A0A077ZMQ8_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077ZMQ8, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 375 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
1M45.6Very low45.3Very low240 Ų240166.5 Ų166.5100%1.18288%0.877SS**  082.80-66.1173.4-172.300106.9
2K39.3Very low45.2Very low195 Ų195166.4 Ų166.485%0.84887%0.868SS**  55.511850.6-70.9-166.8179.2-1770113.6
3Q43.3Very low45.5Very low182 Ų182166.8 Ų166.885%0.8586%0.859SS**  trans78.7123.3166.1-64.9164.6-21.200114.9
4L53.3Low45.4Very low178 Ų178166.9 Ų166.993%0.93285%0.854SS**  -147.4125.863.3-78.5153.6000112.8
5L40.1Very low45.3Very low170 Ų170160.9 Ų160.989%0.8985%0.849SS**  trans-132.9150.5170.8-164.6139.4000105.9
6A47.1Very low45.5Very low81 Ų81160.5 Ų160.567%0.66985%0.847SS**  trans81143.4-176.100000113.5
7E46.6Very low45.6Very low188 Ų188159.5 Ų159.588%0.87984%0.836SS**  cis-179.714042.1-157.6162.6167.600108.2
8A50.2Low45.9Very low102 Ų102159.3 Ų159.384%0.84383%0.83SS**  trans176.978.8150.400000111.4
9R41.6Very low45.8Very low246 Ų246163 Ų16393%0.92883%0.832SS**  trans-125.5142.8152.3-81.3-173.1176-172.1-0.2107.1
10S42.5Very low45.8Very low108 Ų108158.7 Ų158.776%0.75583%0.829SS**  trans101.1111.5162.1-169.80000118.3
11T48.5Very low45.7Very low141 Ų141155.7 Ų155.787%0.86582%0.822SS**  trans-163.8101141.2270000106.3
12Q44.3Very low45.9Very low166 Ų166151.4 Ų151.478%0.77680%0.803SS**  68.7141.673.7-106.9-139.9-14.800117.6
13K48.8Very low46.3Very low172 Ų172150.7 Ų150.775%0.74880%0.802SS**  trans86.2148.1162.8-76.7-170.4163.9-175.20119.4
14E44.4Very low46.4Very low168 Ų168149.5 Ų149.579%0.78580%0.796SS**  cis176.3155.5-25.9-116.8-177.8163.500104.2
15G44.4Very low46.5Very low76 Ų76145.8 Ų145.878%0.78478%0.783SS**  trans130.493.216700000114.2
16L48.7Very low46.9Very low155 Ų155143.9 Ų143.981%0.81278%0.778SS**  102.9102.156.4-162.281.9000111.9
17E45.8Very low47Very low144 Ų144143.1 Ų143.167%0.67378%0.778SS**  trans81.1143.9134.3-69.5-165.3163.100127.7
18H51.1Low47Very low156 Ų156141.6 Ų141.672%0.72278%0.776SS**  trans95.7141.3146.2-74.3-12.8000119.1
19R45Very low46.7Very low229 Ų229141.6 Ų141.686%0.86477%0.77SS**  cis179.9135.3-18.2-168.7180-174-153.43106.7
20G44.6Very low46.9Very low76 Ų76137.3 Ų137.378%0.78476%0.764SS**  trans73.7156154.800000118.3
21S45.1Very low47.1Very low97 Ų97140.5 Ų140.568%0.67877%0.767SS**  cis175.2125.72.3164.30000109.1
22I48.9Very low46.9Very low150 Ų150138.4 Ų138.477%0.76976%0.756SS**  trans60.7121.6140.3-44.3163.1000120.2
23H48.8Very low46.6Very low179 Ų179134.7 Ų134.783%0.82975%0.754SS**  173.6128.3112.5-141.1-96.1000112.7
24E45.3Very low46.2Very low158 Ų158131.2 Ų131.274%0.73875%0.751SS**  trans-113.2-176.8161.5-98.4-81.1144.300106.4
25P54.3Low46.2Very low100 Ų100132.2 Ų132.265%0.64976%0.756SS**  cis-141.5-172.12.827-0.1000116.1
26T48.7Very low45.7Very low130 Ų130134.7 Ų134.780%0.79876%0.756SS**  trans105.7125.9138.7-350000118.6
27G50Low45.6Very low64 Ų64135.4 Ų135.466%0.6676%0.755SS**  trans147.178.4148.700000117.3
28D45.4Very low45.3Very low157 Ų157133.1 Ų133.184%0.8475%0.753SS**  trans46.1126.3138.8-54.4-27.5000122.2
29S44.9Very low44.5Very low101 Ų101133.8 Ų133.871%0.70676%0.761SS**  160121.192-150.60000113.9
30L46.4Very low44.4Very low156 Ų156127.2 Ų127.282%0.81776%0.755SS**  trans73.590144-61.4165.3000122.9
31Q45.5Very low44Very low175 Ų175135.5 Ų135.582%0.81876%0.763SS**  32.4163.6112.5-74.8-114.5-27.500122.6
32P44.4Very low43.6Very low97 Ų97135.7 Ų135.763%0.6377%0.765SS**  cis-147175.6-3941.7-23.4000116.4
33A39Very low43.4Very low88 Ų88135.7 Ų135.773%0.72777%0.765SS**  trans79.4129.2140.900000123.3
34S38.9Very low42.8Very low100 Ų100137.9 Ų137.970%0.69977%0.766SS**  trans85.8105.4151.981.60000117.5
35Q44.4Very low42.6Very low188 Ų188137 Ų13788%0.87977%0.767SS**  175128.299.3-88.5171.244.900111.1
36T35.3Very low41.8Very low128 Ų128142 Ų14279%0.78578%0.778SS**  trans-68131.1174.8-47.30000110.5
37E44.9Very low41.2Very low170 Ų170146.8 Ų146.879%0.79478%0.782SS**  trans-160.6127.5150.8-93.4-50.5123.600109.6
38P40.1Very low40.3Very low96 Ų96149.8 Ų149.862%0.62379%0.787SS**  trans-98.3138175.434.9-25.8000109.9
39L34.7Very low39.9Very low171 Ų171149.5 Ų149.590%0.89578%0.784SS**  trans-175.2140.5153.5-101.9151.5000114.5
40A42.1Very low39.6Very low90 Ų90150.5 Ų150.574%0.74479%0.785SS**  trans77.283.615600000118.8S42A40-S42 PolarHBondContact O-N 3.28Å; A40-S42 VanDerWaalsContact O-N 3.09Å
41R37.7Very low39.5Very low250 Ų250148.8 Ų148.894%0.94378%0.781SS**  trans-54.4109.6155.4-76.2175.6178.7152.40110.2L43R41-L43 PolarHBondContact O-N 3.25Å
42S36.8Very low39.5Very low102 Ų102146.2 Ų146.271%0.71378%0.78SS**  trans-65.495170.6-176.60000110.7A40 R44A40-S42 PolarHBondContact O-N 3.28Å; A40-S42 VanDerWaalsContact O-N 3.09Å; S42-R44 PolarHBondContact O-N 3.25Å; S42-R44 VanDerWaalsContact O-N 3.14Å
43L44.4Very low38.9Very low149 Ų149145.5 Ų145.578%0.7878%0.782SS**  trans-75.694166.4-74.5170.4000108.7R41 N45R41-L43 PolarHBondContact O-N 3.25Å; L43-N45 PolarHBondContact O-N 3.34Å
44R36.8Very low38.6Very low225 Ų225146.6 Ų146.685%0.84978%0.78SS**  trans-65.297.9170.2-69.5-176.5-149.6-132.72.1109.5S42 K46S42-R44 PolarHBondContact O-N 3.25Å; S42-R44 VanDerWaalsContact O-N 3.14Å; R44-K46 PolarHBondContact O-N 3.22Å
45N39.9Very low38.2Very low141 Ų141151.7 Ų151.775%0.75479%0.785SS**  trans-65.3100.8172.6-70-30.6000110.5L43 R47L43-N45 PolarHBondContact O-N 3.34Å; N45-R47 PolarHBondContact O-N 2.99Å
46K37.6Very low37.8Very low204 Ų204148.3 Ų148.389%0.88778%0.779SS**  trans-66.8112.2164.4-67.4176.2179.8176.20108R44R44-K46 PolarHBondContact O-N 3.22Å
47R36.6Very low37.6Very low230 Ų230151.6 Ų151.687%0.86878%0.777SS**  trans-91.4117.3173.5-69.2-175.7176.6-133.40109.3N45N45-R47 PolarHBondContact O-N 2.99Å
48V31.4Very low37.1Very low127 Ų127152.1 Ų152.177%0.7779%0.785SS**  trans-88120.4170173.40000107.6V50V48-V50 HydrophobicContact CG1-CG2 3.97Å
49I36Very low36.8Very low152 Ų152154.3 Ų154.378%0.77980%0.796SS**  trans-94.9112.1175.6-60.2173.3000106.9
50V38.2Very low36.6Very low122 Ų122154 Ų15474%0.73979%0.79SS**  trans-102.5116.8171.6-177.70000108V48 P52V48-V50 HydrophobicContact CG1-CG2 3.97Å; V50-P52 VanDerWaalsContact O-CD 3.24Å; V50-P52 WeakPolarHBondContact O-CD 3.27Å
51T44.6Very low36.1Very low119 Ų119157.4 Ų157.473%0.7379%0.788SS**  trans-86.2109.9175.3-45.40000108.7A53T51-A53 PolarHBondContact O-N 3.28Å
52P46.4Very low35.8Very low121 Ų121153.6 Ų153.679%0.78679%0.786SS**  trans-71.7104168.527.9-30.6000108.5V50V50-P52 VanDerWaalsContact O-CD 3.24Å; V50-P52 WeakPolarHBondContact O-CD 3.27Å
53A31.5Very low35.6Very low83 Ų83157.8 Ų157.869%0.68679%0.794SS**  trans-65.5156.9159.500000109.3T51T51-A53 PolarHBondContact O-N 3.28Å
54V33.5Very low34.9Very low111 Ų111158.9 Ų158.967%0.67379%0.793SS**  trans91.5104.5171.6-164.50000115.1
55Y29.6Very low34.4Very low206 Ų206154.2 Ų154.281%0.80879%0.785SS**  -177.696.9115-98.6-72.5000111
56P35Very low33.9Very low117 Ų117154.4 Ų154.476%0.7678%0.784SS**  trans-100.374.8166.535.3-25.4000109.7
57R32.3Very low33.6Very low197 Ų197152.4 Ų152.474%0.74378%0.778SS**  trans-143.713.3176-71.9-158.3173.2-160.4-2.1117.4V59R57-V59 VanDerWaalsContact C-N 3.29Å; R57-V59 PolarHBondContact O-N 3.02Å
58L33.6Very low33.3Very low182 Ų182146 Ų14695%0.95377%0.768SS**THydrogen-bonded Turntrans-89.533.6179.5-65.7174.9000114.4
59V33.4Very low33.4Very low141 Ų141146.4 Ų146.486%0.85577%0.771SS**THydrogen-bonded Turntrans-108.1-7.8-179.8163.30000113.8R57R57-V59 VanDerWaalsContact C-N 3.29Å; R57-V59 PolarHBondContact O-N 3.02Å
60E31.5Very low33Very low165 Ų165143 Ų14377%0.77177%0.774SS**SBendtrans-117.71.7-168-82.6176.8156.800117.4
61F30.5Very low32.7Very low162 Ų162146.2 Ų146.271%0.71178%0.781SS**  trans-117.115-172-69.6-75.9000116.8
62L32.8Very low32.3Very low170 Ų170150.7 Ų150.789%0.8979%0.79SS**  trans-107.443.4177-114.881.9000113.6
63H32.3Very low31.9Very low189 Ų189149.9 Ų149.988%0.87579%0.787SS**  trans-101.760.9159.6-162.3-101.4000108.8
64F28.9Very low31.8Very low173 Ų173153.8 Ų153.876%0.75979%0.791SS**  trans-90.5121.5164.8-82.8-80.9000108.2I66F64-I66 VanDerWaalsContact C-N 3.31Å; F64-I66 PolarHBondContact O-N 3.37Å
65D26.7Very low31.8Very low127 Ų127154 Ų15468%0.67980%0.796SS**  trans-6084.9177.4-17223.6000110.1Q67D65-Q67 PolarHBondContact O-N 3.48Å
66I29.8Very low31.8Very low145 Ų145149 Ų14974%0.74479%0.787SS**  trans-78.587.1165.3-53.3175.6000105.1F64 S68F64-I66 VanDerWaalsContact C-N 3.31Å; F64-I66 PolarHBondContact O-N 3.37Å; I66-S68 PolarHBondContact O-N 3.29Å
67Q31.3Very low31.5Very low161 Ų161149.6 Ų149.675%0.75278%0.784SS**  trans-62.374.1159.3-69.6-171.3-12.600108.3D65 T69D65-Q67 PolarHBondContact O-N 3.48Å; Q67-T69 PolarHBondContact O-N 2.8Å; Q67-T69 VanDerWaalsContact O-N 3.14Å
68S29.9Very low31.5Very low95 Ų95144.6 Ų144.666%0.66478%0.775SS**  trans-68.6111.6168.169.10000106.6I66 G70I66-S68 PolarHBondContact O-N 3.29Å; S68-G70 PolarHBondContact O-N 3.21Å; S68-G70 VanDerWaalsContact O-N 3.12Å
69T34.7Very low31.4Very low137 Ų137141.6 Ų141.684%0.8476%0.76SS**  trans-53.6117.116744.60000107.5Q67 Q71Q67-T69 PolarHBondContact O-N 2.8Å; Q67-T69 VanDerWaalsContact O-N 3.14Å; T69-Q71 PolarHBondContact O-N 3.43Å
70G27.5Very low31.4Very low81 Ų81143.7 Ų143.784%0.83576%0.76SS**  trans-64.694-170.300000112.7S68S68-G70 PolarHBondContact O-N 3.21Å; S68-G70 VanDerWaalsContact O-N 3.12Å
71Q30.5Very low31.4Very low189 Ų189146.3 Ų146.388%0.88376%0.763SS**  trans-104101.9154.8-113.6-172.8200108.4T69 S73T69-Q71 PolarHBondContact O-N 3.43Å; Q71-S73 PolarHBondContact O-N 3.44Å; Q71-S73 VanDerWaalsContact O-N 3.16Å
72K36.5Very low31.5Very low212 Ų212144.5 Ų144.592%0.92277%0.767SS**  trans-63.2108.1170.4-94.5171.21621750108.9
73S38.7Very low31.6Very low104 Ų104140.7 Ų140.773%0.72776%0.755SS**  trans-79.9132.2159.456.40000109Q71 C75Q71-S73 PolarHBondContact O-N 3.44Å; Q71-S73 VanDerWaalsContact O-N 3.16Å; S73-C75 PolarHBondContact O-N 3.19Å
74H28.7Very low31.6Very low166 Ų166138.9 Ų138.977%0.76975%0.747SS**  trans-73.1105.5-178.7-173.3-59.5000109.6V76H74-V76 WeakPolarHBondContact ND1-CG2 3.32Å; H74-V76 PolarHBondContact O-N 3.09Å
75C34.4Very low31.5Very low115 Ų115135.9 Ų135.978%0.77775%0.746SS**  trans-70.499.4168.9-570000108.8S73 N77S73-C75 PolarHBondContact O-N 3.19Å; C75-N77 PolarHBondContact O-N 3.09Å
76V29.9Very low31.7Very low101 Ų101137 Ų13761%0.61275%0.746SS**  trans-75.4106.5162.4178.40000106.9H74 T78H74-V76 WeakPolarHBondContact ND1-CG2 3.32Å; H74-V76 PolarHBondContact O-N 3.09Å; V76-T78 HydrophobicContact CG1-CG2 4.23Å; V76-T78 PolarHBondContact O-N 3.39Å
77N28.7Very low31.6Very low130 Ų130135.4 Ų135.470%0.69574%0.742SS**  trans-72.389.7172.4-168.424.9000108.5C75C75-N77 PolarHBondContact O-N 3.09Å
78T32.2Very low31.5Very low91 Ų91133.6 Ų133.656%0.55874%0.737SS**  trans-91.5102.4161.141.70000107.9V76 H80V76-T78 HydrophobicContact CG1-CG2 4.23Å; V76-T78 PolarHBondContact O-N 3.39Å; T78-H80 PolarHBondContact O-N 3.2Å
79D31.3Very low31.5Very low120 Ų120135.4 Ų135.464%0.64274%0.738SS**THydrogen-bonded Turntrans-47.6132.4168.8-62.2-54.1000109.8
80H31.9Very low31.3Very low185 Ų185135 Ų13586%0.85673%0.729SS**THydrogen-bonded Turntrans74.346.5171.6-48.9-47000118.4T78T78-H80 PolarHBondContact O-N 3.2Å
81R32.8Very low31.3Very low219 Ų219137.8 Ų137.883%0.82672%0.72SS**SBendtrans-168.9145.5149.5-115176.9153.5-157.9-7.2111.1S83R81-S83 PolarHBondContact O-N 3.33Å
82P33.2Very low31.2Very low124 Ų124133.5 Ų133.581%0.80571%0.711SS**  trans-60.5114.1172.424.4-30.3000108.5
83S33.1Very low31Very low91 Ų91130.9 Ų130.964%0.63671%0.707SS**  trans-62.1132.4176.644.20000109.5R81 C85R81-S83 PolarHBondContact O-N 3.33Å; S83-C85 PolarHBondContact O-N 3.15Å
84Q33.8Very low30.6Very low150 Ų150128.1 Ų128.170%0.70169%0.688SS**  trans-68.1116.3170.3-71.6172.8-1400107.9F86Q84-F86 HydrophobicContact CB-CE2 4.16Å; Q84-F86 HydrophobicContact CB-CZ 4.25Å
85C27.1Very low30.7Very low110 Ų110126.2 Ų126.274%0.74369%0.693SS**  trans-86.8112.6168.7-630000108.3S83S83-C85 PolarHBondContact O-N 3.15Å
86F29.6Very low30.5Very low152 Ų152124 Ų12467%0.66768%0.679SS**  trans-82.6127.3166.1-59-82.2000108.2Q84Q84-F86 HydrophobicContact CB-CE2 4.16Å; Q84-F86 HydrophobicContact CB-CZ 4.25Å
87V28.3Very low30.4Very low111 Ų111125.4 Ų125.467%0.67369%0.69SS**  trans-113.4117.9174.8-1780000107.6I89V87-I89 HydrophobicContact CG1-CG1 4.4Å; V87-I89 PolarHBondContact O-N 3.32Å
88L29.1Very low30.4Very low122 Ų122123.1 Ų123.164%0.63968%0.683SS**  trans-81.8111.3172.1-175.266.5000108.2I90L88-I90 HydrophobicContact CD2-CD1 4.1Å; L88-I90 HydrophobicContact CD2-CG1 4.14Å; L88-I90 HydrophobicContact CG-CG1 4.04Å
89I30.4Very low30.2Very low133 Ų133126.5 Ų126.568%0.68269%0.692SS**  trans-93.2110.7172-57.9173000106.7V87V87-I89 HydrophobicContact CG1-CG1 4.4Å; V87-I89 PolarHBondContact O-N 3.32Å
90I30.3Very low30.2Very low128 Ų128129.8 Ų129.866%0.65670%0.695SS**  trans-95.8108.8170.7-57.1178.7000107.2L88 S92L88-I90 HydrophobicContact CD2-CD1 4.1Å; L88-I90 HydrophobicContact CD2-CG1 4.14Å; L88-I90 HydrophobicContact CG-CG1 4.04Å; I90-S92 PolarHBondContact O-N 3.32Å
91Q28Very low30.2Very low141 Ų141128.1 Ų128.166%0.65969%0.692SS**  trans-77.9107.6172.5-161.6175.2-16.200107.6D93Q91-D93 VanDerWaalsContact C-N 3.31Å; Q91-D93 PolarHBondContact O-N 3.12Å
92S27.9Very low30.1Very low98 Ų98123.9 Ų123.969%0.68568%0.68SS**THydrogen-bonded Turntrans-80.6-5.6-168.5-58.70000114.7I90I90-S92 PolarHBondContact O-N 3.32Å
93D31.4Very low29.9Very low158 Ų158124.9 Ų124.985%0.84568%0.678SS**THydrogen-bonded Turntrans-133.225.6-172-55.1-51.7000114.4Q91Q91-D93 VanDerWaalsContact C-N 3.31Å; Q91-D93 PolarHBondContact O-N 3.12Å
94S30.4Very low30Very low45 Ų45126 Ų12632%0.31569%0.693SS.*  trans-111.2126.5170.4162.30000108.9C96S94-C96 PolarHBondContact O-N 3.35Å; S94-C96 PolarHBondContact OG-N 3.09Å; S94-C96 PolarHBondContact OG-O 3.49Å; S94-C96 VanDerWaalsContact OG-O 3.09Å
95S31.7Very low29.9Very low127 Ų127121.8 Ų121.889%0.88869%0.69SS**SBendtrans-65.415.3174.168.50000113.9
96C28.6Very low30.1Very low69 Ų69128.5 Ų128.547%0.46670%0.699SS.*SBendtrans-137.4117.6-174.9-51.20000109.1S94 C98S94-C96 PolarHBondContact O-N 3.35Å; S94-C96 PolarHBondContact OG-N 3.09Å; S94-C96 PolarHBondContact OG-O 3.49Å; S94-C96 VanDerWaalsContact OG-O 3.09Å; C96-C98 PolarHBondContact O-N 2.84Å; C96-C98 VanDerWaalsContact O-N 3.09Å
97P27.9Very low30.2Very low130 Ų130127.5 Ų127.584%0.84471%0.712SS**  trans-7891.1174.129.7-29.9000109.9
98C28.8Very low30.3Very low82 Ų82125.3 Ų125.355%0.55471%0.711SS**  trans-93.894.4173.8-58.10000109.9C96 R100C96-C98 PolarHBondContact O-N 2.84Å; C96-C98 VanDerWaalsContact O-N 3.09Å; C98-R100 PolarHBondContact O-N 2.85Å; C98-R100 VanDerWaalsContact O-N 3.12Å
99H29.8Very low30.3Very low162 Ų162126.2 Ų126.275%0.7572%0.716SS**  trans-66105.7167-104.2-117000109.6
100R31.2Very low30.5Very low189 Ų189125.2 Ų125.271%0.71372%0.721SS**  trans-105.3109.4164.2-79-168.2-162.9166.16.4110.2C98 F102C98-R100 PolarHBondContact O-N 2.85Å; C98-R100 VanDerWaalsContact O-N 3.12Å; R100-F102 HydrophobicContact CB-CD2 4.06Å; R100-F102 HydrophobicContact CB-CE2 3.64Å; R100-F102 HydrophobicContact CB-CZ 4.41Å; R100-F102 HydrophobicContact CG-CE2 4.28Å
101L30.3Very low30.5Very low150 Ų150131.1 Ų131.179%0.78574%0.735SS**  trans-76.2116.5165.2-76.8157.9000108.8
102F31.5Very low30.6Very low130 Ų130129 Ų12957%0.5774%0.742SS**  trans-107118.5169.6-77.1-80000110.1R100 A104R100-F102 HydrophobicContact CB-CD2 4.06Å; R100-F102 HydrophobicContact CB-CE2 3.64Å; R100-F102 HydrophobicContact CB-CZ 4.41Å; R100-F102 HydrophobicContact CG-CE2 4.28Å; F102-A104 PolarHBondContact O-N 3.34Å
103N29.7Very low30.8Very low145 Ų145127.9 Ų127.978%0.77575%0.746SS**  trans-78.3104.3167.1-84.7-41.4000109.2G105N103-G105 PolarHBondContact O-N 3.36Å
104A34Very low30.8Very low114 Ų114129.9 Ų129.994%0.94275%0.75SS**  trans-79.574.9167.600000109.7F102F102-A104 PolarHBondContact O-N 3.34Å
105G31.4Very low30.7Very low61 Ų61131.3 Ų131.363%0.62976%0.764SS**SBendtrans-152107.9177.800000111.8N103N103-G105 PolarHBondContact O-N 3.36Å
106R32.4Very low30.7Very low251 Ų251133.1 Ų133.195%0.94776%0.758SS**  trans53.588.7172-80.6-178.4155.9-150.5-4.5116.2G108R106-G108 PolarHBondContact O-N 2.91Å
107S31Very low30.7Very low132 Ų132136.5 Ų136.592%0.92378%0.777SS**  trans-77.178.2151.257.10000109.1
108G30.8Very low30.7Very low64 Ų64135.3 Ų135.366%0.6678%0.778SS**  trans-100.3111.3160.700000107.4R106 S110R106-G108 PolarHBondContact O-N 2.91Å; G108-S110 PolarHBondContact O-N 3.4Å
109L29.6Very low30.9Very low141 Ų141137.9 Ų137.974%0.73878%0.782SS**  trans-55119.1178.3-73.1148.1000110.4F205L109-F205 HydrophobicContact CD1-CD2 4.34Å; L109-F205 HydrophobicContact CD1-CE1 3.69Å; L109-F205 HydrophobicContact CD1-CE2 3.41Å; L109-F205 VanDerWaalsContact CD1-CE2 3.41Å; L109-F205 HydrophobicContact CD1-CZ 3.05Å; L109-F205 HydrophobicContact CG-CZ 4.48Å
110S33.2Very low31Very low113 Ų113137.1 Ų137.179%0.7979%0.788SS**  trans-128.3128.3151.8-172.20000108.7G108 A112G108-S110 PolarHBondContact O-N 3.4Å; S110-A112 PolarHBondContact O-N 2.94Å
111R30.7Very low31Very low251 Ų251135 Ų13595%0.94780%0.796SS**SBendtrans-7386.4-173.5-169.5-179.4-173.1-154.72.5108.8
112A31.1Very low31.1Very low98 Ų98138 Ų13881%0.8180%0.797SS**  trans-159.783.5167.600000108.6S110S110-A112 PolarHBondContact O-N 2.94Å
113G32.1Very low31.3Very low74 Ų74136.7 Ų136.776%0.76381%0.81SS**  trans178.121.6-177.600000115
114Q30.4Very low31.4Very low200 Ų200138.8 Ų138.894%0.93582%0.815SS**  trans-86.699.5155.1-81.2-175.6-72.700106
115A27.7Very low31.3Very low74 Ų74137.8 Ų137.861%0.61281%0.806SS**  trans157.351.815200000112.9
116H31.9Very low31.4Very low166 Ų166140.2 Ų140.277%0.76981%0.814SS**  trans-14454160.2-64.3-72.2000111
117T28.6Very low31.4Very low139 Ų139136.5 Ų136.585%0.85381%0.812SS**SBendtrans-70.7126.3144.1430000106.4
118A29.5Very low31.7Very low105 Ų105136 Ų13687%0.86881%0.806SS**SBendtrans86.655-179.200000118
119E32.6Very low31.9Very low137 Ų137139.4 Ų139.464%0.6481%0.814SS**  trans-159.248150.7-145.9-169.2146.700114
120V31.1Very low32Very low145 Ų145137.8 Ų137.888%0.87982%0.82SS**SBendtrans-131.454.2168.5-172.20000108.8
121V32.4Very low32.3Very low146 Ų146136.7 Ų136.789%0.88582%0.818SS**SBendtrans-128.20.4176166.60000111.6
122R32.1Very low32.6Very low213 Ų213129.3 Ų129.380%0.80481%0.805SS**SBendtrans-11712.1-172.1-154.8174.9-82.8116.9-5.1116.7
123A34.4Very low33Very low101 Ų101132.8 Ų132.884%0.83581%0.805SS**SBendtrans-117.68.717800000115
124Q32.9Very low33.1Very low190 Ų190138 Ų13889%0.88881%0.809SS**SBendtrans-111.564.1175.9-67.1-171.4-800110.5
125A30.4Very low33.1Very low92 Ų92132.8 Ų132.876%0.7680%0.8SS**  trans-162.458.8176.400000112.1
126S34.3Very low33.6Very low113 Ų113135.4 Ų135.479%0.7981%0.811SS**  trans179.189.9161.346.40000110.2
127L33.5Very low33.7Very low173 Ų173138.9 Ų138.991%0.90682%0.817SS**  trans-163.4117.8151.2-101152.4000107.6
128P36Very low34.1Very low122 Ų122140.7 Ų140.779%0.79282%0.821SS**  trans-83.4142.9-170.931.7-32.6000112.6A130P128-A130 PolarHBondContact O-N 3.48Å
129T34.5Very low34.4Very low135 Ų135147.3 Ų147.383%0.82882%0.823SS**  trans-61.7120.8167.7-54.20000110.3A131T129-A131 PolarHBondContact O-N 2.87Å
130A33.7Very low34.8Very low106 Ų106147.9 Ų147.988%0.87684%0.836SS**  trans-78.6103.7168.800000109.1P128P128-A130 PolarHBondContact O-N 3.48Å
131A38.4Very low35.2Very low90 Ų90145.2 Ų145.274%0.74483%0.829SS**  trans-98.7153.7165.200000109.9T129T129-A131 PolarHBondContact O-N 2.87Å
132S37.5Very low35.5Very low96 Ų96144.6 Ų144.667%0.67182%0.82SS**  trans-34.1152.8173.9-1630000117.1
133E38.5Very low36.1Very low171 Ų171141.4 Ų141.480%0.79983%0.825SS**  trans91.2136.9144.1-97157126.400122.6
134E34.9Very low36.5Very low185 Ų185145.9 Ų145.986%0.86482%0.82SS**  trans74114.2159.6-91.7-169.9114.500121.7
135A30.3Very low37Very low89 Ų89145.4 Ų145.474%0.73682%0.818SS**  trans-75.6155.1160.600000110.9
136P38.2Very low37.6Very low129 Ų129148.5 Ų148.584%0.83882%0.816SS**  -146.9160.4104.927.3-6.4000115.6
137R33.5Very low38.2Very low239 Ų239151.4 Ų151.490%0.90281%0.81SS**  trans-80.7137-176.9-62.9177162178.5-4.1112.9
138L37.4Very low38.7Very low178 Ų178153.1 Ų153.193%0.93280%0.804SS**  trans-146129.6154.4-79.7175.9000111
139R35.8Very low39.1Very low244 Ų244151.2 Ų151.292%0.92181%0.807SS**  trans-111.6135169.6-77-161.9177.4173.30.7108.9
140V41.7Very low39.7Very low149 Ų149149.7 Ų149.790%0.90381%0.808SS**  trans-147.6139.2158.3-179.70000108.8
141A39Very low40.4Very low89 Ų89152.2 Ų152.274%0.73681%0.807SS**  trans-108.9163-177.200000112.4
142D39.3Very low41.2Very low132 Ų132157.5 Ų157.571%0.70681%0.813SS**  trans76.7117.5147.5-147.211000119.8
143V44.8Very low42Very low147 Ų147158.7 Ų158.789%0.89182%0.819SS**  trans-150.9119.6145.9-179.50000110.1
144R41.2Very low42.3Very low195 Ų195162.4 Ų162.474%0.73683%0.825SS**  trans-89155.5175.3-79177170.3176-2.6113.1
145Q43.8Very low42.7Very low180 Ų180157.4 Ų157.484%0.84182%0.815SS**  trans69.3122.7148.6-75.9-170.461.200120.8
146Q44.1Very low43.5Very low156 Ų156164.6 Ų164.673%0.72982%0.823SS**  trans-161.4110.6140.5-154.4159-10500116
147R46.6Very low44Very low175 Ų175163.3 Ų163.366%0.6682%0.817SS**  trans66.5151139.9-63.1173.4-160.2-125.5-0.2120.1
148R44.3Very low44.8Very low209 Ų209163.4 Ų163.479%0.78982%0.818SS**  cis-177.8149.5-6.2-102.5172.9-170-153.80.4108.7
149G44.4Very low45.3Very low82 Ų82161 Ų16185%0.84581%0.813SS**  trans89.8142.6150.900000117.7
150A47.6Very low45.6Very low103 Ų103154.6 Ų154.685%0.85181%0.812SS**  cis-164160.21.300000110.3
151D47.6Very low45.7Very low158 Ų158151.4 Ų151.485%0.84581%0.809SS**  trans-55.7165.2-177.2-57.3-65.9000116.1
152K55.4Low46Very low201 Ų201155.5 Ų155.587%0.87481%0.813SS**  cis177.115544.6-149172.5-1711760110.7
153P53.8Low46.3Very low122 Ų122156.6 Ų156.679%0.79282%0.819SS**  trans-123.9157.817438.4-25.7000115.9
154R44.9Very low46.4Very low249 Ų249153.9 Ų153.994%0.9481%0.812SS**  trans-172.9126153.6-121.7-175.6175.1-169.7-0.9117.6
155A43.7Very low46.9Very low79 Ų79150.8 Ų150.865%0.65382%0.815SS**  75.6126.6128.200000126.1
156R46.8Very low46.9Very low241 Ų241148.3 Ų148.391%0.90982%0.815SS**  trans71.3142139.1-74.4-179.9179-148-0.9117.6
157S49Very low47Very low101 Ų101144.2 Ų144.271%0.70681%0.814SS**  cis-174.3151.319.616.60000112.7
158R48.8Very low47.1Very low241 Ų241145.7 Ų145.791%0.90983%0.825SS**  trans73.9132.9147.6-72178.6112.9143.32.5123.3
159P48.4Very low47Very low128 Ų128147 Ų14783%0.83183%0.83SS**  trans-116.6-179.9158.239.7-26.5000113.8
160A42.9Very low46.9Very low110 Ų110148.1 Ų148.191%0.90983%0.825SS**  trans111.8129.1162.600000117.3
161G44.4Very low46.9Very low82 Ų82147.9 Ų147.985%0.84582%0.817SS**  trans165.688.9171.500000113.3
162E44Very low47.1Very low174 Ų174145 Ų14581%0.81381%0.81SS**  trans-66.7152.5168.4-65.6160128.800111.6
163N46.9Very low46.6Very low156 Ų156142.5 Ų142.583%0.83481%0.806SS**  161.9121.3125.6-79.4-34.9000114.2
164A46.2Very low46.1Very low89 Ų89147.4 Ų147.474%0.73681%0.808SS**  63.3122128.800000122.4
165T50.5Low45.9Very low131 Ų131144.3 Ų144.380%0.80480%0.804SS**  123.4118.5124.6-31.30000115
166P44Very low45.6Very low128 Ų128146.3 Ų146.383%0.83181%0.814SS**  trans-98.5151.2175.636.8-29.2000112.2
167G47Very low45.3Very low69 Ų69138.9 Ų138.971%0.71180%0.804SS**  trans-173.4129.4172.700000115.1
168K48.8Very low44.9Very low206 Ų206140.6 Ų140.690%0.89681%0.811SS**  trans75.6143.5162.1-54.4-179.7-178.8-1780115.8
169R42.1Very low44.6Very low236 Ų236133.5 Ų133.589%0.89180%0.803SS**  cis-177138.2-26.3-120.2-179.3-171.1179.52.4102.3
170S42.2Very low44.3Very low106 Ų106132.6 Ų132.674%0.74180%0.797SS**  trans76.6121.8146.8-145.10000120.9
171S47.2Very low44Very low99 Ų99134.3 Ų134.369%0.69279%0.791SS**  trans85.9130.3130.9490000122
172S52.1Low43.7Very low98 Ų98136.2 Ų136.269%0.68579%0.787SS**  trans78.9106151.838.20000119.1
173D44Very low43.2Very low148 Ų148136 Ų13679%0.79179%0.79SS**  trans81.491132.9-53.3-32.2000119.6
174R43.9Very low42.6Very low225 Ų225139.7 Ų139.785%0.84979%0.792SS**  10.3125.1120.6-70.8-179.5179.2163.90.2113.9
175Q40.1Very low42Very low183 Ų183141 Ų14186%0.85580%0.796SS**  cis-165133.819.9-93.8155-18.300106.8
176S37.5Very low41.8Very low122 Ų122142.9 Ų142.985%0.85380%0.8SS**  trans-140.5162.5165-173.10000108.1
177A41.6Very low41.3Very low85 Ų85141.2 Ų141.270%0.70279%0.791SS**  trans88.7104.5-175.800000113.8
178T39.9Very low41.1Very low137 Ų137144.3 Ų144.384%0.8480%0.799SS**  69.1120.361.2-50.70000112.9
179A43.3Very low40.5Very low92 Ų92141.1 Ų141.176%0.7680%0.796SS**  trans96.6143.7155.600000119.7
180P42.2Very low40.1Very low108 Ų108133.4 Ų133.470%0.70179%0.791SS**  trans-112.4-176.9-147.739.3-25.1000113.6
181N36.4Very low39.7Very low146 Ų146134.4 Ų134.478%0.78180%0.797SS**  trans94.1114.3171.2-53.9-26.5000115.1
182T37.9Very low39Very low122 Ų122134.1 Ų134.175%0.74880%0.801SS**  156.6114.8104.2-51.20000108.6R184T182-R184 PolarHBondContact O-N 3.43Å
183L33.1Very low38.3Very low169 Ų169138.2 Ų138.289%0.88581%0.814SS**  trans12.5101.7156.1-75156.2000117.4
184R35.6Very low38Very low235 Ų235142.5 Ų142.589%0.88782%0.819SS**  trans-141.1100154-86.6-172160.6153.3-5.6110.8T182 I186T182-R184 PolarHBondContact O-N 3.43Å; R184-I186 PolarHBondContact O-N 3.18Å
185S33Very low37.9Very low117 Ų117136 Ų13682%0.81881%0.814SS**  trans24.397.7131160.10000116
186I46.8Very low37.7Very low170 Ų170133.7 Ų133.787%0.87281%0.807SS**  trans-136.6117155.3-56179.8000108.4R184R184-I186 PolarHBondContact O-N 3.18Å
187S33.3Very low38Very low92 Ų92133.2 Ų133.264%0.64380%0.801SS**  trans-57156.1-172.6-57.10000115.5T189S187-T189 PolarHBondContact O-N 2.92Å
188P42.4Very low37.7Very low135 Ų135134.4 Ų134.488%0.87780%0.803SS**SBendtrans-83.283.6-173.334.3-33.2000111.6
189T35.3Very low38Very low138 Ų138132.7 Ų132.785%0.84780%0.797SS**  trans-137.983.9169.9-45.90000108.9S187S187-T189 PolarHBondContact O-N 2.92Å
190G34.5Very low37.8Very low75 Ų75137.9 Ų137.977%0.77381%0.805SS**  trans-172.183.7-177.900000112.3A192G190-A192 PolarHBondContact O-N 3.45Å
191S32.7Very low37.8Very low126 Ų126136.2 Ų136.288%0.88181%0.808SS**  trans-61.6117.1170.545.70000111.9
192A32.6Very low38.3Very low93 Ų93135.3 Ų135.377%0.76981%0.808SS**  trans-14974.7159.100000109.9G190 R194G190-A192 PolarHBondContact O-N 3.45Å; A192-R194 PolarHBondContact O-N 2.87Å
193L38.6Very low38.6Very low184 Ų184133.7 Ų133.796%0.96379%0.794SS**  trans-64.784164.1-71.6172000108.7A195L193-A195 PolarHBondContact O-N 2.81Å
194R37.3Very low39.5Very low239 Ų239130.3 Ų130.390%0.90278%0.783SS**  trans-8394.2171.4-155179.2-172.8-118.92.6108A192 N196A192-R194 PolarHBondContact O-N 2.87Å; R194-N196 PolarHBondContact O-N 3.12Å
195A41.1Very low39.8Very low89 Ų89125.1 Ų125.174%0.73677%0.767SS**  trans-58.8131.9171.400000109.8L193 P197L193-A195 PolarHBondContact O-N 2.81Å; A195-P197 WeakPolarHBondContact O-CD 3.24Å
196N37.3Very low40.2Very low134 Ų134124.4 Ų124.472%0.71776%0.761SS**  trans-66.7117.3171.5179.528.9000109.4R194 C198R194-N196 PolarHBondContact O-N 3.12Å; N196-C198 PolarHBondContact O-N 3.14Å; N196-C198 VanDerWaalsContact O-N 3.14Å
197P42.6Very low39.7Very low111 Ų111127 Ų12772%0.72176%0.759SS**  trans-7997175.230.8-28.3000108.9A195 S199A195-P197 WeakPolarHBondContact O-CD 3.24Å; P197-S199 PolarHBondContact O-N 2.72Å; P197-S199 VanDerWaalsContact O-N 3.16Å
198C36.5Very low40.2Very low111 Ų111127 Ų12775%0.7575%0.752SS**  trans-71.3104.9159.3-66.20000107.1N196 E200N196-C198 PolarHBondContact O-N 3.14Å; N196-C198 VanDerWaalsContact O-N 3.14Å; C198-E200 PolarHBondContact O-N 3.07Å
199S45.5Very low40.2Very low101 Ų101124.5 Ų124.571%0.70674%0.736SS**  trans-62.6115176.9520000110.3P197 G201P197-S199 PolarHBondContact O-N 2.72Å; P197-S199 VanDerWaalsContact O-N 3.16Å; S199-G201 PolarHBondContact O-N 3.33Å
200E38.5Very low40.7Very low201 Ų201124.4 Ų124.494%0.93973%0.729SS**THydrogen-bonded Turntrans-50.594.4170.4-172.5164.8-164.300110.9C198C198-E200 PolarHBondContact O-N 3.07Å
201G43.4Very low41Very low73 Ų73124.6 Ų124.675%0.75372%0.719SS**THydrogen-bonded Turntrans174.8-13.8178.500000119.7S199S199-G201 PolarHBondContact O-N 3.33Å
202T47Very low41.5Very low127 Ų127121.2 Ų121.278%0.77970%0.698SS**SBendtrans-141.77.4-168.1-20.70000116.1P204T202-P204 WeakPolarHBondContact O-CD 3.29Å
203D42.8Very low42Very low87 Ų87122.9 Ų122.947%0.46569%0.694SS.*  trans-107107.7179.5-163.5-2000112F205 C206D203-F205 PolarHBondContact O-N 3.01Å; D203-F205 VanDerWaalsContact O-N 3.16Å; D203-F205 WeakPolarHBondContact OD1-CB 3.39Å; D203-F205 PolarHBondContact OD1-N 3.24Å; D203-F205 VanDerWaalsContact OD1-N 3.14Å; D203-C206 HydrophobicContact CB-CB 4.27Å; D203-C206 PolarHBondContact O-N 3.47Å; D203-C206 VanDerWaalsContact O-N 3.12Å; D203-C206 PolarHBondContact OD2-SG 2.98Å; D203-C206 VanDerWaalsContact OD2-SG 3.4Å
204P52.2Low42.1Very low98 Ų98122.4 Ų122.464%0.63668%0.684SS**G310 helixtrans-58.8-22.2175-20.431.5000113.2T202 C206T202-P204 WeakPolarHBondContact O-CD 3.29Å; P204-C206 VanDerWaalsContact C-N 3.32Å
205F42Very low42Very low126 Ų126117.2 Ų117.255%0.55367%0.674SS**G310 helixtrans-79.2-16.3180-72.3-82.8000113.4L109 D203L109-F205 HydrophobicContact CD1-CD2 4.34Å; L109-F205 HydrophobicContact CD1-CE1 3.69Å; L109-F205 HydrophobicContact CD1-CE2 3.41Å; L109-F205 VanDerWaalsContact CD1-CE2 3.41Å; L109-F205 HydrophobicContact CD1-CZ 3.05Å; L109-F205 HydrophobicContact CG-CZ 4.48Å; D203-F205 PolarHBondContact O-N 3.01Å; D203-F205 VanDerWaalsContact O-N 3.16Å; D203-F205 WeakPolarHBondContact OD1-CB 3.39Å; D203-F205 PolarHBondContact OD1-N 3.24Å; D203-F205 VanDerWaalsContact OD1-N 3.14Å
206C42Very low41.8Very low103 Ų103121.6 Ų121.670%0.69667%0.672SS**G310 helixtrans-91.63179-63.70000113.7D203 P204D203-C206 HydrophobicContact CB-CB 4.27Å; D203-C206 PolarHBondContact O-N 3.47Å; D203-C206 VanDerWaalsContact O-N 3.12Å; D203-C206 PolarHBondContact OD2-SG 2.98Å; D203-C206 VanDerWaalsContact OD2-SG 3.4Å; P204-C206 VanDerWaalsContact C-N 3.32Å
207R37.4Very low41.9Very low223 Ų223120.1 Ų120.184%0.84267%0.67SS**G310 helixtrans-117.98.7175.4-75.6-154.2173.9-171.10.7114.8P209R207-P209 WeakPolarHBondContact O-CD 3.35Å; R207-P209 VanDerWaalsContact O-N 3.15Å
208L43.8Very low41.9Very low93 Ų93120.8 Ų120.849%0.48766%0.663SS.*  trans-70.7110.4169-92.1109.4000109L210 A212L208-L210 PolarHBondContact O-N 3.44Å; L208-L210 VanDerWaalsContact O-N 3.13Å; L208-A212 HydrophobicContact CD2-CB 4.46Å
209P41.4Very low42.2Very low83 Ų83118.8 Ų118.854%0.53966%0.655SS.*  trans-58.6124.916726.8-32.1000106.5R207 S211 A212R207-P209 WeakPolarHBondContact O-CD 3.35Å; R207-P209 VanDerWaalsContact O-N 3.15Å; P209-S211 PolarHBondContact O-N 2.98Å; P209-A212 PolarHBondContact O-N 3.5Å
210L45.1Very low42.1Very low136 Ų136118.9 Ų118.971%0.71265%0.651SS**G310 helixtrans-45.4-23.9175.6-78.6157.9000112.5L208 A212 L213 F214L208-L210 PolarHBondContact O-N 3.44Å; L208-L210 VanDerWaalsContact O-N 3.13Å; L210-A212 VanDerWaalsContact C-N 3.26Å; L210-A212 PolarHBondContact O-N 3.43Å; L210-L213 PolarHBondContact O-N 2.66Å; L210-F214 WeakPolarHBondContact O-CD2 3.36Å
211S40.5Very low42.7Very low78 Ų78115.1 Ų115.155%0.54563%0.633SS.*G310 helixtrans-59.6-20.1173.5-39.90000116.2P209 N215P209-S211 PolarHBondContact O-N 2.98Å; S211-N215 PolarHBondContact O-ND2 3.35Å; S211-N215 VanDerWaalsContact O-ND2 3.16Å
212A43.2Very low43Very low55 Ų55116.4 Ų116.446%0.45562%0.622SS.*G310 helixtrans-82.1-20.9179.300000113.4L208 P209 L210L208-A212 HydrophobicContact CD2-CB 4.46Å; P209-A212 PolarHBondContact O-N 3.5Å; L210-A212 VanDerWaalsContact C-N 3.26Å; L210-A212 PolarHBondContact O-N 3.43Å
213L43.3Very low43.6Very low129 Ų129112.4 Ų112.468%0.67561%0.607SS**SBendtrans-91.7-10.5177.7-66.6172.7000113.1L210L210-L213 PolarHBondContact O-N 2.66Å
214F41.6Very low44Very low174 Ų174111.9 Ų111.976%0.76360%0.604SS**SBendtrans-114.86.4-176.1-75.7-82.3000114.7L210L210-F214 WeakPolarHBondContact O-CD2 3.36Å
215N34.7Very low43.9Very low130 Ų130112.8 Ų112.870%0.69560%0.603SS**  trans-121.121.7175.9-82.1-64000112.9S211 P217S211-N215 PolarHBondContact O-ND2 3.35Å; S211-N215 VanDerWaalsContact O-ND2 3.16Å; N215-P217 WeakPolarHBondContact O-CD 3.13Å
216W36.3Very low44.7Very low180 Ų180110.9 Ų110.968%0.68260%0.598SS**  trans-76.2110.3171.5-166.6-98.1000108.9E218W216-E218 VanDerWaalsContact CE2-OE2 3.29Å; W216-E218 HydrophobicContact CG-CB 4.43Å; W216-E218 WeakPolarHBondContact CZ2-OE2 3.33Å; W216-E218 PolarHBondContact NE1-OE2 2.88Å; W216-E218 PolarHBondContact O-N 3.16Å; W216-E218 VanDerWaalsContact O-N 3.09Å
217P39.8Very low45.4Very low104 Ų104113.9 Ų113.968%0.67559%0.594SS**G310 helixtrans-74.63.5-171.331.1-32.4000113.6N215 A219N215-P217 WeakPolarHBondContact O-CD 3.13Å; P217-A219 VanDerWaalsContact C-N 3.3Å; P217-A219 PolarHBondContact O-N 3.3Å
218E43.2Very low46Very low124 Ų124108.7 Ų108.758%0.57958%0.582SS**G310 helixtrans-85-0-174.1-148.2164.3-156.900113.9W216W216-E218 VanDerWaalsContact CE2-OE2 3.29Å; W216-E218 HydrophobicContact CG-CB 4.43Å; W216-E218 WeakPolarHBondContact CZ2-OE2 3.33Å; W216-E218 PolarHBondContact NE1-OE2 2.88Å; W216-E218 PolarHBondContact O-N 3.16Å; W216-E218 VanDerWaalsContact O-N 3.09Å
219A43Very low46.5Very low70 Ų70111 Ų11158%0.57959%0.585SS**G310 helixtrans-89.9-6.6177.900000114.5P217 H221 L222P217-A219 VanDerWaalsContact C-N 3.3Å; P217-A219 PolarHBondContact O-N 3.3Å; A219-H221 VanDerWaalsContact C-N 3.26Å; A219-H221 PolarHBondContact O-N 3.03Å; A219-L222 PolarHBondContact O-N 3.04Å
220V44.2Very low46.7Very low102 Ų102111.8 Ų111.862%0.61859%0.588SS**Hα-helixtrans-67.7-28.8176.4179.70000111.2
221H49.5Very low46.9Very low123 Ų123113.9 Ų113.957%0.56959%0.586SS**Hα-helixtrans-90.5-15.6-179.7-57.2-55.2000114.4A219 G223 D224 L225A219-H221 VanDerWaalsContact C-N 3.26Å; A219-H221 PolarHBondContact O-N 3.03Å; H221-G223 VanDerWaalsContact C-N 3.34Å; H221-D224 PolarHBondContact O-N 3.05Å; H221-L225 WeakPolarHBondContact O-CD1 3.19Å; H221-L225 PolarHBondContact O-N 3.39Å
222L49.6Very low47.1Very low99 Ų99112.2 Ų112.252%0.51858%0.577SS.*Hα-helixtrans-70.2-33.7174-101.477.4000112A219 D224 L225 L226A219-L222 PolarHBondContact O-N 3.04Å; L222-D224 VanDerWaalsContact C-N 3.3Å; L222-L225 PolarHBondContact O-N 3.09Å; L222-L226 PolarHBondContact O-N 3.44Å
223G60.6Low47Very low44 Ų44111.8 Ų111.845%0.45457%0.57SS.*Hα-helixtrans-62.3-39.9172.700000111.7H221 R227H221-G223 VanDerWaalsContact C-N 3.34Å; G223-R227 WeakPolarHBondContact O-CB 3.38Å; G223-R227 PolarHBondContact O-N 3.33Å
224D50.9Low46.9Very low76 Ų76110.5 Ų110.541%0.40657%0.568SS.*Hα-helixtrans-70.4-42176.8-66.2-27.7000111.7H221 L222 L226 R227 I228H221-D224 PolarHBondContact O-N 3.05Å; L222-D224 VanDerWaalsContact C-N 3.3Å; D224-L226 PolarHBondContact O-N 3.26Å; D224-R227 PolarHBondContact O-N 3.01Å; D224-I228 WeakPolarHBondContact O-CB 3.2Å; D224-I228 WeakPolarHBondContact O-CD1 3.22Å; D224-I228 WeakPolarHBondContact O-CG1 3.39Å; D224-I228 PolarHBondContact O-N 3.06Å
225L50.5Low47Very low117 Ų117109 Ų10961%0.61357%0.568SS**Hα-helixtrans-60.3-45.3175.2-101.674.1000112.4H221 L222 R227 I228 W229H221-L225 WeakPolarHBondContact O-CD1 3.19Å; H221-L225 PolarHBondContact O-N 3.39Å; L222-L225 PolarHBondContact O-N 3.09Å; L225-R227 VanDerWaalsContact C-N 3.35Å; L225-I228 PolarHBondContact O-N 3.19Å; L225-W229 WeakPolarHBondContact O-CB 3.4Å; L225-W229 PolarHBondContact O-N 3.06Å
226L59Low47.1Very low86 Ų86109.8 Ų109.845%0.4557%0.571SS.*Hα-helixtrans-67.8-35.2177-76.7166000111.8L222 D224 W229 V230L222-L226 PolarHBondContact O-N 3.44Å; D224-L226 PolarHBondContact O-N 3.26Å; L226-W229 PolarHBondContact O-N 3.09Å; L226-V230 WeakPolarHBondContact O-CB 3.49Å; L226-V230 WeakPolarHBondContact O-CG2 3.39Å; L226-V230 PolarHBondContact O-N 3.05Å
227R55.6Low47.1Very low165 Ų165111.3 Ų111.362%0.62358%0.579SS**Hα-helixtrans-72.1-36.2177.2-166.3175-173-175.71.6112.7G223 D224 L225 R231G223-R227 WeakPolarHBondContact O-CB 3.38Å; G223-R227 PolarHBondContact O-N 3.33Å; D224-R227 PolarHBondContact O-N 3.01Å; L225-R227 VanDerWaalsContact C-N 3.35Å; R227-R231 PolarHBondContact O-N 3.23Å
228I50.2Low46.8Very low115 Ų115109.2 Ų109.259%0.5958%0.576SS**Hα-helixtrans-67.3-40.7172.8-68.1162.2000109.7D224 L225 R231 A232D224-I228 WeakPolarHBondContact O-CB 3.2Å; D224-I228 WeakPolarHBondContact O-CD1 3.22Å; D224-I228 WeakPolarHBondContact O-CG1 3.39Å; D224-I228 PolarHBondContact O-N 3.06Å; L225-I228 PolarHBondContact O-N 3.19Å; I228-R231 PolarHBondContact O-N 3.4Å; I228-A232 VanDerWaalsContact O-CB 3.27Å; I228-A232 WeakPolarHBondContact O-CB 3.42Å; I228-A232 PolarHBondContact O-N 3.03Å
229W54Low46.4Very low141 Ų141112 Ų11253%0.53459%0.594SS.*Hα-helixtrans-74.9-34-179.8-166.935000113.8L225 L226 R231 A232 S233L225-W229 WeakPolarHBondContact O-CB 3.4Å; L225-W229 PolarHBondContact O-N 3.06Å; L226-W229 PolarHBondContact O-N 3.09Å; W229-R231 VanDerWaalsContact C-N 3.35Å; W229-A232 PolarHBondContact O-N 3.26Å; W229-S233 VanDerWaalsContact O-CB 3.29Å; W229-S233 WeakPolarHBondContact O-CB 3.24Å; W229-S233 PolarHBondContact O-N 3.16Å; W229-S233 PolarHBondContact O-OG 3.13Å
230V46.3Very low45.8Very low100 Ų100111.7 Ų111.761%0.60660%0.598SS**Hα-helixtrans-65.8-37.2171.91690000111.2L226 T234L226-V230 WeakPolarHBondContact O-CB 3.49Å; L226-V230 WeakPolarHBondContact O-CG2 3.39Å; L226-V230 PolarHBondContact O-N 3.05Å; V230-T234 PolarHBondContact O-OG1 3Å
231R48.3Very low45.1Very low180 Ų180116.8 Ų116.868%0.67961%0.612SS**Hα-helixtrans-74.3-32.1172.9-92-178.9160.6168-6.9113.7R227 I228 W229 T234R227-R231 PolarHBondContact O-N 3.23Å; I228-R231 PolarHBondContact O-N 3.4Å; W229-R231 VanDerWaalsContact C-N 3.35Å; R231-T234 PolarHBondContact O-OG1 2.89Å
232A44.8Very low44.4Very low42 Ų42117 Ų11735%0.34763%0.627SS.*Hα-helixtrans-74.2-35.2176.400000112.2I228 W229 T234 N235I228-A232 VanDerWaalsContact O-CB 3.27Å; I228-A232 WeakPolarHBondContact O-CB 3.42Å; I228-A232 PolarHBondContact O-N 3.03Å; W229-A232 PolarHBondContact O-N 3.26Å; A232-T234 VanDerWaalsContact C-N 3.26Å; A232-T234 PolarHBondContact O-N 3.14Å; A232-N235 PolarHBondContact O-N 3.12Å; A232-N235 VanDerWaalsContact O-N 3.09Å
233S41.7Very low44Very low46 Ų46123.7 Ų123.732%0.32265%0.645SS.*Hα-helixtrans-70.8-20.3179.5-62.90000113.4W229 N235 Y237W229-S233 VanDerWaalsContact O-CB 3.29Å; W229-S233 WeakPolarHBondContact O-CB 3.24Å; W229-S233 PolarHBondContact O-N 3.16Å; W229-S233 PolarHBondContact O-OG 3.13Å; S233-N235 VanDerWaalsContact C-N 3.34Å; S233-Y237 VanDerWaalsContact O-CD2 3.24Å; S233-Y237 WeakPolarHBondContact O-CD2 3Å; S233-Y237 VanDerWaalsContact O-CE2 3.32Å; S233-Y237 WeakPolarHBondContact O-CE2 3.36Å
234T41.9Very low42.5Very low103 Ų103128.2 Ų128.263%0.63266%0.664SS**THydrogen-bonded Turntrans-81.4-9.117142.10000114V230 R231 A232V230-T234 PolarHBondContact O-OG1 3Å; R231-T234 PolarHBondContact O-OG1 2.89Å; A232-T234 VanDerWaalsContact C-N 3.26Å; A232-T234 PolarHBondContact O-N 3.14Å
235N42.1Very low41.9Very low141 Ų141131.4 Ų131.475%0.75469%0.686SS**SBendtrans-110.16.4179.3-91.2-45.4000114.1A232 S233A232-N235 PolarHBondContact O-N 3.12Å; A232-N235 VanDerWaalsContact O-N 3.09Å; S233-N235 VanDerWaalsContact C-N 3.34Å
236L37.8Very low41.1Very low147 Ų147134.9 Ų134.977%0.7770%0.699SS**SBendtrans-107.78175.8-80.6157.9000113.8
237Y37.2Very low40Very low212 Ų212135.8 Ų135.883%0.83171%0.713SS**  trans-101.465.6166.6-66.1-81.8000109.6S233S233-Y237 VanDerWaalsContact O-CD2 3.24Å; S233-Y237 WeakPolarHBondContact O-CD2 3Å; S233-Y237 VanDerWaalsContact O-CE2 3.32Å; S233-Y237 WeakPolarHBondContact O-CE2 3.36Å
238G31.5Very low39.3Very low60 Ų60134.2 Ų134.262%0.61972%0.721SS**  trans-138.621.4-176.100000114
239L35Very low38.6Very low184 Ų184134.2 Ų134.296%0.96373%0.729SS**SBendtrans-155.2110.8171.6-90.6113.5000109.9
240G31.3Very low37.8Very low63 Ų63135.2 Ų135.265%0.64974%0.744SS**  trans116.152.5153.100000118.4
241F29.5Very low37.4Very low208 Ų208134.6 Ų134.691%0.91275%0.75SS**  trans-14463.4153-67.2-72000110.9R243F241-R243 PolarHBondContact O-N 3.25Å
242S34Very low36.9Very low128 Ų128133 Ų13390%0.89576%0.761SS**  trans-78.897.9167.7-72.60000109.3
243R40.9Very low36.7Very low240 Ų240134.4 Ų134.491%0.90678%0.779SS**  trans-77.5121.3157.8-67-171.2-177-149.71.3107.6F241 V245F241-R243 PolarHBondContact O-N 3.25Å; R243-V245 PolarHBondContact O-N 2.81Å
244T30.7Very low36Very low139 Ų139140.3 Ų140.385%0.85381%0.807SS**  trans-51.2120.6173.5-19.40000111.1
245V38Very low35.8Very low143 Ų143139.2 Ų139.287%0.86781%0.809SS**  trans-156133.2142.7132.60000108.5R243R243-V245 PolarHBondContact O-N 2.81Å
246E33.5Very low35.5Very low190 Ų190136.8 Ų136.889%0.88881%0.808SS**  trans-86.3119.6-166.4-175.6179.3-157.800110.3
247S36.5Very low35.2Very low104 Ų104139.7 Ų139.773%0.72782%0.815SS**  trans-169.7104.1144.267.20000112.2
248V40.2Very low34.9Very low132 Ų132135.9 Ų135.980%0.882%0.818SS**  trans64.8112.7145.7-166.10000119.1
249P35.9Very low35.1Very low116 Ų116136.1 Ų136.175%0.75382%0.82SS**  trans-92145171.836.1-28.5000111.1
250N36.3Very low35Very low161 Ų161134.6 Ų134.686%0.86181%0.813SS**  trans-138.1113.8159-109.9-18.6000110.9
251A37.5Very low35.3Very low88 Ų88140 Ų14073%0.72783%0.825SS**  trans21.8116.2154.200000118.7
252T38.8Very low35.8Very low147 Ų147136.1 Ų136.190%0.90282%0.818SS**  178.3118118.3-70.50000109.9
253G39.5Very low35.8Very low71 Ų71134.3 Ų134.373%0.73281%0.811SS**  trans74.181.1144.600000118.4A255G253-A255 PolarHBondContact O-N 3.16Å
254D28.7Very low35.3Very low169 Ų169131.4 Ų131.490%0.90481%0.811SS**  trans-60.1119.1155.2-168.28.4000109.7
255A37.3Very low35.5Very low81 Ų81130.5 Ų130.567%0.66981%0.81SS**  trans-136.410617100000109.1G253G253-A255 PolarHBondContact O-N 3.16Å
256A35.4Very low35.3Very low89 Ų89127 Ų12774%0.73680%0.804SS**  trans-46.3134176.500000114.1
257F32Very low35.2Very low209 Ų209126.5 Ų126.592%0.91780%0.801SS**  trans-13190.8155.3-85.6-81.3000109.4
258C30.7Very low35.1Very low132 Ų132127 Ų12789%0.89280%0.802SS**  trans-111.1116.4154.2-1690000105.4
259G35.8Very low34.7Very low64 Ų64124.3 Ų124.366%0.6680%0.801SS**  trans-165.4111.2-17700000110.2
260D32.3Very low34.6Very low153 Ų153124 Ų12482%0.81880%0.801SS**  trans-50.2131.6-175.9-59.3-58.7000114.5
261I36.9Very low35Very low175 Ų175120.4 Ų120.490%0.89779%0.789SS**  trans-98.886.8164.4-57.3179.7000107.6
262V40.1Very low34.7Very low128 Ų128123.1 Ų123.178%0.77679%0.792SS**  trans-87.5144.2163.2169.70000109.4
263A34.4Very low34.5Very low90 Ų90122.6 Ų122.674%0.74479%0.792SS**  trans-27.8139.3-171.900000119.6S265A263-S265 PolarHBondContact O-N 3.3Å; A263-S265 VanDerWaalsContact O-N 3.15Å
264I30.9Very low34.8Very low179 Ų179125.6 Ų125.692%0.91880%0.796SS**  trans-66101.6171.2-48.9165.8000109.3
265S34.9Very low35.2Very low119 Ų119123.4 Ų123.483%0.83279%0.791SS**  trans-145.398.3158.9-1800000107.2A263A263-S265 PolarHBondContact O-N 3.3Å; A263-S265 VanDerWaalsContact O-N 3.15Å
266G34.5Very low35.4Very low70 Ų70129 Ų12972%0.72280%0.796SS**  trans-13692.7-171.800000112.5
267Q30.8Very low35.7Very low180 Ų180132.2 Ų132.284%0.84180%0.796SS**  trans-159.3149.3150.1-87.9-68.5-79.300106
268P33.5Very low35.8Very low114 Ų114129.8 Ų129.874%0.7479%0.787SS**  cis-124.2171-3.134.2-15000112.7
269G32Very low36.4Very low76 Ų76131.1 Ų131.178%0.78478%0.778SS**  trans-70.7164.1-175.500000115.8
270S35.3Very low36.8Very low108 Ų108135.9 Ų135.976%0.75578%0.781SS**  trans174.3131.5140.6-179.10000108.7
271S42.8Very low37.1Very low87 Ų87133.5 Ų133.561%0.60877%0.772SS**  trans48.3139.1151.862.20000118.6
272D32.7Very low37.3Very low145 Ų145132.7 Ų132.778%0.77577%0.769SS**  cis176.9132.4-2.4-90.6-36.8000100.2
273C34.3Very low37.2Very low136 Ų136131.8 Ų131.892%0.91977%0.768SS**  trans-169.6110.6151.9-99.50000109.3
274V45Very low37.5Very low133 Ų133130.9 Ų130.981%0.80677%0.767SS**PPolyproline II helixtrans-86.3140.2179.9175.90000109.5
275P38Very low37.8Very low123 Ų123129 Ų12980%0.79976%0.764SS**PPolyproline II helixtrans-86.7129.8164.432.8-26.4000110
276Y41Very low38.1Very low199 Ų199127.1 Ų127.178%0.7876%0.756SS**PPolyproline II helixtrans-89.7134.5179.1140.1-95.6000111.2
277E42.6Very low38.5Very low156 Ų156131.8 Ų131.873%0.72976%0.764SS**PPolyproline II helixtrans-103.2139.2172.8-82.6-74.3163.900111.5
278E34.3Very low39Very low158 Ų158126.9 Ų126.974%0.73876%0.762SS**  trans44.3124.4142-152.1-163.9155.500121.8
279K42.3Very low39.2Very low160 Ų160128.1 Ų128.170%0.69677%0.772SS**  -174.1127.4128-124.3-176.5174.4158.20116.8
280K45.4Very low39.6Very low164 Ų164129.9 Ų129.971%0.71377%0.772SS**  86.7118.2123.2-110.4-172.7-175.1-173.50123.7
281T38.5Very low40Very low103 Ų103130.6 Ų130.663%0.63277%0.774SS**  114.6107.6121-39.70000118.9
282L40.5Very low39.5Very low159 Ų159131.6 Ų131.683%0.83278%0.781SS**  trans33.9151.3132.4-54.2170000120.3
283S37.1Very low40Very low109 Ų109130.7 Ų130.776%0.76279%0.786SS**  cis175.5151.7-7.449.10000107.8
284G40.3Very low40.4Very low70 Ų70132.5 Ų132.572%0.72278%0.781SS**  trans103.6143.516200000115
285T37.2Very low40.3Very low140 Ų140131.2 Ų131.286%0.85979%0.785SS**  cis-164.6143.47.9-62.80000109.1
286A42Very low40.5Very low79 Ų79132.5 Ų132.565%0.65378%0.784SS**  trans4.8167.1155.600000125.2
287D42.8Very low41.1Very low168 Ų168128.1 Ų128.190%0.89878%0.78SS**  trans99122.4169.3-55.8-20.9000114.6
288G41.3Very low41Very low77 Ų77132.7 Ų132.779%0.79479%0.79SS**  cis139.2139.811.400000108.9
289C38.1Very low41.6Very low141 Ų141129.6 Ų129.695%0.95379%0.792SS**  trans111.1145.3161.7-144.70000119.6
290S39.2Very low42Very low112 Ų112127.6 Ų127.678%0.78380%0.795SS**  trans-103.6177.7-145-73.40000115.6
291P44.9Very low42.3Very low123 Ų123126.4 Ų126.480%0.79980%0.801SS**  trans-104177.2-167.939.5-31.1000115.6
292S31.6Very low42.8Very low109 Ų109126.7 Ų126.776%0.76281%0.805SS**  trans106123.4157.8-165.80000118.2
293S43.6Very low43Very low125 Ų125131 Ų13187%0.87481%0.81SS**  trans-167.2139.4138.8-79.80000112.1
294E42.5Very low43.2Very low174 Ų174130.3 Ų130.381%0.81381%0.811SS**  trans-74.2161-171-61.516888.200115.9
295A43.1Very low43.3Very low107 Ų107132.1 Ų132.188%0.88481%0.813SS**  trans-159.8114.6141.400000112
296L41.8Very low43.8Very low150 Ų150130.5 Ų130.579%0.78581%0.807SS**  trans-96.2-168.1172.6-79.2169.9000110.7
297P53.2Low44Very low106 Ų106138.1 Ų138.169%0.68882%0.819SS**  -138.9178.4-64.541.5-24.8000113.6
298R41.2Very low44.2Very low252 Ų252134.7 Ų134.795%0.95181%0.814SS**  trans164.3143.8151.5-99.5171.4-176.3174.52.7109
299A47.1Very low44.3Very low94 Ų94137.8 Ų137.878%0.77781%0.812SS**  cis-167.1167.6-8.800000106.4
300P51.5Low44.5Very low117 Ų117142 Ų14276%0.7681%0.808SS**  trans-108.9-161.6-151.741.1-33.6000116
301V51.6Low44.8Very low139 Ų139141.4 Ų141.484%0.84281%0.81SS**  trans109.8143.8160.8-90.60000120.9
302P48.7Very low44.7Very low110 Ų110143.2 Ų143.271%0.71481%0.813SS**  -138.2-164.4-122.638.9-13.9000115.7
303R43.2Very low45.6Very low248 Ų248143 Ų14394%0.93681%0.811SS**  trans112.4132.7168.9-69.7173.7167.8163-3112.3
304A41.6Very low45.8Very low95 Ų95141 Ų14179%0.78581%0.811SS**  cis-147.9134.818.100000108
305S44.1Very low46.2Very low108 Ų108140.6 Ų140.676%0.75581%0.814SS**  67.8106.670.91790000116.1
306S46.5Very low46.5Very low106 Ų106144.3 Ų144.374%0.74181%0.813SS**  trans75.8139.8156.981.30000116.1
307R45.6Very low47.1Very low240 Ų240141.1 Ų141.191%0.90681%0.809SS**  cis-171.4149.724.1-149.8172.1-176.1170.9-0.4109.2
308A47.1Very low47Very low95 Ų95142.2 Ų142.279%0.78582%0.816SS**  trans81119.3150.100000120.8
309N44.4Very low47.2Very low143 Ų143141.1 Ų141.177%0.76581%0.812SS**  trans-77.8170.3171.8-64.7-58.7000113.7
310R41.8Very low47.1Very low229 Ų229142.8 Ų142.886%0.86481%0.814SS**  trans91.8101.6157.8-59.6-173.7-177.2100.4-1.1114.5
311A45.1Very low46.5Very low99 Ų99148.4 Ų148.482%0.81882%0.82SS**  77.8105.679.200000111.5
312D43.9Very low46Very low162 Ų162151.6 Ų151.687%0.86682%0.823SS**  trans-155.6128.8140.1-151.84.2000110.5
313S49.4Very low45.4Very low103 Ų103158 Ų15872%0.7283%0.833SS**  trans-84.2122.1178.443.40000109.1D315S313-D315 PolarHBondContact O-N 3.04Å
314G49.5Very low44.8Very low85 Ų85154.4 Ų154.488%0.87683%0.827SS**  trans-74.2107.8172.800000111.4E316G314-E316 PolarHBondContact O-N 3.14Å
315D49.1Very low44.4Very low165 Ų165155.3 Ų155.388%0.88283%0.825SS**  trans-57.9109.5167.5-98.8-36.6000111.2S313 A317S313-D315 PolarHBondContact O-N 3.04Å; D315-A317 PolarHBondContact O-N 3.4Å
316E50.5Low43.7Very low185 Ų185157.1 Ų157.186%0.86482%0.821SS**  trans-79.1103.4164-172.6101.9-17400108.1G314G314-E316 PolarHBondContact O-N 3.14Å
317A53.6Low42.8Very low83 Ų83158 Ų15869%0.68682%0.822SS**PPolyproline II helixtrans-55.2130.9-178.800000112.4D315 R319D315-A317 PolarHBondContact O-N 3.4Å; A317-R319 PolarHBondContact O-N 3.01Å
318P51.1Low42Very low129 Ų129154.7 Ų154.784%0.83881%0.81SS**PPolyproline II helixtrans-67.8122.2177.7-12.926.1000110.4
319R47Very low41.1Very low229 Ų229153.3 Ų153.386%0.86479%0.791SS**PPolyproline II helixtrans-54.3139.7172.5-63.3-165.5-167.9-144.85.1110.4A317 R321A317-R319 PolarHBondContact O-N 3.01Å; R319-R321 PolarHBondContact O-N 3.21Å
320P44.1Very low40.4Very low128 Ų128154.5 Ų154.583%0.83179%0.786SS**  trans-63.8110.2-179.825.2-32.4000109.8K322P320-K322 PolarHBondContact O-N 2.98Å
321R39.8Very low39.9Very low235 Ų235147.8 Ų147.889%0.88777%0.767SS**  trans-62.6118.9168.7-68.7-176178.3-177.2-0.4107.5R319 R323R319-R321 PolarHBondContact O-N 3.21Å; R321-R323 PolarHBondContact O-N 3.14Å
322K40.4Very low39.4Very low206 Ų206150.3 Ų150.390%0.89676%0.76SS**  trans-49.9113.2169.5-75.1-177.3175.9-178.90108P320 Q324P320-K322 PolarHBondContact O-N 2.98Å; K322-Q324 PolarHBondContact O-N 3.49Å
323R36.3Very low38.8Very low246 Ų246147 Ų14793%0.92875%0.745SS**PPolyproline II helixtrans-65.2125.4175.4-73-172.5176-163.1-1108.3R321R321-R323 PolarHBondContact O-N 3.14Å
324Q30.8Very low38Very low172 Ų172145.6 Ų145.680%0.80474%0.735SS**PPolyproline II helixtrans-61.5141.9168.7-70.6-85.20.200108.7K322 E326K322-Q324 PolarHBondContact O-N 3.49Å; Q324-E326 PolarHBondContact O-N 3.16Å
325P31.8Very low37.1Very low114 Ų114151 Ų15174%0.7473%0.729SS**PPolyproline II helixtrans-66117.6178.425.8-31.3000110.2T327P325-T327 PolarHBondContact O-N 3.46Å
326E29.7Very low36.2Very low146 Ų146150.7 Ų150.768%0.68272%0.72SS**  trans-77105.1168.4-78-177.9179.800109.1Q324 R328Q324-E326 PolarHBondContact O-N 3.16Å; E326-R328 PolarHBondContact O-N 3.19Å; E326-R328 IonicContact OE2-CZ 3.72Å; E326-R328 IonicContact OE2-NE 3.4Å; E326-R328 IonicContact OE2-NH2 3.97Å; E326-R328 PolarHBondContact OE2-NH2 3.47Å
327T28.1Very low35.4Very low124 Ų124152.7 Ų152.776%0.76172%0.72SS**  trans-71.1109.1169.6-54.90000109.5P325 V329P325-T327 PolarHBondContact O-N 3.46Å; T327-V329 HydrophobicContact CG2-CG2 4.49Å
328R29.4Very low34.3Very low170 Ų170155.4 Ų155.464%0.64272%0.723SS**  trans-95.8113.8174.1-67.9-176.7175.8-174.7-1.8110.4E326 Y330E326-R328 PolarHBondContact O-N 3.19Å; E326-R328 IonicContact OE2-CZ 3.72Å; E326-R328 IonicContact OE2-NE 3.4Å; E326-R328 IonicContact OE2-NH2 3.97Å; E326-R328 PolarHBondContact OE2-NH2 3.47Å; R328-Y330 HydrophobicContact CB-CE2 3.93Å
329V26.9Very low33.4Very low66 Ų66159.1 Ų159.140%0.473%0.726SS.*  trans-91116.5174-1780000109.2T327T327-V329 HydrophobicContact CG2-CG2 4.49Å
330Y30.7Very low32.7Very low168 Ų168154.9 Ų154.966%0.65972%0.721SS**  trans-94.4120.1175-68.1-87.8000110.6R328R328-Y330 HydrophobicContact CB-CE2 3.93Å
331I31.4Very low32.1Very low89 Ų89160.2 Ų160.246%0.45672%0.724SS.*  trans-95.3111.3174.8-58.6175.3000108.8V333 L370I331-V333 HydrophobicContact CG2-CG2 4.31Å; I331-L370 HydrophobicContact CG2-CD1 3.54Å
332F33.5Very low31.6Very low152 Ų152156.1 Ų156.167%0.66772%0.718SS**  trans-89.7120.2172.5-81.2-90.3000110.9
333V31.8Very low31.1Very low92 Ų92151.7 Ų151.756%0.55871%0.711SS**  trans-103.599.9172.9-176.40000109.1I331 F368I331-V333 HydrophobicContact CG2-CG2 4.31Å; V333-F368 HydrophobicContact CG1-CD1 3.84Å; V333-F368 HydrophobicContact CG1-CE1 4.17Å
334S32.1Very low30.5Very low74 Ų74150.3 Ų150.352%0.51771%0.712SS.*  trans-87.3116.6173.5-66.70000110.8F336S334-F336 PolarHBondContact O-N 2.86Å
335R30.5Very low30.4Very low199 Ų199152.9 Ų152.975%0.75171%0.714SS**  trans-74.8114.8169.1-82.8-177.9178.7168.20.5109.8F368R335-F368 HydrophobicContact CG-CE1 3.88Å
336F31Very low30.1Very low157 Ų157153.3 Ų153.369%0.68972%0.715SS**  trans-89.1109164.5-81.1-87000110.1S334S334-F336 PolarHBondContact O-N 2.86Å
337R33.1Very low30.2Very low228 Ų228153.4 Ų153.486%0.8673%0.725SS**  trans-91.792.9161-82.7-175173.4-178.9-1.2108.1
338N30.7Very low30Very low140 Ų140158.7 Ų158.775%0.74973%0.731SS**  trans179.686.1153.1-104.8-37.7000112.7
339F33Very low29.8Very low207 Ų207162.4 Ų162.491%0.90875%0.745SS**  trans-148.568.8156.7-85.1-76.5000108.7
340N32.3Very low29.8Very low140 Ų140164.1 Ų164.175%0.74977%0.766SS**  trans-149.552.6168.1-97.6-25.4000110.9
341R31Very low29.5Very low239 Ų239161.1 Ų161.190%0.90278%0.776SS**  trans-133.973.1164.3-87.3-168.6173.8-176.9-0.7109.5
342I29.7Very low29.3Very low150 Ų150161.7 Ų161.777%0.76979%0.788SS**  trans-121.8117.1158.2-57.1177.7000106F344I342-F344 PolarHBondContact O-N 3.32Å
343P29.1Very low29Very low113 Ų113165.4 Ų165.473%0.73480%0.799SS**  trans-72.9118.4179.128-30.2000109.7R345P343-R345 PolarHBondContact O-N 3.22Å
344F24.9Very low28.7Very low217 Ų217164.5 Ų164.595%0.95281%0.808SS**  trans-65.1101.7167.7-80.6-89.9000109.1I342I342-F344 PolarHBondContact O-N 3.32Å
345R28.5Very low28.4Very low226 Ų226169.2 Ų169.285%0.85382%0.822SS**  trans-119.2110.7162.4-88-171.3174.3177.4-1109.4P343P343-R345 PolarHBondContact O-N 3.22Å
346T26Very low28.2Very low123 Ų123167.1 Ų167.176%0.75582%0.821SS**  trans72.794.4142.6-36.80000117.9
347V30.6Very low28Very low148 Ų148166.1 Ų166.190%0.89783%0.827SS**  trans-138.193138.6-174.20000108.3
348R24.7Very low27.7Very low235 Ų235165.8 Ų165.889%0.88783%0.826SS**  trans-82113.8158.6-80.1-177.3178.5174.3-1107.2
349R24.6Very low27.6Very low247 Ų247166.4 Ų166.493%0.93283%0.829SS**  trans173.9150.4135.9-114177.4177.2166.9-0.6111.6
350A26.7Very low27.4Very low102 Ų102163.7 Ų163.784%0.84382%0.824SS**  trans85.566.9172.900000115.7
351A24.5Very low27.5Very low106 Ų106163.7 Ų163.788%0.87683%0.829SS**  trans-84.4119.3145.700000107.6
352S27.4Very low27.5Very low100 Ų100158.3 Ų158.370%0.69982%0.823SS**  trans-170131.7151.2-151.50000110.2
353Y26.4Very low27.7Very low230 Ų230156.3 Ų156.390%0.90282%0.82SS**  trans70.698.8170.8-75.8-88.5000118.9
354G25.4Very low27.9Very low73 Ų73157.7 Ų157.775%0.75382%0.821SS**  94.9111.6114.500000116.7
355E26.5Very low28.3Very low173 Ų173159.2 Ų159.281%0.80882%0.82SS**  trans110.2117.2133.9-136.7176.1174.100118.8
356Q25.4Very low28.7Very low155 Ų155153.9 Ų153.972%0.72481%0.808SS**  trans69.1101.9151.5-82.9178.748.700121.5R358Q356-R358 PolarHBondContact O-N 3.47Å
357V27Very low29Very low136 Ų136151 Ų15182%0.82480%0.802SS**  trans-36116151.3-1800000113.1
358R28.3Very low28.9Very low221 Ų221149.4 Ų149.483%0.83478%0.784SS**  trans-145.1137.3148.1-77.5-163.6175.4-177.7-1.5110.8Q356 D360Q356-R358 PolarHBondContact O-N 3.47Å; R358-D360 PolarHBondContact O-N 3.05Å
359N28.6Very low29.1Very low153 Ų153148 Ų14882%0.81878%0.778SS**  trans-66.5108.2-175.5-58.6-66.3000111.8
360D28.9Very low29.4Very low150 Ų150141.4 Ų141.480%0.80276%0.761SS**  trans-111.599172-83.9-25.1000111.4R358 T362R358-D360 PolarHBondContact O-N 3.05Å; D360-T362 PolarHBondContact O-N 3.37Å
361V32.8Very low29.7Very low140 Ų140141.5 Ų141.585%0.84875%0.751SS**  trans-68.7111.5167.8177.40000108.2P363V361-P363 WeakPolarHBondContact O-CD 3.37Å
362T32.6Very low29.9Very low126 Ų126140.5 Ų140.577%0.77373%0.73SS**PPolyproline II helixtrans-83.4117.7178.6-40.60000110.7D360 L364D360-T362 PolarHBondContact O-N 3.37Å; T362-L364 PolarHBondContact O-N 3.03Å
363P33.5Very low30.1Very low108 Ų108143.1 Ų143.170%0.70173%0.725SS**PPolyproline II helixtrans-82.5120.5174.530-29000110.8V361 R365V361-P363 WeakPolarHBondContact O-CD 3.37Å; P363-R365 PolarHBondContact O-N 3.29Å
364L33Very low30.5Very low143 Ų143139 Ų13975%0.74972%0.717SS**PPolyproline II helixtrans-54.2116.1168.1-81.3154.6000110.1T362 L366T362-L364 PolarHBondContact O-N 3.03Å; L364-L366 PolarHBondContact O-N 3.33Å
365R33.3Very low30.8Very low249 Ų249144.9 Ų144.994%0.9473%0.731SS**  trans-67.498.6175.5-76.1-171.7175.6-175.3-0.4110.6P363P363-R365 PolarHBondContact O-N 3.29Å
366L36Very low31Very low114 Ų114143.5 Ų143.560%0.59773%0.727SS**  trans-86.8109167.1-139.878.3000108.7L364 F368L364-L366 PolarHBondContact O-N 3.33Å; L366-F368 HydrophobicContact CB-CE2 4.3Å; L366-F368 HydrophobicContact CD2-CE2 3.98Å; L366-F368 HydrophobicContact CD2-CZ 3.73Å
367G31.9Very low31.3Very low62 Ų62142.9 Ų142.964%0.63973%0.727SS**  trans-82.8121.217600000111.4
368F29.6Very low31.6Very low115 Ų115143.3 Ų143.350%0.50472%0.722SS.*  trans-102139.4167-64.1-89.8000109.1V333 R335 L366V333-F368 HydrophobicContact CG1-CD1 3.84Å; V333-F368 HydrophobicContact CG1-CE1 4.17Å; R335-F368 HydrophobicContact CG-CE1 3.88Å; L366-F368 HydrophobicContact CB-CE2 4.3Å; L366-F368 HydrophobicContact CD2-CE2 3.98Å; L366-F368 HydrophobicContact CD2-CZ 3.73Å
369R29.8Very low31.8Very low204 Ų204138.7 Ų138.777%0.7772%0.715SS**  trans-108.7108.9169.2-165.5177.7-173.6-179.31.6107.9V371R369-V371 HydrophobicContact CG-CG2 4.45Å
370L29.5Very low32Very low110 Ų110137.8 Ų137.858%0.57671%0.709SS**  trans-79.9121.4170.8-169.971.2000107.8I331 L372I331-L370 HydrophobicContact CG2-CD1 3.54Å; L370-L372 HydrophobicContact CD1-CD1 4.26Å; L370-L372 HydrophobicContact CD2-CD1 3.6Å; L370-L372 HydrophobicContact CG-CD1 3.77Å
371V34.2Very low32.2Very low103 Ų103137 Ų13762%0.62470%0.703SS**  trans-111.4101.8169.9-179.50000106.3R369R369-V371 HydrophobicContact CG-CG2 4.45Å
372L28.9Very low32.1Very low85 Ų85136.8 Ų136.845%0.44569%0.692SS.*  trans-82.6124.5165.9-108.581.6000108L370L370-L372 HydrophobicContact CD1-CD1 4.26Å; L370-L372 HydrophobicContact CD2-CD1 3.6Å; L370-L372 HydrophobicContact CG-CD1 3.77Å
373R30.9Very low32.1Very low156 Ų156137.6 Ų137.659%0.58969%0.686SS**  trans-110.2120.4161.1-174179.2180133.66.2106.5D375R373-D375 IonicContact NE-OD1 3.32Å; R373-D375 PolarHBondContact NE-OD1 3.39Å
374I34.5Very low32Very low142 Ų142140.1 Ų140.173%0.72869%0.685SS**  trans-97.6123.5169.8-55.1174000104.4
375D32.2Very low31.9Very low198 Ų198139.8 Ų139.8100%1.05968%0.679SS**  trans-87.90172.7-80.6-31.7000111.2R373R373-D375 IonicContact NE-OD1 3.32Å; R373-D375 PolarHBondContact NE-OD1 3.39Å

Retrieved 375 of 375 residues in 209.5 ms (Link to these results)