD1-CE 3.45Å; D234-K237 IonicContact OD1-NZ 2.71Å; D234-K237 PolarHBondContact OD1-NZ 2.94Å; D234-K237 IonicContact OD2-NZ 4Å; D234-I238 PolarHBondContact O-N 3.07Å
235I64.4Low66.5Low77 Ų77128.3 Ų128.340%0.39566%0.655SS.*G310 helixtrans-60.9-35.1175.7-74.5174.3000111.3W232 K237 I238W232-I235 HydrophobicContact CD2-CD1 4.25Å; W232-I235 HydrophobicContact CE3-CD1 3.38Å; W232-I235 HydrophobicContact CZ3-CD1 3.61Å; W232-I235 PolarHBondContact O-N 3.42Å; I235-K237 PolarHBondContact O-N 3.19Å; I235-I238 HydrophobicContact CB-CD1 4.4Å; I235-I238 HydrophobicContact CG1-CD1 4.15Å; I235-I238 PolarHBondContact O-N 2.91Å; I235-I238 VanDerWaalsContact O-N 3.17Å
236H60.6Low66.8Low177 Ų177122 Ų12282%0.81963%0.634SS**G310 helixtrans-67.4-19.6172.3-61.7-57.3000113.2D234D234-H236 PolarHBondContact O-N 3.12Å
237K67.6Low66.6Low158 Ų158117.8 Ų117.869%0.68763%0.628SS**G310 helixtrans-81.6-13.5173.5-61.1-175.4-176.9162.30113.7D234 I235 G239D234-K237 HydrophobicContact CB-CD 4.26Å; D234-K237 WeakPolarHBondContact O-CA 3.34Å; D234-K237 VanDerWaalsContact O-CB 3.24Å; D234-K237 WeakPolarHBondContact O-CB 3.42Å; D234-K237 PolarHBondContact O-N 2.85Å; D234-K237 WeakPolarHBondContact OD1-CD 3.18Å; D234-K237 WeakPolarHBondContact OD1-CE 3.45Å; D234-K237 IonicContact OD1-NZ 2.71Å; D234-K237 PolarHBondContact OD1-NZ 2.94Å; D234-K237 IonicContact OD2-NZ 4Å; I235-K237 PolarHBondContact O-N 3.19Å; K237-G239 PolarHBondContact O-N 2.97Å
238I67.1Low66.2Low105 Ų105116.3 Ų116.354%0.53863%0.625SS.*G310 helixtrans-68.82.1177.5-46.4173.1000110.8D234 I235 L240D234-I238 PolarHBondContact O-N 3.07Å; I235-I238 HydrophobicContact CB-CD1 4.4Å; I235-I238 HydrophobicContact CG1-CD1 4.15Å; I235-I238 PolarHBondContact O-N 2.91Å; I235-I238 VanDerWaalsContact O-N 3.17Å; I238-L240 HydrophobicContact CB-CG 4.24Å; I238-L240 HydrophobicContact CG2-CD1 4.19Å; I238-L240 HydrophobicContact CG2-CD2 4.44Å; I238-L240 HydrophobicContact CG2-CG 3.96Å; I238-L240 PolarHBondContact O-N 2.84Å
239G67.4Low65.6Low67 Ų67116.1 Ų116.169%0.69162%0.624SS**  trans60.318.4169.600000113.2K237 D241K237-G239 PolarHBondContact O-N 2.97Å; G239-D241 PolarHBondContact O-N 2.87Å
240L70.4Confident65.7Low126 Ų126117.4 Ų117.466%0.6662%0.619SS**  trans-74.595.5178.2-63.7-178.8000107.3I238 L242I238-L240 HydrophobicContact CB-CG 4.24Å; I238-L240 HydrophobicContact CG2-CD1 4.19Å; I238-L240 HydrophobicContact CG2-CD2 4.44Å; I238-L240 HydrophobicContact CG2-CG 3.96Å; I238-L240 PolarHBondContact O-N 2.84Å; L240-L242 HydrophobicContact CB-CD2 4.39Å; L240-L242 PolarHBondContact O-N 2.95Å
241D72.6Confident65.2Low87 Ų87117.8 Ų117.847%0.46563%0.628SS.*  trans-66.398.2170.1179.123.1000109.6G239 N243G239-D241 PolarHBondContact O-N 2.87Å; D241-N243 PolarHBondContact O-N 3.22Å; D241-N243 WeakPolarHBondContact OD1-CB 3.27Å; D241-N243 VanDerWaalsContact OD1-CG 3.25Å; D241-N243 PolarHBondContact OD1-N 3.27Å; D241-N243 PolarHBondContact OD1-ND2 2.8Å
242L69.1Low65.1Low115 Ų115123.7 Ų123.760%0.60264%0.64SS**G310 helixtrans-72.6-10.8178.6-55.8179.4000112.3L240 C244 L245L240-L242 HydrophobicContact CB-CD2 4.39Å; L240-L242 PolarHBondContact O-N 2.95Å; L242-C244 PolarHBondContact O-N 2.99Å; L242-L245 HydrophobicContact CB-CD1 4.47Å; L242-L245 HydrophobicContact CD2-CD1 3.7Å; L242-L245 WeakPolarHBondContact O-CB 3.16Å; L242-L245 PolarHBondContact O-N 2.7Å
243N71.5Confident65.3Low131 Ų131123.3 Ų123.370%0.70164%0.644SS**G310 helixtrans-61.3-30176.3-61.7-51.1000111.4D241 L245 S246D241-N243 PolarHBondContact O-N 3.22Å; D241-N243 WeakPolarHBondContact OD1-CB 3.27Å; D241-N243 VanDerWaalsContact OD1-CG 3.25Å; D241-N243 PolarHBondContact OD1-N 3.27Å; D241-N243 PolarHBondContact OD1-ND2 2.8Å; N243-L245 PolarHBondContact O-N 3.48Å; N243-S246 WeakPolarHBondContact O-CB 3.21Å; N243-S246 PolarHBondContact O-N 3.09Å
244C66.1Low65.2Low80 Ų80128.9 Ų128.954%0.54166%0.662SS.*G310 helixtrans-67.5-15.3174.2-67.60000113.9L242 K250L242-C244 PolarHBondContact O-N 2.99Å; C244-K250 WeakPolarHBondContact O-CE 3.45Å; C244-K250 PolarHBondContact O-NZ 2.86Å
245L64.6Low65.3Low122 Ų122132.6 Ų132.664%0.63968%0.682SS**G310 helixtrans-86.7-10.4177.4-59.8178.8000112.7L242 N243 L247L242-L245 HydrophobicContact CB-CD1 4.47Å; L242-L245 HydrophobicContact CD2-CD1 3.7Å; L242-L245 WeakPolarHBondContact O-CB 3.16Å; L242-L245 PolarHBondContact O-N 2.7Å; N243-L245 PolarHBondContact O-N 3.48Å; L245-L247 PolarHBondContact O-N 3.04Å
246S68.1Low65.6Low68 Ų68131.8 Ų131.848%0.47669%0.686SS.*  trans-61.6113.7178.5-151.70000109.7N243 E248N243-S246 WeakPolarHBondContact O-CB 3.21Å; N243-S246 PolarHBondContact O-N 3.09Å; S246-E248 PolarHBondContact O-N 3.49Å
247L62.4Low66.2Low150 Ų150127.2 Ų127.279%0.78567%0.667SS**  trans-77.7-4.1-179.6-69.1173.8000112.3L245 N249L245-L247 PolarHBondContact O-N 3.04Å; L247-N249 PolarHBondContact O-N 3.44Å; L247-N249 VanDerWaalsContact O-N 3.1Å
248E64.3Low66.9Low175 Ų175122.5 Ų122.582%0.81865%0.654SS**THydrogen-bonded Turntrans-66.4-19.6-164-153.2176.5-178.300113.8S246S246-E248 PolarHBondContact O-N 3.49Å
249N56.2Low67.8Low156 Ų156123.6 Ų123.683%0.83466%0.659SS**THydrogen-bonded Turntrans-152.530.8-178.6-129.6-12.3000115.7L247 P251L247-N249 PolarHBondContact O-N 3.44Å; L247-N249 VanDerWaalsContact O-N 3.1Å; N249-P251 WeakPolarHBondContact O-CD 3.34Å
250K62.8Low68.7Low130 Ų130125.9 Ų125.957%0.56566%0.655SS**PPolyproline II helixtrans-79.1119.7168-71.9-177.3-175.7172.20108C244 R252C244-K250 WeakPolarHBondContact O-CE 3.45Å; C244-K250 PolarHBondContact O-NZ 2.86Å; K250-R252 PolarHBondContact O-N 3.27Å
251P58.4Low69.6Low121 Ų121124.6 Ų124.679%0.78665%0.646SS**PPolyproline II helixtrans-55.3119174.122.1-31.2000107.7N249 K253N249-P251 WeakPolarHBondContact O-CD 3.34Å; P251-K253 PolarHBondContact O-N 3.33Å
252R64.8Low70.4Confident210 Ų210124.2 Ų124.279%0.79264%0.643SS**PPolyproline II helixtrans-49.4117.8177.3-165.1177.4-171.8132.5-0.5106.5K250 Q254K250-R252 PolarHBondContact O-N 3.27Å; R252-Q254 PolarHBondContact O-N 3.27Å
253K64.6Low71.3Confident183 Ų183124.2 Ų124.280%0.79664%0.64SS**PPolyproline II helixtrans-47.5119.6177.3-70.3-176.8178-179.20106.7P251 N255 A256P251-K253 PolarHBondContact O-N 3.33Å; K253-N255 PolarHBondContact O-N 2.89Å; K253-A256 PolarHBondContact O-N 3.18Å
254Q63.8Low72.2Confident194 Ų194121 Ų12191%0.90762%0.621SS**THydrogen-bonded Turntrans-57-15.9-170.9-67.3179.6-30.100113.4R252R252-Q254 PolarHBondContact O-N 3.27Å
255N64.4Low73.2Confident153 Ų153122.2 Ų122.282%0.81862%0.619SS**THydrogen-bonded Turntrans-100.59.9-179.7-65.8-42.2000114.7K253 L257K253-N255 PolarHBondContact O-N 2.89Å; N255-L257 VanDerWaalsContact C-N 3.3Å; N255-L257 PolarHBondContact O-N 3.41Å
256A70.1Confident74.4Confident59 Ų59120.2 Ų120.249%0.48861%0.609SS.*  trans-7786.7169.300000108.9K253 S258K253-A256 PolarHBondContact O-N 3.18Å; A256-S258 PolarHBondContact O-N 2.71Å
257L73.1Confident75.5Confident81 Ų81123.2 Ų123.242%0.42461%0.61SS.*  trans-52.4136172-63.4171.1000109.1N255 E261N255-L257 VanDerWaalsContact C-N 3.3Å; N255-L257 PolarHBondContact O-N 3.41Å; L257-E261 HydrophobicContact CB-CB 4.43Å; L257-E261 HydrophobicContact CD2-CG 3.93Å; L257-E261 VanDerWaalsContact CD2-OE1 3.32Å; L257-E261 WeakPolarHBondContact CD2-OE1 3.47Å
258S82.3Confident76.6Confident60 Ų60121 Ų12142%0.4260%0.595SS.*  trans-61.1150.1170.8178.20000109.8A256 N260 E261 L262A256-S258 PolarHBondContact O-N 2.71Å; S258-N260 PolarHBondContact O-N 3.49Å; S258-N260 VanDerWaalsContact O-N 3.17Å; S258-E261 WeakPolarHBondContact O-CA 3.24Å; S258-E261 WeakPolarHBondContact O-CB 3.2Å; S258-E261 PolarHBondContact O-N 3.33Å; S258-L262 PolarHBondContact O-N 2.84Å
259M86.5Confident77.5Confident127 Ų127119.9 Ų119.963%0.62659%0.588SS**Hα-helixtrans-52.2-38.2174-77.7-60.8-59.500112.1L262 Q263M259-L262 PolarHBondContact O-N 3.16Å; M259-Q263 VanDerWaalsContact O-CG 3.29Å; M259-Q263 WeakPolarHBondContact O-CG 3.48Å; M259-Q263 PolarHBondContact O-N 2.81Å
260N86.4Confident78.6Confident116 Ų116118.2 Ų118.262%0.6258%0.576SS**Hα-helixtrans-66.5-37.6175.9-75.8-7.5000112.6S258 Q263 E264S258-N260 PolarHBondContact O-N 3.49Å; S258-N260 VanDerWaalsContact O-N 3.17Å; N260-Q263 PolarHBondContact O-N 2.89Å; N260-E264 WeakPolarHBondContact O-CB 3.31Å; N260-E264 PolarHBondContact O-N 3.09Å
261E88.7Confident79.2Confident99 Ų99117.6 Ų117.646%0.46358%0.575SS.*Hα-helixtrans-69.7-39.6179.3-167.7174.2-179.800111L257 S258 E264 Q265L257-E261 HydrophobicContact CB-CB 4.43Å; L257-E261 HydrophobicContact CD2-CG 3.93Å; L257-E261 VanDerWaalsContact CD2-OE1 3.32Å; L257-E261 WeakPolarHBondContact CD2-OE1 3.47Å; S258-E261 WeakPolarHBondContact O-CA 3.24Å; S258-E261 WeakPolarHBondContact O-CB 3.2Å; S258-E261 PolarHBondContact O-N 3.33Å; E261-E264 PolarHBondContact O-N 3.02Å; E261-Q265 WeakPolarHBondContact O-CG 3.3Å; E261-Q265 PolarHBondContact O-N 3.19Å
262L89.4Confident79.6Confident79 Ų79121.9 Ų121.941%0.41458%0.576SS.*Hα-helixtrans-62.8-41.8172.8-176.863.9000111.8S258 M259 N266S258-L262 PolarHBondContact O-N 2.84Å; M259-L262 PolarHBondContact O-N 3.16Å; L262-N266 PolarHBondContact O-N 2.81Å; L262-N266 VanDerWaalsContact O-N 3.11Å; L262-N266 PolarHBondContact O-ND2 3.05Å
263Q89.9Confident79.7Confident115 Ų115116.7 Ų116.754%0.53757%0.567SS.*Hα-helixtrans-64.2-43.1176.3-74.6173.9-2.200111.8M259 N260 N266 R267M259-Q263 VanDerWaalsContact O-CG 3.29Å; M259-Q263 WeakPolarHBondContact O-CG 3.48Å; M259-Q263 PolarHBondContact O-N 2.81Å; N260-Q263 PolarHBondContact O-N 2.89Å; Q263-N266 PolarHBondContact O-N 3.37Å; Q263-R267 PolarHBondContact O-N 3.38Å
264E89Confident79.1Confident63 Ų63114.3 Ų114.329%0.29456%0.563SS.*Hα-helixtrans-65-41.9178.3-179.354.6-154.500112.1N260 E261 N266 R267 Q268N260-E264 WeakPolarHBondContact O-CB 3.31Å; N260-E264 PolarHBondContact O-N 3.09Å; E261-E264 PolarHBondContact O-N 3.02Å; E264-N266 VanDerWaalsContact C-N 3.3Å; E264-N266 PolarHBondContact O-N 3.32Å; E264-R267 WeakPolarHBondContact O-CB 3.44Å; E264-R267 PolarHBondContact O-N 3.08Å; E264-R267 IonicContact OE1-CZ 2.78Å; E264-R267 IonicContact OE1-NE 2.75Å; E264-R267 IonicContact OE1-NH2 2.75Å; E264-R267 PolarHBondContact OE1-NH2 3.49Å; E264-R267 IonicContact OE2-CZ 3.55Å; E264-R267 IonicContact OE2-NE 3.5Å; E264-R267 PolarHBondContact OE2-NE 2.96Å; E264-R267 IonicContact OE2-NH2 2.94Å; E264-R267 PolarHBondContact OE2-NH2 3.28Å; E264-Q268 WeakPolarHBondContact O-CG 3.02Å; E264-Q268 PolarHBondContact O-N 2.83Å; E264-Q268 PolarHBondContact OE1-NE2 3.28Å
265Q88.5Confident78.5Confident106 Ų106113.9 Ų113.950%0.49556%0.561SS.*Hα-helixtrans-61.2-39.4173.7-74.6-155.81.600112.4E261 Q268 K269E261-Q265 WeakPolarHBondContact O-CG 3.3Å; E261-Q265 PolarHBondContact O-N 3.19Å; Q265-Q268 PolarHBondContact O-N 2.99Å; Q265-K269 WeakPolarHBondContact O-CB 3.03Å; Q265-K269 PolarHBondContact O-N 3.31Å
266N88.1Confident77.5Confident79 Ų79110.7 Ų110.742%0.42255%0.551SS.*Hα-helixtrans-64.9-39.7174.8-79.3-57.9000112L262 Q263 E264 K269 M270L262-N266 PolarHBondContact O-N 2.81Å; L262-N266 VanDerWaalsContact O-N 3.11Å; L262-N266 PolarHBondContact O-ND2 3.05Å; Q263-N266 PolarHBondContact O-N 3.37Å; E264-N266 VanDerWaalsContact C-N 3.3Å; E264-N266 PolarHBondContact O-N 3.32Å; N266-K269 PolarHBondContact O-N 2.91Å; N266-M270 PolarHBondContact O-N 3.44Å
267R90.9Very high75.9Confident132 Ų132113 Ų11350%0.49856%0.563SS.*Hα-helixtrans-61.5-45.7175.5-169.4179.170.7127.55.1111.7Q263 E264 M270 Q271Q263-R267 PolarHBondContact O-N 3.38Å; E264-R267 WeakPolarHBondContact O-CB 3.44Å; E264-R267 PolarHBondContact O-N 3.08Å; E264-R267 IonicContact OE1-CZ 2.78Å; E264-R267 IonicContact OE1-NE 2.75Å; E264-R267 IonicContact OE1-NH2 2.75Å; E264-R267 PolarHBondContact OE1-NH2 3.49Å; E264-R267 IonicContact OE2-CZ 3.55Å; E264-R267 IonicContact OE2-NE 3.5Å; E264-R267 PolarHBondContact OE2-NE 2.96Å; E264-R267 IonicContact OE2-NH2 2.94Å; E264-R267 PolarHBondContact OE2-NH2 3.28Å; R267-M270 PolarHBondContact O-N 2.92Å; R267-Q271 PolarHBondContact O-N 2.87Å
268Q85.6Confident74.5Confident103 Ų103114.7 Ų114.748%0.48158%0.579SS.*Hα-helixtrans-65-38.8177.3-69.2-179.322.700112.3E264 Q265 M270 Q271 R272E264-Q268 WeakPolarHBondContact O-CG 3.02Å; E264-Q268 PolarHBondContact O-N 2.83Å; E264-Q268 PolarHBondContact OE1-NE2 3.28Å; Q265-Q268 PolarHBondContact O-N 2.99Å; Q268-M270 VanDerWaalsContact C-N 3.34Å; Q268-M270 PolarHBondContact O-N 2.8Å; Q268-Q271 PolarHBondContact O-N 2.88Å; Q268-R272 PolarHBondContact O-N 3.25Å
269K84.9Confident72.3Confident152 Ų152119.5 Ų119.566%0.66160%0.6SS**Hα-helixtrans-62.2-42176.1-167.2176.6179.6-176.50111.5Q265 N266 R272 V273Q265-K269 WeakPolarHBondContact O-CB 3.03Å; Q265-K269 PolarHBondContact O-N 3.31Å; N266-K269 PolarHBondContact O-N 2.91Å; K269-R272 PolarHBondContact O-N 3.25Å; K269-V273 WeakPolarHBondContact O-CG2 3.28Å; K269-V273 PolarHBondContact O-N 3.04Å
270M77.9Confident70Confident121 Ų121119.4 Ų119.460%0.59661%0.608SS**Hα-helixtrans-67.7-36.5176-74.6-172.4-83.200113.2N266 R267 Q268 R272 V273 N274N266-M270 PolarHBondContact O-N 3.44Å; R267-M270 PolarHBondContact O-N 2.92Å; Q268-M270 VanDerWaalsContact C-N 3.34Å; Q268-M270 PolarHBondContact O-N 2.8Å; M270-R272 VanDerWaalsContact C-N 3.34Å; M270-R272 PolarHBondContact O-N 2.94Å; M270-V273 PolarHBondContact O-N 3.11Å; M270-N274 PolarHBondContact O-ND2 3.04Å; M270-N274 VanDerWaalsContact O-ND2 3.12Å
271Q75.7Confident67.6Low116 Ų116119.4 Ų119.454%0.54262%0.617SS.*Hα-helixtrans-65.7-35.3176.7-75.5-179.611.800112.8R267 Q268 V273 N274R267-Q271 PolarHBondContact O-N 2.87Å; Q268-Q271 PolarHBondContact O-N 2.88Å; Q271-V273 VanDerWaalsContact C-N 3.34Å; Q271-V273 PolarHBondContact O-N 3.22Å; Q271-N274 PolarHBondContact O-N 2.83Å
272R66.9Low65.2Low212 Ų212119.9 Ų119.980%0.863%0.632SS**Hα-helixtrans-67.5-31.7175.5-75.5-159.9-172.3170.34.4113.7Q268 K269 M270 N274Q268-R272 PolarHBondContact O-N 3.25Å; K269-R272 PolarHBondContact O-N 3.25Å; M270-R272 VanDerWaalsContact C-N 3.34Å; M270-R272 PolarHBondContact O-N 2.94Å; R272-N274 VanDerWaalsContact C-N 3.25Å; R272-N274 PolarHBondContact O-N 3.26Å
273V66.8Low62.6Low101 Ų101123.2 Ų123.261%0.61265%0.65SS**Hα-helixtrans-68.2-27.8177.9175.90000111.5K269 M270 Q271 S276K269-V273 WeakPolarHBondContact O-CG2 3.28Å; K269-V273 PolarHBondContact O-N 3.04Å; M270-V273 PolarHBondContact O-N 3.11Å; Q271-V273 VanDerWaalsContact C-N 3.34Å; Q271-V273 PolarHBondContact O-N 3.22Å; V273-S276 PolarHBondContact O-OG 3.49Å
274N52.2Low59.9Low133 Ų133126.1 Ų126.171%0.71166%0.664SS**THydrogen-bonded Turntrans-83.5-7.9-176.3-75.6-54000115.4M270 Q271 R272M270-N274 PolarHBondContact O-ND2 3.04Å; M270-N274 VanDerWaalsContact O-ND2 3.12Å; Q271-N274 PolarHBondContact O-N 2.83Å; R272-N274 VanDerWaalsContact C-N 3.25Å; R272-N274 PolarHBondContact O-N 3.26Å
275Q51.6Low57.2Low185 Ų185128.5 Ų128.586%0.86469%0.686SS**THydrogen-bonded Turntrans-98.9-3.5176.1-75.5-165.9200114.8S277Q275-S277 PolarHBondContact O-N 3.18Å
276S42.9Very low54.7Low85 Ų85128.3 Ų128.359%0.59469%0.692SS**  trans-97.169174.552.50000111.5V273 P278V273-S276 PolarHBondContact O-OG 3.49Å; S276-P278 WeakPolarHBondContact O-CD 3.31Å
277S37.2Very low52.1Low108 Ų108131.5 Ų131.576%0.75571%0.709SS**  trans-107.691.8156.2-69.60000108.3Q275Q275-S277 PolarHBondContact O-N 3.18Å
278P43.4Very low49.4Very low117 Ų117131.2 Ų131.276%0.7672%0.722SS**PPolyproline II helixtrans-74.8129.3171.920.3-13.4000109.7S276S276-P278 WeakPolarHBondContact O-CD 3.31Å
279L35.6Very low47.1Very low161 Ų161131.7 Ų131.784%0.84373%0.732SS**PPolyproline II helixtrans-53.9143.4164.9-87.583.8000109.7S281L279-S281 PolarHBondContact O-N 3.46Å
280P38.5Very low44.5Very low124 Ų124131.9 Ų131.981%0.80574%0.74SS**PPolyproline II helixtrans-67.2118.6-174.327-32.6000110.5S282P280-S282 PolarHBondContact O-N 3.07Å
281S36.6Very low42.5Very low116 Ų116134.6 Ų134.681%0.81175%0.75SS**  trans-66.8100.2166.651.90000109.2L279 N283L279-S281 PolarHBondContact O-N 3.46Å; S281-N283 PolarHBondContact O-N 3.08Å
282S37.7Very low40.5Very low110 Ų110132.7 Ų132.777%0.76976%0.762SS**  trans-72.7113165.2-174.50000109.1P280 Q284P280-S282 PolarHBondContact O-N 3.07Å; S282-Q284 PolarHBondContact O-N 3.11Å
283N34.5Very low38.8Very low148 Ų148129.3 Ų129.379%0.79177%0.765SS**  trans-11.3104.2165.8-59.6-43.2000117.1S281S281-N283 PolarHBondContact O-N 3.08Å
284Q34.3Very low37.5Very low177 Ų177130.3 Ų130.383%0.82777%0.774SS**  trans-120.586.6141.2-81.5-166.320.500108.3S282 V286S282-Q284 PolarHBondContact O-N 3.11Å; Q284-V286 HydrophobicContact CB-CG2 4.26Å; Q284-V286 PolarHBondContact O-N 3.04Å
285C30.6Very low36.5Very low113 Ų113126.8 Ų126.876%0.76477%0.769SS**  trans-75.280.6166.8-1590000107.4N287C285-N287 PolarHBondContact O-N 3.27Å
286V37.4Very low35.8Very low102 Ų102124 Ų12462%0.61877%0.77SS**  trans-93.586.3169.4-165.40000107.2Q284 T288Q284-V286 HydrophobicContact CB-CG2 4.26Å; Q284-V286 PolarHBondContact O-N 3.04Å; V286-T288 PolarHBondContact O-N 3.02Å
287N32.9Very low35.3Very low146 Ų146123.1 Ų123.178%0.78178%0.775SS**  trans-54.5107.4159.9-77.7-14.3000108C285C285-N287 PolarHBondContact O-N 3.27Å
288T35.3Very low35.6Very low125 Ų125125.4 Ų125.477%0.76778%0.777SS**  trans-127.5118.4158.4-310000108.7V286V286-T288 PolarHBondContact O-N 3.02Å
289V36.5Very low35.3Very low114 Ų114127.1 Ų127.169%0.69178%0.78SS**  trans-61.5140.2-174.8170.50000111.1H291V289-H291 PolarHBondContact O-N 2.91Å
290N29.9Very low35.7Very low155 Ų155126.6 Ų126.683%0.82978%0.778SS**  trans-49.4118.2171.4-68.6-60.2000112.5
291H36.5Very low35.7Very low178 Ų178128.1 Ų128.182%0.82478%0.778SS**  trans-142.6118.9152.6-69.9-66.6000110V289V289-H291 PolarHBondContact O-N 2.91Å
292G32.7Very low36Very low76 Ų76131.9 Ų131.978%0.78480%0.804SS**  trans87.2107.7150.800000118.2
293T32.7Very low35.9Very low142 Ų142133 Ų13387%0.87181%0.806SS**  trans-65.6130147.3-51.40000108.3
294P37.9Very low36Very low121 Ų121132.2 Ų132.279%0.78681%0.807SS**  -136.4146.586.634.2-17.3000111.1
295G31.1Very low36.1Very low60 Ų60129.7 Ų129.762%0.61981%0.805SS**  107.51306400000108.9
296S37.8Very low36.4Very low126 Ų126130.6 Ų130.688%0.88181%0.808SS**  trans62.2116.516360.60000120.3
297G32.3Very low36.4Very low67 Ų67132.4 Ų132.469%0.69182%0.82SS**  96.888.5116.100000117.2
298L42.4Very low36.6Very low155 Ų155131.5 Ų131.581%0.81282%0.822SS**  trans-135.274.7143.8-64.9175.6000105.4L300L298-L300 VanDerWaalsContact C-N 3.29Å; L298-L300 HydrophobicContact CD2-CD1 3.99Å; L298-L300 HydrophobicContact CD2-CG 4.19Å
299D38.3Very low36.7Very low154 Ų154132 Ų13282%0.82483%0.826SS**  -36.49295.8-81.8-18.8000115.3
300L42.9Very low36.7Very low150 Ų150133.4 Ų133.479%0.78584%0.837SS**  trans-124.4101.5143.2-80.7174.5000107.9L298L298-L300 VanDerWaalsContact C-N 3.29Å; L298-L300 HydrophobicContact CD2-CD1 3.99Å; L298-L300 HydrophobicContact CD2-CG 4.19Å
301L39.8Very low37.3Very low156 Ų156131.6 Ų131.682%0.81784%0.837SS**  trans-47.2134.8165.9-70.5153.2000111.8
302S43.1Very low37.4Very low194 Ų194127.4 Ų127.4100%1.35784%0.839SS**  -137.50124.8-77.90000108.5

Retrieved 302 of 302 residues in 271 ms (Link to these results)