A0A087XE01_POEFO Loading...

Zinc finger protein 148

AlphaFold DB , UniProt , Accession A0A087XE01, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 816 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M30.3Very low34.2Very low226 Ų226144.2 Ų144.2100%1.11378%0.778SS**  0138.30-66.117171.800107.1
2N30.5Very low34Very low149 Ų149145.8 Ų145.880%0.79779%0.785SS**  trans63.5149173-558.1000115.3
3S35.2Very low33.7Very low111 Ų111149.2 Ų149.278%0.77679%0.788SS**  cis-161153.3-22.741.90000108.6
4E46.1Very low33.3Very low176 Ų176145.6 Ų145.682%0.82278%0.779SS**  trans-75144170.2-54.2-179.9136.500111
5D39Very low33Very low131 Ų131143.9 Ų143.970%0.70178%0.784SS**  trans167.8162.8144.9-94.7-22.2000109
6K35.5Very low32.5Very low153 Ų153139.9 Ų139.967%0.66579%0.786SS**  cis179.4142.6-42.4-121.8-165.2-151.799.40107.3
7L34.5Very low32.2Very low147 Ų147136.6 Ų136.677%0.7779%0.791SS**  trans63.5160.9160.5-52.5171.4000115.2
8D30.5Very low31.9Very low130 Ų130132.6 Ų132.670%0.69578%0.784SS**  cis-140161.5-13-138.5-44.8000110.4
9G31.6Very low31.9Very low73 Ų73134.3 Ų134.375%0.75379%0.787SS**  trans-163.639.3-165.400000116.3L11G9-L11 PolarHBondContact O-N 3.4Å
10M32Very low31.8Very low151 Ų151135.1 Ų135.174%0.74479%0.788SS**  trans-48.7125.1-178.9-61.2167.34700115.4
11L30.8Very low31.8Very low139 Ų139132.2 Ų132.273%0.72879%0.787SS**  164.9143.5106.5-96.2150.9000115.9G9G9-L11 PolarHBondContact O-N 3.4Å
12L32.2Very low31.6Very low164 Ų164125.7 Ų125.786%0.85978%0.777SS**  trans67.3162.1154-78.5161.8000120.2
13K30Very low31.5Very low189 Ų189121.7 Ų121.782%0.82277%0.771SS**  trans-163.1163.3-153.9174175.9171.1176.10110
14C28.8Very low31.2Very low99 Ų99128.2 Ų128.267%0.66978%0.779SS**  trans84102.9172.3-700000117.9
15S27.8Very low30.3Very low121 Ų121125.7 Ų125.785%0.84678%0.776SS**  55.3124.1109-48.50000121.8
16G26.1Very low29.9Very low80 Ų80124.9 Ų124.983%0.82578%0.779SS**  113.3139126.800000117
17G26.8Very low29.6Very low84 Ų84126.1 Ų126.187%0.86679%0.792SS**  trans82.7137.6-175.500000112.3
18G27.4Very low29.2Very low64 Ų64122.3 Ų122.366%0.6679%0.788SS**  cis101.7147.27.400000112
19I31Very low29.3Very low165 Ų165121.3 Ų121.385%0.84680%0.798SS**  trans62152.8-174.679.9155.8000114.4
20D30.8Very low29Very low150 Ų150121.4 Ų121.480%0.80280%0.798SS**  cis-154.3161.8-11.6-132.5-35.2000111.9
21G30.4Very low28.9Very low75 Ų75118.1 Ų118.177%0.77380%0.804SS**  trans66.9171.7162.400000118.6
22G27Very low28.6Very low88 Ų88115 Ų11591%0.90780%0.804SS**  cis144.283.4-5.700000114.2
23G27.6Very low28.5Very low65 Ų65114.7 Ų114.767%0.6780%0.803SS**  trans134.8141-174.900000110.1
24R29.4Very low28.3Very low248 Ų248112.1 Ų112.194%0.93680%0.803SS**  cis58.2128.341.3-47.7-169.8-168.4-149.66.2110.5
25V28Very low28.3Very low124 Ų124111.5 Ų111.575%0.75280%0.796SS**  cis-152.4129.630.7173.10000112.5
26C28.8Very low28.4Very low113 Ų113114.3 Ų114.376%0.76480%0.798SS**  trans45.6-177.5149.3-56.40000122.9
27L30.5Very low28.8Very low180 Ų180115.9 Ų115.994%0.94279%0.791SS**  trans74.9133.2-179.5-47.3178.2000114.6
28G26.5Very low29.1Very low66 Ų66120.2 Ų120.268%0.6879%0.794SS**  cis176.6167.1-6.400000112
29A31.9Very low29Very low110 Ų110120.5 Ų120.591%0.90980%0.797SS**  trans61.7161.6-17800000115.5
30G26.3Very low29.2Very low74 Ų74121.8 Ų121.876%0.76380%0.799SS**  cis123.5115.5-4.700000112.1
31G28.5Very low29.1Very low83 Ų83126.6 Ų126.686%0.85681%0.806SS**  trans92.4164.1-170.100000112.6
32G25.5Very low29Very low72 Ų72128.5 Ų128.574%0.74281%0.808SS**  cis167.5120.4-2.300000110.3
33L29.3Very low29.1Very low159 Ų159132.7 Ų132.783%0.83281%0.808SS**  trans-63.1132.9-180-171.681.8000111.1V35L33-V35 HydrophobicContact CD2-CG2 3.77Å; L33-V35 HydrophobicContact CG-CG2 4.07Å
34V26.6Very low29.2Very low135 Ų135133.4 Ų133.482%0.81881%0.808SS**  trans-127.6132.9154.6-179.30000108.3
35V29.2Very low29.1Very low86 Ų86129.4 Ų129.452%0.52181%0.805SS.*  trans-100.1142.7-178176.60000109.3L33 T37L33-V35 HydrophobicContact CD2-CG2 3.77Å; L33-V35 HydrophobicContact CG-CG2 4.07Å; V35-T37 HydrophobicContact CG1-CG2 3.8Å
36M28Very low29.1Very low180 Ų180132.4 Ų132.489%0.88781%0.811SS**  trans-110.3134.4154.4-82.9-76.211200108.2
37T35Very low29.2Very low112 Ų112132.8 Ų132.869%0.68781%0.812SS**  trans-102.8-161.5-169.7530000111.6V35V35-T37 HydrophobicContact CG1-CG2 3.8Å
38L32.4Very low29Very low176 Ų176132.5 Ų132.592%0.92181%0.81SS**  trans88.4136.3-169.4-53.7168.5000113.3
39G26Very low29.1Very low70 Ų70136.8 Ų136.872%0.72282%0.817SS**  cis-178.7140.8-5.100000109.7
40E34.7Very low29Very low192 Ų192134.7 Ų134.790%0.89780%0.799SS**  trans-76.8148.3-162.1-56.8-177.5126.400115
41R29.3Very low29.2Very low250 Ų250138.6 Ų138.694%0.94380%0.798SS**  trans-157119142.3-108.1162.2-159.9-165.34110.6
42S27.5Very low29.4Very low116 Ų116140.8 Ų140.881%0.81179%0.79SS**  trans-85.8147.2169.3-71.90000110.8
43L29.9Very low30Very low175 Ų175144 Ų14492%0.91679%0.79SS**  -166165.3118.2-105.5170.5000112.1
44A29.3Very low30.4Very low81 Ų81140.7 Ų140.767%0.66977%0.773SS**  trans-77.6144-168.600000113.8
45N27.9Very low31.1Very low163 Ų163138.2 Ų138.287%0.87276%0.755SS**  trans-163.8110.5130.3-97.1-30.9000109.5
46Q27.3Very low31.6Very low187 Ų187139.8 Ų139.887%0.87476%0.761SS**PPolyproline II helixtrans-91.9121.7162.6-79.4-168.8-20.200108
47P30.8Very low32.4Very low121 Ų121135.8 Ų135.879%0.78674%0.743SS**PPolyproline II helixtrans-62.7142.8165.228.5-32.9000108.9L49P47-L49 PolarHBondContact O-N 3.46Å
48L27.8Very low32.7Very low174 Ų174136.7 Ų136.791%0.91174%0.744SS**PPolyproline II helixtrans-61.5135.6176-68.6168.5000109.5A50L48-A50 PolarHBondContact O-N 3.43Å
49L28.1Very low33.2Very low157 Ų157133.4 Ų133.482%0.82273%0.727SS**  trans-65.5106.3167.4-67.3170.9000107.9P47 E51P47-L49 PolarHBondContact O-N 3.46Å; L49-E51 PolarHBondContact O-N 3.3Å
50A29.1Very low34.3Very low65 Ų65138.4 Ų138.454%0.53773%0.732SS.*  trans-57.5130.8149.400000107L48 D52L48-A50 PolarHBondContact O-N 3.43Å; A50-D52 WeakPolarHBondContact CB-OD1 3.31Å; A50-D52 PolarHBondContact O-N 3.09Å
51E31.6Very low34.6Very low157 Ų157136 Ų13673%0.73473%0.725SS**  trans-80.984.6167.4-66.4-168.6157.300105.8L49 D53L49-E51 PolarHBondContact O-N 3.3Å; E51-D53 PolarHBondContact O-N 3.03Å
52D32Very low35.3Very low128 Ų128131.2 Ų131.268%0.68472%0.718SS**  trans-67.472177.9-65.1-30.8000110.2A50 D54A50-D52 WeakPolarHBondContact CB-OD1 3.31Å; A50-D52 PolarHBondContact O-N 3.09Å; D52-D54 PolarHBondContact O-N 3.15Å
53D37.8Very low35.8Very low141 Ų141132.7 Ų132.775%0.75472%0.722SS**  trans-72.240.5163.5-79-11.3000110.4E51 D55E51-D53 PolarHBondContact O-N 3.03Å; D53-D55 PolarHBondContact O-N 3.26Å
54D38.8Very low35.9Very low88 Ų88128.1 Ų128.147%0.47172%0.717SS.*  trans-75.369.9160.9-89.5-38.9000107.7D52 D56 R196D52-D54 PolarHBondContact O-N 3.15Å; D54-D56 PolarHBondContact O-N 3.3Å; D54-R196 IonicContact OD1-CZ 2.67Å; D54-R196 IonicContact OD1-NH2 2.72Å; D54-R196 PolarHBondContact OD1-NH2 2.38Å
55D41.6Very low36Very low83 Ų83130 Ų13044%0.44473%0.725SS.*  trans-63.285.6160.3-79.4-37.2000107.5D53 D57D53-D55 PolarHBondContact O-N 3.26Å; D55-D57 PolarHBondContact O-N 2.86Å
56D38Very low36.2Very low119 Ų119128 Ų12864%0.63672%0.724SS**  trans-66.976.9166.9-83.2-23.2000108.8D54 D58D54-D56 PolarHBondContact O-N 3.3Å; D56-D58 VanDerWaalsContact C-N 3.27Å; D56-D58 PolarHBondContact O-N 3.43Å
57D45.8Very low36.4Very low96 Ų96126.8 Ų126.851%0.51372%0.723SS.*  trans-66.878.1175.6-81-37.1000110.5D55 D59D55-D57 PolarHBondContact O-N 2.86Å; D57-D59 PolarHBondContact O-N 2.8Å
58D41.2Very low36.4Very low131 Ų131126.5 Ų126.570%0.70172%0.718SS**  trans-63.547.9163.1-93-11.1000110.6D56 E60D56-D58 VanDerWaalsContact C-N 3.27Å; D56-D58 PolarHBondContact O-N 3.43Å; D58-E60 PolarHBondContact O-N 3.48Å; D58-E60 VanDerWaalsContact O-N 3.12Å
59D42.3Very low36.5Very low107 Ų107124.3 Ų124.357%0.57271%0.713SS**  trans-88.149.2-176.8-132.612.6000111.2D57 D61 K247D57-D59 PolarHBondContact O-N 2.8Å; D59-D61 PolarHBondContact O-N 3.36Å; D59-K247 VanDerWaalsContact CG-NZ 3.34Å; D59-K247 IonicContact OD1-NZ 2.73Å; D59-K247 PolarHBondContact OD1-NZ 2.93Å; D59-K247 IonicContact OD2-NZ 3.33Å; D59-K247 PolarHBondContact OD2-NZ 2.83Å; D59-K247 VanDerWaalsContact OD2-NZ 3.13Å
60E50.3Low36.6Very low175 Ų175125.2 Ų125.282%0.81871%0.712SS**  trans-74.8101.3170.6-80.2-78.5-176.400110.6D58D58-E60 PolarHBondContact O-N 3.48Å; D58-E60 VanDerWaalsContact O-N 3.12Å
61D40.4Very low36.6Very low141 Ų141129.2 Ų129.275%0.75473%0.725SS**  trans-164125.5152.3-113-18.5000113.9D59D59-D61 PolarHBondContact O-N 3.36Å
62L42.9Very low36.6Very low151 Ų151129.9 Ų129.979%0.79173%0.732SS**  trans53.483.7144.7-54.3175.9000120
63T38.1Very low36.6Very low147 Ų147130 Ų13090%0.90274%0.737SS**  trans-124.7110.713148.90000109.9S65T63-S65 PolarHBondContact O-N 2.86Å
64G32.3Very low36.5Very low79 Ų79128.7 Ų128.781%0.81474%0.737SS**  trans-82.4104.6-178.200000112.2
65S32.8Very low36.7Very low120 Ų120130.4 Ų130.484%0.83975%0.752SS**  trans-148.6111.1161.7-76.20000109.1T63T63-S65 PolarHBondContact O-N 2.86Å
66S31.4Very low36.2Very low121 Ų121136 Ų13685%0.84678%0.776SS**  trans-77.4127.2173.7179.40000109.6
67L31.9Very low35.9Very low162 Ų162138.7 Ų138.785%0.84878%0.784SS**  trans-162.9115.2150.8-109.8164.4000111.4
68V30.8Very low35.1Very low114 Ų114141.3 Ų141.369%0.69180%0.798SS**  trans11.2126.5155.4-177.60000118.9
69T29.2Very low34.4Very low129 Ų129141.6 Ų141.679%0.79180%0.797SS**  trans-66.1136.8164.247.20000112.9
70H31.3Very low33.8Very low176 Ų176143.7 Ų143.782%0.81581%0.805SS**  trans-137.4121.4156.7-105.6-82.6000109.8
71D27.8Very low32.7Very low149 Ų149143.3 Ų143.380%0.79780%0.803SS**  trans-74.4136.2169.7-64.3-70.2000110.6
72L31.6Very low32.2Very low170 Ų170144.4 Ų144.489%0.8980%0.803SS**  trans-140.8136.2159.4-78-178.5000110.6
73V32Very low31.8Very low132 Ų132144 Ų14480%0.880%0.798SS**PPolyproline II helixtrans-87.1151.5179.9177.20000109.6
74P35.2Very low31.5Very low113 Ų113143.5 Ų143.573%0.73479%0.789SS**PPolyproline II helixtrans-64.5157.7177.1-21.534.7000113.7
75P43Very low31.4Very low124 Ų124144.8 Ų144.881%0.80578%0.781SS**PPolyproline II helixtrans-87.9152.4-173.435.3-36.1000114.2
76E32.4Very low31.6Very low199 Ų199146.9 Ų146.993%0.9378%0.775SS**  trans-90.5-172.8159.7-66.8-165.2137.400111.4
77Q30.9Very low31.7Very low176 Ų176148.4 Ų148.482%0.82277%0.774SS**  trans-135.3162.2-152.8-164.5172.746.800112.6
78L28.2Very low31.5Very low152 Ų152144.4 Ų144.480%0.79677%0.772SS**  trans80.5158.2175.9-50.3175.2000115.9
79M28.4Very low31.4Very low137 Ų137143.4 Ų143.468%0.67578%0.775SS**  cis171.1127.7-46.6-98.5-94-71.300108.3
80M29.5Very low31.5Very low151 Ų151147 Ų14774%0.74478%0.783SS**  trans65156170.2-63.1163.4174.700114.6
81Q26.3Very low31.4Very low166 Ų166142.4 Ų142.478%0.77678%0.783SS**  cis-145.3148.814.1-125.8147.74.700106.5
82E30.3Very low31.8Very low164 Ų164143.3 Ų143.377%0.76679%0.787SS**  50.2132.368.5-70.5179.5147.900113.8
83E34.4Very low31.8Very low144 Ų144143.4 Ų143.467%0.67378%0.783SS**  cis-164.21676.5-134.4-159.3145.700111.8
84L32.6Very low31.9Very low136 Ų136145.7 Ų145.771%0.71278%0.784SS**  trans56.2155.5152.8-62.5169.8000119.9
85T30.2Very low31.9Very low106 Ų106148.2 Ų148.265%0.6579%0.786SS**  cis-146.1-172.8-4.629.30000107
86K36.7Very low31.4Very low164 Ų164146 Ų14671%0.71378%0.779SS**  cis-170.1147.226.8-143.7144.8-168.5162.80111.4
87N32Very low31.2Very low153 Ų153140.3 Ų140.382%0.81877%0.774SS**  trans41.2150.6150.7-54.814.6000121.5
88G28Very low31.2Very low78 Ų78136 Ų13680%0.80478%0.776SS**  cis149.5131.6-4.800000113
89A29.5Very low31.2Very low93 Ų93137.7 Ų137.777%0.76978%0.78SS**  trans-167.2115166.500000107
90E30.7Very low31.3Very low205 Ų205137.8 Ų137.896%0.95879%0.788SS**  78.8128.476.3-76.1-163.4159.900115
91G30.5Very low31.2Very low78 Ų78134.3 Ų134.380%0.80479%0.791SS**  trans147.189.5-179.100000113.2
92L34.7Very low31.2Very low168 Ų168132.7 Ų132.788%0.8879%0.792SS**  trans-84.3165.7168.8-68.9165.9000109.5
93E31.5Very low31.1Very low173 Ų173131.8 Ų131.881%0.80879%0.787SS**  -163.4146.475.7-82.2160.7-171.900111.6
94E35.8Very low30.8Very low179 Ų179133.1 Ų133.184%0.83679%0.791SS**  31.3150.4127.9-53.5-169.4168.400120.9
95E34.4Very low31.7Very low166 Ų166131.3 Ų131.378%0.77679%0.788SS**  cis-171.5-175.6-6.1-114.7-62.577.200107.5
96A31.3Very low31.7Very low78 Ų78134 Ų13465%0.64580%0.797SS**  cis-155.3146.8-0.200000112.9
97G30Very low31.5Very low80 Ų80133.7 Ų133.783%0.82580%0.796SS**  trans73.5170.9144.400000121
98G29.9Very low31.4Very low85 Ų85131.7 Ų131.788%0.87679%0.785SS**  trans127.899.9163.300000116.8
99E29.1Very low31.5Very low188 Ų188133 Ų13388%0.87978%0.777SS**  trans-77.2151.6-179.2-65.2-178.8124.100115.7
100V28.8Very low31.6Very low139 Ų139135 Ų13584%0.84278%0.775SS**  trans45.1122.4139.4-179.10000120.2
101G27.8Very low31.7Very low77 Ų77134.3 Ų134.379%0.79477%0.769SS**  trans-170.3104.7166.100000115.8
102V27.9Very low31.8Very low132 Ų132138.3 Ų138.380%0.877%0.771SS**  trans-93.9118.7-167.3172.80000114.5
103H27.1Very low32.4Very low145 Ų145135.4 Ų135.467%0.67176%0.762SS**  trans56.8139.1148.5-96.3-82.9000124.8
104F28.4Very low32.2Very low172 Ų172136.6 Ų136.675%0.75477%0.765SS**  trans73.2163.6140-80.6-37.1000121.5
105P51.3Low31.9Very low99 Ų99132.5 Ų132.564%0.64376%0.756SS**  cis-141.8148.7-23.533.3-13.2000118.6
106L31.1Very low31.5Very low161 Ų161132.2 Ų132.284%0.84376%0.759SS**  trans67.7159.1135.1-68.3172000125.1
107K31.4Very low31.2Very low158 Ų158136.4 Ų136.469%0.68777%0.765SS**  trans81.5143.6175.5-67.1-164172.5-161.30115.8
108L29.4Very low31.4Very low111 Ų111140.1 Ų140.158%0.58176%0.763SS**  cis-143.2-166.54.6-126.5163.3000111.6
109T32Very low31.7Very low107 Ų107141.4 Ų141.466%0.65676%0.756SS**  trans-114.2146.2-165.453.40000115.1
110N30Very low32Very low134 Ų134140.5 Ų140.572%0.71776%0.756SS**  178.8153.6117.8-101-73.4000116.6
111K33.2Very low31.9Very low190 Ų190139.4 Ų139.483%0.82676%0.755SS**  trans1.8137165.6-62.8170-173.5174.20124
112L33.6Very low32.1Very low163 Ų163143.8 Ų143.885%0.85376%0.758SS**  trans-37.8166.9149.8-74.6166.9000115.9
113P46.3Very low32.4Very low107 Ų107146.2 Ų146.270%0.69576%0.758SS**  cis-145.9-170.228.628.2-0.8000118.7
114F26.9Very low32.5Very low198 Ų198148.3 Ų148.387%0.86877%0.768SS**  trans97162.2156.9-87.6-74.2000121.4
115S30.3Very low32.7Very low92 Ų92147.2 Ų147.264%0.64377%0.765SS**  trans-131.5146.6-150.3570000113.3
116L26.3Very low31.7Very low161 Ų161148.6 Ų148.684%0.84377%0.767SS**  trans-149.1167.7160.6-69.4177.8000109.7
117Q25.5Very low31.5Very low166 Ų166149.9 Ų149.978%0.77677%0.765SS**  cis-168.9149.8-44.7178.9165.3-35.300107.6
118M32.5Very low31.5Very low158 Ų158150 Ų15078%0.77877%0.773SS**  trans-67.7140.6172.5-75.9-65.5-66.100112.7
119P36.5Very low31.3Very low112 Ų112150.1 Ų150.173%0.72778%0.783SS**  trans-77.9152.3170.832.7-34.5000112.3
120L34.9Very low31.4Very low168 Ų168152.7 Ų152.788%0.8879%0.793SS**  trans-134.2143.6171.4-81.6175.2000111.6
121S28.5Very low31.9Very low116 Ų116152.6 Ų152.681%0.81180%0.799SS**  trans-163.5151160.4-77.70000106.1
122I30.6Very low31.8Very low169 Ų169147.7 Ų147.787%0.86779%0.794SS**  cis-129.5165.629.6-70.3169.1000111.1
123K34Very low31.8Very low184 Ų184146 Ų14680%0.879%0.791SS**  trans-94.7155.5-177.3-53.4172.4179.8177.50113.2
124Q28.9Very low31.3Very low188 Ų188148.5 Ų148.588%0.87979%0.793SS**  trans157.9151.9132.6-90.3172.9-26.800111.1
125E33.5Very low31.6Very low149 Ų149144.7 Ų144.770%0.69678%0.78SS**  cis-169.7136.8-40.5-109.3-123.4131.400109
126L30.8Very low31.7Very low129 Ų129149.8 Ų149.868%0.67579%0.791SS**  trans63.7154163.6-58.5168.5000116.8
127K26.5Very low32Very low187 Ų187150.7 Ų150.781%0.81379%0.788SS**  cis-150.6169.117.8-137.2154.3-171.91720111.2
128L31.4Very low32.5Very low160 Ų160147.8 Ų147.884%0.83878%0.778SS**  trans-88.9153.7-172.3-48.488.7000114.5
129S25.3Very low32.7Very low114 Ų114148.1 Ų148.180%0.79778%0.775SS**  -174.1117.9126.9580000113.7
130D33.1Very low32.6Very low162 Ų162152 Ų15287%0.86678%0.78SS**  trans-91.9161.1153.6-77.6-49.4000109.5
131P40.7Very low32.4Very low131 Ų131147.4 Ų147.485%0.85177%0.766SS**  -143.2158.4105.437.8-24.5000115.4
132A30.8Very low32.9Very low88 Ų88149.6 Ų149.673%0.72777%0.767SS**  trans-101.3164.5176.200000113.2
133V33.8Very low33.1Very low128 Ų128151.1 Ų151.178%0.77677%0.768SS**  trans-179.7110.5156.7133.20000108.3
134H35.6Very low32.9Very low158 Ų158148.9 Ų148.973%0.73177%0.765SS**  79.2139.380.9-73.221.7000114.8
135I33.3Very low33Very low119 Ų119147.4 Ų147.461%0.6176%0.759SS**  cis-160.9143-6.1-96.9157.4000108.4
136K33Very low33.3Very low198 Ų198145.6 Ų145.686%0.86176%0.759SS**  trans179.4131.8143.4-90.6141.2-161.9178.30110
137K33.3Very low33.2Very low180 Ų180144.1 Ų144.178%0.78377%0.765SS**  cis71.5135.441.3-78.4-167.8174.2-179.60114.6
138D35.2Very low33.3Very low105 Ų105145.2 Ų145.256%0.56177%0.766SS**  cis-166.5161.4-13.4-151.1-13.4000110.2
139K37.7Very low33.7Very low165 Ų165142.9 Ų142.972%0.71776%0.76SS**  trans28.5133.8152.5-76.4164.7-161770120.3
140K33.8Very low34.1Very low193 Ų193147.2 Ų147.284%0.83976%0.764SS**  cis159.3153.542.5150.7178.5177.4-177.10111.7
141A30.5Very low34.2Very low72 Ų72148.8 Ų148.860%0.59576%0.764SS**  trans80.6112.9153.300000123.7
142I38.8Very low34Very low162 Ų162152.2 Ų152.283%0.83177%0.765SS**  46.9110.2119.7-52.4161.8000118.7
143K34.5Very low34.1Very low201 Ų201157.7 Ų157.787%0.87477%0.772SS**  trans-153.2158.1130.7-148.2170.2-176.7179.30111
144D30Very low34.4Very low138 Ų138162 Ų16274%0.73878%0.775SS**  trans-82.2178.2-166.6-55.7-86.3000116.5
145M32.3Very low34.2Very low156 Ų156163.4 Ų163.477%0.76878%0.779SS**  trans97.4102151.1-58.6-13568.200119.9
146T38.2Very low34.2Very low111 Ų111166.7 Ų166.768%0.68179%0.792SS**  trans51.772.7132.959.20000118.7
147A28.5Very low34.5Very low98 Ų98168.7 Ų168.781%0.8179%0.794SS**  trans-90.593.8152.900000110.2
148Y30.6Very low34.3Very low211 Ų211164.4 Ų164.483%0.82779%0.787SS**  trans-59.9126.7162.7-100.1-97.2000108.5K150Y148-K150 PolarHBondContact O-N 3.04Å
149P38.4Very low34.8Very low110 Ų110165.2 Ų165.271%0.71480%0.797SS**  trans-62.5116.4168.225.8-31.9000107.9K151P149-K151 VanDerWaalsContact C-N 3.32Å; P149-K151 PolarHBondContact O-N 3.47Å
150K33.3Very low35Very low205 Ų205161.8 Ų161.889%0.89180%0.8SS**  trans-62.192.7178-72.7179.3179.5174.20108.8Y148 K152Y148-K150 PolarHBondContact O-N 3.04Å; K150-K152 PolarHBondContact O-N 3.05Å
151K36.6Very low35.1Very low195 Ų195162.2 Ų162.285%0.84880%0.802SS**  trans-51.1109.3174.4-69.6-172.5177.7-174.30108.1P149 K153P149-K151 VanDerWaalsContact C-N 3.32Å; P149-K151 PolarHBondContact O-N 3.47Å; K151-K153 PolarHBondContact O-N 3.31Å
152K35.9Very low35.7Very low203 Ų203166 Ų16688%0.88381%0.811SS**  trans-52.6119.3171.7-73.6179.8177.3175.40106.3K150 R154K150-K152 PolarHBondContact O-N 3.05Å; K152-R154 VanDerWaalsContact C-N 3.27Å; K152-R154 PolarHBondContact O-N 3.32Å
153K33Very low35.9Very low203 Ų203165.1 Ų165.188%0.88381%0.807SS**  trans-65.588.1179.1-73.7-175.2177.3-179.90108.6K151 K155K151-K153 PolarHBondContact O-N 3.31Å; K153-K155 VanDerWaalsContact C-N 3.26Å; K153-K155 PolarHBondContact O-N 2.88Å
154R38.9Very low36.1Very low218 Ų218158.9 Ų158.982%0.82380%0.8SS**  trans-56.896.3163.5-178.9168.9171.8173.2-7.8104.9K152 Q156K152-R154 VanDerWaalsContact C-N 3.27Å; K152-R154 PolarHBondContact O-N 3.32Å; R154-Q156 PolarHBondContact O-N 3.16Å; R154-Q156 VanDerWaalsContact O-N 3.08Å
155K31.4Very low36.7Very low188 Ų188160.6 Ų160.682%0.81781%0.805SS**  trans-51.8120.3-174.3-73.3-178.6177.7178.50107.2K153 R157K153-K155 VanDerWaalsContact C-N 3.26Å; K153-K155 PolarHBondContact O-N 2.88Å; K155-R157 PolarHBondContact O-N 2.9Å
156Q34.6Very low37.7Very low188 Ų188157.4 Ų157.488%0.87979%0.791SS**  trans-60.8113.8166.4-74.7-162.6-20.400106.7R154 S158R154-Q156 PolarHBondContact O-N 3.16Å; R154-Q156 VanDerWaalsContact O-N 3.08Å; Q156-S158 PolarHBondContact O-N 3.38Å
157R38.1Very low38.4Very low240 Ų240160.6 Ų160.691%0.90680%0.804SS**  trans-71.2106.1163.7-76.2-172.8173.1-169-1.3105.4K155K155-R157 PolarHBondContact O-N 2.9Å
158S30.7Very low39.7Very low91 Ų91161.2 Ų161.264%0.63679%0.794SS**  trans-55.5146.3171.938.20000110.2Q156Q156-S158 PolarHBondContact O-N 3.38Å
159P44.5Very low40.8Very low121 Ų121154 Ų15479%0.78678%0.784SS**SBendtrans-62.3143174.128.2-34.6000109.9K161P159-K161 PolarHBondContact O-N 3.32Å
160A41.7Very low41.3Very low94 Ų94152 Ų15278%0.77777%0.773SS**  trans37.278169.700000115.8I162A160-I162 PolarHBondContact O-N 3.26Å; A160-I162 VanDerWaalsContact O-N 3.11Å
161K36.6Very low42Very low202 Ų202148.4 Ų148.488%0.87877%0.768SS**  trans-64.8114.9158.6-168.3179.5-177.9-1720107.4P159P159-K161 PolarHBondContact O-N 3.32Å
162I43.5Very low42.3Very low151 Ų151142.5 Ų142.577%0.77476%0.755SS**PPolyproline II helixtrans-54.7145.8177.6-64.7174.1000109.6A160 G164A160-I162 PolarHBondContact O-N 3.26Å; A160-I162 VanDerWaalsContact O-N 3.11Å; I162-G164 PolarHBondContact O-N 3.3Å
163L43.2Very low43Very low143 Ų143138.9 Ų138.975%0.74975%0.75SS**PPolyproline II helixtrans-47.5121.9-177.5-63.4167.6000111.3
164G37.2Very low43.8Very low70 Ų70133.7 Ų133.772%0.72274%0.737SS**PPolyproline II helixtrans-80.6128.5155.900000107.8I162I162-G164 PolarHBondContact O-N 3.3Å
165M43.9Very low44.6Very low174 Ų174129.9 Ų129.986%0.85773%0.733SS**PPolyproline II helixtrans-80.4137.9166.6-62.6169.767.800107.7
166N52.5Low46.2Very low89 Ų89126 Ų12648%0.47673%0.727SS.*PPolyproline II helixtrans-88.8150.5164.3-57.8-21.9000108.5D168 G169N166-D168 WeakPolarHBondContact CB-OD1 3.42Å; N166-D168 PolarHBondContact O-N 3.43Å; N166-D168 VanDerWaalsContact O-N 3.12Å; N166-G169 PolarHBondContact O-N 3.02Å
167D52.9Low47.6Very low179 Ų179125.6 Ų125.696%0.95772%0.722SS**THydrogen-bonded Turntrans-67.9-12.4-173.2-56.8-66.3000114.1
168D55.2Low49.7Very low110 Ų110118 Ų11859%0.58871%0.705SS**THydrogen-bonded Turntrans-86.4-2.8173.360.6-77.7000114.3N166 S170N166-D168 WeakPolarHBondContact CB-OD1 3.42Å; N166-D168 PolarHBondContact O-N 3.43Å; N166-D168 VanDerWaalsContact O-N 3.12Å; D168-S170 PolarHBondContact O-N 3.14Å; D168-S170 VanDerWaalsContact OD2-CB 3.26Å; D168-S170 WeakPolarHBondContact OD2-CB 3.3Å; D168-S170 PolarHBondContact OD2-N 3.02Å; D168-S170 PolarHBondContact OD2-OG 2.92Å
169G55.3Low52.2Low61 Ų61116.5 Ų116.563%0.62969%0.688SS**  trans72.43.2172.800000116.1N166N166-G169 PolarHBondContact O-N 3.02Å
170S48.2Very low54.3Low68 Ų68114.1 Ų114.148%0.47667%0.671SS.*  trans-76.6131.3177.770.50000112.4D168 A172D168-S170 PolarHBondContact O-N 3.14Å; D168-S170 VanDerWaalsContact OD2-CB 3.26Å; D168-S170 WeakPolarHBondContact OD2-CB 3.3Å; D168-S170 PolarHBondContact OD2-N 3.02Å; D168-S170 PolarHBondContact OD2-OG 2.92Å; S170-A172 PolarHBondContact O-N 2.82Å; S170-A172 VanDerWaalsContact O-N 3.14Å
171V47.6Very low56.7Low128 Ų128109.7 Ų109.778%0.77663%0.634SS**  trans-83.191.8176.2-178.80000109.4V173V171-V173 PolarHBondContact O-N 2.8Å
172A42.5Very low59.1Low72 Ų72106.3 Ų106.360%0.59563%0.631SS**  trans-65.1100.5171.400000110.7S170 P174S170-A172 PolarHBondContact O-N 2.82Å; S170-A172 VanDerWaalsContact O-N 3.14Å; A172-P174 WeakPolarHBondContact O-CD 3.28Å; A172-P174 WeakPolarHBondContact O-CG 3.4Å
173V51.6Low61.2Low126 Ų126104.6 Ų104.676%0.76462%0.619SS**  trans-59.6114.9-176.3179.30000111.5V171 N175V171-V173 PolarHBondContact O-N 2.8Å; V173-N175 PolarHBondContact O-N 3.47Å
174P50.6Low63.5Low95 Ų95100.7 Ų100.762%0.61760%0.603SS**  trans-83.2111.6-173.2-13.830.9000114.1A172A172-P174 WeakPolarHBondContact O-CD 3.28Å; A172-P174 WeakPolarHBondContact O-CG 3.4Å
175N55.3Low66Low138 Ų138103.3 Ų103.374%0.73860%0.6SS**SBendtrans71148.8170.6-74.1-74.6000118.1V173V173-N175 PolarHBondContact O-N 3.47Å
176P63.6Low68.1Low107 Ų10796.7 Ų96.770%0.69557%0.573SS**SBendtrans-83.1139.3-17433-35.6000113.7C178P176-C178 PolarHBondContact O-N 2.89Å
177K65.4Low69.9Low178 Ų17895.6 Ų95.677%0.77458%0.576SS**  trans45.359.6156.5-62.4-177178.8178.40115.9H179K177-H179 PolarHBondContact O-CD2 2.89Å; K177-H179 VanDerWaalsContact O-CD2 3.26Å; K177-H179 PolarHBondContact O-N 3.49Å
178C81.8Confident71.7Confident81 Ų8188.8 Ų88.855%0.54754%0.538SS..  trans-61.4123.7156.8-68.50000109.6P176 F188P176-C178 PolarHBondContact O-N 2.89Å; C178-F188 CarbonylContact C-O 3.53Å; C178-F188 WeakPolarHBondContact CA-O 3.24Å
179H83.9Confident73.2Confident59 Ų5994.8 Ų94.827%0.27355%0.553SS.*EExtended strand (participates in β ladder)trans-90.3113.4178.5-72.6-85.7000109.8K177 F188 T190 N191 L194K177-H179 PolarHBondContact O-CD2 2.89Å; K177-H179 VanDerWaalsContact O-CD2 3.26Å; K177-H179 PolarHBondContact O-N 3.49Å; H179-F188 PolarHBondContact N-O 2.81Å; H179-F188 PolarHBondContact O-N 3.23Å; H179-T190 VanDerWaalsContact CD2-C 3.44Å; H179-N191 PolarHBondContact CD2-N 3.37Å; H179-N191 VanDerWaalsContact CD2-N 3.28Å; H179-N191 PolarHBondContact ND1-ND2 2.95Å; H179-L194 HydrophobicContact CB-CB 4.04Å; H179-L194 HydrophobicContact CB-CD2 3.81Å
180V88.3Confident74.8Confident72 Ų7294.7 Ų94.744%0.43654%0.54SS..EExtended strand (participates in β ladder)trans-95.4137.1-173.8-1770000111.4N185 A186 A187V180-N185 HydrophobicContact CG1-CB 4.33Å; V180-A186 CarbonylContact C-O 3.55Å; V180-A186 WeakPolarHBondContact CA-O 3.37Å; V180-A187 HydrophobicContact CG2-CB 4.19Å
181C91.8Very high76.7Confident0 Ų094.8 Ų94.80%054%0.535CS..  trans-78.4122.7175.5-179.10000111.9H183 C184 N185 A186 F188 L194 H197C181-H183 PolarHBondContact O-N 3.24Å; C181-C184 PolarHBondContact O-N 3.44Å; C181-N185 WeakPolarHBondContact O-CA 3.3Å; C181-N185 PolarHBondContact O-N 2.85Å; C181-A186 HydrophobicContact CB-CB 4.48Å; C181-A186 PolarHBondContact N-O 2.87Å; C181-F188 HydrophobicContact CB-CE2 4.18Å; C181-L194 VanDerWaalsContact CA-CD1 3.44Å; C181-L194 HydrophobicContact CB-CD1 3.55Å; C181-H197 PolarHBondContact SG-CD2 2.9Å
182V87.4Confident78.6Confident132 Ų13295.5 Ų95.580%0.853%0.525SS*.THydrogen-bonded Turntrans-62.8-27.1-179.8-174.70000112.7
183H88Confident80.8Confident115 Ų11595.3 Ų95.353%0.53251%0.511SS..THydrogen-bonded Turntrans-85.4-22.2-175.6-59.2-71000114.8C181 H201C181-H183 PolarHBondContact O-N 3.24Å; H183-H201 HydrophobicContact CB-CB 4.05Å; H183-H201 WeakPolarHBondContact CB-ND1 3.25Å; H183-H201 AromaticContact CD2-CG 3.95Å; H183-H201 AromaticContact CG-CG 3.86Å
184C91.7Very high82.7Confident60 Ų6090.4 Ų90.441%0.40548%0.481SS..THydrogen-bonded Turntrans-147.44.9-176.568.80000115.4C181 A186 H197C181-C184 PolarHBondContact O-N 3.44Å; C184-A186 PolarHBondContact O-N 3.5Å; C184-A186 VanDerWaalsContact O-N 3.12Å; C184-A186 VanDerWaalsContact SG-CB 3.59Å; C184-H197 PolarHBondContact SG-NE2 2.86Å
185N87.9Confident84.4Confident126 Ų12690.9 Ų90.967%0.67448%0.475SS*.  trans5815.9-177.4-61-40000116.2V180 C181V180-N185 HydrophobicContact CG1-CB 4.33Å; C181-N185 WeakPolarHBondContact O-CA 3.3Å; C181-N185 PolarHBondContact O-N 2.85Å
186A88.4Confident86Confident34 Ų3486.3 Ų86.328%0.28145%0.447SS..  trans-64.1134.5170.800000111.1V180 C181 C184 F188V180-A186 CarbonylContact C-O 3.55Å; V180-A186 WeakPolarHBondContact CA-O 3.37Å; C181-A186 HydrophobicContact CB-CB 4.48Å; C181-A186 PolarHBondContact N-O 2.87Å; C184-A186 PolarHBondContact O-N 3.5Å; C184-A186 VanDerWaalsContact O-N 3.12Å; C184-A186 VanDerWaalsContact SG-CB 3.59Å; A186-F188 HydrophobicContact CB-CE2 3.65Å; A186-F188 HydrophobicContact CB-CZ 3.77Å; A186-F188 WeakPolarHBondContact O-CE2 3.42Å
187A90.5Very high87.2Confident66 Ų6682.6 Ų82.655%0.54542%0.421SS..EExtended strand (participates in β ladder)trans-109116.5-172.600000112.2V180V180-A187 HydrophobicContact CG2-CB 4.19Å
188F90.1Very high88.3Confident36 Ų3676.1 Ų76.116%0.15840%0.396CS..EExtended strand (participates in β ladder)trans-104.8148-176.1-60.2-82.8000111.9C178 H179 C181 A186 T190 H193 L194 H197C178-F188 CarbonylContact C-O 3.53Å; C178-F188 WeakPolarHBondContact CA-O 3.24Å; H179-F188 PolarHBondContact N-O 2.81Å; H179-F188 PolarHBondContact O-N 3.23Å; C181-F188 HydrophobicContact CB-CE2 4.18Å; A186-F188 HydrophobicContact CB-CE2 3.65Å; A186-F188 HydrophobicContact CB-CZ 3.77Å; A186-F188 WeakPolarHBondContact O-CE2 3.42Å; F188-T190 VanDerWaalsContact C-N 3.25Å; F188-T190 PolarHBondContact O-N 3.29Å; F188-H193 HydrophobicContact CB-CB 4.13Å; F188-H193 HydrophobicContact CD1-CB 4.04Å; F188-H193 HydrophobicContact CG-CB 4.35Å; F188-L194 HydrophobicContact CB-CB 4.25Å; F188-L194 HydrophobicContact CD2-CB 3.98Å; F188-L194 HydrophobicContact CD2-CD1 3.92Å; F188-L194 HydrophobicContact CE2-CD1 4.2Å; F188-L194 HydrophobicContact CG-CB 4.33Å; F188-H197 HydrophobicContact CE1-CB 4.06Å; F188-H197 HydrophobicContact CE2-CB 3.89Å; F188-H197 AromaticContact CE2-CD2 3.58Å; F188-H197 AromaticContact CE2-CG 3.61Å; F188-H197 HydrophobicContact CZ-CB 3.57Å; F188-H197 AromaticContact CZ-CD2 3.69Å; F188-H197 AromaticContact CZ-CE1 3.92Å; F188-H197 AromaticContact CZ-CG 3.27Å; F188-H197 AromaticContact CZ-ND1 3.45Å; F188-H197 WeakPolarHBondContact CZ-ND1 3.47Å
189R88.4Confident88.7Confident237 Ų23775.2 Ų75.289%0.89438%0.383SS*.SBendtrans-74.7-10.3-179.6-62.6-175.8-172.11458.6114.6
190T88.1Confident88.9Confident59 Ų5977.5 Ų77.536%0.36240%0.396SS..SBendtrans-149.8155.3-177.161.90000110.2H179 F188 Y192 H193 L194H179-T190 VanDerWaalsContact CD2-C 3.44Å; F188-T190 VanDerWaalsContact C-N 3.25Å; F188-T190 PolarHBondContact O-N 3.29Å; T190-Y192 VanDerWaalsContact C-N 3.35Å; T190-Y192 PolarHBondContact O-N 3.43Å; T190-H193 PolarHBondContact O-N 2.88Å; T190-H193 PolarHBondContact OG1-N 2.92Å; T190-H193 PolarHBondContact OG1-ND1 2.88Å; T190-L194 PolarHBondContact O-N 3.34Å
191N88.4Confident88.9Confident69 Ų6977.7 Ų77.737%0.36939%0.392SS..Hα-helixtrans-64-37.9176.3-167.8-93.6000112.6H179 H193 L194 Q195H179-N191 PolarHBondContact CD2-N 3.37Å; H179-N191 VanDerWaalsContact CD2-N 3.28Å; H179-N191 PolarHBondContact ND1-ND2 2.95Å; N191-H193 PolarHBondContact O-N 3.4Å; N191-L194 CarbonylContact O-C 3.6Å; N191-L194 WeakPolarHBondContact O-CA 3.34Å; N191-L194 WeakPolarHBondContact O-CB 3.48Å; N191-L194 PolarHBondContact O-N 3.16Å; N191-L194 VanDerWaalsContact O-N 3.08Å; N191-Q195 PolarHBondContact O-N 3.42Å; N191-Q195 PolarHBondContact OD1-NE2 2.82Å
192Y87.6Confident88.6Confident144 Ų14480.8 Ų80.857%0.56541%0.411SS*.Hα-helixtrans-56.6-45.7177.4175.8-103.6000112.8T190 L194 Q195 R196T190-Y192 VanDerWaalsContact C-N 3.35Å; T190-Y192 PolarHBondContact O-N 3.43Å; Y192-L194 VanDerWaalsContact C-N 3.33Å; Y192-L194 PolarHBondContact O-N 3.13Å; Y192-Q195 PolarHBondContact O-N 3.48Å; Y192-R196 WeakPolarHBondContact O-CB 3.49Å; Y192-R196 PolarHBondContact O-N 3.24Å
193H89.2Confident88.6Confident67 Ų6776.6 Ų76.631%0.3139%0.394SS..Hα-helixtrans-68.1-33177.2-73.179.5000112.1F188 T190 N191 H197F188-H193 HydrophobicContact CB-CB 4.13Å; F188-H193 HydrophobicContact CD1-CB 4.04Å; F188-H193 HydrophobicContact CG-CB 4.35Å; T190-H193 PolarHBondContact O-N 2.88Å; T190-H193 PolarHBondContact OG1-N 2.92Å; T190-H193 PolarHBondContact OG1-ND1 2.88Å; N191-H193 PolarHBondContact O-N 3.4Å; H193-H197 WeakPolarHBondContact O-CB 3.4Å; H193-H197 PolarHBondContact O-N 3.34Å; H193-H197 VanDerWaalsContact O-N 3.1Å
194L89.8Confident88.6Confident23 Ų2376.4 Ų76.412%0.1239%0.394CS..Hα-helixtrans-64.7-49170.3170.760.6000111.6H179 C181 F188 T190 N191 Y192 R196 H197 V198H179-L194 HydrophobicContact CB-CB 4.04Å; H179-L194 HydrophobicContact CB-CD2 3.81Å; C181-L194 VanDerWaalsContact CA-CD1 3.44Å; C181-L194 HydrophobicContact CB-CD1 3.55Å; F188-L194 HydrophobicContact CB-CB 4.25Å; F188-L194 HydrophobicContact CD2-CB 3.98Å; F188-L194 HydrophobicContact CD2-CD1 3.92Å; F188-L194 HydrophobicContact CE2-CD1 4.2Å; F188-L194 HydrophobicContact CG-CB 4.33Å; T190-L194 PolarHBondContact O-N 3.34Å; N191-L194 CarbonylContact O-C 3.6Å; N191-L194 WeakPolarHBondContact O-CA 3.34Å; N191-L194 WeakPolarHBondContact O-CB 3.48Å; N191-L194 PolarHBondContact O-N 3.16Å; N191-L194 VanDerWaalsContact O-N 3.08Å; Y192-L194 VanDerWaalsContact C-N 3.33Å; Y192-L194 PolarHBondContact O-N 3.13Å; L194-R196 PolarHBondContact O-N 3.16Å; L194-H197 CarbonylContact O-C 3.58Å; L194-H197 WeakPolarHBondContact O-CA 3.49Å; L194-H197 WeakPolarHBondContact O-CB 3.41Å; L194-H197 PolarHBondContact O-N 2.61Å; L194-V198 HydrophobicContact CD1-CG2 3.87Å; L194-V198 HydrophobicContact CG-CG2 4.3Å; L194-V198 WeakPolarHBondContact O-CG2 3.4Å; L194-V198 PolarHBondContact O-N 3.27Å
195Q87.4Confident88.5Confident106 Ų10677.8 Ų77.850%0.49539%0.393SS..Hα-helixtrans-58.9-46.1178.4-72.8-179.1-23.300111.6N191 Y192 H197 V198 F199N191-Q195 PolarHBondContact O-N 3.42Å; N191-Q195 PolarHBondContact OD1-NE2 2.82Å; Y192-Q195 PolarHBondContact O-N 3.48Å; Q195-H197 PolarHBondContact O-N 2.87Å; Q195-V198 PolarHBondContact O-N 3.2Å; Q195-V198 VanDerWaalsContact O-N 3.1Å; Q195-F199 WeakPolarHBondContact O-CD2 3.45Å; Q195-F199 PolarHBondContact O-N 3.1Å
196R87.8Confident88.5Confident41 Ų4175 Ų7516%0.15538%0.382CS..Hα-helixtrans-52.1-40.9172.3178178.4114.3-176.8-1.1112.4D54 Y192 L194D54-R196 IonicContact OD1-CZ 2.67Å; D54-R196 IonicContact OD1-NH2 2.72Å; D54-R196 PolarHBondContact OD1-NH2 2.38Å; Y192-R196 WeakPolarHBondContact O-CB 3.49Å; Y192-R196 PolarHBondContact O-N 3.24Å; L194-R196 PolarHBondContact O-N 3.16Å
197H88.6Confident88.6Confident30 Ų3076.9 Ų76.914%0.13938%0.383CS..Hα-helixtrans-77.3-33.6178.4173.187.9000113.2C181 C184 F188 H193 L194 Q195 F199 I200 H201C181-H197 PolarHBondContact SG-CD2 2.9Å; C184-H197 PolarHBondContact SG-NE2 2.86Å; F188-H197 HydrophobicContact CE1-CB 4.06Å; F188-H197 HydrophobicContact CE2-CB 3.89Å; F188-H197 AromaticContact CE2-CD2 3.58Å; F188-H197 AromaticContact CE2-CG 3.61Å; F188-H197 HydrophobicContact CZ-CB 3.57Å; F188-H197 AromaticContact CZ-CD2 3.69Å; F188-H197 AromaticContact CZ-CE1 3.92Å; F188-H197 AromaticContact CZ-CG 3.27Å; F188-H197 AromaticContact CZ-ND1 3.45Å; F188-H197 WeakPolarHBondContact CZ-ND1 3.47Å; H193-H197 WeakPolarHBondContact O-CB 3.4Å; H193-H197 PolarHBondContact O-N 3.34Å; H193-H197 VanDerWaalsContact O-N 3.1Å; L194-H197 CarbonylContact O-C 3.58Å; L194-H197 WeakPolarHBondContact O-CA 3.49Å; L194-H197 WeakPolarHBondContact O-CB 3.41Å; L194-H197 PolarHBondContact O-N 2.61Å; Q195-H197 PolarHBondContact O-N 2.87Å; H197-F199 PolarHBondContact O-N 3.32Å; H197-I200 VanDerWaalsContact O-CB 3.23Å; H197-I200 WeakPolarHBondContact O-CB 3.19Å; H197-I200 WeakPolarHBondContact O-CG1 3.39Å; H197-I200 PolarHBondContact O-N 3.39Å; H197-H201 AromaticContact CD2-CD2 3.93Å; H197-H201 AromaticContact CD2-NE2 3.68Å; H197-H201 AromaticContact CE1-NE2 3.58Å; H197-H201 AromaticContact NE2-CD2 3.66Å; H197-H201 AromaticContact NE2-NE2 2.93Å; H197-H201 PolarHBondContact NE2-NE2 3.1Å
198V89Confident88.7Confident41 Ų4178.6 Ų78.625%0.24838%0.38CS..Hα-helixtrans-60.7-34.5176168.10000111.5L194 Q195 I200 H201 T202L194-V198 HydrophobicContact CD1-CG2 3.87Å; L194-V198 HydrophobicContact CG-CG2 4.3Å; L194-V198 WeakPolarHBondContact O-CG2 3.4Å; L194-V198 PolarHBondContact O-N 3.27Å; Q195-V198 PolarHBondContact O-N 3.2Å; Q195-V198 VanDerWaalsContact O-N 3.1Å; V198-I200 PolarHBondContact O-N 3.1Å; V198-I200 VanDerWaalsContact O-N 3.1Å; V198-H201 WeakPolarHBondContact O-CA 3.28Å; V198-H201 PolarHBondContact O-N 3.43Å; V198-T202 HydrophobicContact CG1-CG2 3.92Å; V198-T202 PolarHBondContact O-N 2.77Å
199F90.3Very high88.9Confident62 Ų6277.1 Ų77.127%0.27238%0.375SS..Hα-helixtrans-59.5-18.5172.2-63.4-42.3000114.7Q195 H197 G203 E204 I217Q195-F199 WeakPolarHBondContact O-CD2 3.45Å; Q195-F199 PolarHBondContact O-N 3.1Å; H197-F199 PolarHBondContact O-N 3.32Å; F199-G203 WeakPolarHBondContact O-CA 3.26Å; F199-G203 PolarHBondContact O-N 3.17Å; F199-G203 VanDerWaalsContact O-N 3.13Å; F199-E204 HydrophobicContact CD1-CB 3.98Å; F199-I217 HydrophobicContact CB-CD1 4.34Å; F199-I217 HydrophobicContact CB-CG1 4.31Å; F199-I217 HydrophobicContact CB-CG2 3.72Å; F199-I217 HydrophobicContact CD2-CG2 3.83Å; F199-I217 HydrophobicContact CG-CG2 4.22Å
200I88.1Confident89Confident108 Ų10870.3 Ų70.355%0.55436%0.363SS*.Hα-helixtrans-72.6-34172.1-53.6175000110.5H197 V198 I217H197-I200 VanDerWaalsContact O-CB 3.23Å; H197-I200 WeakPolarHBondContact O-CB 3.19Å; H197-I200 WeakPolarHBondContact O-CG1 3.39Å; H197-I200 PolarHBondContact O-N 3.39Å; V198-I200 PolarHBondContact O-N 3.1Å; V198-I200 VanDerWaalsContact O-N 3.1Å; I200-I217 HydrophobicContact CG1-CD1 4.07Å
201H88Confident89.1Confident76 Ų7673.7 Ų73.735%0.35238%0.375SS..Hα-helixtrans-86.2-41.9-179.9-60.9-78.3000112.9H183 H197 V198 G203H183-H201 HydrophobicContact CB-CB 4.05Å; H183-H201 WeakPolarHBondContact CB-ND1 3.25Å; H183-H201 AromaticContact CD2-CG 3.95Å; H183-H201 AromaticContact CG-CG 3.86Å; H197-H201 AromaticContact CD2-CD2 3.93Å; H197-H201 AromaticContact CD2-NE2 3.68Å; H197-H201 AromaticContact CE1-NE2 3.58Å; H197-H201 AromaticContact NE2-CD2 3.66Å; H197-H201 AromaticContact NE2-NE2 2.93Å; H197-H201 PolarHBondContact NE2-NE2 3.1Å; V198-H201 WeakPolarHBondContact O-CA 3.28Å; V198-H201 PolarHBondContact O-N 3.43Å; H201-G203 PolarHBondContact O-N 2.66Å
202T86.4Confident89.3Confident64 Ų6472.1 Ų72.139%0.39337%0.369SS..Hα-helixtrans-73.3-19.8175.464.80000112.2V198 E204V198-T202 HydrophobicContact CG1-CG2 3.92Å; V198-T202 PolarHBondContact O-N 2.77Å; T202-E204 VanDerWaalsContact CB-OE2 3.26Å; T202-E204 WeakPolarHBondContact CB-OE2 3.17Å; T202-E204 PolarHBondContact O-N 3.43Å; T202-E204 WeakPolarHBondContact OG1-CB 3.22Å; T202-E204 WeakPolarHBondContact OG1-CG 3.41Å; T202-E204 PolarHBondContact OG1-N 3.28Å; T202-E204 PolarHBondContact OG1-OE2 3.38Å
203G87.4Confident89.5Confident44 Ų4472 Ų7245%0.45438%0.378SS..  trans70.44.9-174.800000113.6F199 H201F199-G203 WeakPolarHBondContact O-CA 3.26Å; F199-G203 PolarHBondContact O-N 3.17Å; F199-G203 VanDerWaalsContact O-N 3.13Å; H201-G203 PolarHBondContact O-N 2.66Å
204E87.2Confident89.5Confident111 Ų11174.1 Ų74.152%0.51939%0.389SS..  trans-68.4135.4179.7-67.3167.3133.600111F199 T202F199-E204 HydrophobicContact CD1-CB 3.98Å; T202-E204 VanDerWaalsContact CB-OE2 3.26Å; T202-E204 WeakPolarHBondContact CB-OE2 3.17Å; T202-E204 PolarHBondContact O-N 3.43Å; T202-E204 WeakPolarHBondContact OG1-CB 3.22Å; T202-E204 WeakPolarHBondContact OG1-CG 3.41Å; T202-E204 PolarHBondContact OG1-N 3.28Å; T202-E204 PolarHBondContact OG1-OE2 3.38Å
205K89.9Confident89.7Confident90 Ų9079 Ų7939%0.39141%0.406SS..  trans-135.786.5-174.4-67.9-178.5-161.5176.70108.4F207 R215 F216 I217K205-F207 PolarHBondContact O-N 3.04Å; K205-R215 HydrophobicContact CB-CB 3.45Å; K205-R215 VanDerWaalsContact CB-CB 3.45Å; K205-R215 HydrophobicContact CD-CB 4.36Å; K205-R215 WeakPolarHBondContact CD-O 3.47Å; K205-R215 VanDerWaalsContact O-CZ 3.28Å; K205-R215 PolarHBondContact O-NE 3.12Å; K205-R215 PolarHBondContact O-NH2 3.15Å; K205-F216 CarbonylContact C-O 3.48Å; K205-F216 VanDerWaalsContact C-O 3.3Å; K205-F216 WeakPolarHBondContact CA-O 3.28Å; K205-I217 HydrophobicContact CG-CG1 3.93Å
206P87.6Confident89.9Confident68 Ų6875.8 Ų75.844%0.44239%0.391SS..  trans-63.2-28-170.419.7-30000113.4Q208P206-Q208 PolarHBondContact O-N 3.48Å
207F90.2Very high90Very high72 Ų7275.6 Ų75.632%0.31639%0.392SS..EExtended strand (participates in β ladder)trans-94.196.8-175.5-55.6-77000111.8K205 R215 F216 I217 K219 L222K205-F207 PolarHBondContact O-N 3.04Å; F207-R215 CarbonylContact O-C 3.53Å; F207-R215 WeakPolarHBondContact O-CA 3.15Å; F207-F216 HydrophobicContact CB-CB 4.39Å; F207-F216 PolarHBondContact N-O 2.64Å; F207-F216 VanDerWaalsContact N-O 3.13Å; F207-F216 PolarHBondContact O-N 3.24Å; F207-I217 WeakPolarHBondContact CD2-O 3.15Å; F207-I217 WeakPolarHBondContact CE2-O 3.42Å; F207-K219 HydrophobicContact CD1-CB 4Å; F207-K219 HydrophobicContact CD1-CG 4.35Å; F207-K219 HydrophobicContact CE1-CB 3.79Å; F207-K219 HydrophobicContact CE1-CG 4.29Å; F207-K219 HydrophobicContact CE2-CB 4.46Å; F207-K219 HydrophobicContact CG-CB 4.43Å; F207-K219 HydrophobicContact CZ-CB 4.04Å; F207-L222 HydrophobicContact CB-CB 4.17Å; F207-L222 HydrophobicContact CB-CD2 3.96Å
208Q92.8Very high90.1Very high102 Ų10275.4 Ų75.448%0.47739%0.391SS..EExtended strand (participates in β ladder)trans-83.7144.6172.6-176.3163.9-15.200111.6P206 R215 L222P206-Q208 PolarHBondContact O-N 3.48Å; Q208-R215 HydrophobicContact CB-CG 3.95Å; Q208-R215 HydrophobicContact CG-CG 4Å; Q208-L222 WeakPolarHBondContact O-CD2 3.45Å
209C94.4Very high90.1Very high6 Ų679.9 Ų79.94%0.04141%0.407CS..  trans-79140172.2-171.90000111.9Q211 C212 M214 F216 L222 H229C209-Q211 VanDerWaalsContact C-N 3.26Å; C209-Q211 PolarHBondContact O-N 3.3Å; C209-Q211 PolarHBondContact SG-N 2.85Å; C209-C212 WeakPolarHBondContact CB-O 3.32Å; C209-M214 PolarHBondContact N-O 3Å; C209-F216 HydrophobicContact CB-CE2 4.48Å; C209-L222 VanDerWaalsContact CA-CD1 3.48Å; C209-L222 HydrophobicContact CB-CD1 3.53Å; C209-H229 PolarHBondContact SG-NE2 2.87Å
210S91.1Very high90.1Very high93 Ų9381.7 Ų81.765%0.6541%0.413SS*.SBendtrans-69-21.8175.4530000113.7
211Q89.4Confident90.3Very high130 Ų13078.3 Ų78.361%0.60740%0.396SS*.SBendtrans-105.7-7.8-173.7-60.1-64.7-23.700113.9C209 H229C209-Q211 VanDerWaalsContact C-N 3.26Å; C209-Q211 PolarHBondContact O-N 3.3Å; C209-Q211 PolarHBondContact SG-N 2.85Å; Q211-H229 HydrophobicContact CB-CB 4.21Å; Q211-H229 HydrophobicContact CG-CB 4.26Å; Q211-H229 PolarHBondContact O-CE1 3.23Å
212C92.9Very high90.5Very high36 Ų3675.5 Ų75.524%0.24338%0.384CS..SBendtrans-167.5164.8169.265.70000112C209 M214 H225 H229C209-C212 WeakPolarHBondContact CB-O 3.32Å; C212-M214 PolarHBondContact O-N 3.31Å; C212-H225 PolarHBondContact SG-NE2 3.24Å; C212-H225 VanDerWaalsContact SG-NE2 3.39Å; C212-H229 WeakPolarHBondContact CB-CE1 3.44Å; C212-H229 PolarHBondContact SG-CE1 3.34Å; C212-H229 PolarHBondContact SG-NE2 3.32Å
213D91Very high90.7Very high141 Ų14177.2 Ų77.275%0.75439%0.387SS*.SBendtrans-68.812.9-176.9-43.5-70.5000115.2R215D213-R215 PolarHBondContact O-N 2.89Å
214M90.8Very high90.9Very high112 Ų11278.6 Ų78.655%0.55238%0.379SS*.  trans-71.1122.4173.7-75-69.1-175.800110.5C209 C212 F216C209-M214 PolarHBondContact N-O 3Å; C212-M214 PolarHBondContact O-N 3.31Å; M214-F216 HydrophobicContact CB-CE2 3.77Å; M214-F216 HydrophobicContact CB-CZ 3.83Å; M214-F216 WeakPolarHBondContact O-CE2 3.39Å
215R92.9Very high91.1Very high126 Ų12674.7 Ų74.748%0.47536%0.36SS..EExtended strand (participates in β ladder)trans-109145.3176.2-57.6-179.261.3169.53110.8K205 F207 Q208 D213K205-R215 HydrophobicContact CB-CB 3.45Å; K205-R215 VanDerWaalsContact CB-CB 3.45Å; K205-R215 HydrophobicContact CD-CB 4.36Å; K205-R215 WeakPolarHBondContact CD-O 3.47Å; K205-R215 VanDerWaalsContact O-CZ 3.28Å; K205-R215 PolarHBondContact O-NE 3.12Å; K205-R215 PolarHBondContact O-NH2 3.15Å; F207-R215 CarbonylContact O-C 3.53Å; F207-R215 WeakPolarHBondContact O-CA 3.15Å; Q208-R215 HydrophobicContact CB-CG 3.95Å; Q208-R215 HydrophobicContact CG-CG 4Å; D213-R215 PolarHBondContact O-N 2.89Å
216F91.3Very high91.2Very high39 Ų3973 Ų7317%0.17135%0.354CS..EExtended strand (participates in β ladder)trans-127.2152.1-176-59.3-84.4000112K205 F207 C209 M214 L221 L222 H225K205-F216 CarbonylContact C-O 3.48Å; K205-F216 VanDerWaalsContact C-O 3.3Å; K205-F216 WeakPolarHBondContact CA-O 3.28Å; F207-F216 HydrophobicContact CB-CB 4.39Å; F207-F216 PolarHBondContact N-O 2.64Å; F207-F216 VanDerWaalsContact N-O 3.13Å; F207-F216 PolarHBondContact O-N 3.24Å; C209-F216 HydrophobicContact CB-CE2 4.48Å; M214-F216 HydrophobicContact CB-CE2 3.77Å; M214-F216 HydrophobicContact CB-CZ 3.83Å; M214-F216 WeakPolarHBondContact O-CE2 3.39Å; F216-L221 HydrophobicContact CB-CB 4.12Å; F216-L221 HydrophobicContact CD1-CB 4.02Å; F216-L221 HydrophobicContact CG-CB 4.31Å; F216-L222 HydrophobicContact CB-CB 4.41Å; F216-L222 HydrophobicContact CD2-CB 3.95Å; F216-L222 HydrophobicContact CD2-CD1 4.01Å; F216-L222 HydrophobicContact CE2-CD1 4.18Å; F216-L222 HydrophobicContact CG-CB 4.36Å; F216-H225 HydrophobicContact CE1-CB 4.05Å; F216-H225 HydrophobicContact CE2-CB 3.86Å; F216-H225 AromaticContact CE2-CD2 3.57Å; F216-H225 AromaticContact CE2-CG 3.66Å; F216-H225 HydrophobicContact CZ-CB 3.49Å; F216-H225 VanDerWaalsContact CZ-CB 3.49Å; F216-H225 AromaticContact CZ-CD2 3.61Å; F216-H225 AromaticContact CZ-CG 3.26Å; F216-H225 AromaticContact CZ-ND1 3.58Å
217I90.8Very high91.4Very high37 Ų3773.6 Ų73.619%0.1935%0.349CS..SBendtrans-74.7-27177.2-61.5177.6000111.4F199 I200 K205 F207F199-I217 HydrophobicContact CB-CD1 4.34Å; F199-I217 HydrophobicContact CB-CG1 4.31Å; F199-I217 HydrophobicContact CB-CG2 3.72Å; F199-I217 HydrophobicContact CD2-CG2 3.83Å; F199-I217 HydrophobicContact CG-CG2 4.22Å; I200-I217 HydrophobicContact CG1-CD1 4.07Å; K205-I217 HydrophobicContact CG-CG1 3.93Å; F207-I217 WeakPolarHBondContact CD2-O 3.15Å; F207-I217 WeakPolarHBondContact CE2-O 3.42Å
218Q90Very high91.4Very high26 Ų2675.1 Ų75.112%0.12136%0.36CS..SBendtrans-136.2145.6-173-51.8-168.372.300112.6Y220 L221 L222Q218-Y220 HydrophobicContact CB-CD1 3.89Å; Q218-Y220 HydrophobicContact CB-CE1 3.81Å; Q218-Y220 VanDerWaalsContact CD-CE1 3.47Å; Q218-Y220 HydrophobicContact CG-CE1 4.26Å; Q218-Y220 PolarHBondContact NE2-OH 3.47Å; Q218-Y220 PolarHBondContact O-N 2.81Å; Q218-L221 HydrophobicContact CB-CD1 3.92Å; Q218-L221 HydrophobicContact CB-CG 4.08Å; Q218-L221 HydrophobicContact CG-CD1 4.11Å; Q218-L221 WeakPolarHBondContact O-CB 3.27Å; Q218-L221 PolarHBondContact O-N 3.46Å; Q218-L221 VanDerWaalsContact O-N 3.11Å; Q218-L222 PolarHBondContact O-N 3.48Å
219K90.4Very high91.3Very high134 Ų13474.6 Ų74.658%0.58336%0.357SS*.Hα-helixtrans-60.6-39.1-177.1-170174.8179.2178.40113.6F207 L221 L222 Q223F207-K219 HydrophobicContact CD1-CB 4Å; F207-K219 HydrophobicContact CD1-CG 4.35Å; F207-K219 HydrophobicContact CE1-CB 3.79Å; F207-K219 HydrophobicContact CE1-CG 4.29Å; F207-K219 HydrophobicContact CE2-CB 4.46Å; F207-K219 HydrophobicContact CG-CB 4.43Å; F207-K219 HydrophobicContact CZ-CB 4.04Å; K219-L221 VanDerWaalsContact C-N 3.3Å; K219-L221 PolarHBondContact O-N 2.88Å; K219-L222 WeakPolarHBondContact O-CB 3.28Å; K219-L222 PolarHBondContact O-N 3.17Å; K219-Q223 PolarHBondContact O-N 2.93Å
220Y89.5Confident91Very high100 Ų10078.4 Ų78.439%0.39238%0.381SS..Hα-helixtrans-67.8-30.3177.480.4-92.4000112.4Q218 L222 Q223 R224Q218-Y220 HydrophobicContact CB-CD1 3.89Å; Q218-Y220 HydrophobicContact CB-CE1 3.81Å; Q218-Y220 VanDerWaalsContact CD-CE1 3.47Å; Q218-Y220 HydrophobicContact CG-CE1 4.26Å; Q218-Y220 PolarHBondContact NE2-OH 3.47Å; Q218-Y220 PolarHBondContact O-N 2.81Å; Y220-L222 VanDerWaalsContact C-N 3.35Å; Y220-Q223 PolarHBondContact O-N 2.82Å; Y220-R224 WeakPolarHBondContact O-CB 3.37Å; Y220-R224 PolarHBondContact O-N 3.45Å
221L91.9Very high90.9Very high37 Ų3776 Ų7619%0.19437%0.37CS..Hα-helixtrans-67.4-38174.7-63.2173.5000111F216 Q218 K219 R224 H225F216-L221 HydrophobicContact CB-CB 4.12Å; F216-L221 HydrophobicContact CD1-CB 4.02Å; F216-L221 HydrophobicContact CG-CB 4.31Å; Q218-L221 HydrophobicContact CB-CD1 3.92Å; Q218-L221 HydrophobicContact CB-CG 4.08Å; Q218-L221 HydrophobicContact CG-CD1 4.11Å; Q218-L221 WeakPolarHBondContact O-CB 3.27Å; Q218-L221 PolarHBondContact O-N 3.46Å; Q218-L221 VanDerWaalsContact O-N 3.11Å; K219-L221 VanDerWaalsContact C-N 3.3Å; K219-L221 PolarHBondContact O-N 2.88Å; L221-R224 VanDerWaalsContact CD2-NH2 3.25Å; L221-H225 WeakPolarHBondContact O-CB 3.49Å; L221-H225 PolarHBondContact O-N 2.87Å
222L93.3Very high90.9Very high18 Ų1874.6 Ų74.69%0.09436%0.364CS..Hα-helixtrans-63.1-53.2170.9169.658.8000111.2F207 Q208 C209 F216 Q218 K219 Y220 R224 H225 E226F207-L222 HydrophobicContact CB-CB 4.17Å; F207-L222 HydrophobicContact CB-CD2 3.96Å; Q208-L222 WeakPolarHBondContact O-CD2 3.45Å; C209-L222 VanDerWaalsContact CA-CD1 3.48Å; C209-L222 HydrophobicContact CB-CD1 3.53Å; F216-L222 HydrophobicContact CB-CB 4.41Å; F216-L222 HydrophobicContact CD2-CB 3.95Å; F216-L222 HydrophobicContact CD2-CD1 4.01Å; F216-L222 HydrophobicContact CE2-CD1 4.18Å; F216-L222 HydrophobicContact CG-CB 4.36Å; Q218-L222 PolarHBondContact O-N 3.48Å; K219-L222 WeakPolarHBondContact O-CB 3.28Å; K219-L222 PolarHBondContact O-N 3.17Å; Y220-L222 VanDerWaalsContact C-N 3.35Å; L222-R224 PolarHBondContact O-N 3.46Å; L222-H225 CarbonylContact O-C 3.58Å; L222-H225 WeakPolarHBondContact O-CA 3.45Å; L222-H225 VanDerWaalsContact O-CB 3.31Å; L222-H225 WeakPolarHBondContact O-CB 3.33Å; L222-H225 PolarHBondContact O-N 3.27Å; L222-E226 HydrophobicContact CD1-CG 3.81Å; L222-E226 HydrophobicContact CG-CG 4.35Å; L222-E226 WeakPolarHBondContact O-CG 3.36Å; L222-E226 PolarHBondContact O-N 2.87Å
223Q90.6Very high90.8Very high99 Ų9976.8 Ų76.846%0.46337%0.369SS..Hα-helixtrans-58.3-36.6177.9-69.5175.1-34.400112.7K219 Y220 H225 E226 K227K219-Q223 PolarHBondContact O-N 2.93Å; Y220-Q223 PolarHBondContact O-N 2.82Å; Q223-H225 VanDerWaalsContact C-N 3.28Å; Q223-H225 PolarHBondContact O-N 3.22Å; Q223-E226 PolarHBondContact O-N 3.46Å; Q223-K227 PolarHBondContact O-N 2.99Å
224R90.9Very high90.7Very high73 Ų7373.3 Ų73.328%0.27535%0.354SS..Hα-helixtrans-69.5-23.8174.7-170.2170.879.5170.66.1112.7Y220 L221 L222 Q246Y220-R224 WeakPolarHBondContact O-CB 3.37Å; Y220-R224 PolarHBondContact O-N 3.45Å; L221-R224 VanDerWaalsContact CD2-NH2 3.25Å; L222-R224 PolarHBondContact O-N 3.46Å; R224-Q246 HydrophobicContact CG-CG 4.29Å
225H92.5Very high90.8Very high29 Ų2971.4 Ų71.413%0.13434%0.343CS..Hα-helixtrans-85.2-36.7172.3173.879.3000112.6C212 F216 L221 L222 Q223 K227 I228 H229C212-H225 PolarHBondContact SG-NE2 3.24Å; C212-H225 VanDerWaalsContact SG-NE2 3.39Å; F216-H225 HydrophobicContact CE1-CB 4.05Å; F216-H225 HydrophobicContact CE2-CB 3.86Å; F216-H225 AromaticContact CE2-CD2 3.57Å; F216-H225 AromaticContact CE2-CG 3.66Å; F216-H225 HydrophobicContact CZ-CB 3.49Å; F216-H225 VanDerWaalsContact CZ-CB 3.49Å; F216-H225 AromaticContact CZ-CD2 3.61Å; F216-H225 AromaticContact CZ-CG 3.26Å; F216-H225 AromaticContact CZ-ND1 3.58Å; L221-H225 WeakPolarHBondContact O-CB 3.49Å; L221-H225 PolarHBondContact O-N 2.87Å; L222-H225 CarbonylContact O-C 3.58Å; L222-H225 WeakPolarHBondContact O-CA 3.45Å; L222-H225 VanDerWaalsContact O-CB 3.31Å; L222-H225 WeakPolarHBondContact O-CB 3.33Å; L222-H225 PolarHBondContact O-N 3.27Å; Q223-H225 VanDerWaalsContact C-N 3.28Å; Q223-H225 PolarHBondContact O-N 3.22Å; H225-K227 PolarHBondContact O-N 3.46Å; H225-I228 WeakPolarHBondContact O-CA 3.44Å; H225-I228 WeakPolarHBondContact O-CB 3.44Å; H225-I228 WeakPolarHBondContact O-CG1 3.46Å; H225-I228 PolarHBondContact O-N 3.02Å; H225-H229 AromaticContact CD2-NE2 3.16Å; H225-H229 PolarHBondContact CD2-NE2 3.34Å; H225-H229 AromaticContact CE1-NE2 3.34Å; H225-H229 PolarHBondContact CE1-NE2 3.24Å; H225-H229 VanDerWaalsContact CE1-NE2 3.34Å; H225-H229 AromaticContact NE2-CD2 3.75Å; H225-H229 AromaticContact NE2-NE2 2.38Å; H225-H229 PolarHBondContact NE2-NE2 3.35Å
226E91.2Very high90.9Very high56 Ų5672.9 Ų72.926%0.26235%0.348SS..Hα-helixtrans-60.6-33.2178-73.1170.7146.400112.1L222 Q223 I228 H229 T230L222-E226 HydrophobicContact CD1-CG 3.81Å; L222-E226 HydrophobicContact CG-CG 4.35Å; L222-E226 WeakPolarHBondContact O-CG 3.36Å; L222-E226 PolarHBondContact O-N 2.87Å; Q223-E226 PolarHBondContact O-N 3.46Å; E226-I228 PolarHBondContact O-N 3.38Å; E226-I228 VanDerWaalsContact O-N 3.1Å; E226-H229 WeakPolarHBondContact O-CA 3.49Å; E226-H229 WeakPolarHBondContact O-CB 3.32Å; E226-H229 PolarHBondContact O-N 3.2Å; E226-T230 PolarHBondContact O-N 3Å
227K92.1Very high91Very high79 Ų7971 Ų7134%0.34334%0.34SS..Hα-helixtrans-60.4-15.5169.9-67.5175.3-179.3178.50114.7Q223 H225 G231 E232 I245Q223-K227 PolarHBondContact O-N 2.99Å; H225-K227 PolarHBondContact O-N 3.46Å; K227-G231 CarbonylContact O-C 3.54Å; K227-G231 PolarHBondContact O-N 3.2Å; K227-E232 HydrophobicContact CB-CB 4.22Å; K227-E232 HydrophobicContact CG-CB 4.18Å; K227-E232 PolarHBondContact O-N 3Å; K227-E232 VanDerWaalsContact O-N 3.14Å; K227-I245 HydrophobicContact CB-CG2 3.66Å; K227-I245 HydrophobicContact CD-CG2 4.32Å
228I90.8Very high91.1Very high104 Ų10474.8 Ų74.853%0.53336%0.361SS..Hα-helixtrans-77.3-35171.1-53.3173.3000110.4H225 E226 I245H225-I228 WeakPolarHBondContact O-CA 3.44Å; H225-I228 WeakPolarHBondContact O-CB 3.44Å; H225-I228 WeakPolarHBondContact O-CG1 3.46Å; H225-I228 PolarHBondContact O-N 3.02Å; E226-I228 PolarHBondContact O-N 3.38Å; E226-I228 VanDerWaalsContact O-N 3.1Å; I228-I245 HydrophobicContact CB-CD1 4.31Å; I228-I245 HydrophobicContact CG1-CD1 3.66Å
229H89.9Confident91.1Very high91 Ų9179 Ų7942%0.42138%0.38SS..Hα-helixtrans-78.4-42.7177.9-66-78.7000112.1C209 Q211 C212 H225 E226 G231C209-H229 PolarHBondContact SG-NE2 2.87Å; Q211-H229 HydrophobicContact CB-CB 4.21Å; Q211-H229 HydrophobicContact CG-CB 4.26Å; Q211-H229 PolarHBondContact O-CE1 3.23Å; C212-H229 WeakPolarHBondContact CB-CE1 3.44Å; C212-H229 PolarHBondContact SG-CE1 3.34Å; C212-H229 PolarHBondContact SG-NE2 3.32Å; H225-H229 AromaticContact CD2-NE2 3.16Å; H225-H229 PolarHBondContact CD2-NE2 3.34Å; H225-H229 AromaticContact CE1-NE2 3.34Å; H225-H229 PolarHBondContact CE1-NE2 3.24Å; H225-H229 VanDerWaalsContact CE1-NE2 3.34Å; H225-H229 AromaticContact NE2-CD2 3.75Å; H225-H229 AromaticContact NE2-NE2 2.38Å; H225-H229 PolarHBondContact NE2-NE2 3.35Å; E226-H229 WeakPolarHBondContact O-CA 3.49Å; E226-H229 WeakPolarHBondContact O-CB 3.32Å; E226-H229 PolarHBondContact O-N 3.2Å; H229-G231 PolarHBondContact O-N 3.24Å
230T88.6Confident91.2Very high87 Ų8775.2 Ų75.253%0.53437%0.371SS..SBendtrans-72-13.5173.867.30000113E226 E232E226-T230 PolarHBondContact O-N 3Å; T230-E232 WeakPolarHBondContact CB-OE1 3.47Å; T230-E232 PolarHBondContact O-N 3.29Å; T230-E232 WeakPolarHBondContact OG1-CB 3.07Å; T230-E232 VanDerWaalsContact OG1-CD 3.27Å; T230-E232 VanDerWaalsContact OG1-CG 3.28Å; T230-E232 WeakPolarHBondContact OG1-CG 3.29Å; T230-E232 PolarHBondContact OG1-N 2.89Å; T230-E232 PolarHBondContact OG1-OE1 3.01Å
231G89.1Confident91.3Very high42 Ų4271.7 Ų71.743%0.43336%0.364SS..  trans70.79.1-175.100000113.9K227 H229 K233K227-G231 CarbonylContact O-C 3.54Å; K227-G231 PolarHBondContact O-N 3.2Å; H229-G231 PolarHBondContact O-N 3.24Å; G231-K233 WeakPolarHBondContact O-CG 3.39Å; G231-K233 PolarHBondContact O-N 2.94Å
232E88.6Confident91.3Very high101 Ų10173.7 Ų73.747%0.47237%0.374SS..  trans-61.9104.9-179-85169.5-122.600112.3K227 T230 P234K227-E232 HydrophobicContact CB-CB 4.22Å; K227-E232 HydrophobicContact CG-CB 4.18Å; K227-E232 PolarHBondContact O-N 3Å; K227-E232 VanDerWaalsContact O-N 3.14Å; T230-E232 WeakPolarHBondContact CB-OE1 3.47Å; T230-E232 PolarHBondContact O-N 3.29Å; T230-E232 WeakPolarHBondContact OG1-CB 3.07Å; T230-E232 VanDerWaalsContact OG1-CD 3.27Å; T230-E232 VanDerWaalsContact OG1-CG 3.28Å; T230-E232 WeakPolarHBondContact OG1-CG 3.29Å; T230-E232 PolarHBondContact OG1-N 2.89Å; T230-E232 PolarHBondContact OG1-OE1 3.01Å; E232-P234 VanDerWaalsContact C-CD 3.41Å; E232-P234 WeakPolarHBondContact O-CD 3.5Å
233K90.9Very high91.2Very high81 Ų8179.7 Ų79.735%0.35240%0.395SS..  trans-112.376.2175.6-68.1163.8175.1-176.90109.1G231 F235 R243 F244 I245G231-K233 WeakPolarHBondContact O-CG 3.39Å; G231-K233 PolarHBondContact O-N 2.94Å; K233-F235 VanDerWaalsContact C-N 3.34Å; K233-F235 PolarHBondContact O-N 3.11Å; K233-R243 HydrophobicContact CB-CB 3.48Å; K233-R243 VanDerWaalsContact CB-CB 3.48Å; K233-R243 HydrophobicContact CD-CB 4.28Å; K233-R243 WeakPolarHBondContact CD-O 3.34Å; K233-R243 HydrophobicContact CG-CB 4.45Å; K233-R243 VanDerWaalsContact O-CZ 3.26Å; K233-R243 PolarHBondContact O-NE 3.46Å; K233-R243 PolarHBondContact O-NH2 3.19Å; K233-F244 CarbonylContact C-O 3.55Å; K233-F244 VanDerWaalsContact C-O 3.22Å; K233-F244 VanDerWaalsContact CA-O 3.27Å; K233-F244 WeakPolarHBondContact CA-O 3.31Å; K233-I245 HydrophobicContact CG-CG1 3.85Å
234P89.8Confident91.3Very high68 Ų6876.9 Ų76.944%0.44238%0.382SS..  trans-64.1-35.4-174.522.7-32.5000113.1E232 R236E232-P234 VanDerWaalsContact C-CD 3.41Å; E232-P234 WeakPolarHBondContact O-CD 3.5Å; P234-R236 PolarHBondContact O-N 3.48Å
235F92.4Very high91.4Very high73 Ų7375.2 Ų75.232%0.3238%0.378SS..EExtended strand (participates in β ladder)trans-84.3107-174.9-55.4-78.5000111.3K233 R243 F244 I245 K247 M250K233-F235 VanDerWaalsContact C-N 3.34Å; K233-F235 PolarHBondContact O-N 3.11Å; F235-R243 CarbonylContact O-C 3.22Å; F235-R243 WeakPolarHBondContact O-CA 3.49Å; F235-F244 HydrophobicContact CB-CB 4.48Å; F235-F244 PolarHBondContact N-O 3Å; F235-F244 VanDerWaalsContact N-O 3.1Å; F235-F244 PolarHBondContact O-N 3.32Å; F235-I245 WeakPolarHBondContact CE2-O 3.4Å; F235-K247 HydrophobicContact CD1-CB 3.96Å; F235-K247 HydrophobicContact CD1-CG 4.47Å; F235-K247 VanDerWaalsContact CD2-N 3.34Å; F235-K247 HydrophobicContact CE1-CB 3.69Å; F235-K247 HydrophobicContact CE1-CD 4.5Å; F235-K247 HydrophobicContact CE1-CG 4.26Å; F235-K247 HydrophobicContact CE2-CB 4.29Å; F235-K247 HydrophobicContact CG-CB 4.38Å; F235-K247 HydrophobicContact CZ-CB 3.87Å; F235-M250 HydrophobicContact CB-CB 3.98Å; F235-M250 HydrophobicContact CB-CG 4.31Å
236R93.6Very high91.3Very high156 Ų15675.6 Ų75.659%0.58938%0.379SS*.EExtended strand (participates in β ladder)trans-87.4142.5173-176.4172.1176.2159.11.7110.4P234 R243 M250P234-R236 PolarHBondContact O-N 3.48Å; R236-R243 HydrophobicContact CB-CG 4.39Å; R236-R243 HydrophobicContact CG-CG 4.43Å; R236-M250 WeakPolarHBondContact O-CG 3.11Å
237C94.6Very high91.3Very high0 Ų076.6 Ų76.60%038%0.383CS..  trans-88.7125.5162.4179.20000108.8E239 G241 M242 F244 M250C237-E239 VanDerWaalsContact C-N 3.34Å; C237-E239 PolarHBondContact O-N 3.24Å; C237-G241 WeakPolarHBondContact O-CA 3.36Å; C237-G241 PolarHBondContact O-N 2.73Å; C237-M242 PolarHBondContact N-O 2.62Å; C237-F244 HydrophobicContact CB-CE2 4.14Å; C237-M250 HydrophobicContact CB-CG 4.22Å
238D91.8Very high91.2Very high116 Ų11676.9 Ų76.962%0.6238%0.382SS*.THydrogen-bonded Turntrans-71.3-31.8-173-45.4-70.1000112.4K254D238-K254 WeakPolarHBondContact OD2-CE 3.37Å; D238-K254 IonicContact OD2-NZ 2.66Å; D238-K254 PolarHBondContact OD2-NZ 3.25Å
239E91.3Very high91.2Very high114 Ų11474.6 Ų74.653%0.53337%0.369SS..THydrogen-bonded Turntrans-75.1-29.2-173.3-63.6162.4-97.700113.5C237 K254 H257C237-E239 VanDerWaalsContact C-N 3.34Å; C237-E239 PolarHBondContact O-N 3.24Å; E239-K254 WeakPolarHBondContact OE1-CG 3.22Å; E239-H257 IonicContact OE1-CD2 3.7Å; E239-H257 WeakPolarHBondContact OE2-CB 3.44Å; E239-H257 IonicContact OE2-CD2 2.66Å; E239-H257 IonicContact OE2-CG 3.83Å
240C92.2Very high91.4Very high56 Ų5671.3 Ų71.338%0.37836%0.355SS..THydrogen-bonded Turntrans-132-3.5-175.368.10000114.3M242 H253 H257C240-M242 HydrophobicContact CB-CG 4.46Å; C240-M242 PolarHBondContact O-N 2.81Å; C240-M242 VanDerWaalsContact O-N 3.15Å; C240-M242 VanDerWaalsContact SG-CB 3.56Å; C240-M242 VanDerWaalsContact SG-CG 3.58Å; C240-M242 PolarHBondContact SG-N 3.39Å; C240-H253 PolarHBondContact SG-NE2 3.29Å; C240-H257 PolarHBondContact SG-NE2 2.9Å
241G90.6Very high91.5Very high25 Ų2571 Ų7126%0.25835%0.347SS..  trans73-7.2-17700000116C237C237-G241 WeakPolarHBondContact O-CA 3.36Å; C237-G241 PolarHBondContact O-N 2.73Å
242M91.8Very high91.5Very high79 Ų7972.3 Ų72.339%0.38934%0.339SS..  trans-60.8137.6-178.2-68.8-68.7-82.800111.5C237 C240 F244C237-M242 PolarHBondContact N-O 2.62Å; C240-M242 HydrophobicContact CB-CG 4.46Å; C240-M242 PolarHBondContact O-N 2.81Å; C240-M242 VanDerWaalsContact O-N 3.15Å; C240-M242 VanDerWaalsContact SG-CB 3.56Å; C240-M242 VanDerWaalsContact SG-CG 3.58Å; C240-M242 PolarHBondContact SG-N 3.39Å; M242-F244 HydrophobicContact CB-CE2 3.8Å; M242-F244 HydrophobicContact CB-CZ 3.94Å; M242-F244 WeakPolarHBondContact O-CE2 3.39Å
243R92.9Very high91.6Very high145 Ų14569.4 Ų69.455%0.54733%0.325SS..EExtended strand (participates in β ladder)trans-110141.1-176-56.9-177.764.1169.32.3111.6K233 F235 R236K233-R243 HydrophobicContact CB-CB 3.48Å; K233-R243 VanDerWaalsContact CB-CB 3.48Å; K233-R243 HydrophobicContact CD-CB 4.28Å; K233-R243 WeakPolarHBondContact CD-O 3.34Å; K233-R243 HydrophobicContact CG-CB 4.45Å; K233-R243 VanDerWaalsContact O-CZ 3.26Å; K233-R243 PolarHBondContact O-NE 3.46Å; K233-R243 PolarHBondContact O-NH2 3.19Å; F235-R243 CarbonylContact O-C 3.22Å; F235-R243 WeakPolarHBondContact O-CA 3.49Å; R236-R243 HydrophobicContact CB-CG 4.39Å; R236-R243 HydrophobicContact CG-CG 4.43Å
244F91.8Very high91.6Very high40 Ų4068.5 Ų68.518%0.17532%0.321CS..EExtended strand (participates in β ladder)trans-129.2152.3-175.5-58.1-88.7000111.6K233 F235 C237 M242 Q246 H249 M250 H253K233-F244 CarbonylContact C-O 3.55Å; K233-F244 VanDerWaalsContact C-O 3.22Å; K233-F244 VanDerWaalsContact CA-O 3.27Å; K233-F244 WeakPolarHBondContact CA-O 3.31Å; F235-F244 HydrophobicContact CB-CB 4.48Å; F235-F244 PolarHBondContact N-O 3Å; F235-F244 VanDerWaalsContact N-O 3.1Å; F235-F244 PolarHBondContact O-N 3.32Å; C237-F244 HydrophobicContact CB-CE2 4.14Å; M242-F244 HydrophobicContact CB-CE2 3.8Å; M242-F244 HydrophobicContact CB-CZ 3.94Å; M242-F244 WeakPolarHBondContact O-CE2 3.39Å; F244-Q246 VanDerWaalsContact C-N 3.34Å; F244-H249 HydrophobicContact CB-CB 4.25Å; F244-H249 HydrophobicContact CD1-CB 4.19Å; F244-H249 HydrophobicContact CG-CB 4.47Å; F244-M250 HydrophobicContact CB-CB 4.13Å; F244-M250 HydrophobicContact CD2-CB 3.67Å; F244-M250 HydrophobicContact CD2-CG 3.98Å; F244-M250 HydrophobicContact CE2-CB 4.47Å; F244-M250 HydrophobicContact CG-CB 4.06Å; F244-H253 HydrophobicContact CE1-CB 4.14Å; F244-H253 HydrophobicContact CE2-CB 4.09Å; F244-H253 AromaticContact CE2-CD2 3.45Å; F244-H253 VanDerWaalsContact CE2-CD2 3.45Å; F244-H253 WeakPolarHBondContact CE2-CD2 3.07Å; F244-H253 AromaticContact CE2-CG 3.94Å; F244-H253 HydrophobicContact CZ-CB 3.64Å; F244-H253 AromaticContact CZ-CD2 3.28Å; F244-H253 WeakPolarHBondContact CZ-CD2 3.33Å; F244-H253 AromaticContact CZ-CG 3.41Å; F244-H253 VanDerWaalsContact CZ-CG 3.41Å; F244-H253 AromaticContact CZ-NE2 3.91Å
245I92.1Very high91.6Very high38 Ų3868.5 Ų68.520%0.19531%0.313CS..SBendtrans-76.9-23.4179-56.7179.8000111.5K227 I228 K233 F235K227-I245 HydrophobicContact CB-CG2 3.66Å; K227-I245 HydrophobicContact CD-CG2 4.32Å; I228-I245 HydrophobicContact CB-CD1 4.31Å; I228-I245 HydrophobicContact CG1-CD1 3.66Å; K233-I245 HydrophobicContact CG-CG1 3.85Å; F235-I245 WeakPolarHBondContact CE2-O 3.4Å
246Q91.8Very high91.4Very high36 Ų3669 Ų6917%0.16832%0.321CS..SBendtrans-133.8142.7-171.2-63.1166.218.200111.4R224 F244 Y248 H249 M250R224-Q246 HydrophobicContact CG-CG 4.29Å; F244-Q246 VanDerWaalsContact C-N 3.34Å; Q246-Y248 HydrophobicContact CB-CD1 4.34Å; Q246-Y248 HydrophobicContact CB-CE1 4.32Å; Q246-Y248 PolarHBondContact OE1-OH 3.34Å; Q246-H249 HydrophobicContact CB-CB 4.2Å; Q246-H249 WeakPolarHBondContact O-CB 3.34Å; Q246-H249 PolarHBondContact O-N 3.25Å; Q246-H249 PolarHBondContact OE1-CE1 3.42Å; Q246-H249 VanDerWaalsContact OE1-CE1 3.23Å; Q246-H249 PolarHBondContact OE1-ND1 3.24Å; Q246-M250 PolarHBondContact O-N 3.13Å
247K91.2Very high91.1Very high78 Ų7865.2 Ų65.234%0.33931%0.31SS..Hα-helixtrans-58.3-54-177.6-179.9175.6160-167.70112.5D59 F235 H249 M250 E251D59-K247 VanDerWaalsContact CG-NZ 3.34Å; D59-K247 IonicContact OD1-NZ 2.73Å; D59-K247 PolarHBondContact OD1-NZ 2.93Å; D59-K247 IonicContact OD2-NZ 3.33Å; D59-K247 PolarHBondContact OD2-NZ 2.83Å; D59-K247 VanDerWaalsContact OD2-NZ 3.13Å; F235-K247 HydrophobicContact CD1-CB 3.96Å; F235-K247 HydrophobicContact CD1-CG 4.47Å; F235-K247 VanDerWaalsContact CD2-N 3.34Å; F235-K247 HydrophobicContact CE1-CB 3.69Å; F235-K247 HydrophobicContact CE1-CD 4.5Å; F235-K247 HydrophobicContact CE1-CG 4.26Å; F235-K247 HydrophobicContact CE2-CB 4.29Å; F235-K247 HydrophobicContact CG-CB 4.38Å; F235-K247 HydrophobicContact CZ-CB 3.87Å; K247-H249 PolarHBondContact O-N 3.13Å; K247-M250 WeakPolarHBondContact O-CA 3.1Å; K247-M250 WeakPolarHBondContact O-CB 3.32Å; K247-M250 PolarHBondContact O-N 2.67Å; K247-E251 PolarHBondContact O-N 3.43Å
248Y89.6Confident90.7Very high84 Ų8468.2 Ų68.233%0.32933%0.331SS..Hα-helixtrans-64.3-25.117982.4-98.7000113.4Q246 R252Q246-Y248 HydrophobicContact CB-CD1 4.34Å; Q246-Y248 HydrophobicContact CB-CE1 4.32Å; Q246-Y248 PolarHBondContact OE1-OH 3.34Å; Y248-R252 WeakPolarHBondContact O-CB 3.27Å; Y248-R252 PolarHBondContact O-N 2.83Å
249H91.4Very high90.4Very high57 Ų5764.8 Ų64.826%0.26432%0.324SS..Hα-helixtrans-66.4-40.9172.2-86.545.1000111.5F244 Q246 K247 R252 H253F244-H249 HydrophobicContact CB-CB 4.25Å; F244-H249 HydrophobicContact CD1-CB 4.19Å; F244-H249 HydrophobicContact CG-CB 4.47Å; Q246-H249 HydrophobicContact CB-CB 4.2Å; Q246-H249 WeakPolarHBondContact O-CB 3.34Å; Q246-H249 PolarHBondContact O-N 3.25Å; Q246-H249 PolarHBondContact OE1-CE1 3.42Å; Q246-H249 VanDerWaalsContact OE1-CE1 3.23Å; Q246-H249 PolarHBondContact OE1-ND1 3.24Å; K247-H249 PolarHBondContact O-N 3.13Å; H249-R252 PolarHBondContact CD2-NH2 2.78Å; H249-R252 PolarHBondContact CE1-NH2 3.11Å; H249-R252 VanDerWaalsContact CE1-NH2 3.34Å; H249-R252 VanDerWaalsContact CG-NH2 3.29Å; H249-R252 PolarHBondContact ND1-NH2 3.27Å; H249-R252 PolarHBondContact NE2-NH2 3.38Å; H249-H253 WeakPolarHBondContact O-CB 3.39Å; H249-H253 PolarHBondContact O-N 3.1Å; H249-H253 VanDerWaalsContact O-N 3.11Å
250M94.1Very high90.1Very high22 Ų2264.1 Ų64.111%0.10832%0.32CS..Hα-helixtrans-68.6-45.2175.8178.3-77.5-64.300111.3F235 R236 C237 F244 Q246 K247 R252 H253 K254F235-M250 HydrophobicContact CB-CB 3.98Å; F235-M250 HydrophobicContact CB-CG 4.31Å; R236-M250 WeakPolarHBondContact O-CG 3.11Å; C237-M250 HydrophobicContact CB-CG 4.22Å; F244-M250 HydrophobicContact CB-CB 4.13Å; F244-M250 HydrophobicContact CD2-CB 3.67Å; F244-M250 HydrophobicContact CD2-CG 3.98Å; F244-M250 HydrophobicContact CE2-CB 4.47Å; F244-M250 HydrophobicContact CG-CB 4.06Å; Q246-M250 PolarHBondContact O-N 3.13Å; K247-M250 WeakPolarHBondContact O-CA 3.1Å; K247-M250 WeakPolarHBondContact O-CB 3.32Å; K247-M250 PolarHBondContact O-N 2.67Å; M250-R252 PolarHBondContact O-N 2.72Å; M250-H253 CarbonylContact O-C 3.54Å; M250-H253 WeakPolarHBondContact O-CA 3.49Å; M250-H253 WeakPolarHBondContact O-CB 3.4Å; M250-H253 PolarHBondContact O-N 3.41Å; M250-K254 PolarHBondContact O-N 3.44Å; M250-K254 HydrophobicContact SD-CD 3.77Å; M250-K254 VanDerWaalsContact SD-CE 3.53Å; M250-K254 HydrophobicContact SD-CG 3.96Å
251E90.1Very high89.8Confident79 Ų7967.3 Ų67.337%0.36933%0.328SS..Hα-helixtrans-63.4-42.9176.4-68.3179-168.400112.6K247 H253 K254 R255K247-E251 PolarHBondContact O-N 3.43Å; E251-H253 PolarHBondContact O-N 2.97Å; E251-K254 PolarHBondContact O-N 3.18Å; E251-K254 VanDerWaalsContact O-N 3.15Å; E251-R255 PolarHBondContact O-N 3.41Å
252R89.6Confident89.6Confident70 Ų7069.9 Ų69.926%0.26434%0.34SS..Hα-helixtrans-62.3-24.1172.8-175.4-177.866.1-165.4-5.1112.2Y248 H249 M250 R274Y248-R252 WeakPolarHBondContact O-CB 3.27Å; Y248-R252 PolarHBondContact O-N 2.83Å; H249-R252 PolarHBondContact CD2-NH2 2.78Å; H249-R252 PolarHBondContact CE1-NH2 3.11Å; H249-R252 VanDerWaalsContact CE1-NH2 3.34Å; H249-R252 VanDerWaalsContact CG-NH2 3.29Å; H249-R252 PolarHBondContact ND1-NH2 3.27Å; H249-R252 PolarHBondContact NE2-NH2 3.38Å; M250-R252 PolarHBondContact O-N 2.72Å; R252-R274 HydrophobicContact CG-CG 4.22Å
253H91.1Very high89.4Confident41 Ų4170 Ų7019%0.1934%0.337CS..Hα-helixtrans-81.3-38.2172177.259.5000112.5C240 F244 H249 M250 E251 R255 T256 H257C240-H253 PolarHBondContact SG-NE2 3.29Å; F244-H253 HydrophobicContact CE1-CB 4.14Å; F244-H253 HydrophobicContact CE2-CB 4.09Å; F244-H253 AromaticContact CE2-CD2 3.45Å; F244-H253 VanDerWaalsContact CE2-CD2 3.45Å; F244-H253 WeakPolarHBondContact CE2-CD2 3.07Å; F244-H253 AromaticContact CE2-CG 3.94Å; F244-H253 HydrophobicContact CZ-CB 3.64Å; F244-H253 AromaticContact CZ-CD2 3.28Å; F244-H253 WeakPolarHBondContact CZ-CD2 3.33Å; F244-H253 AromaticContact CZ-CG 3.41Å; F244-H253 VanDerWaalsContact CZ-CG 3.41Å; F244-H253 AromaticContact CZ-NE2 3.91Å; H249-H253 WeakPolarHBondContact O-CB 3.39Å; H249-H253 PolarHBondContact O-N 3.1Å; H249-H253 VanDerWaalsContact O-N 3.11Å; M250-H253 CarbonylContact O-C 3.54Å; M250-H253 WeakPolarHBondContact O-CA 3.49Å; M250-H253 WeakPolarHBondContact O-CB 3.4Å; M250-H253 PolarHBondContact O-N 3.41Å; E251-H253 PolarHBondContact O-N 2.97Å; H253-R255 PolarHBondContact O-N 3.38Å; H253-T256 PolarHBondContact ND1-OG1 3.39Å; H253-T256 WeakPolarHBondContact O-CA 3.44Å; H253-T256 VanDerWaalsContact O-CB 3.32Å; H253-T256 WeakPolarHBondContact O-CB 3.38Å; H253-T256 PolarHBondContact O-N 3.07Å; H253-T256 PolarHBondContact O-OG1 3.12Å; H253-H257 AromaticContact CD2-NE2 3.91Å; H253-H257 AromaticContact CE1-CE1 3.98Å; H253-H257 AromaticContact CE1-NE2 3.8Å; H253-H257 AromaticContact NE2-CE1 3.89Å; H253-H257 AromaticContact NE2-NE2 3.37Å; H253-H257 PolarHBondContact NE2-NE2 2.86Å
254K90Very high89.4Confident62 Ų6266.6 Ų66.627%0.2733%0.327SS..Hα-helixtrans-55-37.9172.5-72-169.8165.3179.70112.7D238 E239 M250 E251 T256 H257 S258D238-K254 WeakPolarHBondContact OD2-CE 3.37Å; D238-K254 IonicContact OD2-NZ 2.66Å; D238-K254 PolarHBondContact OD2-NZ 3.25Å; E239-K254 WeakPolarHBondContact OE1-CG 3.22Å; M250-K254 PolarHBondContact O-N 3.44Å; M250-K254 HydrophobicContact SD-CD 3.77Å; M250-K254 VanDerWaalsContact SD-CE 3.53Å; M250-K254 HydrophobicContact SD-CG 3.96Å; E251-K254 PolarHBondContact O-N 3.18Å; E251-K254 VanDerWaalsContact O-N 3.15Å; K254-T256 PolarHBondContact O-N 2.79Å; K254-H257 WeakPolarHBondContact O-CB 3.38Å; K254-H257 PolarHBondContact O-N 3.25Å; K254-S258 PolarHBondContact O-N 3.05Å; K254-S258 VanDerWaalsContact O-N 3.12Å
255R89.3Confident89.4Confident68 Ų6864.7 Ų64.726%0.25732%0.319SS..Hα-helixtrans-60-12.3171.4-61.9-179.1-161.1136.415.1115E251 H253 G259 E260E251-R255 PolarHBondContact O-N 3.41Å; H253-R255 PolarHBondContact O-N 3.38Å; R255-G259 PolarHBondContact O-N 3.22Å; R255-E260 HydrophobicContact CB-CB 4.5Å; R255-E260 HydrophobicContact CG-CB 4.49Å
256T88.3Confident89.3Confident82 Ų8267.8 Ų67.850%0.50334%0.336SS..Hα-helixtrans-85.3-19.5172.170.60000113.2H253 K254H253-T256 PolarHBondContact ND1-OG1 3.39Å; H253-T256 WeakPolarHBondContact O-CA 3.44Å; H253-T256 VanDerWaalsContact O-CB 3.32Å; H253-T256 WeakPolarHBondContact O-CB 3.38Å; H253-T256 PolarHBondContact O-N 3.07Å; H253-T256 PolarHBondContact O-OG1 3.12Å; K254-T256 PolarHBondContact O-N 2.79Å
257H87.9Confident89Confident77 Ų7772.1 Ų72.136%0.35635%0.351SS..Hα-helixtrans-88.8-49.2172-57.4-49.1000111.4E239 C240 H253 K254 G259E239-H257 IonicContact OE1-CD2 3.7Å; E239-H257 WeakPolarHBondContact OE2-CB 3.44Å; E239-H257 IonicContact OE2-CD2 2.66Å; E239-H257 IonicContact OE2-CG 3.83Å; C240-H257 PolarHBondContact SG-NE2 2.9Å; H253-H257 AromaticContact CD2-NE2 3.91Å; H253-H257 AromaticContact CE1-CE1 3.98Å; H253-H257 AromaticContact CE1-NE2 3.8Å; H253-H257 AromaticContact NE2-CE1 3.89Å; H253-H257 AromaticContact NE2-NE2 3.37Å; H253-H257 PolarHBondContact NE2-NE2 2.86Å; K254-H257 WeakPolarHBondContact O-CB 3.38Å; K254-H257 PolarHBondContact O-N 3.25Å; H257-G259 PolarHBondContact O-N 3.18Å
258S85.4Confident89Confident63 Ų6370 Ų7044%0.44135%0.346SS..SBendtrans-67.7-13.9176.669.10000113.8K254 E260K254-S258 PolarHBondContact O-N 3.05Å; K254-S258 VanDerWaalsContact O-N 3.12Å; S258-E260 VanDerWaalsContact CB-OE1 3.27Å; S258-E260 WeakPolarHBondContact CB-OE1 3.31Å; S258-E260 PolarHBondContact O-N 3.2Å; S258-E260 WeakPolarHBondContact OG-CG 3.15Å; S258-E260 PolarHBondContact OG-OE1 3.37Å
259G85.6Confident88.9Confident45 Ų4571.8 Ų71.846%0.46436%0.357SS..  trans69.97.8179.100000114.5R255 H257 K261R255-G259 PolarHBondContact O-N 3.22Å; H257-G259 PolarHBondContact O-N 3.18Å; G259-K261 PolarHBondContact O-N 2.82Å
260E85.9Confident88.7Confident99 Ų9973.1 Ų73.146%0.46336%0.364SS..  trans-55.6130.3-177.2-81.8165.7-119.600112.9R255 S258 P262 S273R255-E260 HydrophobicContact CB-CB 4.5Å; R255-E260 HydrophobicContact CG-CB 4.49Å; S258-E260 VanDerWaalsContact CB-OE1 3.27Å; S258-E260 WeakPolarHBondContact CB-OE1 3.31Å; S258-E260 PolarHBondContact O-N 3.2Å; S258-E260 WeakPolarHBondContact OG-CG 3.15Å; S258-E260 PolarHBondContact OG-OE1 3.37Å; E260-P262 VanDerWaalsContact C-CD 3.48Å; E260-S273 WeakPolarHBondContact O-CA 3.19Å; E260-S273 WeakPolarHBondContact O-CB 3.37Å
261K85.6Confident88.5Confident124 Ų12478.6 Ų78.654%0.53938%0.384SS..  trans-127.665.3178.6-67.5166.8-176.3175.30111.3G259 Y263 F272G259-K261 PolarHBondContact O-N 2.82Å; K261-Y263 PolarHBondContact O-N 2.93Å; K261-F272 CarbonylContact C-O 3.3Å; K261-F272 VanDerWaalsContact C-O 3.28Å; K261-F272 VanDerWaalsContact CA-O 3.29Å; K261-F272 WeakPolarHBondContact CA-O 3.24Å
262P85.9Confident88.4Confident79 Ų7976.8 Ų76.851%0.51338%0.375SS..  trans-72-12.7-17230.4-36000113.8E260E260-P262 VanDerWaalsContact C-CD 3.48Å
263Y88.2Confident88.3Confident81 Ų8175.2 Ų75.232%0.31837%0.374SS..EExtended strand (participates in β ladder)trans-102.2114.9-177.5-49-74.9000110.8K261 Y271 F272 T275K261-Y263 PolarHBondContact O-N 2.93Å; Y263-Y271 CarbonylContact O-C 3.53Å; Y263-F272 PolarHBondContact N-O 2.94Å; Y263-F272 PolarHBondContact O-N 3.44Å; Y263-T275 HydrophobicContact CD1-CG2 3.54Å; Y263-T275 HydrophobicContact CD2-CG2 4.36Å; Y263-T275 HydrophobicContact CE1-CG2 3.44Å; Y263-T275 VanDerWaalsContact CE1-CG2 3.44Å; Y263-T275 HydrophobicContact CE2-CG2 4.26Å; Y263-T275 HydrophobicContact CG-CG2 4.01Å
264Q91.8Very high88.1Confident73 Ų7376.8 Ų76.834%0.34138%0.379SS..EExtended strand (participates in β ladder)trans-91.8152.6175.9-162.1171.72400111H269 Q270 Y271 V278Q264-H269 WeakPolarHBondContact CG-O 3.48Å; Q264-H269 VanDerWaalsContact NE2-CB 3.31Å; Q264-H269 PolarHBondContact NE2-O 3.37Å; Q264-Q270 CarbonylContact C-O 3.28Å; Q264-Q270 WeakPolarHBondContact CA-O 3.29Å; Q264-Y271 HydrophobicContact CB-CD1 3.93Å; Q264-Y271 HydrophobicContact CB-CE1 3.89Å; Q264-Y271 HydrophobicContact CG-CD1 3.99Å; Q264-Y271 HydrophobicContact CG-CE1 3.78Å; Q264-Y271 HydrophobicContact CG-CG 4.46Å; Q264-Y271 PolarHBondContact NE2-OH 2.98Å; Q264-V278 WeakPolarHBondContact O-CG1 3.46Å
265C91.9Very high88Confident0 Ų077.4 Ų77.40%039%0.388CS..  trans-93.9121.8167.6-177.50000110.6Y267 C268 H269 Q270 F272 V278C265-Y267 PolarHBondContact O-N 3.12Å; C265-Y267 VanDerWaalsContact O-N 3.1Å; C265-C268 PolarHBondContact O-N 2.81Å; C265-C268 VanDerWaalsContact SG-SG 3.7Å; C265-H269 VanDerWaalsContact O-CA 3.3Å; C265-H269 WeakPolarHBondContact O-CA 3.46Å; C265-H269 PolarHBondContact O-N 3.23Å; C265-Q270 PolarHBondContact N-O 2.84Å; C265-F272 HydrophobicContact CB-CE2 4.06Å; C265-V278 HydrophobicContact CB-CG1 3.94Å
266D90.3Very high88Confident103 Ų10375.7 Ų75.755%0.55138%0.384SS*.THydrogen-bonded Turntrans-57-31.7-172.3-33.8-66.8000113.5H269 R282D266-H269 PolarHBondContact O-CE1 3.35Å; D266-R282 IonicContact OD2-NH1 2.69Å
267Y86.9Confident88Confident127 Ų12778.3 Ų78.350%0.49839%0.385SS..THydrogen-bonded Turntrans-92.1-15-170.1-67.5-110.2000115C265 R282 H286C265-Y267 PolarHBondContact O-N 3.12Å; C265-Y267 VanDerWaalsContact O-N 3.1Å; Y267-R282 HydrophobicContact CD2-CG 4.19Å; Y267-R282 HydrophobicContact CE2-CG 4.05Å; Y267-H286 VanDerWaalsContact CB-CE1 3.44Å; Y267-H286 WeakPolarHBondContact CB-CE1 3.38Å; Y267-H286 WeakPolarHBondContact CB-ND1 3.27Å; Y267-H286 HydrophobicContact CD1-CB 4.03Å; Y267-H286 HydrophobicContact CG-CB 4.25Å; Y267-H286 AromaticContact CG-CG 3.95Å
268C89.7Confident88.2Confident34 Ų3475.2 Ų75.223%0.2337%0.371CS..THydrogen-bonded Turntrans-145.63-174.7680000113.8C265 Q270 H281C265-C268 PolarHBondContact O-N 2.81Å; C265-C268 VanDerWaalsContact SG-SG 3.7Å; C268-Q270 PolarHBondContact O-N 3.35Å; C268-H281 PolarHBondContact SG-NE2 3.1Å
269H87.6Confident88.5Confident121 Ų12176.1 Ų76.156%0.5637%0.371SS*.  trans56.311.9178.1-58.6-55.6000115.9Q264 C265 D266 Y271Q264-H269 WeakPolarHBondContact CG-O 3.48Å; Q264-H269 VanDerWaalsContact NE2-CB 3.31Å; Q264-H269 PolarHBondContact NE2-O 3.37Å; C265-H269 VanDerWaalsContact O-CA 3.3Å; C265-H269 WeakPolarHBondContact O-CA 3.46Å; C265-H269 PolarHBondContact O-N 3.23Å; D266-H269 PolarHBondContact O-CE1 3.35Å; H269-Y271 WeakPolarHBondContact O-CD2 3.27Å; H269-Y271 WeakPolarHBondContact O-CE2 3.37Å
270Q87.8Confident88.6Confident86 Ų8679.1 Ų79.140%0.40237%0.371SS..  trans-70.6139.7174.8-69.1-169.21.600111.5Q264 C265 C268 F272 H281Q264-Q270 CarbonylContact C-O 3.28Å; Q264-Q270 WeakPolarHBondContact CA-O 3.29Å; C265-Q270 PolarHBondContact N-O 2.84Å; C268-Q270 PolarHBondContact O-N 3.35Å; Q270-F272 HydrophobicContact CB-CE2 3.65Å; Q270-F272 HydrophobicContact CB-CZ 3.97Å; Q270-F272 WeakPolarHBondContact O-CD2 3.47Å; Q270-F272 WeakPolarHBondContact O-CE2 3.34Å; Q270-H281 PolarHBondContact OE1-CE1 3.33Å
271Y89.8Confident88.8Confident137 Ų13775.7 Ų75.754%0.53736%0.355SS..EExtended strand (participates in β ladder)trans-100.8138.7-177.3-64.2-87.9000112.1Y263 Q264 H269Y263-Y271 CarbonylContact O-C 3.53Å; Q264-Y271 HydrophobicContact CB-CD1 3.93Å; Q264-Y271 HydrophobicContact CB-CE1 3.89Å; Q264-Y271 HydrophobicContact CG-CD1 3.99Å; Q264-Y271 HydrophobicContact CG-CE1 3.78Å; Q264-Y271 HydrophobicContact CG-CG 4.46Å; Q264-Y271 PolarHBondContact NE2-OH 2.98Å; H269-Y271 WeakPolarHBondContact O-CD2 3.27Å; H269-Y271 WeakPolarHBondContact O-CE2 3.37Å
272F88.3Confident89Confident41 Ų4173.8 Ų73.818%0.1834%0.344CS..EExtended strand (participates in β ladder)trans-134.3149.1-177.2-58.9-95.2000111.3K261 Y263 C265 Q270 R274 R277 V278 H281K261-F272 CarbonylContact C-O 3.3Å; K261-F272 VanDerWaalsContact C-O 3.28Å; K261-F272 VanDerWaalsContact CA-O 3.29Å; K261-F272 WeakPolarHBondContact CA-O 3.24Å; Y263-F272 PolarHBondContact N-O 2.94Å; Y263-F272 PolarHBondContact O-N 3.44Å; C265-F272 HydrophobicContact CB-CE2 4.06Å; Q270-F272 HydrophobicContact CB-CE2 3.65Å; Q270-F272 HydrophobicContact CB-CZ 3.97Å; Q270-F272 WeakPolarHBondContact O-CD2 3.47Å; Q270-F272 WeakPolarHBondContact O-CE2 3.34Å; F272-R274 VanDerWaalsContact C-N 3.27Å; F272-R274 PolarHBondContact O-N 2.96Å; F272-R277 HydrophobicContact CB-CB 4.21Å; F272-R277 HydrophobicContact CD1-CB 3.92Å; F272-R277 HydrophobicContact CG-CB 4.34Å; F272-V278 HydrophobicContact CB-CG2 3.86Å; F272-V278 HydrophobicContact CD2-CG2 3.74Å; F272-V278 HydrophobicContact CG-CG2 4.05Å; F272-H281 HydrophobicContact CE1-CB 4.25Å; F272-H281 HydrophobicContact CE2-CB 4.35Å; F272-H281 HydrophobicContact CZ-CB 3.81Å; F272-H281 AromaticContact CZ-CG 3.6Å; F272-H281 AromaticContact CZ-ND1 3.52Å
273S87.4Confident89.2Confident36 Ų3676.1 Ų76.125%0.25234%0.343SS..SBendtrans-77.9-6.7179.255.50000114.6E260E260-S273 WeakPolarHBondContact O-CA 3.19Å; E260-S273 WeakPolarHBondContact O-CB 3.37Å
274R86.3Confident89.2Confident74 Ų7478.5 Ų78.528%0.27936%0.358SS..SBendtrans-148137.9-174.6-67.8165.750.2134.82.4111.8R252 F272 D276 R277 V278R252-R274 HydrophobicContact CG-CG 4.22Å; F272-R274 VanDerWaalsContact C-N 3.27Å; F272-R274 PolarHBondContact O-N 2.96Å; R274-D276 WeakPolarHBondContact CB-OD1 3.43Å; R274-D276 IonicContact CZ-OD1 3.67Å; R274-D276 IonicContact NE-OD1 3.29Å; R274-D276 PolarHBondContact NE-OD1 3.43Å; R274-D276 VanDerWaalsContact NH2-CG 3.28Å; R274-D276 IonicContact NH2-OD1 3.21Å; R274-D276 PolarHBondContact NH2-OD1 3.41Å; R274-D276 IonicContact NH2-OD2 2.81Å; R274-D276 PolarHBondContact NH2-OD2 2.8Å; R274-D276 PolarHBondContact O-N 3.06Å; R274-R277 HydrophobicContact CB-CG 4.01Å; R274-R277 WeakPolarHBondContact O-CB 3.39Å; R274-R277 PolarHBondContact O-N 2.77Å; R274-R277 VanDerWaalsContact O-N 3.12Å; R274-V278 PolarHBondContact O-N 3.39Å
275T88.4Confident88.9Confident76 Ų7677.4 Ų77.447%0.46636%0.358SS..Hα-helixtrans-53.6-46.5173.848.10000112.8Y263 R277 V278 L279Y263-T275 HydrophobicContact CD1-CG2 3.54Å; Y263-T275 HydrophobicContact CD2-CG2 4.36Å; Y263-T275 HydrophobicContact CE1-CG2 3.44Å; Y263-T275 VanDerWaalsContact CE1-CG2 3.44Å; Y263-T275 HydrophobicContact CE2-CG2 4.26Å; Y263-T275 HydrophobicContact CG-CG2 4.01Å; T275-R277 PolarHBondContact O-N 3.17Å; T275-V278 WeakPolarHBondContact O-CA 3.41Å; T275-V278 WeakPolarHBondContact O-CB 3.28Å; T275-V278 PolarHBondContact O-N 3.01Å; T275-L279 PolarHBondContact O-N 3.4Å
276D89Confident88.5Confident31 Ų3178.5 Ų78.517%0.16636%0.363CS..Hα-helixtrans-60.5-24-179.287.7-69000113.1R274 K280R274-D276 WeakPolarHBondContact CB-OD1 3.43Å; R274-D276 IonicContact CZ-OD1 3.67Å; R274-D276 IonicContact NE-OD1 3.29Å; R274-D276 PolarHBondContact NE-OD1 3.43Å; R274-D276 VanDerWaalsContact NH2-CG 3.28Å; R274-D276 IonicContact NH2-OD1 3.21Å; R274-D276 PolarHBondContact NH2-OD1 3.41Å; R274-D276 IonicContact NH2-OD2 2.81Å; R274-D276 PolarHBondContact NH2-OD2 2.8Å; R274-D276 PolarHBondContact O-N 3.06Å; D276-K280 VanDerWaalsContact O-CB 3.31Å; D276-K280 WeakPolarHBondContact O-CB 3.4Å; D276-K280 WeakPolarHBondContact O-CD 3.48Å; D276-K280 WeakPolarHBondContact O-CG 3.42Å; D276-K280 PolarHBondContact O-N 3.04Å; D276-K280 VanDerWaalsContact O-N 3.1Å; D276-K280 IonicContact OD2-NZ 3.13Å; D276-K280 PolarHBondContact OD2-NZ 2.9Å
277R89.7Confident88Confident138 Ų13876.3 Ų76.352%0.52135%0.349SS..Hα-helixtrans-79.9-37.3174.7-59.2-58.3-174.8151.74.3111.9F272 R274 T275 H281F272-R277 HydrophobicContact CB-CB 4.21Å; F272-R277 HydrophobicContact CD1-CB 3.92Å; F272-R277 HydrophobicContact CG-CB 4.34Å; R274-R277 HydrophobicContact CB-CG 4.01Å; R274-R277 WeakPolarHBondContact O-CB 3.39Å; R274-R277 PolarHBondContact O-N 2.77Å; R274-R277 VanDerWaalsContact O-N 3.12Å; T275-R277 PolarHBondContact O-N 3.17Å; R277-H281 VanDerWaalsContact O-CB 3.24Å; R277-H281 WeakPolarHBondContact O-CB 3.42Å; R277-H281 PolarHBondContact O-N 3.11Å
278V91.6Very high87.3Confident12 Ų1273.5 Ų73.57%0.07334%0.343CS..Hα-helixtrans-60.1-49.8169.1-1760000110.3Q264 C265 F272 R274 T275 K280 H281 R282Q264-V278 WeakPolarHBondContact O-CG1 3.46Å; C265-V278 HydrophobicContact CB-CG1 3.94Å; F272-V278 HydrophobicContact CB-CG2 3.86Å; F272-V278 HydrophobicContact CD2-CG2 3.74Å; F272-V278 HydrophobicContact CG-CG2 4.05Å; R274-V278 PolarHBondContact O-N 3.39Å; T275-V278 WeakPolarHBondContact O-CA 3.41Å; T275-V278 WeakPolarHBondContact O-CB 3.28Å; T275-V278 PolarHBondContact O-N 3.01Å; V278-K280 PolarHBondContact O-N 2.92Å; V278-H281 WeakPolarHBondContact O-CB 3.39Å; V278-H281 PolarHBondContact O-N 2.83Å; V278-R282 WeakPolarHBondContact O-CB 3.5Å; V278-R282 PolarHBondContact O-N 3Å
279L90.2Very high86.1Confident82 Ų8278.2 Ų78.243%0.42936%0.356SS..Hα-helixtrans-63-42.9-178.2-65.4175.6000112.1T275 R282 R283T275-L279 PolarHBondContact O-N 3.4Å; L279-R282 PolarHBondContact O-N 3.25Å; L279-R283 WeakPolarHBondContact O-CB 3.37Å; L279-R283 PolarHBondContact O-N 3.02Å
280K89.5Confident84.8Confident107 Ų10776.3 Ų76.347%0.46535%0.347SS..Hα-helixtrans-66.4-37.8174.9-71.7162.7-164.6164.80111.8D276 V278 M284D276-K280 VanDerWaalsContact O-CB 3.31Å; D276-K280 WeakPolarHBondContact O-CB 3.4Å; D276-K280 WeakPolarHBondContact O-CD 3.48Å; D276-K280 WeakPolarHBondContact O-CG 3.42Å; D276-K280 PolarHBondContact O-N 3.04Å; D276-K280 VanDerWaalsContact O-N 3.1Å; D276-K280 IonicContact OD2-NZ 3.13Å; D276-K280 PolarHBondContact OD2-NZ 2.9Å; V278-K280 PolarHBondContact O-N 2.92Å; K280-M284 WeakPolarHBondContact O-CB 3.33Å; K280-M284 WeakPolarHBondContact O-CE 3.48Å; K280-M284 VanDerWaalsContact O-CG 3.27Å; K280-M284 WeakPolarHBondContact O-CG 3.47Å; K280-M284 PolarHBondContact O-N 3.46Å
281H90.2Very high83.6Confident27 Ų2779.6 Ų79.613%0.12536%0.356CS..Hα-helixtrans-63.2-49.7172.6-178.697.2000111.6C268 Q270 F272 R277 V278 R283 M284 C285 H286C268-H281 PolarHBondContact SG-NE2 3.1Å; Q270-H281 PolarHBondContact OE1-CE1 3.33Å; F272-H281 HydrophobicContact CE1-CB 4.25Å; F272-H281 HydrophobicContact CE2-CB 4.35Å; F272-H281 HydrophobicContact CZ-CB 3.81Å; F272-H281 AromaticContact CZ-CG 3.6Å; F272-H281 AromaticContact CZ-ND1 3.52Å; R277-H281 VanDerWaalsContact O-CB 3.24Å; R277-H281 WeakPolarHBondContact O-CB 3.42Å; R277-H281 PolarHBondContact O-N 3.11Å; V278-H281 WeakPolarHBondContact O-CB 3.39Å; V278-H281 PolarHBondContact O-N 2.83Å; H281-R283 PolarHBondContact O-N 3.05Å; H281-M284 PolarHBondContact O-N 3.01Å; H281-C285 VanDerWaalsContact O-CB 3.28Å; H281-C285 WeakPolarHBondContact O-CB 3.49Å; H281-C285 PolarHBondContact O-N 2.73Å; H281-H286 AromaticContact NE2-NE2 3.69Å
282R89.7Confident82.1Confident85 Ų8580.5 Ų80.532%0.32136%0.363SS..Hα-helixtrans-55.2-51177.3-172.4171.973.3-165.68.9111.6D266 Y267 V278 L279 M284 H286 E287D266-R282 IonicContact OD2-NH1 2.69Å; Y267-R282 HydrophobicContact CD2-CG 4.19Å; Y267-R282 HydrophobicContact CE2-CG 4.05Å; V278-R282 WeakPolarHBondContact O-CB 3.5Å; V278-R282 PolarHBondContact O-N 3Å; L279-R282 PolarHBondContact O-N 3.25Å; R282-M284 PolarHBondContact O-N 3.24Å; R282-H286 PolarHBondContact O-N 3.16Å; R282-H286 VanDerWaalsContact O-N 3.11Å; R282-E287 PolarHBondContact O-N 3.19Å
283R89.2Confident80.7Confident128 Ų12882 Ų8248%0.48338%0.376SS..Iπ-helixtrans-60.2-40.6178.6-166.7-179.8-68.1172.12.8112.1L279 H281 E287 N288L279-R283 WeakPolarHBondContact O-CB 3.37Å; L279-R283 PolarHBondContact O-N 3.02Å; H281-R283 PolarHBondContact O-N 3.05Å; R283-E287 WeakPolarHBondContact CG-OE2 3.47Å; R283-N288 WeakPolarHBondContact O-CB 3.3Å; R283-N288 PolarHBondContact O-N 2.89Å; R283-N288 VanDerWaalsContact O-N 3.17Å; R283-N288 PolarHBondContact O-ND2 2.98Å
284M87.6Confident79.4Confident130 Ų13085.3 Ų85.364%0.6439%0.391SS*.Iπ-helixtrans-84-39-176.9-68.8-171-56.600114.8K280 H281 R282K280-M284 WeakPolarHBondContact O-CB 3.33Å; K280-M284 WeakPolarHBondContact O-CE 3.48Å; K280-M284 VanDerWaalsContact O-CG 3.27Å; K280-M284 WeakPolarHBondContact O-CG 3.47Å; K280-M284 PolarHBondContact O-N 3.46Å; H281-M284 PolarHBondContact O-N 3.01Å; R282-M284 PolarHBondContact O-N 3.24Å
285C85.4Confident78Confident50 Ų5090.3 Ų90.334%0.33841%0.414SS..Iπ-helixtrans-96.8-29.2-169-62.30000114H281 R289H281-C285 VanDerWaalsContact O-CB 3.28Å; H281-C285 WeakPolarHBondContact O-CB 3.49Å; H281-C285 PolarHBondContact O-N 2.73Å; C285-R289 WeakPolarHBondContact O-CB 3.41Å
286H84.8Confident76.4Confident23 Ų2391.6 Ų91.611%0.10642%0.422CS..Iπ-helixtrans-112.5-61.9-175-61.8-75.7000111.1Y267 H281 R282 N288 R289 E290Y267-H286 VanDerWaalsContact CB-CE1 3.44Å; Y267-H286 WeakPolarHBondContact CB-CE1 3.38Å; Y267-H286 WeakPolarHBondContact CB-ND1 3.27Å; Y267-H286 HydrophobicContact CD1-CB 4.03Å; Y267-H286 HydrophobicContact CG-CB 4.25Å; Y267-H286 AromaticContact CG-CG 3.95Å; H281-H286 AromaticContact NE2-NE2 3.69Å; R282-H286 PolarHBondContact O-N 3.16Å; R282-H286 VanDerWaalsContact O-N 3.11Å; H286-N288 PolarHBondContact O-N 3.1Å; H286-R289 WeakPolarHBondContact O-CA 3.34Å; H286-R289 VanDerWaalsContact O-CB 3.27Å; H286-R289 WeakPolarHBondContact O-CB 3.32Å; H286-R289 PolarHBondContact O-N 3.33Å; H286-E290 WeakPolarHBondContact O-CG 3.49Å; H286-E290 PolarHBondContact O-N 3.43Å
287E79.6Confident74.9Confident57 Ų5793.3 Ų93.327%0.26644%0.441SS..Iπ-helixtrans-61.7-46.1-176.2-163.8-161.9143.200112.4R282 R283 R289 E290 R291R282-E287 PolarHBondContact O-N 3.19Å; R283-E287 WeakPolarHBondContact CG-OE2 3.47Å; E287-R289 PolarHBondContact O-N 2.67Å; E287-E290 PolarHBondContact O-N 3.13Å; E287-R291 WeakPolarHBondContact O-CG 3.44Å; E287-R291 PolarHBondContact O-N 3.45Å; E287-R291 IonicContact OE1-CZ 3.34Å; E287-R291 IonicContact OE1-NE 3.73Å; E287-R291 PolarHBondContact OE1-NE 2.97Å; E287-R291 IonicContact OE1-NH2 3.71Å; E287-R291 PolarHBondContact OE1-NH2 2.78Å
288N71.7Confident73.2Confident69 Ų6990.2 Ų90.237%0.36945%0.451SS..Hα-helixtrans-71.9-6.5173.9-88.6-60000114.5R283 H286 K292R283-N288 WeakPolarHBondContact O-CB 3.3Å; R283-N288 PolarHBondContact O-N 2.89Å; R283-N288 VanDerWaalsContact O-N 3.17Å; R283-N288 PolarHBondContact O-ND2 2.98Å; H286-N288 PolarHBondContact O-N 3.1Å; N288-K292 WeakPolarHBondContact O-CD 3.26Å; N288-K292 WeakPolarHBondContact O-CG 3.45Å
289R64Low71.3Confident132 Ų13298.7 Ų98.750%0.49849%0.487SS..Hα-helixtrans-91.5-43.3172.1-176.6178.3178.1169.3-2.3110.5C285 H286 E287 K292 T293C285-R289 WeakPolarHBondContact O-CB 3.41Å; H286-R289 WeakPolarHBondContact O-CA 3.34Å; H286-R289 VanDerWaalsContact O-CB 3.27Å; H286-R289 WeakPolarHBondContact O-CB 3.32Å; H286-R289 PolarHBondContact O-N 3.33Å; E287-R289 PolarHBondContact O-N 2.67Å; R289-K292 WeakPolarHBondContact O-CA 3.4Å; R289-K292 WeakPolarHBondContact O-CB 3.38Å; R289-K292 PolarHBondContact O-N 2.81Å; R289-T293 PolarHBondContact O-N 3.32Å; R289-T293 PolarHBondContact O-OG1 2.69Å
290E61Low69.5Low81 Ų81101.6 Ų101.638%0.37950%0.502SS..Hα-helixtrans-58.4-46.6171.4-69156.4-168.300111.2H286 E287 K292 T293 N294H286-E290 WeakPolarHBondContact O-CG 3.49Å; H286-E290 PolarHBondContact O-N 3.43Å; E287-E290 PolarHBondContact O-N 3.13Å; E290-K292 PolarHBondContact O-N 3.46Å; E290-T293 WeakPolarHBondContact CA-OG1 3.48Å; E290-T293 PolarHBondContact O-N 2.86Å; E290-T293 PolarHBondContact O-OG1 2.95Å; E290-N294 WeakPolarHBondContact O-CB 3.41Å; E290-N294 PolarHBondContact O-N 2.88Å; E290-N294 PolarHBondContact O-OD1 2.66Å; E290-N294 VanDerWaalsContact O-OD1 3.1Å
291R61.5Low67.3Low156 Ų15699.1 Ų99.159%0.58951%0.506SS*.Hα-helixtrans-57.9-22.6173.4-69174.8-173.2-134.24.5113.5E287 K295E287-R291 WeakPolarHBondContact O-CG 3.44Å; E287-R291 PolarHBondContact O-N 3.45Å; E287-R291 IonicContact OE1-CZ 3.34Å; E287-R291 IonicContact OE1-NE 3.73Å; E287-R291 PolarHBondContact OE1-NE 2.97Å; E287-R291 IonicContact OE1-NH2 3.71Å; E287-R291 PolarHBondContact OE1-NH2 2.78Å; R291-K295 WeakPolarHBondContact O-CB 3.36Å
292K58.6Low65.4Low156 Ų156104.6 Ų104.668%0.67854%0.544SS*.Hα-helixtrans-86.8-45.4175.2-72.5174.3-177.9175.90112.4N288 R289 E290 N294 K295 T296N288-K292 WeakPolarHBondContact O-CD 3.26Å; N288-K292 WeakPolarHBondContact O-CG 3.45Å; R289-K292 WeakPolarHBondContact O-CA 3.4Å; R289-K292 WeakPolarHBondContact O-CB 3.38Å; R289-K292 PolarHBondContact O-N 2.81Å; E290-K292 PolarHBondContact O-N 3.46Å; K292-N294 VanDerWaalsContact C-N 3.29Å; K292-N294 PolarHBondContact O-N 3.07Å; K292-K295 PolarHBondContact O-N 3.04Å; K292-T296 PolarHBondContact O-N 3.45Å; K292-T296 VanDerWaalsContact O-N 3.16Å; K292-T296 PolarHBondContact O-OG1 3.1Å
293T60.1Low62.9Low73 Ų73108.3 Ų108.345%0.44857%0.57SS.*Hα-helixtrans-61.1-40.7176.448.50000111.4R289 E290 K295 T296 A297R289-T293 PolarHBondContact O-N 3.32Å; R289-T293 PolarHBondContact O-OG1 2.69Å; E290-T293 WeakPolarHBondContact CA-OG1 3.48Å; E290-T293 PolarHBondContact O-N 2.86Å; E290-T293 PolarHBondContact O-OG1 2.95Å; T293-K295 VanDerWaalsContact C-N 3.34Å; T293-K295 PolarHBondContact O-N 3.34Å; T293-T296 WeakPolarHBondContact CA-OG1 3.36Å; T293-T296 PolarHBondContact O-N 3.43Å; T293-T296 PolarHBondContact O-OG1 2.93Å; T293-A297 PolarHBondContact O-N 2.96Å
294N58.5Low60.7Low105 Ų105110 Ų11056%0.56158%0.583SS**Hα-helixtrans-73.4-31-176.6-58.17.7000110.9E290 K292 T296 A297 G298E290-N294 WeakPolarHBondContact O-CB 3.41Å; E290-N294 PolarHBondContact O-N 2.88Å; E290-N294 PolarHBondContact O-OD1 2.66Å; E290-N294 VanDerWaalsContact O-OD1 3.1Å; K292-N294 VanDerWaalsContact C-N 3.29Å; K292-N294 PolarHBondContact O-N 3.07Å; N294-T296 VanDerWaalsContact C-N 3.34Å; N294-A297 PolarHBondContact O-N 3.22Å; N294-G298 PolarHBondContact O-N 2.97Å
295K58.2Low58.4Low178 Ų178110.7 Ų110.777%0.77459%0.589SS**Hα-helixtrans-72.5-22.2172.3-171.3163.2-176.1167.10113.6R291 K292 T293R291-K295 WeakPolarHBondContact O-CB 3.36Å; K292-K295 PolarHBondContact O-N 3.04Å; T293-K295 VanDerWaalsContact C-N 3.34Å; T293-K295 PolarHBondContact O-N 3.34Å
296T55.2Low56.2Low104 Ų104114.7 Ų114.764%0.63861%0.612SS**Hα-helixtrans-81.4-32.7167390000113.1K292 T293 N294K292-T296 PolarHBondContact O-N 3.45Å; K292-T296 VanDerWaalsContact O-N 3.16Å; K292-T296 PolarHBondContact O-OG1 3.1Å; T293-T296 WeakPolarHBondContact CA-OG1 3.36Å; T293-T296 PolarHBondContact O-N 3.43Å; T293-T296 PolarHBondContact O-OG1 2.93Å; N294-T296 VanDerWaalsContact C-N 3.34Å
297A56.6Low54.1Low67 Ų67121.2 Ų121.255%0.55465%0.648SS**Hα-helixtrans-67.9-46.8175.700000112T293 N294 K299 I300T293-A297 PolarHBondContact O-N 2.96Å; N294-A297 PolarHBondContact O-N 3.22Å; A297-K299 PolarHBondContact O-N 3.32Å; A297-I300 PolarHBondContact O-N 2.99Å
298G53.6Low52.1Low72 Ų72124.5 Ų124.574%0.74268%0.677SS**THydrogen-bonded Turntrans-68.724.1178.800000116.1N294N294-G298 PolarHBondContact O-N 2.97Å
299K53.4Low50.8Low191 Ų191127.4 Ų127.483%0.8370%0.703SS**THydrogen-bonded Turntrans-127.49.6173.2-146.1-173.3179.1-174.80113.6A297A297-K299 PolarHBondContact O-N 3.32Å
300I50.6Low49.2Very low143 Ų143124.5 Ų124.573%0.73371%0.714SS**SBendtrans-111.9121.7167.6-56.6179.2000106.4A297A297-I300 PolarHBondContact O-N 2.99Å
301G44.4Very low48.3Very low54 Ų54125.7 Ų125.756%0.55773%0.731SS**  trans-73.7168.7175.700000111.8L303G301-L303 PolarHBondContact O-N 3.19Å
302P49.1Very low47.5Very low142 Ų142123.1 Ų123.192%0.92273%0.734SS**  trans-61.1124.3-177.2-20.432.4000111.4
303L38.1Very low46.4Very low163 Ų163125.1 Ų125.185%0.85374%0.744SS**  trans-136.9104168.6-169.869.7000109.8G301G301-L303 PolarHBondContact O-N 3.19Å
304H42.7Very low45.1Very low165 Ų165127.7 Ų127.776%0.76475%0.754SS**  trans20.9129.4156.3-149.9-69.2000120
305D39.2Very low44.1Very low144 Ų144128.8 Ų128.877%0.7777%0.77SS**  trans-61.8140.7173.9-47.4-93.5000113.7
306T38.9Very low43Very low134 Ų134127.6 Ų127.682%0.82277%0.765SS**  trans-150.7138.2145.949.90000108.7
307D41.8Very low42Very low159 Ų159131 Ų13185%0.8577%0.773SS**  trans-68.3143.1-173.4-53.9-91.7000114.8
308S37.2Very low40.7Very low127 Ų127131.4 Ų131.489%0.88877%0.771SS**  trans-162146.6146.9-860000112
309S44.4Very low39.8Very low129 Ų129132.7 Ų132.790%0.90277%0.769SS**  trans-83.1148.8-176.552.10000112.7
310G31.1Very low38.9Very low71 Ų71131 Ų13173%0.73277%0.768SS**  trans165.693.717300000115.3P312G310-P312 WeakPolarHBondContact O-CD 3.48Å
311S40.7Very low38Very low106 Ų106130.1 Ų130.174%0.74177%0.772SS**  trans-74.7137.6156.1175.50000109.3F313S311-F313 PolarHBondContact OG-N 2.8Å
312P45.3Very low37.6Very low102 Ų102137.4 Ų137.466%0.66279%0.788SS**  trans-131.997.5138.834.4-23.4000111.9G310 L314G310-P312 WeakPolarHBondContact O-CD 3.48Å; P312-L314 HydrophobicContact CB-CD1 4.39Å; P312-L314 HydrophobicContact CB-CG 4.33Å; P312-L314 PolarHBondContact O-N 3.48Å; P312-L314 VanDerWaalsContact O-N 3.13Å
313F35.9Very low37.1Very low199 Ų199140.8 Ų140.887%0.87379%0.788SS**  trans-58.8110.7149.4-103.8-94.7000108.3S311S311-F313 PolarHBondContact OG-N 2.8Å
314L31.6Very low36.7Very low126 Ų126142.5 Ų142.566%0.6679%0.789SS**  trans-130.1108.2171.3-79.9175.9000110.3P312 K316P312-L314 HydrophobicContact CB-CD1 4.39Å; P312-L314 HydrophobicContact CB-CG 4.33Å; P312-L314 PolarHBondContact O-N 3.48Å; P312-L314 VanDerWaalsContact O-N 3.13Å; L314-K316 PolarHBondContact O-N 3.13Å
315S38.3Very low36.4Very low128 Ų128146.1 Ų146.190%0.89580%0.796SS**  trans-53.2116.4169.4-55.60000110.1
316K35.4Very low36Very low154 Ų154147.8 Ų147.867%0.6780%0.799SS**  trans-114.3100178.5-78.2175.8-179.1172.70110.2L314 C318L314-K316 PolarHBondContact O-N 3.13Å; K316-C318 PolarHBondContact O-N 3.42Å
317E34Very low35.5Very low175 Ų175151 Ų15182%0.81880%0.802SS**  trans-51131.8174.4-58.6-174.1140.400111.3S319E317-S319 PolarHBondContact O-N 3.33Å
318C28.7Very low34.8Very low75 Ų75148.2 Ų148.251%0.50779%0.793SS.*  trans-85.262.5177.7-73.10000111.7K316 L320K316-C318 PolarHBondContact O-N 3.42Å; C318-L320 PolarHBondContact O-N 3.44Å
319S34.7Very low34.4Very low99 Ų99146.1 Ų146.169%0.69278%0.783SS**  trans-74.5108.2175.1-770000111.5E317E317-S319 PolarHBondContact O-N 3.33Å
320L34.7Very low33.7Very low157 Ų157148.5 Ų148.582%0.82278%0.78SS**  trans-69.8140.2175.2-70.3172000111.4C318 K322C318-L320 PolarHBondContact O-N 3.44Å; L320-K322 PolarHBondContact O-N 2.93Å
321P32.3Very low33.6Very low124 Ų124154.6 Ų154.681%0.80579%0.786SS**  trans-74.4115.6-169.128.2-35.1000113.2K323P321-K323 PolarHBondContact O-N 3.1Å
322K34.5Very low33.2Very low207 Ų207154.2 Ų154.290%0.978%0.784SS**  trans-73.9118.6167.7-67.3178.6-179.5174.50109.9L320 K324L320-K322 PolarHBondContact O-N 2.93Å; K322-K324 PolarHBondContact O-N 3.25Å
323K38.7Very low32.4Very low213 Ų213155.5 Ų155.593%0.92680%0.795SS**  trans-73116169.8-73.7-177.4177.1179.20110.4P321P321-K323 PolarHBondContact O-N 3.1Å
324K30.3Very low32Very low198 Ų198149.5 Ų149.586%0.86179%0.79SS**  trans-143.8136.5155.8-160.3170.9-178-179.30110.4K322K322-K324 PolarHBondContact O-N 3.25Å
325R36.7Very low31.8Very low242 Ų242148.9 Ų148.991%0.91380%0.796SS**  trans-76.9138.2173.5-72.5158.656.8-175.2-1.8109.1
326Q30.9Very low31.1Very low178 Ų178147.9 Ų147.983%0.83279%0.788SS**  trans-148.9136.9162.4-164.3153.5-14.400110.2
327K28.2Very low30.8Very low203 Ų203147.2 Ų147.288%0.88379%0.79SS**  trans-135139.2162.5-177.8174.7177.8-179.40106.3
328C26.3Very low30.5Very low100 Ų100144.5 Ų144.568%0.67679%0.786SS**  trans-87165.7-167.1-470000112.9
329A29.1Very low30.3Very low82 Ų82146.8 Ų146.868%0.67880%0.797SS**  51.5148.1125.200000119.9
330E29.3Very low29.9Very low179 Ų179149.1 Ų149.184%0.83680%0.801SS**  cis-170.7177.1-1.1-115.7163.8178.100107.9
331K30.7Very low29.5Very low199 Ų199146.5 Ų146.587%0.86579%0.792SS**  trans139.3162.7148.2-80.1177.8176.3-1760114.1
332S30.8Very low29.3Very low98 Ų98149.7 Ų149.769%0.68580%0.795SS**  cis171.9123.4-47.956.30000110.9
333S29.2Very low29Very low130 Ų130143 Ų14391%0.90979%0.786SS**  trans-174.9142.1159.749.40000109.7
334G27.6Very low28.6Very low73 Ų73141.6 Ų141.675%0.75378%0.782SS**  cis-174.8-169.3-2.600000111.5
335S26.6Very low28.3Very low113 Ų113136.6 Ų136.679%0.7977%0.768SS**  trans5.8140.3167.2-113.90000120.5
336C25.1Very low27.8Very low107 Ų107133.9 Ų133.972%0.72376%0.764SS**  -147.5141.754.8-80.30000115.9
337I28.8Very low27.5Very low140 Ų140129.7 Ų129.772%0.71876%0.759SS**  49.5126.3127.9-60.5174.6000118.6
338T26.7Very low27.5Very low118 Ų118125.7 Ų125.772%0.72475%0.751SS**  cis-168.3171.4-6.527.30000110
339V25.9Very low27.5Very low122 Ų122128.8 Ų128.874%0.73976%0.756SS**  trans105.3119.5153.8-173.80000117.3
340L26.5Very low27.3Very low149 Ų149132.8 Ų132.878%0.7876%0.761SS**  trans16.5148.9137.7-47.8177.5000119.5
341T26.1Very low27.2Very low102 Ų102130.1 Ų130.163%0.62676%0.757SS**  cis-171.5155.75.712.40000110.7
342E28.1Very low27Very low190 Ų190129.1 Ų129.189%0.88876%0.755SS**  trans53.6169.7144.1-66.4172.1-167.600122.4
343G28.3Very low26.8Very low68 Ų68128.7 Ų128.770%0.70176%0.758SS**  trans103.5115177.300000113.7
344H28.9Very low27Very low182 Ų182131.7 Ų131.784%0.84375%0.754SS**  50.8133.554.9-82.167.9000113.5
345T23.9Very low27Very low93 Ų93136.6 Ų136.657%0.57176%0.758SS**  cis161.2161.8-14.130.40000104.4
346F26.9Very low27.4Very low186 Ų186134.9 Ų134.982%0.81676%0.757SS**  trans69.2135.9-176.9-58-91.1000113.7
347A25.7Very low27.7Very low89 Ų89138 Ų13874%0.73676%0.762SS**  cis85.3155.116.800000116.6
348V26.8Very low28Very low119 Ų119136.5 Ų136.572%0.72176%0.763SS**  trans88.9109.1-178.7-171.40000116
349E26Very low28.5Very low165 Ų165140.7 Ų140.777%0.77177%0.766SS**  trans27140.1135.4-62.5162.8151.500123
350E25.1Very low28.8Very low167 Ų167141.6 Ų141.678%0.7877%0.767SS**  25.2126.2129.6-40.8-172.9155.400118.5
351T27.2Very low29.2Very low122 Ų122144.5 Ų144.575%0.74877%0.773SS**  -175.1157.871250000114.1
352E26.2Very low29.6Very low178 Ų178145.8 Ų145.883%0.83278%0.775SS**  trans44.3106.9143.5-59.8-162.914700124.1
353A27.8Very low30.2Very low90 Ų90145.8 Ų145.874%0.74478%0.775SS**  86.7157.4113.900000122.9
354K32Very low30.2Very low192 Ų192148.7 Ų148.784%0.83578%0.779SS**  trans73.6149.8172-62.6-170.7-178.7-173.10117.6
355E28Very low31.3Very low177 Ų177145.4 Ų145.483%0.82777%0.774SS**  cis-168.5131.3-22.4-176.6167.217000107
356G35.2Very low31.6Very low76 Ų76146 Ų14678%0.78478%0.78SS**  trans-165.130-160.800000120.7
357Q31.2Very low31.7Very low174 Ų174145.3 Ų145.381%0.81378%0.783SS**  trans-1.6114.6163.5-171.5173.45600122.1
358S36Very low31.8Very low108 Ų108150.2 Ų150.276%0.75579%0.789SS**  trans-178.5106139.330.80000111
359R36.9Very low31.6Very low205 Ų205148.8 Ų148.877%0.77479%0.789SS**  45.199.994.6-75.3-175.2170.5150.2-1.8113
360D31.3Very low31.5Very low142 Ų142147.2 Ų147.276%0.75979%0.791SS**SBend-154.317160.2-95.4-20.6000115.1
361K34.8Very low31.6Very low210 Ų210144 Ų14491%0.91379%0.787SS**SBendtrans68.9101.5-173.8-55.6-179.5-171.9178.80113.3
362I34.7Very low31.5Very low129 Ų129142.9 Ų142.966%0.66278%0.784SS**  trans-141.2125.9-165.9-56.7172.5000110.4
363E41.1Very low31.6Very low190 Ų190143.1 Ų143.189%0.88878%0.782SS**  trans-166.2122.7144.3-114170.8-14900109.8
364T29Very low31.7Very low129 Ų129146.4 Ų146.479%0.79179%0.793SS**  trans176.7170.5-170.35.40000109
365P50.6Low31.5Very low112 Ų112144.6 Ų144.673%0.72779%0.785SS**  cis-136-177.1-14.437.8-18.2000116
366C32Very low31.5Very low105 Ų105141.8 Ų141.871%0.70977%0.771SS**  trans-23.5159.2164.8-47.90000122.9
367I27.7Very low31.3Very low172 Ų172145 Ų14588%0.88277%0.766SS**  trans-128.8144.5139.6-59.4-180000108.6
368F27.4Very low31.1Very low193 Ų193147 Ų14785%0.84677%0.767SS**  trans-106.1148.1179.1-101.3-94.2000112.4
369A23.8Very low30.6Very low89 Ų89146.5 Ų146.574%0.73676%0.76SS**  trans-156.9122.6161.600000115.3
370V23.9Very low30.4Very low132 Ų132144 Ų14480%0.876%0.76SS**  trans62.5100.4131-175.50000120.5
371S26Very low30.7Very low99 Ų99142.4 Ų142.469%0.69276%0.758SS**  61.1121124.9-53.90000124.2
372S26.4Very low30.2Very low98 Ų98139.7 Ų139.769%0.68575%0.753SS**  81.9154.6129.381.90000120.7
373K28.3Very low30Very low184 Ų184143.8 Ų143.880%0.876%0.762SS**  trans62.6105.8166.2-57.3167.4-172.41690116.6
374V29.3Very low29.4Very low159 Ų159140.4 Ų140.496%0.96476%0.759SS**  trans-97.2110.1134.9178.20000106.5
375K27.9Very low29.4Very low154 Ų154140.5 Ų140.567%0.6776%0.759SS**  trans-145.5131175.4-141-134177.7-147.20108.7
376H27.7Very low28.3Very low118 Ų118144.2 Ų144.255%0.54677%0.767SS.*  trans70.6140.1166.2-80.3-128.8000118.8
377E30.8Very low28.3Very low144 Ų144146 Ų14667%0.67377%0.769SS**  trans47.7140.3133.7-63.3154.9167.500120.8
378Y27Very low28.6Very low214 Ų214143.9 Ų143.984%0.83977%0.766SS**  177.9154.9110.6-107.9-122.8000106.3
379V26.5Very low28.8Very low99 Ų99142.9 Ų142.960%0.676%0.764SS**  cis-167.1163.5-25112.10000105.1P381V379-P381 WeakPolarHBondContact O-CD 3.41Å
380I32.6Very low29.1Very low152 Ų152147.1 Ų147.178%0.77977%0.768SS**  trans-89.6115.5165.4-60.5172.3000107.6
381P36.8Very low29.4Very low109 Ų109146.5 Ų146.571%0.70877%0.765SS**  trans-82.7130.6166.932.7-30.8000109.9V379V379-P381 WeakPolarHBondContact O-CD 3.41Å
382D25.4Very low29.6Very low153 Ų153146 Ų14682%0.81877%0.767SS**  trans-66.8159168-60-67.5000111.3
383Y30.2Very low29.7Very low215 Ų215146 Ų14684%0.84377%0.767SS**  trans-127.6132.9155.889.7-88.3000109.6
384S27.3Very low29.9Very low118 Ų118145 Ų14583%0.82577%0.765SS**  trans-138.7129.9166.2-71.30000106.9
385V30.3Very low29.9Very low132 Ų132144.2 Ų144.280%0.875%0.751SS**  trans-131.1142.7169179.50000107.4
386E27.5Very low30.1Very low189 Ų189143.8 Ų143.888%0.88375%0.751SS**  trans-63.6166.4-150.9-65.9156.5144.700117.6
387L32.4Very low30.1Very low144 Ų144144.4 Ų144.475%0.75476%0.759SS**  trans-64.9166.3172.3-75.5156.9000112.3
388P33.9Very low30.1Very low127 Ų127144.6 Ų144.683%0.82576%0.764SS**  -110.5154.2102.7-15.432.1000114.6
389E30.8Very low30.2Very low171 Ų171141.3 Ų141.380%0.79976%0.761SS**  trans-82.3156.7170.2-56177.2131.600111
390E30.6Very low30.5Very low178 Ų178142 Ų14283%0.83277%0.766SS**  trans-169.1172.1144.6-103.8-61.8157.400108.2
391T29.7Very low30.2Very low120 Ų120139.5 Ų139.574%0.73676%0.761SS**  trans-113.8168.1-15260.50000117.2
392A30.3Very low29.9Very low87 Ų87139 Ų13972%0.71976%0.76SS**  trans61.8116.1165.500000117.3
393S28.5Very low30.4Very low100 Ų100140.5 Ų140.570%0.69976%0.762SS**  85.1134.752.678.20000115.7
394Q31.5Very low30.5Very low163 Ų163136.3 Ų136.376%0.76276%0.755SS**  trans84.9141.9164.5-67.4-171.3-69.600120
395H30.3Very low30.6Very low142 Ų142135.7 Ų135.766%0.65775%0.746SS**  trans40.4147.4151.8-69.5-76.7000120.7
396E32Very low30.7Very low144 Ų144135.3 Ų135.367%0.67374%0.744SS**  cis-173.1156.1-28.9-127.7166.4-152.700106
397D28.6Very low31.9Very low132 Ų132132 Ų13271%0.70674%0.739SS**  trans32.7152.2150.8-56.6-23.4000125.1
398D29.2Very low32.3Very low147 Ų147131.2 Ų131.279%0.78674%0.742SS**  trans80.6139.4154.4-64.7-27.1000123.9
399D29.1Very low32.1Very low146 Ų146134.5 Ų134.578%0.78174%0.744SS**  trans63.9153.2150.2-78.3-12.3000122.7
400V32.7Very low32.1Very low114 Ų114133.7 Ų133.769%0.69174%0.743SS**  cis-168.4156.6-38.1109.40000109
401S27.8Very low32Very low98 Ų98131.6 Ų131.669%0.68574%0.743SS**  trans63.9151.4172.2-67.70000116.5
402S30.8Very low32.1Very low99 Ų99133 Ų13369%0.69275%0.745SS**  cis81.1138.625.799.60000114.5
403E35.2Very low32.2Very low184 Ų184138.7 Ų138.786%0.8675%0.753SS**  cis-122.6-152.9-19.4-66.2-165.6101.600107.2
404D31.2Very low32.3Very low128 Ų128143.1 Ų143.168%0.68476%0.76SS**  cis-159.3-163.42.9-178.525.1000107.9
405T29.8Very low32.3Very low105 Ų105141.1 Ų141.164%0.64476%0.759SS**  trans85.881.7156560000119.1
406T32.8Very low33Very low123 Ų123140.1 Ų140.176%0.75577%0.765SS**  47.3137.411957.80000122.2
407P53.3Low33.2Very low120 Ų120142.3 Ų142.378%0.77977%0.772SS**  trans-103.2168.5-170.241.3-38.3000116.2
408P39.9Very low33.2Very low127 Ų127147.4 Ų147.483%0.82578%0.781SS**  trans-109.6167.9157.735.9-26.7000114.8
409K30.7Very low33.2Very low197 Ų197145.2 Ų145.286%0.85778%0.777SS**  trans-86.3179.5175.4-64.5157.8-175.7166.10109.7
410I30.2Very low33.2Very low153 Ų153145.8 Ų145.879%0.78578%0.78SS**  cis-130.4-12319.6-30.4175.6000111.8
411V29.4Very low33Very low135 Ų135149.6 Ų149.682%0.81879%0.787SS**  cis-145.8169.24.2-1630000109.5
412L30.2Very low33.3Very low150 Ų150151.7 Ų151.779%0.78579%0.786SS**  trans-111.4151.5-173.1-65.8149.8000114.8
413K32.1Very low33.6Very low205 Ų205152.9 Ų152.989%0.89179%0.791SS**  trans179.1117.9141.4-95.3149.5-174.9178.90109
414K31.3Very low33.2Very low194 Ų194152 Ų15284%0.84378%0.78SS**  95.884.960.2-90.5-167.3172.7-178.50115.9
415V31.3Very low33.1Very low121 Ų121152 Ų15273%0.73378%0.776SS**  40122.8115.4177.90000118.5K417V415-K417 HydrophobicContact CG1-CG 4.13Å
416P44.6Very low33Very low121 Ų121155.2 Ų155.279%0.78678%0.784SS**  -147.2129.788.833.4-13.7000116.5
417K36.4Very low33Very low189 Ų189156 Ų15682%0.82279%0.788SS**  84.8113.280.8-79.4-168.8176-175.30118.2V415V415-K417 HydrophobicContact CG1-CG 4.13Å
418R29.1Very low32.8Very low239 Ų239155.6 Ų155.690%0.90279%0.786SS**  trans-174.4110134.1-106.6170.9174.8150.3-1.2109.2
419S28.4Very low33.1Very low101 Ų101155.3 Ų155.371%0.70678%0.784SS**  70.5131.8101.2670000115.3
420L30Very low32.9Very low158 Ų158151.4 Ų151.483%0.82778%0.78SS**  cis-165.2163.22.8-132.7158.9000111
421K28.9Very low32.9Very low194 Ų194152 Ų15284%0.84378%0.784SS**  trans79.7117.3170.2-59.1-171177-177.10119.2
422Q33.2Very low32.8Very low143 Ų143150.8 Ų150.867%0.66878%0.782SS**  trans-102.7-178.4152-56.9176.4-73.200108.1R424Q422-R424 HydrophobicContact CB-CG 4.06Å; Q422-R424 HydrophobicContact CG-CG 4.48Å
423P36.6Very low32.7Very low124 Ų124148.4 Ų148.481%0.80578%0.778SS**  -105.4157.659.2-10.532.1000113.7
424R27.7Very low32.5Very low164 Ų164143.4 Ų143.462%0.61977%0.769SS**  cis69.6134.332.3-66.3-174.8106.6149.6-4.1114Q422Q422-R424 HydrophobicContact CB-CG 4.06Å; Q422-R424 HydrophobicContact CG-CG 4.48Å
425E28.2Very low32.3Very low128 Ų128142.4 Ų142.460%0.59877%0.772SS**  cis-152141.2-2.9-125.7145.9171.400106.7
426Q27.9Very low32Very low174 Ų174141.9 Ų141.981%0.81377%0.773SS**  58.997.360.2-78.1-170.2-0.300115.8
427T33.7Very low31.2Very low138 Ų138141.3 Ų141.385%0.84777%0.772SS**  trans-74.7137.4146.449.10000109.5
428P49.1Very low30.8Very low112 Ų112142 Ų14273%0.72777%0.771SS**  -147-15497.942.5-24.7000109.6
429P45.4Very low30.9Very low122 Ų122137.9 Ų137.979%0.79276%0.762SS**  cis-131.4-162.6-7.142.9-24000114.6
430C26.3Very low30.9Very low115 Ų115142.2 Ų142.278%0.77777%0.771SS**  trans-111.9156-173.6-74.80000114.3
431L30.2Very low31.2Very low165 Ų165139.5 Ų139.586%0.86477%0.771SS**  trans68.1113.1147.3-69.2163.8000122.2
432S27.9Very low31.4Very low110 Ų110136.2 Ų136.277%0.76976%0.763SS**  -155137.8121.943.80000107.8
433S28.8Very low31.6Very low100 Ų100137.1 Ų137.170%0.69977%0.765SS**  66.5132.158.9-50.70000111.9
434S28.4Very low31.3Very low100 Ų100137.4 Ų137.470%0.69976%0.764SS**  cis-169.8157.64.5-110.80000111.9
435L26.9Very low31.4Very low173 Ų173133.1 Ų133.191%0.90676%0.764SS**  trans64.7165.6160.7-59.3163.6000115.8
436S24.3Very low31.5Very low109 Ų109135.3 Ų135.376%0.76277%0.774SS**  cis-139.2163.4-053.80000111.6
437S28.9Very low31.5Very low110 Ų110136.4 Ų136.477%0.76977%0.772SS**  trans-65.5145171.851.20000114
438Y27.4Very low31.4Very low204 Ų204135.2 Ų135.280%0.877%0.765SS**  trans-149.4-177.4137.8-141.1-108.8000111.8
439E30.4Very low30.4Very low151 Ų151137.2 Ų137.271%0.70676%0.762SS**  trans-80.4171.1-159.8-59.2175.3143.600115.7
440E29.5Very low29.7Very low193 Ų193138.2 Ų138.290%0.90276%0.756SS**  135118.8127.4-160.5161.7-134.500112.3
441A35.2Very low30.1Very low101 Ų101139.3 Ų139.384%0.83575%0.753SS**  trans-142.8122.4-178.200000109.4
442D32.9Very low30.1Very low124 Ų124137.5 Ų137.566%0.66375%0.748SS**  trans-156.7131.9-179.2-1541000112.4
443K38.9Very low30.3Very low162 Ų162138.1 Ų138.170%0.70474%0.743SS**  trans70.9138.4165.4-51.5-169.2168.950.50117.4
444V29.6Very low30.6Very low130 Ų130140.9 Ų140.979%0.78874%0.743SS**  cis-157.7152.2-0.11040000113.4
445A30.1Very low30.8Very low75 Ų75144.6 Ų144.662%0.6275%0.749SS**  trans63148.4163.100000118.5
446Q30.2Very low30.9Very low173 Ų173139.7 Ų139.781%0.80874%0.741SS**  cis-162.6129.9-12.7-116.1164-36.900105.6
447Y28Very low31.1Very low198 Ų198142.7 Ų142.778%0.77675%0.747SS**  42.1110.870.1-74.7-71.5000112.1F449Y447-F449 HydrophobicContact CD1-CE1 4.24Å
448T30.5Very low31.6Very low113 Ų113144.5 Ų144.569%0.69375%0.747SS**  cis-162.8177.143.744.40000108.6
449F28.7Very low31.6Very low153 Ų153141.4 Ų141.467%0.67175%0.745SS**  cis-175164.3-13.4-94.3-2000105.9Y447Y447-F449 HydrophobicContact CD1-CE1 4.24Å
450E31.1Very low31.8Very low144 Ų144141.3 Ų141.367%0.67375%0.754SS**  cis-160.8-175.8-3.6-117.3-179.6125.500113.6
451I34.3Very low32.1Very low137 Ų137140.3 Ų140.370%0.70375%0.749SS**  trans-27.6140.1171.7-27.8176.4000120.7
452V29.2Very low32Very low127 Ų127140.7 Ų140.777%0.7775%0.746SS**  158.598.2119.6170.30000113.7
453D31.9Very low32.1Very low123 Ų123142 Ų14266%0.65875%0.753SS**  50.1138.1128-141.619.4000125.5
454K35.2Very low31.7Very low159 Ų159138.3 Ų138.369%0.69175%0.753SS**  trans81.4131.9156.7-73.4-178.3-178.377.70124.6
455Q33Very low31.9Very low177 Ų177137 Ų13783%0.82774%0.741SS**  trans46.4127.4148.9-101.668.710.200122.3
456G28.9Very low32.1Very low71 Ų71138.6 Ų138.673%0.73274%0.739SS**  150.1146.5120.300000119.1
457L29.8Very low32.1Very low171 Ų171137.9 Ų137.990%0.89574%0.735SS**  trans68.7149154.1-121.868.4000121.5
458L38.3Very low32.2Very low149 Ų149133.2 Ų133.278%0.7873%0.732SS**  trans-98.2174.5165.2-66.7167.3000109
459D28.3Very low32.1Very low139 Ų139133.7 Ų133.774%0.74373%0.734SS**  trans135.1122.2139.2-67.9-17.6000113.3
460V34.9Very low32.3Very low149 Ų149134.1 Ų134.190%0.90374%0.738SS**  trans-141.4133.8147-178.80000107.1
461E35.8Very low32.1Very low171 Ų171132.7 Ų132.780%0.79974%0.74SS**  trans-90.5-168.8-169.4-53163.290.700113.1
462S33.2Very low31.9Very low109 Ų109133.3 Ų133.376%0.76274%0.744SS**  trans88.4153.9142.981.20000119.1
463N33.4Very low31.8Very low151 Ų151135.7 Ų135.781%0.80775%0.746SS**  cis-162.6169.1-49.8-136.2-33.6000108.7
464A32.3Very low31.6Very low85 Ų85133.5 Ų133.570%0.70275%0.752SS**  trans64.7159160.200000119.2
465D33Very low31.3Very low103 Ų103129.4 Ų129.455%0.55176%0.756SS**  cis-164.3169-46.6-141.5-31.1000109.9
466L34.7Very low31.3Very low109 Ų109127.9 Ų127.957%0.57176%0.759SS**  trans64.6121.5159.2-59.9170.4000117.4
467E29.6Very low31.5Very low157 Ų157131.2 Ų131.273%0.73477%0.765SS**  66.4140.293.6-61.6175.4-165.400113
468S30.3Very low31.7Very low100 Ų100132.5 Ų132.570%0.69976%0.763SS**  cis-163.4147.432.9650000110.3
469V29.2Very low31.5Very low123 Ų123131.3 Ų131.375%0.74577%0.765SS**  89.1123103.5164.80000117.4
470E31.1Very low31.6Very low162 Ų162129.7 Ų129.776%0.75777%0.77SS**  trans58.2130.4147.3-72.8-177.2133.700126.7
471T26.9Very low31.6Very low115 Ų115129.1 Ų129.171%0.70677%0.767SS**  trans87.1135.1131.5550000124.9
472L31.6Very low31.7Very low150 Ų150126 Ų12679%0.78576%0.764SS**  trans61.3103.8138.7-68.3169.3000121.6
473Q27.3Very low32Very low177 Ų177126.1 Ų126.183%0.82777%0.765SS**  -179.7135.1104.6-138.263.4-16.100105.5
474G26.9Very low32.7Very low76 Ų76125 Ų12578%0.78476%0.764SS**  111.3106.152.100000108.3
475G28.5Very low33.9Very low74 Ų74125 Ų12576%0.76375%0.752SS**  trans-163.368.6-167.700000115T477G475-T477 PolarHBondContact O-N 3.29Å
476T33.9Very low35.5Very low145 Ų145128.7 Ų128.789%0.8976%0.76SS**  trans-74119.117751.90000112.3
477T33.5Very low36.6Very low140 Ų140128.4 Ų128.486%0.85976%0.759SS**  trans-129.8153.9162.554.70000111.3G475G475-T477 PolarHBondContact O-N 3.29Å
478K33.5Very low38.3Very low199 Ų199124.8 Ų124.887%0.86575%0.745SS**PPolyproline II helixtrans-86.4156.3-170.7-75.8176.8179174.60111.8
479P33.9Very low39.9Very low124 Ų124122.3 Ų122.381%0.80573%0.73SS**PPolyproline II helixtrans-63.7136.9-178.126-35.7000112.6
480A30.6Very low42.6Very low104 Ų104120.5 Ų120.586%0.8671%0.714SS**PPolyproline II helixtrans-73.9137.7171.800000111S482A480-S482 PolarHBondContact O-N 2.84Å
481T35Very low44.6Very low137 Ų137118 Ų11884%0.8470%0.703SS**PPolyproline II helixtrans-77.1117.2-174.250.90000112.6S483T481-S483 PolarHBondContact O-N 3.39Å
482S38.5Very low47Very low106 Ų106119.5 Ų119.574%0.74170%0.7SS**  trans-75.9105.9169.155.50000111.1A480 T484A480-S482 PolarHBondContact O-N 2.84Å; S482-T484 PolarHBondContact O-N 3.32Å
483S38.8Very low49.2Very low112 Ų112116.3 Ų116.378%0.78368%0.683SS**  trans-74.788.8174.843.90000111.4T481 N485T481-S483 PolarHBondContact O-N 3.39Å; S483-N485 PolarHBondContact O-N 3.47Å; S483-N485 VanDerWaalsContact O-N 3.09Å
484T47.1Very low51.7Low126 Ų126115.4 Ų115.477%0.77368%0.676SS**  trans-63.3110.5171.650.50000110.1S482 Y486S482-T484 PolarHBondContact O-N 3.32Å; T484-Y486 PolarHBondContact O-N 3.39Å
485N59.2Low54.2Low86 Ų86118.9 Ų118.946%0.4667%0.67SS.*  trans-60.3123.5-174.2-112.3-33.3000111.6S483 D487 D488 A489S483-N485 PolarHBondContact O-N 3.47Å; S483-N485 VanDerWaalsContact O-N 3.09Å; N485-D487 PolarHBondContact O-N 3.48Å; N485-D487 VanDerWaalsContact O-N 3.16Å; N485-D488 HydrophobicContact CB-CB 4.29Å; N485-D488 PolarHBondContact O-N 3.07Å; N485-A489 PolarHBondContact O-N 2.92Å
486Y65.4Low56.6Low180 Ų180121.9 Ų121.971%0.70666%0.662SS**Hα-helixtrans-56.7-32.9-179.2179.3-96.7000112.3T484 A489 M490T484-Y486 PolarHBondContact O-N 3.39Å; Y486-A489 PolarHBondContact O-N 3.05Å; Y486-M490 HydrophobicContact CD1-CG 4.06Å; Y486-M490 HydrophobicContact CE1-CG 3.75Å; Y486-M490 HydrophobicContact CE2-CG 4.47Å; Y486-M490 WeakPolarHBondContact O-CB 3.48Å; Y486-M490 VanDerWaalsContact O-CG 3.24Å; Y486-M490 WeakPolarHBondContact O-CG 3.4Å; Y486-M490 PolarHBondContact O-N 2.93Å
487D57.5Low58.6Low104 Ų104123.8 Ų123.856%0.55665%0.653SS**Hα-helixtrans-75.9-29.7179.3-154.328.6000113.1N485 Q491N485-D487 PolarHBondContact O-N 3.48Å; N485-D487 VanDerWaalsContact O-N 3.16Å; D487-Q491 WeakPolarHBondContact O-CB 3.23Å; D487-Q491 VanDerWaalsContact O-CG 3.28Å; D487-Q491 WeakPolarHBondContact O-CG 3.36Å; D487-Q491 PolarHBondContact O-N 2.82Å; D487-Q491 PolarHBondContact O-NE2 2.82Å
488D65.8Low60.6Low81 Ų81126.2 Ų126.243%0.43365%0.647SS.*Hα-helixtrans-72.2-40170.2-74.9-40.4000110.5N485 M490 Q491 F492N485-D488 HydrophobicContact CB-CB 4.29Å; N485-D488 PolarHBondContact O-N 3.07Å; D488-M490 VanDerWaalsContact C-N 3.34Å; D488-M490 PolarHBondContact O-N 3.14Å; D488-Q491 PolarHBondContact O-N 3.1Å; D488-F492 WeakPolarHBondContact O-CB 3.46Å; D488-F492 PolarHBondContact O-N 2.76Å
489A63.8Low62.7Low47 Ų47121.2 Ų121.239%0.38863%0.63SS.*Hα-helixtrans-61.9-40.9172.100000111.9N485 Y486 F492 L493N485-A489 PolarHBondContact O-N 2.92Å; Y486-A489 PolarHBondContact O-N 3.05Å; A489-F492 PolarHBondContact O-N 3.06Å; A489-L493 WeakPolarHBondContact O-CB 3.34Å; A489-L493 VanDerWaalsContact O-CG 3.3Å; A489-L493 WeakPolarHBondContact O-CG 3.4Å; A489-L493 PolarHBondContact O-N 3.41Å
490M85.4Confident64.3Low85 Ų85121.7 Ų121.742%0.41962%0.621SS.*Hα-helixtrans-69.5-36175.4-76.9-68.6-7500112.7Y486 D488 L493 K494Y486-M490 HydrophobicContact CD1-CG 4.06Å; Y486-M490 HydrophobicContact CE1-CG 3.75Å; Y486-M490 HydrophobicContact CE2-CG 4.47Å; Y486-M490 WeakPolarHBondContact O-CB 3.48Å; Y486-M490 VanDerWaalsContact O-CG 3.24Å; Y486-M490 WeakPolarHBondContact O-CG 3.4Å; Y486-M490 PolarHBondContact O-N 2.93Å; D488-M490 VanDerWaalsContact C-N 3.34Å; D488-M490 PolarHBondContact O-N 3.14Å; M490-L493 HydrophobicContact SD-CD1 4.34Å; M490-K494 WeakPolarHBondContact O-CB 3.48Å; M490-K494 PolarHBondContact O-N 3.34Å
491Q74.6Confident66Low110 Ų110118.8 Ų118.851%0.51460%0.597SS.*Hα-helixtrans-65.6-41170.2-78.3177.585.900112D487 D488 K494 K495D487-Q491 WeakPolarHBondContact O-CB 3.23Å; D487-Q491 VanDerWaalsContact O-CG 3.28Å; D487-Q491 WeakPolarHBondContact O-CG 3.36Å; D487-Q491 PolarHBondContact O-N 2.82Å; D487-Q491 PolarHBondContact O-NE2 2.82Å; D488-Q491 PolarHBondContact O-N 3.1Å; Q491-K494 PolarHBondContact O-N 3.46Å; Q491-K495 WeakPolarHBondContact O-CB 3.48Å; Q491-K495 PolarHBondContact O-N 3.23Å
492F76.3Confident67.4Low147 Ų147114 Ų11465%0.64557%0.572SS**Hα-helixtrans-65-44.5175.7-163.7-89.3000111.7D488 A489 K494 K495 K496D488-F492 WeakPolarHBondContact O-CB 3.46Å; D488-F492 PolarHBondContact O-N 2.76Å; A489-F492 PolarHBondContact O-N 3.06Å; F492-K494 VanDerWaalsContact C-N 3.32Å; F492-K494 PolarHBondContact O-N 2.8Å; F492-K495 PolarHBondContact O-N 3.45Å; F492-K496 VanDerWaalsContact O-CB 3.31Å; F492-K496 WeakPolarHBondContact O-CB 3.45Å; F492-K496 PolarHBondContact O-N 3.5Å
493L78.3Confident68.4Low82 Ų82115.3 Ų115.343%0.42957%0.568SS.*Hα-helixtrans-62.2-37.3173.2-74.7169.4000112.2A489 M490 R497A489-L493 WeakPolarHBondContact O-CB 3.34Å; A489-L493 VanDerWaalsContact O-CG 3.3Å; A489-L493 WeakPolarHBondContact O-CG 3.4Å; A489-L493 PolarHBondContact O-N 3.41Å; M490-L493 HydrophobicContact SD-CD1 4.34Å; L493-R497 WeakPolarHBondContact O-CB 3.35Å; L493-R497 VanDerWaalsContact O-CG 3.3Å; L493-R497 WeakPolarHBondContact O-CG 3.41Å; L493-R497 PolarHBondContact O-N 3.16Å
494K80Confident69.2Low158 Ų158112.7 Ų112.769%0.68755%0.553SS**Hα-helixtrans-68.4-43174.9-171.8179.5179.1-172.80111.8M490 Q491 F492 R497 Y498M490-K494 WeakPolarHBondContact O-CB 3.48Å; M490-K494 PolarHBondContact O-N 3.34Å; Q491-K494 PolarHBondContact O-N 3.46Å; F492-K494 VanDerWaalsContact C-N 3.32Å; F492-K494 PolarHBondContact O-N 2.8Å; K494-R497 PolarHBondContact O-N 3.49Å; K494-Y498 WeakPolarHBondContact O-CB 3.43Å; K494-Y498 PolarHBondContact O-N 3.49Å
495K79.8Confident69.3Low149 Ų149112.9 Ų112.965%0.64855%0.549SS*.Hα-helixtrans-63.1-43.2174.2-168.9177.2-179.1-176.80111Q491 F492 Y498 L499Q491-K495 WeakPolarHBondContact O-CB 3.48Å; Q491-K495 PolarHBondContact O-N 3.23Å; F492-K495 PolarHBondContact O-N 3.45Å; K495-Y498 PolarHBondContact O-N 3.24Å; K495-L499 PolarHBondContact O-N 3.31Å
496K78.1Confident68.7Low138 Ų138115.5 Ų115.560%0.656%0.563SS**Hα-helixtrans-63.6-42175.3-172.3171-177.1173.70112.4F492 L499 H500F492-K496 VanDerWaalsContact O-CB 3.31Å; F492-K496 WeakPolarHBondContact O-CB 3.45Å; F492-K496 PolarHBondContact O-N 3.5Å; K496-L499 PolarHBondContact O-N 3.33Å; K496-H500 VanDerWaalsContact O-CB 3.28Å; K496-H500 WeakPolarHBondContact O-CB 3.34Å; K496-H500 PolarHBondContact O-N 3.24Å
497R75.9Confident67.5Low185 Ų185111.4 Ų111.470%0.69856%0.56SS**Hα-helixtrans-65.3-36.3172.8-74.8177.6-170.11765.7112.5L493 K494 A501L493-R497 WeakPolarHBondContact O-CB 3.35Å; L493-R497 VanDerWaalsContact O-CG 3.3Å; L493-R497 WeakPolarHBondContact O-CG 3.41Å; L493-R497 PolarHBondContact O-N 3.16Å; K494-R497 PolarHBondContact O-N 3.49Å; R497-A501 VanDerWaalsContact O-CB 3.26Å; R497-A501 WeakPolarHBondContact O-CB 3.47Å; R497-A501 PolarHBondContact O-N 2.84Å
498Y75.4Confident66.7Low190 Ų190116.5 Ų116.575%0.74557%0.572SS**Hα-helixtrans-69.8-42.3176.6-161.9-96.2000111.9K494 K495 A501 A502K494-Y498 WeakPolarHBondContact O-CB 3.43Å; K494-Y498 PolarHBondContact O-N 3.49Å; K495-Y498 PolarHBondContact O-N 3.24Å; Y498-A501 PolarHBondContact O-N 3.08Å; Y498-A502 WeakPolarHBondContact O-CB 3.44Å; Y498-A502 PolarHBondContact O-N 3.28Å
499L76.6Confident65.2Low94 Ų94119.5 Ų119.549%0.49259%0.588SS.*Hα-helixtrans-61.3-45.2171.5-102.3160.2000112.2K495 K496 A501 A502 M503K495-L499 PolarHBondContact O-N 3.31Å; K496-L499 PolarHBondContact O-N 3.33Å; L499-A501 VanDerWaalsContact C-N 3.31Å; L499-A501 PolarHBondContact O-N 2.79Å; L499-A502 PolarHBondContact O-N 2.83Å; L499-M503 WeakPolarHBondContact O-CB 3.2Å; L499-M503 WeakPolarHBondContact O-CG 3.42Å; L499-M503 PolarHBondContact O-N 3.44Å
500H67.9Low63.7Low134 Ų134128.4 Ų128.462%0.6261%0.613SS**Hα-helixtrans-66.5-32.2176.6-167.8-51.9000112.4K496 A504K496-H500 VanDerWaalsContact O-CB 3.28Å; K496-H500 WeakPolarHBondContact O-CB 3.34Å; K496-H500 PolarHBondContact O-N 3.24Å; H500-A504 VanDerWaalsContact O-CB 3.25Å; H500-A504 WeakPolarHBondContact O-CB 3.26Å; H500-A504 PolarHBondContact O-N 2.95Å
501A66.7Low61.1Low43 Ų43128 Ų12836%0.35563%0.631SS.*Hα-helixtrans-71.9-38172.300000112R497 Y498 L499 A504 N505R497-A501 VanDerWaalsContact O-CB 3.26Å; R497-A501 WeakPolarHBondContact O-CB 3.47Å; R497-A501 PolarHBondContact O-N 2.84Å; Y498-A501 PolarHBondContact O-N 3.08Å; L499-A501 VanDerWaalsContact C-N 3.31Å; L499-A501 PolarHBondContact O-N 2.79Å; A501-A504 PolarHBondContact O-N 3.13Å; A501-N505 VanDerWaalsContact O-CB 3.29Å; A501-N505 WeakPolarHBondContact O-CB 3.48Å; A501-N505 PolarHBondContact O-N 3.47Å; A501-N505 PolarHBondContact O-ND2 3.42Å; A501-N505 PolarHBondContact O-OD1 3.12Å
502A64.2Low59.3Low38 Ų38130.2 Ų130.231%0.31465%0.645SS.*Hα-helixtrans-64.8-44173.200000111.6Y498 L499 N505 N506Y498-A502 WeakPolarHBondContact O-CB 3.44Å; Y498-A502 PolarHBondContact O-N 3.28Å; L499-A502 PolarHBondContact O-N 2.83Å; A502-N505 PolarHBondContact O-N 2.79Å; A502-N506 WeakPolarHBondContact O-CB 3.34Å; A502-N506 PolarHBondContact O-N 3Å; A502-N506 PolarHBondContact O-OD1 3.08Å
503M60Low57.1Low133 Ų133131.1 Ų131.166%0.65566%0.657SS**Hα-helixtrans-62.9-41.5173.8-73.7172.315500112.3L499 S507L499-M503 WeakPolarHBondContact O-CB 3.2Å; L499-M503 WeakPolarHBondContact O-CG 3.42Å; L499-M503 PolarHBondContact O-N 3.44Å; M503-S507 WeakPolarHBondContact O-CB 3.42Å; M503-S507 PolarHBondContact O-N 2.83Å; M503-S507 VanDerWaalsContact O-N 3.13Å
504A54.6Low55.1Low57 Ų57133.1 Ų133.147%0.47167%0.672SS.*Hα-helixtrans-67.5-34.2175.300000113H500 A501 S507H500-A504 VanDerWaalsContact O-CB 3.25Å; H500-A504 WeakPolarHBondContact O-CB 3.26Å; H500-A504 PolarHBondContact O-N 2.95Å; A501-A504 PolarHBondContact O-N 3.13Å; A504-S507 PolarHBondContact O-N 3.32Å
505N49.1Very low52.8Low130 Ų130131.3 Ų131.370%0.69568%0.68SS**Hα-helixtrans-78-30.6177.7-71.1-8.5000112.8A501 A502 S507A501-N505 VanDerWaalsContact O-CB 3.29Å; A501-N505 WeakPolarHBondContact O-CB 3.48Å; A501-N505 PolarHBondContact O-N 3.47Å; A501-N505 PolarHBondContact O-ND2 3.42Å; A501-N505 PolarHBondContact O-OD1 3.12Å; A502-N505 PolarHBondContact O-N 2.79Å; N505-S507 VanDerWaalsContact C-N 3.25Å
506N46.8Very low50.6Low141 Ų141128.3 Ų128.375%0.75468%0.683SS**Hα-helixtrans-79.2-7.2172-71.89.6000112.7A502 R508A502-N506 WeakPolarHBondContact O-CB 3.34Å; A502-N506 PolarHBondContact O-N 3Å; A502-N506 PolarHBondContact O-OD1 3.08Å; N506-R508 PolarHBondContact O-N 3.12Å
507S40.5Very low48.2Very low93 Ų93130.9 Ų130.965%0.6570%0.7SS**  trans-82.753.6174.9-175.10000112M503 A504 N505M503-S507 WeakPolarHBondContact O-CB 3.42Å; M503-S507 PolarHBondContact O-N 2.83Å; M503-S507 VanDerWaalsContact O-N 3.13Å; A504-S507 PolarHBondContact O-N 3.32Å; N505-S507 VanDerWaalsContact C-N 3.25Å
508R41.6Very low46Very low211 Ų211127.6 Ų127.680%0.79671%0.705SS**SBendtrans-137.590169.3-104.4-172.4164.6116.1-0.8110.9N506N506-R508 PolarHBondContact O-N 3.12Å
509D33.7Very low43.9Very low144 Ų144124.2 Ų124.277%0.7771%0.709SS**  trans48.783.4145.4-47.1-41.2000118.3
510Y32.9Very low41.9Very low235 Ų235127.5 Ų127.592%0.92272%0.722SS**  trans-116.975.4141.8-88-83.1000109.3L512Y510-L512 PolarHBondContact O-N 3.46Å
511G31.2Very low40.6Very low76 Ų76126.3 Ų126.378%0.78473%0.726SS**  trans-77.7107.7172.800000110.9N513G511-N513 PolarHBondContact O-N 3.09Å
512L36.4Very low38.8Very low157 Ų157128.7 Ų128.782%0.82274%0.74SS**  trans-71114.8172.5-72.4174.7000109.9Y510 T514Y510-L512 PolarHBondContact O-N 3.46Å; L512-T514 PolarHBondContact O-N 2.81Å; L512-T514 VanDerWaalsContact O-N 3.17Å
513N29.4Very low37.1Very low166 Ų166132.9 Ų132.989%0.88876%0.761SS**  trans-83.192.3-179-139.20.3000109.7G511G511-N513 PolarHBondContact O-N 3.09Å
514T35.5Very low35.6Very low123 Ų123131.5 Ų131.576%0.75576%0.761SS**  trans-102.4104.9174.947.70000110.6L512L512-T514 PolarHBondContact O-N 2.81Å; L512-T514 VanDerWaalsContact O-N 3.17Å
515S31.9Very low34.4Very low120 Ų120136.9 Ų136.984%0.83978%0.776SS**  trans-152.3139168.8-81.40000110.6
516A33.8Very low33.4Very low87 Ų87136.3 Ų136.372%0.71978%0.778SS**  trans-74.9154.4-16300000114.4
517M27.3Very low32.5Very low192 Ų192135.7 Ų135.795%0.94678%0.779SS**  trans-121.4139.7146.8-82.6-73.1103.100108.4
518S30.8Very low31.8Very low115 Ų115137.2 Ų137.280%0.80478%0.784SS**  trans-126.8128.7-177.4177.80000109.8
519S31.1Very low31.3Very low119 Ų119132.6 Ų132.683%0.83278%0.784SS**  trans-154.897.4166.154.90000110.5
520Q34.1Very low31.2Very low163 Ų163131.7 Ų131.776%0.76278%0.784SS**  trans-68.3155.4156-97.4-95.9-19.500109.3
521P40.9Very low31.1Very low110 Ų110126.8 Ų126.871%0.71478%0.778SS**  -151.1140.684.137.7-18.8000118
522S28.4Very low31.2Very low93 Ų93130.8 Ų130.865%0.6578%0.779SS**  trans62.7157.1145.764.40000118
523V28.1Very low30.7Very low125 Ų125129.8 Ų129.876%0.75878%0.775SS**  cis-144.9162.936.1168.80000112.8
524T29Very low30.8Very low105 Ų105129.4 Ų129.464%0.64477%0.768SS**  trans-46.1167.3171.653.60000117.4
525Q30.6Very low30.7Very low169 Ų169129.7 Ų129.779%0.7977%0.77SS**  cis-164.9147.2-7.7-109.8170.620.200111
526T27.3Very low30.6Very low119 Ų119130.6 Ų130.673%0.7377%0.77SS**  trans26.9147.1134.3-16.90000125.6
527V28.3Very low31Very low128 Ų128132.5 Ų132.578%0.77678%0.775SS**  trans78.1121.4155.2-142.10000121
528V26.6Very low31.2Very low125 Ų125127.7 Ų127.776%0.75877%0.766SS**  158.3143.9117.8164.90000110.9
529S29.7Very low31.1Very low114 Ų114128.2 Ų128.280%0.79776%0.764SS**  trans-135132.4176-49.10000111.7
530T31.9Very low31.1Very low125 Ų125129.5 Ų129.577%0.76776%0.76SS**  trans-161.8119.7159.540.70000107.7
531V31.7Very low30.8Very low132 Ų132129.6 Ų129.680%0.877%0.765SS**  78.5144.769.9-169.90000112.8
532I32.9Very low30.1Very low159 Ų159131.4 Ų131.482%0.81576%0.764SS**  trans83.6137.2174.2-49.4-173.1000116.2
533D26.4Very low30.6Very low136 Ų136132.5 Ų132.573%0.72777%0.769SS**  cis-169.6172.8-34.7-145.1-25.1000111.1
534E31.4Very low30.4Very low158 Ų158133.7 Ų133.774%0.73877%0.766SS**  trans68.9151143.9-105.5-176.2-172.600125.9
535T32.2Very low31.1Very low130 Ų130133.6 Ų133.680%0.79877%0.767SS**  trans81103.5157.956.60000122.9
536V30.2Very low31.1Very low139 Ų139132 Ų13284%0.84276%0.763SS**  trans-90.7146.5153.7172.20000106.2
537P42.5Very low31.1Very low127 Ų127133.6 Ų133.683%0.82577%0.767SS**  -152.21796542.4-20.7000118.7
538A31.7Very low31.2Very low91 Ų91131.4 Ų131.475%0.75276%0.762SS**  trans-110.3162.1175.300000112.8
539T28.5Very low31.3Very low125 Ų125133.9 Ų133.977%0.76777%0.766SS**  trans-139.1110.2170.652.40000108.8
540I30.5Very low31.5Very low146 Ų146135.6 Ų135.675%0.74976%0.764SS**  83.8102.382.6-73.3162.8000113
541L27.7Very low31.4Very low166 Ų166138.7 Ų138.787%0.86977%0.767SS**  175.1132.4122.1-101.4157.9000114.3
542E27.2Very low31.3Very low148 Ų148137.1 Ų137.169%0.69277%0.768SS**  trans-88.2-172.8158.9-122.7-158.111100109.3
543P37.7Very low31.1Very low116 Ų116134.3 Ų134.375%0.75377%0.768SS**  cis-142-172.42442.1-20.3000117.6
544Q25Very low31.2Very low149 Ų149135.5 Ų135.570%0.69677%0.769SS**  trans-81.9-151.8169-48.8-162.222.900112
545P43.1Very low31.2Very low104 Ų104134 Ų13468%0.67576%0.762SS**  cis-142.9168-8.826.8-0.4000120
546I30.1Very low31.2Very low134 Ų134136.1 Ų136.169%0.68776%0.76SS**  trans44.5129.1137.5-54160.7000121.7
547N28.1Very low31.5Very low154 Ų154137.2 Ų137.282%0.82476%0.761SS**  165.3133.2127.4-88.2-61.7000108.8
548A29.7Very low31Very low82 Ų82138.1 Ų138.168%0.67876%0.764SS**  cis100.5117.234.800000113.6
549E29.4Very low31Very low177 Ų177143.1 Ų143.183%0.82777%0.769SS**  trans-174174.1136.5-110.2-152.1165.600113.9
550I32.9Very low31.8Very low149 Ų149142.6 Ų142.676%0.76477%0.768SS**  trans-126.7139.5-166.7-60.4160.3000111.1
551K30.5Very low32.2Very low191 Ų191142.2 Ų142.283%0.8377%0.767SS**  trans-163.7166146.9-103.3133.1-159.91540112.4
552A29.2Very low33.2Very low99 Ų99142.3 Ų142.382%0.81876%0.764SS**  trans-140.5172-167.800000112.9
553A28.7Very low34.2Very low99 Ų99140.4 Ų140.482%0.81876%0.762SS**  trans109.7143.415300000119.6
554H28.9Very low34.6Very low162 Ų162141.2 Ų141.275%0.7576%0.759SS**  trans97.1140156.6-114.2-77.7000122.2
555E30.6Very low35.6Very low127 Ų127140.9 Ų140.959%0.59376%0.758SS**  trans-77.6152.2-164.6-30.4146.2127.400114.8
556K34.1Very low36Very low174 Ų174140.3 Ų140.376%0.75775%0.752SS**  179162.7101.4-103.2136.9-165.8153.30114.1
557N35.1Very low36.7Very low162 Ų162139.2 Ų139.287%0.86675%0.747SS**  trans-86129.9-177.4-53.5-70.5000112.8
558V32.7Very low37.6Very low145 Ų145138.5 Ų138.588%0.87974%0.742SS**  trans-142.5160.2155.9-174.90000108.7
559F32.4Very low38.3Very low197 Ų197141.2 Ų141.286%0.86474%0.741SS**  trans-76.8161.6-173.9-82.7-100.4000114.6
560P44Very low39.1Very low114 Ų114140.4 Ų140.474%0.7474%0.737SS**  trans-93.8120.8-17734.8-30.9000113.5
561D39.7Very low39.6Very low137 Ų137143.8 Ų143.873%0.73374%0.742SS**  trans-140.7-17.4166.7-123.3-15.3000113.7V563D561-V563 PolarHBondContact O-N 3.18Å
562E48Very low40Very low169 Ų169139.8 Ų139.879%0.7974%0.738SS**Hα-helixtrans-77.6-16.5-170.5-64.2179.1123.800115L564 Q565 T566E562-L564 VanDerWaalsContact C-N 3.32Å; E562-L564 PolarHBondContact O-N 3.26Å; E562-Q565 PolarHBondContact O-N 3.33Å; E562-T566 PolarHBondContact O-OG1 3.37Å
563V49.5Very low40.6Very low108 Ų108140.5 Ų140.566%0.65573%0.732SS**Hα-helixtrans-71.8-25.5-178.9-178.40000112.4D561 T566D561-V563 PolarHBondContact O-N 3.18Å; V563-T566 PolarHBondContact O-OG1 3.31Å
564L45.4Very low41.3Very low133 Ų133145.9 Ų145.970%0.69674%0.737SS**Hα-helixtrans-81.5-27.6179.1-153.271.3000112.3E562E562-L564 VanDerWaalsContact C-N 3.32Å; E562-L564 PolarHBondContact O-N 3.26Å
565Q46.6Very low41.5Very low142 Ų142142.6 Ų142.666%0.66474%0.738SS**Hα-helixtrans-67.3-47176.9-157.9772000111.1E562 L567 L568E562-Q565 PolarHBondContact O-N 3.33Å; Q565-L567 VanDerWaalsContact C-N 3.26Å; Q565-L567 PolarHBondContact O-N 3.03Å; Q565-L568 PolarHBondContact O-N 3.47Å
566T50.6Low41.5Very low91 Ų91145 Ų14556%0.55876%0.755SS**Hα-helixtrans-67.6-18.2-176.741.70000115.2E562 V563E562-T566 PolarHBondContact O-OG1 3.37Å; V563-T566 PolarHBondContact O-OG1 3.31Å
567L44.9Very low41.4Very low112 Ų112140.1 Ų140.159%0.58675%0.754SS**Hα-helixtrans-85.7-20179.2-96.9162000113.9Q565Q565-L567 VanDerWaalsContact C-N 3.26Å; Q565-L567 PolarHBondContact O-N 3.03Å
568L47.6Very low41.1Very low138 Ų138141.8 Ų141.872%0.72376%0.756SS**Hα-helixtrans-87.6-32.2176.4-10164.6000112.9Q565 H570Q565-L568 PolarHBondContact O-N 3.47Å; L568-H570 PolarHBondContact O-N 3Å
569E44.3Very low41.2Very low140 Ų140138.8 Ų138.865%0.65474%0.742SS**Hα-helixtrans-61-31.8178.3-149.384.4-122.200112.2Y571E569-Y571 PolarHBondContact O-N 3.2Å
570H46.2Very low41.2Very low160 Ų160136.3 Ų136.374%0.74174%0.737SS**THydrogen-bonded Turntrans-80.6-6.3-169.3-115.2-70.8000116L568L568-H570 PolarHBondContact O-N 3Å
571Y41.9Very low40.6Very low219 Ų219139.5 Ų139.586%0.85975%0.747SS**THydrogen-bonded Turntrans-111.80.8-176.1-96.4-78.9000115.2E569E569-Y571 PolarHBondContact O-N 3.2Å
572S40.3Very low40.2Very low107 Ų107138 Ų13875%0.74875%0.746SS**SBendtrans-106.52.5-170.9-147.40000115.4
573T41Very low39.2Very low115 Ų115139.9 Ų139.971%0.70675%0.752SS**  trans-124.244.6-161.446.80000115.4
574K42.8Very low38.4Very low212 Ų212139.3 Ų139.392%0.92275%0.754SS**  trans-154.251.3171.6-133.3170.5-170.7176.60118.6
575A34.1Very low37.6Very low92 Ų92139 Ų13976%0.7676%0.757SS**  trans-156.477.5166.400000114.1
576N31.5Very low36.9Very low179 Ų179137 Ų13796%0.95776%0.764SS**  trans152.8133.8157.5-84.2-21.9000109.2
577G31.9Very low36.1Very low71 Ų71139.7 Ų139.773%0.73278%0.775SS**  cis168.4134.8-10.700000111.9
578Q28.3Very low35.7Very low197 Ų197141.2 Ų141.292%0.92179%0.79SS**  trans-179.5159.5169.2-111.5176.8-22.800109.5
579S34.9Very low35.3Very low82 Ų82143.3 Ų143.357%0.57380%0.796SS**  -154.8169-59.561.90000109.4
580D30.8Very low34.7Very low144 Ų144143.6 Ų143.677%0.7781%0.806SS**  trans54.890.7154.2-44.1-45.5000120.8
581I32.6Very low34Very low182 Ų182141.6 Ų141.693%0.93381%0.806SS**  trans-132.9134.1133-57.7-178000107.8
582S31Very low33.5Very low104 Ų104137.2 Ų137.273%0.72781%0.807SS**  trans-120.7143.1-178.454.40000112.3
583F26.2Very low33.2Very low209 Ų209137.6 Ų137.692%0.91781%0.81SS**  trans-155163.7152.3-118-79.7000109.1
584S33.1Very low32.7Very low97 Ų97139.9 Ų139.968%0.67882%0.816SS**  trans-145.8167.5-149.857.60000115.8
585V29.1Very low32.2Very low127 Ų127135 Ų13577%0.7781%0.808SS**  trans68.7115.4164.3-173.70000117.8
586A31.7Very low32.1Very low98 Ų98138 Ų13881%0.8181%0.81SS**  -164.9118.3128.200000110.1
587D33.2Very low32.1Very low149 Ų149136.2 Ų136.280%0.79780%0.801SS**  trans-89.5146.1176.2-51.1-85000111.8
588T37.5Very low32.2Very low144 Ų144138.1 Ų138.188%0.88380%0.803SS**  trans-143.7118.9151.852.40000110.8
589E37.9Very low32.6Very low182 Ų182132.8 Ų132.885%0.8579%0.787SS**  trans-75.5146.4173.1-48.8170.3150.200111.3
590V32.9Very low32.4Very low145 Ų145135.7 Ų135.788%0.87980%0.796SS**  trans-143.4130.8138.2-179.40000109
591T31.7Very low32.6Very low118 Ų118135.3 Ų135.372%0.72480%0.798SS**  trans-82.3152.4177540000112.9
592S31.7Very low32.7Very low127 Ų127131.2 Ų131.289%0.88879%0.786SS**  trans-177.1122.3130.1-99.90000111.8
593S33.8Very low32.7Very low115 Ų115133.3 Ų133.380%0.80479%0.789SS**  trans-107.6142.6170.844.10000110.8
594I29.9Very low33Very low164 Ų164128.3 Ų128.384%0.84178%0.78SS**  trans-133.9125.4163.4-61.7-178000107.8
595S32.3Very low33.1Very low108 Ų108128.7 Ų128.776%0.75578%0.783SS**  trans-132.2144.3174.350.20000109.3
596I32.6Very low34.5Very low156 Ų156128 Ų12880%0.878%0.781SS**  trans-140.4129.4172.5-54.2-178.1000107.6
597N31.4Very low34.5Very low142 Ų142128.9 Ų128.976%0.75978%0.776SS**  trans-76.3158.4176.5-57-27000110.4
598S33.3Very low34.5Very low111 Ų111130 Ų13078%0.77678%0.776SS**  154162.887.2-91.60000107.7
599S36.2Very low34.4Very low84 Ų84127.5 Ų127.559%0.58777%0.765SS**  cis-167.6161.9-15.956.80000109.9
600D32.2Very low34.1Very low144 Ų144127.3 Ų127.377%0.7777%0.768SS**  trans65.5158.2159.1-43.3-44.8000117.4
601V34.1Very low34Very low135 Ų135123.3 Ų123.382%0.81876%0.756SS**  cis-137.216220.4-168.10000111.8
602S35.5Very low34.1Very low97 Ų97123.4 Ų123.468%0.67876%0.762SS**  trans-52173.1172.7-24.20000115.3
603D30.4Very low34.2Very low148 Ų148123.6 Ų123.679%0.79176%0.763SS**  cis-164.3177.518.4-129.5-50.7000107.7
604S32.4Very low34Very low104 Ų104122 Ų12273%0.72777%0.765SS**  cis-157.6-1514.566.40000112.4
605S35.3Very low34.2Very low104 Ų104119 Ų11973%0.72776%0.764SS**  trans-150.4-167.6172.567.90000108.9
606P57.9Low34.3Very low113 Ų113123.1 Ų123.173%0.73477%0.771SS**  cis-121.7-163.7-13.830.8-7.8000112
607V32.5Very low34.2Very low116 Ų116120.3 Ų120.370%0.70377%0.772SS**  -172.6144.573.9165.50000111.6
608E32.7Very low34.7Very low172 Ų172122.8 Ų122.880%0.80478%0.779SS**  trans-4.7165.7150.7-55.6-176106.400122.4
609S35.1Very low35.4Very low93 Ų93123 Ų12365%0.6578%0.778SS**  cis-178.5178.9-20.2-86.10000108.8
610I33Very low36Very low178 Ų178122.5 Ų122.591%0.91377%0.772SS**  trans75.5137.7170.5-43164.3000114.5
611G29.8Very low36.8Very low61 Ų61121.5 Ų121.563%0.62977%0.771SS**  cis164138.4-12.200000114.8
612S33.5Very low37.6Very low120 Ų120122.3 Ų122.384%0.83977%0.766SS**  trans72124.8157.9-60.60000122.9
613S35Very low38.3Very low131 Ų131125.4 Ų125.492%0.91677%0.768SS**  trans68.9145.7147.576.90000122.4
614G28.9Very low39.5Very low82 Ų82123 Ų12385%0.84576%0.758SS**  trans139.7144-176.900000111
615A34.3Very low41Very low99 Ų99121.4 Ų121.482%0.81875%0.747SS**  trans-128.4160.5-171.700000114.4
616Q33.5Very low42.5Very low195 Ų195122.3 Ų122.391%0.91174%0.743SS**  trans82.6154.5169.7-63.5-162.4-2000120.3
617A31.8Very low43Very low98 Ų98122.7 Ų122.781%0.8174%0.738SS**  trans72.6102.1165.200000119.7
618Q40.9Very low45.1Very low193 Ų193123.3 Ų123.390%0.90273%0.733SS**  trans-86145.1146-71.8-172-19.900109.3
619P47.8Very low47.3Very low116 Ų116121.5 Ų121.575%0.75373%0.725SS**  -152.2-168.9101.640.5-23.7000112.9
620P49.2Very low49.2Very low73 Ų73123.8 Ų123.847%0.47472%0.72SS.*  cis-123.9134.6-3729-11.8000112.3
621T48.3Very low51.5Low123 Ų123117.9 Ų117.976%0.75570%0.695SS**SBendtrans-79.6-24.5179.239.80000115K623 V624T621-K623 VanDerWaalsContact C-N 3.3Å; T621-K623 PolarHBondContact O-N 3.08Å; T621-V624 PolarHBondContact O-N 3.33Å; T621-V624 VanDerWaalsContact O-N 3.17Å
622E51.9Low54Low152 Ų152122.4 Ų122.471%0.7170%0.697SS**Hα-helixtrans-58.3-35.6-171.6-61.8175.7129.400114.2V624 S625 L626E622-V624 PolarHBondContact O-N 3.34Å; E622-S625 PolarHBondContact O-N 3.33Å; E622-S625 VanDerWaalsContact O-N 3.14Å; E622-L626 PolarHBondContact O-N 3.08Å
623K50.1Low56.6Low163 Ų163123.1 Ų123.171%0.70969%0.685SS**Hα-helixtrans-63.1-27.1-178.1-70-172.9177.2-178.20113.3T621 L627T621-K623 VanDerWaalsContact C-N 3.3Å; T621-K623 PolarHBondContact O-N 3.08Å; K623-L627 WeakPolarHBondContact O-CB 3.43Å; K623-L627 PolarHBondContact O-N 3.34Å
624V54.9Low58.9Low98 Ų98120.7 Ų120.759%0.59466%0.661SS**Hα-helixtrans-75.9-42.8176-176.60000110.2T621 E622 L627 Q628T621-V624 PolarHBondContact O-N 3.33Å; T621-V624 VanDerWaalsContact O-N 3.17Å; E622-V624 PolarHBondContact O-N 3.34Å; V624-L627 PolarHBondContact O-N 3.32Å; V624-Q628 WeakPolarHBondContact O-CB 3.17Å; V624-Q628 PolarHBondContact O-N 3.41Å
625S64.5Low61.3Low70 Ų70122.9 Ų122.949%0.4965%0.65SS.*Hα-helixtrans-61.9-46.2178.4-160.20000111.7E622 L627 Q628 E629E622-S625 PolarHBondContact O-N 3.33Å; E622-S625 VanDerWaalsContact O-N 3.14Å; S625-L627 VanDerWaalsContact C-N 3.33Å; S625-L627 PolarHBondContact O-N 3.5Å; S625-Q628 CarbonylContact O-C 3.58Å; S625-Q628 PolarHBondContact O-N 3.18Å; S625-Q628 VanDerWaalsContact O-N 3.08Å; S625-E629 PolarHBondContact O-N 2.74Å
626L66.4Low63.5Low122 Ų122123.4 Ų123.464%0.63964%0.635SS**Hα-helixtrans-65.4-36.6-179.8-154.5160.5000111.7E622 Q628 E629 Y630E622-L626 PolarHBondContact O-N 3.08Å; L626-Q628 VanDerWaalsContact C-N 3.32Å; L626-Q628 PolarHBondContact O-N 2.91Å; L626-E629 PolarHBondContact O-N 3.01Å; L626-Y630 WeakPolarHBondContact O-CB 3.46Å; L626-Y630 PolarHBondContact O-N 3.37Å
627L69.6Low65.4Low122 Ų122116.2 Ų116.264%0.63961%0.61SS**Hα-helixtrans-67.6-32.4173.4-161.373.9000112.3K623 V624 S625 S631K623-L627 WeakPolarHBondContact O-CB 3.43Å; K623-L627 PolarHBondContact O-N 3.34Å; V624-L627 PolarHBondContact O-N 3.32Å; S625-L627 VanDerWaalsContact C-N 3.33Å; S625-L627 PolarHBondContact O-N 3.5Å; L627-S631 PolarHBondContact O-N 3.23Å; L627-S631 PolarHBondContact O-OG 3Å
628Q75.4Confident67.5Low129 Ų129117 Ų11760%0.60360%0.6SS**Hα-helixtrans-78.8-29.7177.9-169.91651.100113V624 S625 L626 S631 K632V624-Q628 WeakPolarHBondContact O-CB 3.17Å; V624-Q628 PolarHBondContact O-N 3.41Å; S625-Q628 CarbonylContact O-C 3.58Å; S625-Q628 PolarHBondContact O-N 3.18Å; S625-Q628 VanDerWaalsContact O-N 3.08Å; L626-Q628 VanDerWaalsContact C-N 3.32Å; L626-Q628 PolarHBondContact O-N 2.91Å; Q628-S631 PolarHBondContact O-OG 3.24Å; Q628-S631 VanDerWaalsContact O-OG 3.08Å; Q628-K632 WeakPolarHBondContact O-CB 3.49Å; Q628-K632 PolarHBondContact O-N 2.92Å
629E78.9Confident69.1Low133 Ų133113.4 Ų113.462%0.62158%0.583SS**Hα-helixtrans-69.1-41.2166.7-70.4-174.5137.400111.3S625 L626 S631 K632 F633S625-E629 PolarHBondContact O-N 2.74Å; L626-E629 PolarHBondContact O-N 3.01Å; E629-S631 PolarHBondContact O-N 3.11Å; E629-K632 PolarHBondContact O-N 3.22Å; E629-F633 WeakPolarHBondContact O-CB 3.39Å; E629-F633 PolarHBondContact O-N 3.34Å
630Y75.3Confident69.9Low142 Ų142115 Ų11556%0.55757%0.573SS**Hα-helixtrans-63.2-40.7176.8-174.1-109000112.8L626 F633 L634L626-Y630 WeakPolarHBondContact O-CB 3.46Å; L626-Y630 PolarHBondContact O-N 3.37Å; Y630-F633 PolarHBondContact O-N 3.49Å; Y630-L634 HydrophobicContact CD1-CD1 3.9Å; Y630-L634 HydrophobicContact CE1-CD1 3.5Å; Y630-L634 HydrophobicContact CE1-CG 4.36Å; Y630-L634 WeakPolarHBondContact O-CG 3.33Å; Y630-L634 PolarHBondContact O-N 3.47Å
631S80.6Confident70.6Confident54 Ų54115.1 Ų115.138%0.37857%0.573SS.*Hα-helixtrans-67.6-37.9174.966.60000112.5L627 Q628 E629 L634 Q635L627-S631 PolarHBondContact O-N 3.23Å; L627-S631 PolarHBondContact O-OG 3Å; Q628-S631 PolarHBondContact O-OG 3.24Å; Q628-S631 VanDerWaalsContact O-OG 3.08Å; E629-S631 PolarHBondContact O-N 3.11Å; S631-L634 PolarHBondContact O-N 2.96Å; S631-Q635 WeakPolarHBondContact O-CG 3.48Å; S631-Q635 PolarHBondContact O-N 3.34Å
632K83.1Confident71.2Confident155 Ų155112.2 Ų112.267%0.67456%0.558SS**Hα-helixtrans-66.7-37.5175.4-161.9174.5-173-179.60112.2Q628 E629 Q635 Q636Q628-K632 WeakPolarHBondContact O-CB 3.49Å; Q628-K632 PolarHBondContact O-N 2.92Å; E629-K632 PolarHBondContact O-N 3.22Å; K632-Q635 PolarHBondContact O-N 3.17Å; K632-Q636 PolarHBondContact O-N 3.37Å
633F88.7Confident71.3Confident136 Ų136110.4 Ų110.460%0.59655%0.549SS*.Hα-helixtrans-64.5-44.6171.9-178.6-96.3000111.9E629 Y630 Q635 Q636 A637E629-F633 WeakPolarHBondContact O-CB 3.39Å; E629-F633 PolarHBondContact O-N 3.34Å; Y630-F633 PolarHBondContact O-N 3.49Å; F633-Q635 PolarHBondContact O-N 3Å; F633-Q636 PolarHBondContact O-N 3.28Å; F633-A637 PolarHBondContact O-N 3.43Å
634L82.5Confident71.3Confident79 Ų79107.7 Ų107.741%0.41454%0.543SS..Hα-helixtrans-61-41.4175.1-80.7168.4000112.5Y630 S631 A637 L638Y630-L634 HydrophobicContact CD1-CD1 3.9Å; Y630-L634 HydrophobicContact CE1-CD1 3.5Å; Y630-L634 HydrophobicContact CE1-CG 4.36Å; Y630-L634 WeakPolarHBondContact O-CG 3.33Å; Y630-L634 PolarHBondContact O-N 3.47Å; S631-L634 PolarHBondContact O-N 2.96Å; L634-A637 PolarHBondContact O-N 3.44Å; L634-L638 WeakPolarHBondContact O-CG 3.26Å; L634-L638 PolarHBondContact O-N 3Å
635Q79.1Confident70.9Confident129 Ų129107.9 Ų107.960%0.60354%0.541SS*.Hα-helixtrans-63.3-44.6173.8-75.2176.8-32.400111.6S631 K632 F633 A637 L638 E639S631-Q635 WeakPolarHBondContact O-CG 3.48Å; S631-Q635 PolarHBondContact O-N 3.34Å; K632-Q635 PolarHBondContact O-N 3.17Å; F633-Q635 PolarHBondContact O-N 3Å; Q635-A637 VanDerWaalsContact C-N 3.26Å; Q635-A637 PolarHBondContact O-N 3.33Å; Q635-L638 PolarHBondContact O-N 3.45Å; Q635-E639 WeakPolarHBondContact O-CB 3.1Å; Q635-E639 PolarHBondContact O-N 3.25Å
636Q82Confident69.9Low109 Ų109108 Ų10851%0.50954%0.541SS..Hα-helixtrans-66.6-26.2177.3-157.9-175.43000113.4K632 F633 R640K632-Q636 PolarHBondContact O-N 3.37Å; F633-Q636 PolarHBondContact O-N 3.28Å; Q636-R640 PolarHBondContact O-N 3.49Å
637A72.3Confident68.9Low45 Ų45110.7 Ų110.737%0.37254%0.544SS..Hα-helixtrans-71.9-44.1170.900000111.6F633 L634 Q635 R640 T641F633-A637 PolarHBondContact O-N 3.43Å; L634-A637 PolarHBondContact O-N 3.44Å; Q635-A637 VanDerWaalsContact C-N 3.26Å; Q635-A637 PolarHBondContact O-N 3.33Å; A637-R640 PolarHBondContact O-N 2.87Å; A637-T641 PolarHBondContact O-N 3.01Å; A637-T641 VanDerWaalsContact O-N 3.08Å
638L75.3Confident67.8Low115 Ų115111.1 Ų111.160%0.60255%0.546SS*.Hα-helixtrans-63.1-41.4177-74.8165.2000112.3L634 Q635 R640 T641 S642L634-L638 WeakPolarHBondContact O-CG 3.26Å; L634-L638 PolarHBondContact O-N 3Å; Q635-L638 PolarHBondContact O-N 3.45Å; L638-R640 PolarHBondContact O-N 3.14Å; L638-T641 WeakPolarHBondContact CA-OG1 3.43Å; L638-T641 PolarHBondContact O-N 3.19Å; L638-T641 VanDerWaalsContact O-N 3.08Å; L638-T641 PolarHBondContact O-OG1 3.29Å; L638-S642 PolarHBondContact O-N 3.08Å; L638-S642 PolarHBondContact O-OG 3.02Å
639E74.3Confident66.2Low117 Ų117110.2 Ų110.255%0.54755%0.55SS..Hα-helixtrans-57.9-36.1173.7-156.576.9-124.500112.1Q635 S642 Q643Q635-E639 WeakPolarHBondContact O-CB 3.1Å; Q635-E639 PolarHBondContact O-N 3.25Å; E639-S642 PolarHBondContact O-OG 2.88Å; E639-Q643 VanDerWaalsContact O-CG 3.26Å; E639-Q643 WeakPolarHBondContact O-CG 3.43Å; E639-Q643 PolarHBondContact O-N 3.49Å
640R66.3Low64.4Low148 Ų148108.1 Ų108.156%0.55855%0.55SS*.Hα-helixtrans-77.5-26.6175.5-76.5-173.9169.9109.9-2.3113.3Q636 A637 L638 N644Q636-R640 PolarHBondContact O-N 3.49Å; A637-R640 PolarHBondContact O-N 2.87Å; L638-R640 PolarHBondContact O-N 3.14Å; R640-N644 PolarHBondContact O-ND2 3.08Å
641T62.9Low62.8Low76 Ų76109.7 Ų109.747%0.46656%0.562SS.*Hα-helixtrans-72.7-43.7171.546.70000112.3A637 L638 Q643 N644 D645A637-T641 PolarHBondContact O-N 3.01Å; A637-T641 VanDerWaalsContact O-N 3.08Å; L638-T641 WeakPolarHBondContact CA-OG1 3.43Å; L638-T641 PolarHBondContact O-N 3.19Å; L638-T641 VanDerWaalsContact O-N 3.08Å; L638-T641 PolarHBondContact O-OG1 3.29Å; T641-Q643 VanDerWaalsContact C-N 3.33Å; T641-Q643 PolarHBondContact O-N 3.42Å; T641-N644 PolarHBondContact O-N 3.36Å; T641-N644 VanDerWaalsContact O-N 3.09Å; T641-D645 PolarHBondContact O-N 3.49Å; T641-D645 VanDerWaalsContact O-N 3.12Å
642S61.8Low60.9Low62 Ų62111.3 Ų111.343%0.43457%0.574SS.*Hα-helixtrans-64.1-36.2179.560.40000112.9L638 E639 N644 D645 S646L638-S642 PolarHBondContact O-N 3.08Å; L638-S642 PolarHBondContact O-OG 3.02Å; E639-S642 PolarHBondContact O-OG 2.88Å; S642-N644 VanDerWaalsContact C-N 3.32Å; S642-N644 PolarHBondContact O-N 3.34Å; S642-D645 PolarHBondContact O-N 3.17Å; S642-S646 PolarHBondContact O-N 3.47Å
643Q54Low58.5Low114 Ų114111.8 Ų111.853%0.53358%0.583SS.*Hα-helixtrans-64-34.3173.7-72.7174.213.300112.6E639 T641E639-Q643 VanDerWaalsContact O-CG 3.26Å; E639-Q643 WeakPolarHBondContact O-CG 3.43Å; E639-Q643 PolarHBondContact O-N 3.49Å; T641-Q643 VanDerWaalsContact C-N 3.33Å; T641-Q643 PolarHBondContact O-N 3.42Å
644N49.3Very low55.7Low107 Ų107110.6 Ų110.657%0.57259%0.591SS**Hα-helixtrans-73.3-39.2176.2-75-42.8000112.7R640 T641 S642 S646 Y647R640-N644 PolarHBondContact O-ND2 3.08Å; T641-N644 PolarHBondContact O-N 3.36Å; T641-N644 VanDerWaalsContact O-N 3.09Å; S642-N644 VanDerWaalsContact C-N 3.32Å; S642-N644 PolarHBondContact O-N 3.34Å; N644-S646 PolarHBondContact O-N 3.03Å; N644-Y647 PolarHBondContact O-N 2.57Å; N644-Y647 VanDerWaalsContact O-N 3.13Å
645D46.5Very low53.1Low102 Ų102114.9 Ų114.955%0.54561%0.614SS.*Hα-helixtrans-64.7-28175.9-72.3-32.7000112.6T641 S642 Y647 L648 T649T641-D645 PolarHBondContact O-N 3.49Å; T641-D645 VanDerWaalsContact O-N 3.12Å; S642-D645 PolarHBondContact O-N 3.17Å; D645-Y647 VanDerWaalsContact C-N 3.33Å; D645-Y647 PolarHBondContact O-N 3.03Å; D645-L648 PolarHBondContact O-N 3.14Å; D645-T649 PolarHBondContact O-N 3Å; D645-T649 VanDerWaalsContact O-N 3.16Å; D645-T649 PolarHBondContact O-OG1 3.17Å
646S44.1Very low50.9Low72 Ų72114.1 Ų114.150%0.50362%0.618SS.*Hα-helixtrans-65-31.3173.1-170.30000113.5S642 N644 T649 S650S642-S646 PolarHBondContact O-N 3.47Å; N644-S646 PolarHBondContact O-N 3.03Å; S646-T649 PolarHBondContact O-OG1 3.4Å; S646-S650 PolarHBondContact O-N 3.22Å; S646-S650 PolarHBondContact O-OG 3.2Å
647Y44.6Very low48.3Very low179 Ų179114.5 Ų114.570%0.70263%0.632SS**Hα-helixtrans-76.1-26.7175.8-90.4-88.6000113.5N644 D645 S650N644-Y647 PolarHBondContact O-N 2.57Å; N644-Y647 VanDerWaalsContact O-N 3.13Å; D645-Y647 VanDerWaalsContact C-N 3.33Å; D645-Y647 PolarHBondContact O-N 3.03Å; Y647-S650 PolarHBondContact O-OG 3.12Å
648L46.4Very low46.5Very low130 Ų130120.9 Ų120.968%0.68165%0.654SS**Hα-helixtrans-84.1-29.9178.3-66.8175.6000113D645D645-L648 PolarHBondContact O-N 3.14Å
649T42.5Very low44.5Very low111 Ų111123 Ų12368%0.68167%0.666SS**Hα-helixtrans-81.8-18.8-179.943.90000114.2D645 S646D645-T649 PolarHBondContact O-N 3Å; D645-T649 VanDerWaalsContact O-N 3.16Å; D645-T649 PolarHBondContact O-OG1 3.17Å; S646-T649 PolarHBondContact O-OG1 3.4Å
650S40.8Very low42.9Very low89 Ų89123 Ų12362%0.62268%0.676SS**Hα-helixtrans-89.9-19.6-179.647.60000114.7S646 Y647S646-S650 PolarHBondContact O-N 3.22Å; S646-S650 PolarHBondContact O-OG 3.2Å; Y647-S650 PolarHBondContact O-OG 3.12Å
651Q42.3Very low41.4Very low175 Ų175122 Ų12282%0.81869%0.687SS**SBendtrans-94.912.4-173-157.4169.792.200114.5
652S39.3Very low40Very low88 Ų88127.1 Ų127.162%0.61571%0.71SS**SBendtrans-13961.1-176.154.80000115.4
653L34.2Very low38.6Very low165 Ų165128.9 Ų128.986%0.86473%0.728SS**SBendtrans-167.6153.4147.3-105.1166.1000112.3
654S28.4Very low37.6Very low110 Ų110126.8 Ų126.877%0.76974%0.737SS**  trans80.671.6159.8-54.90000121.5
655L29.5Very low36.7Very low170 Ų170130.6 Ų130.689%0.8975%0.752SS**  trans-147.2128.2146-81.3-178.5000106.8
656V32Very low36.7Very low113 Ų113130.4 Ų130.469%0.68576%0.756SS**  cis-143152.7-5.8170.60000107.8E658V656-E658 HydrophobicContact CG1-CG 3.84Å
657S28.6Very low36Very low116 Ų116134.1 Ų134.181%0.81177%0.77SS**  trans-137.3133147.165.80000109.6
658E33.6Very low35.2Very low179 Ų179134.4 Ų134.484%0.83678%0.775SS**  trans-85.1155.6-161.7-59.7176.2127.700114.5V656V656-E658 HydrophobicContact CG1-CG 3.84Å
659N33.3Very low34.5Very low161 Ų161132.8 Ų132.886%0.86178%0.775SS**  trans-80.2154.1172.2-69-55.4000111.8
660P40.5Very low33.9Very low115 Ų115133.2 Ų133.275%0.74777%0.773SS**  trans-116.8112.3146.733.3-24.1000112.6
661T34.1Very low33.3Very low129 Ų129135 Ų13579%0.79177%0.771SS**  trans48.6116.2137.9-43.40000120.8
662L35.1Very low32.9Very low183 Ų183134.2 Ų134.296%0.95877%0.765SS**  trans-77.5129.5157.1-85.9165.3000111.5
663A31.6Very low32.6Very low98 Ų98138.2 Ų138.281%0.8177%0.774SS**  trans-150.9137.6157.600000108.8
664G31.9Very low32.3Very low70 Ų70139.1 Ų139.172%0.72277%0.771SS**  trans-154.2117.1-175.400000115.1
665Q30.7Very low32.3Very low187 Ų187139 Ų13987%0.87477%0.77SS**  trans-156.5156.3149-92.7-55.5-71.700107.2
666P46.8Very low32.6Very low98 Ų98136.4 Ų136.464%0.63677%0.766SS**  trans-91.5174-168.437.4-36.3000113.5
667L29.9Very low33.1Very low151 Ų151136.5 Ų136.579%0.79177%0.769SS**  177.8122.6128.3-89.9165.3000111.2
668F28.3Very low33.3Very low184 Ų184135.6 Ų135.681%0.80776%0.763SS**  trans27.1129.8160.8-66-85.6000124.9
669S30.3Very low33.3Very low97 Ų97137 Ų13768%0.67876%0.761SS**  trans69.9148.1135.2-71.50000120.5
670N30Very low33.1Very low120 Ų120137.2 Ų137.264%0.64275%0.754SS**  cis-153.4160.60.1-125.126.7000112.5
671E30Very low32.8Very low125 Ų125140.1 Ų140.158%0.58476%0.755SS**  trans59.9125.4148.9-71.6177.291.700123.4
672K33.8Very low32.6Very low160 Ų160140 Ų14070%0.69676%0.76SS**  60.1148.1128.1-60.1169.9-172.4162.10118.8
673Q31.8Very low32.2Very low171 Ų171134.1 Ų134.180%0.79974%0.743SS**  cis-155.8166.78.5-134.3160-13.400112.9
674F28.1Very low32.1Very low185 Ų185138.4 Ų138.481%0.81175%0.749SS**  trans-44152.4-179.9-83.3-90.2000121.4
675S28.6Very low31.9Very low107 Ų107140.7 Ų140.775%0.74875%0.754SS**  trans81.7119.8135.6-68.20000123
676S36Very low32.1Very low115 Ų115137.3 Ų137.380%0.80475%0.75SS**  trans-69.9156.7152.1-35.20000112.2
677P43.2Very low32.2Very low115 Ų115137.8 Ų137.875%0.74775%0.754SS**  -139.8143.211333.7-20000112.2
678S31.2Very low32.2Very low98 Ų98138.1 Ų138.169%0.68576%0.755SS**  cis97.1136.946.899.60000114.7
679R34.7Very low32.3Very low207 Ų207139.9 Ų139.978%0.78176%0.757SS**  trans86.6146.8149.6-77.7177.5167.6168.3-2.1122.3
680F29.4Very low32.2Very low166 Ų166139.8 Ų139.873%0.72876%0.756SS**  trans68.5153161.2-60.8-53.1000117.9
681K33.8Very low32.3Very low177 Ų177140.1 Ų140.177%0.7776%0.763SS**  cis177.4138.1-38.4-121.4-166.1-168-177.10105.9
682S29.6Very low32.4Very low127 Ų127141.4 Ų141.489%0.88877%0.773SS**  trans64160170.9-152.30000114.9
683G26Very low32.3Very low59 Ų59142.3 Ų142.361%0.60878%0.779SS**  cis152.2131.5-17.200000113.1
684M31.1Very low32.5Very low188 Ų188142.3 Ų142.393%0.92678%0.777SS**  trans75.2159.7169.7-56.5-179.167.300119.3
685S27.2Very low33.5Very low118 Ų118139.1 Ų139.183%0.82578%0.775SS**  trans69.1109.2170.662.90000121
686S34.8Very low33.7Very low115 Ų115140.9 Ų140.980%0.80477%0.771SS**  -82.1169129.4-34.10000108.1
687P48Very low33.5Very low109 Ų109144.6 Ų144.671%0.70877%0.773SS**  -155.6-176.750.439.5-15.5000119
688L31.3Very low32.8Very low157 Ų157143 Ų14382%0.82277%0.77SS**  trans73.8156.1166.6-46.8-177.7000116.5
689R29.3Very low32.7Very low222 Ų222146.2 Ų146.284%0.83878%0.778SS**  cis-155.2151.512.2-150-180-172.3165.90.9112.6
690S29.1Very low32.6Very low95 Ų95143.5 Ų143.566%0.66478%0.778SS**  trans22.8132.7155.956.70000122.4
691T32.3Very low32.7Very low127 Ų127142.4 Ų142.478%0.77979%0.785SS**  -156.6148.480.624.60000112.5
692L32.2Very low32.5Very low152 Ų152137 Ų13780%0.79678%0.779SS**  48.4131.7100.7-101.574.5000115
693E31.1Very low32.5Very low179 Ų179138.6 Ų138.684%0.83678%0.778SS**  cis-144.6-17311.4-87.6-161.9118.700113.9
694K36.3Very low32.8Very low171 Ų171140.4 Ų140.474%0.74378%0.781SS**  trans-148.7147.6172.6-89.7-169.9175.6-172.70113.1
695P49Very low32.9Very low118 Ų118139.7 Ų139.777%0.76678%0.775SS**  trans-122.2151.9132.535.6-28.3000111.4
696H32.3Very low33.1Very low143 Ų143141.7 Ų141.766%0.66277%0.771SS**  cis95.4156.914-82.8-97.4000118.9
697F31.4Very low33Very low193 Ų193140.2 Ų140.285%0.84676%0.761SS**  trans76.9115.3-174.5-54.2-76.8000115.3
698A28.1Very low32.1Very low83 Ų83144.9 Ų144.969%0.68677%0.771SS**  cis86.21226.200000118.8
699L29.9Very low32.1Very low164 Ų164142.6 Ų142.686%0.85977%0.768SS**  trans-158.3154.6158.5-67.4-176.1000106.8
700L31.8Very low32Very low150 Ų150141.6 Ų141.679%0.78577%0.77SS**  cis-156.1156.9-28.9-120177.9000107.3
701V32.9Very low32.2Very low144 Ų144142.3 Ų142.387%0.87378%0.775SS**  trans-138.8137.2168.2175.30000108.5
702G29.3Very low32.1Very low63 Ų63139.8 Ų139.865%0.64977%0.774SS**  trans-176.8147.317200000109.4
703D29.4Very low32Very low160 Ų160140.1 Ų140.186%0.85678%0.777SS**  cis-152.8176.9-8.8-135.5-42.5000112.4
704S32.9Very low32.1Very low97 Ų97139.2 Ų139.268%0.67877%0.772SS**  trans-84.9156.1-170.5-51.60000114.2
705Q33Very low32Very low173 Ų173136.9 Ų136.981%0.80877%0.773SS**  trans-172.4139.8139-107.5161.88500114.2
706H31.9Very low31.4Very low160 Ų160137.7 Ų137.774%0.74178%0.776SS**  trans54.2159.5152.8-66.9-56.2000120.8
707S31.4Very low32.7Very low84 Ų84136.3 Ų136.359%0.58778%0.779SS**  cis-173.5175.1-35.1-97.60000107.7
708F28.4Very low33.4Very low207 Ų207132.7 Ų132.791%0.90878%0.775SS**  trans76.1128.8167.2-70.4-80.5000119.8
709S31.9Very low33.6Very low109 Ų109134.1 Ų134.176%0.76278%0.78SS**  trans-81.1158.9158.9-39.70000110.1
710F27.1Very low33.6Very low201 Ų201130.8 Ų130.888%0.88278%0.777SS**  trans-145.5146.3145.6-142-97.4000112.3
711S35Very low33.5Very low111 Ų111130.4 Ų130.478%0.77678%0.78SS**  trans-125.3123.4169.353.10000106.9
712G29.3Very low33.4Very low73 Ų73128.7 Ų128.775%0.75378%0.775SS**  trans-159.8152.5-17700000110.6
713D30.3Very low34.6Very low159 Ų159131.5 Ų131.585%0.8578%0.781SS**  trans-128171.9-169-155.2-11.3000110.7
714E33.6Very low34.7Very low160 Ų160127.4 Ų127.475%0.74877%0.77SS**  trans75.7148.5156.2-112.6-163.2123.100123.4
715T34.3Very low34.7Very low122 Ų122129.8 Ų129.875%0.74878%0.775SS**  trans78.8164.2155.754.30000121.7
716T35.2Very low34.8Very low135 Ų135129.2 Ų129.283%0.82877%0.772SS**  trans-128.9-179.3-144.18.30000112.2
717P59.1Low34.8Very low114 Ų114127.8 Ų127.874%0.7477%0.77SS**  trans-92.1-175.5-152.341.1-41.6000114.9
718P47.6Very low34.7Very low117 Ų117131.4 Ų131.476%0.7678%0.775SS**  -147.8158.799.340-24.8000117.9
719S30.6Very low34.9Very low113 Ų113127.6 Ų127.679%0.7976%0.764SS**  trans36.1114140.9-590000124.3
720A30Very low35Very low95 Ų95129 Ų12979%0.78576%0.758SS**  83.8168.4111.800000122.5
721V31.1Very low35.3Very low142 Ų142127 Ų12786%0.86175%0.751SS**  trans85121.6173.4-168.20000117.4
722S31.1Very low34.9Very low108 Ų108127.5 Ų127.576%0.75575%0.75SS**  trans-132.5-179.9163-26.90000106.6
723P53.3Low34.9Very low122 Ų122128.7 Ų128.779%0.79275%0.747SS**  cis-127.9-139.8-1240.6-21.3000110.1
724A31.5Very low35.5Very low74 Ų74126.2 Ų126.261%0.61274%0.739SS**  trans74.3148.5159.800000118.6
725D33.2Very low35.2Very low146 Ų146122.9 Ų122.978%0.78173%0.734SS**  cis-163.1158.7-16.6-101.6-18000110.8
726E34Very low35.2Very low162 Ų162125.7 Ų125.776%0.75774%0.735SS**  trans52.5140152.4-56.5-65.368.800125.5
727D32.4Very low35Very low129 Ų129128.5 Ų128.569%0.6974%0.736SS**  98.4138.2128.8-97.4-13.9000126.8
728F29.6Very low33.7Very low161 Ų161127.6 Ų127.671%0.70673%0.733SS**  trans64.5123.6156.3-84.7-129.9000119.6
729L33.4Very low32.8Very low127 Ų127129.1 Ų129.167%0.66574%0.735SS**  66.8135.172.7-75.4169.1000112.8
730E34.4Very low32.9Very low138 Ų138127.5 Ų127.565%0.64572%0.723SS**  cis-166.2-176.8-2.1-157.8-171.6-167.400108.5
731Q32.3Very low33.1Very low158 Ų158130 Ų13074%0.73873%0.729SS**  trans68.9159.4155.2-66.2171.647.200117.6
732V26.8Very low33.2Very low123 Ų123131.7 Ų131.775%0.74573%0.728SS**  cis-151162-25.4123.20000110.3
733S28.7Very low33.2Very low98 Ų98129.9 Ų129.969%0.68573%0.726SS**  trans-49.9-170168.2-37.50000115.7
734P44.2Very low32.1Very low107 Ų107130.7 Ų130.770%0.69572%0.722SS**  cis-147.1165.75.744.6-25.3000119.5
735S27.1Very low32Very low90 Ų90135 Ų13563%0.62973%0.734SS**  trans37.1137.7137.3750000123.2
736K33.3Very low31.8Very low180 Ų180135.6 Ų135.678%0.78373%0.732SS**  174.2133.4103-97.4153.6-171.5167.40115.3
737K31.8Very low31.6Very low194 Ų194132.9 Ų132.984%0.84373%0.726SS**  trans61.9143.4152.1-59.7177.9178.6-171.70118.1
738S32.1Very low31.3Very low96 Ų96134.7 Ų134.767%0.67173%0.729SS**  cis-163.8-163.8-17.151.90000107
739D27.9Very low31.1Very low149 Ų149134.5 Ų134.580%0.79773%0.73SS**  cis-159.6-159.716-140.8-68.1000112.7
740S31.8Very low30.8Very low79 Ų79134.3 Ų134.355%0.55273%0.728SS**  trans-74.6141.6-166.7-179.60000118.7
741T34.4Very low30.5Very low148 Ų148134 Ų13491%0.90873%0.731SS**  -160.2166.3115.2110000111.7
742Q34.3Very low30.4Very low177 Ų177131.2 Ų131.283%0.82773%0.729SS**  trans-124.3164.7-156.6-63.1177.7-32.700115.7
743G29.9Very low30.6Very low70 Ų70133.7 Ų133.772%0.72273%0.73SS**  trans139.380.5165.600000112.9
744I31.9Very low31Very low138 Ų138134.7 Ų134.771%0.70873%0.728SS**  64.7102.869.8-54177.9000114.2
745L27.7Very low30.7Very low165 Ų165134.7 Ų134.786%0.86472%0.718SS**  trans177.3116.9145.7-96.3169000104.5
746Q29.3Very low30.9Very low158 Ų158136.7 Ų136.774%0.73872%0.722SS**  cis78.7144.832.6-155.7163.94.800115
747T30.9Very low30.9Very low105 Ų105134.3 Ų134.364%0.64471%0.712SS**  trans-98.5-166.2-153.649.80000114.5
748F25.6Very low31.1Very low167 Ų167132.8 Ų132.873%0.73271%0.705SS**  trans85.6127.8176.6-51.7-74.6000114.5
749Q25Very low31.5Very low158 Ų158132.7 Ų132.774%0.73871%0.705SS**  cis108.3139.19.6-159.3-149.24.600114.5
750I26.8Very low31.7Very low123 Ų123132.3 Ų132.363%0.63170%0.698SS**  trans77.1143.2166.3-17174.8000119.9
751N28.2Very low31.7Very low131 Ų131135.9 Ų135.970%0.70170%0.704SS**  trans82.2122.1163.3-61.8-39.2000117.4
752S31.6Very low31.8Very low99 Ų99136.4 Ų136.469%0.69270%0.696SS**  cis77.6117.929.8-47.30000114.9
753F30.7Very low31.8Very low175 Ų175132.1 Ų132.177%0.76869%0.691SS**  -157.8138.9105.8-115.3-117.6000106.9
754D36Very low31.9Very low120 Ų120135.6 Ų135.664%0.64270%0.698SS**  71.4146.156.9-115.7-6.7000113.1
755Q38.3Very low32.2Very low106 Ų106140.7 Ų140.750%0.49571%0.708SS.*  cis-160.6172.213.5-160.5163.787.900112F757Q755-F757 HydrophobicContact CG-CD2 4.13Å; Q755-F757 HydrophobicContact CG-CE2 4.13Å
756N32.3Very low32.4Very low132 Ų132137 Ų13771%0.70670%0.702SS**  trans118.9131148.2-64.3-43.5000118.8
757F32.8Very low32.6Very low130 Ų130134.3 Ų134.357%0.5771%0.707SS**  cis-165.8136.2-22.3-140.2-144.7000112.5Q755Q755-F757 HydrophobicContact CG-CD2 4.13Å; Q755-F757 HydrophobicContact CG-CE2 4.13Å
758K36.3Very low32.6Very low162 Ų162135.2 Ų135.270%0.70472%0.717SS**  trans56.6145.5145.7-73.3-170.7-176.21720121.3
759S39.1Very low33Very low95 Ų95132.1 Ų132.166%0.66472%0.716SS**  cis-168.3-156.6-546.80000109.2
760H32.3Very low33.1Very low140 Ų140129.9 Ų129.965%0.64872%0.718SS**  cis-165123.514.6-158.1-110.1000113.4
761F32.7Very low33.3Very low155 Ų155132.6 Ų132.668%0.6873%0.728SS**  trans62.5147.9142.7-82-122.9000120.8
762Q35.7Very low33.2Very low159 Ų159135.7 Ų135.774%0.74374%0.736SS**  cis-163.3154.2-6.3-147.8-179.90.200112.8
763A35.5Very low33.2Very low87 Ų87137.4 Ų137.472%0.71974%0.743SS**  trans65.3151.9153.700000119.9
764T31.8Very low33.4Very low142 Ų142135.5 Ų135.587%0.87175%0.745SS**  cis-149.1178.52.5-17.80000113.3
765R37.8Very low33.3Very low245 Ų245135.5 Ų135.593%0.92575%0.749SS**  trans-81.7-178.6-171.8-58.7171.1156.1162.1-9.1114.3
766A30.9Very low33.2Very low88 Ų88138.3 Ų138.373%0.72777%0.768SS**  cis-162160.517.300000115.8
767A33.5Very low33.5Very low102 Ų102135.8 Ų135.884%0.84377%0.773SS**  trans38.1159.5143.700000122.7
768S32.7Very low33.3Very low124 Ų124139 Ų13987%0.86779%0.79SS**  cis-146.9174.413.755.50000113.8
769S32.6Very low33.2Very low101 Ų101137.9 Ų137.971%0.70680%0.796SS**  trans-120.4162.5-175.6177.10000113
770S27.6Very low32.5Very low112 Ų112138.6 Ų138.678%0.78380%0.801SS**  trans-154.5135.8153-78.80000111.9
771Q31.4Very low32.4Very low180 Ų180137.6 Ų137.684%0.84180%0.804SS**  trans-128.6157.6169.3-72.7-179-28.600108.2
772F25.6Very low32.2Very low195 Ų195140.3 Ų140.386%0.85581%0.81SS**  trans-133.3138.9168-88.7-83.5000111.6
773T31Very low31.7Very low136 Ų136136.3 Ų136.383%0.83481%0.812SS**  trans-133.2148.8167.846.70000108
774V34.7Very low31.5Very low134 Ų134140 Ų14081%0.81281%0.814SS**  trans-140.5139176.3-178.90000108.9
775T34.2Very low31.2Very low121 Ų121136.4 Ų136.474%0.74281%0.805SS**  trans-134.6152.3174480000109.8
776N36.1Very low30.9Very low165 Ų165128.9 Ų128.988%0.88280%0.795SS**  trans59.8121.1174.4-58.7-6.2000115.9
777G39.7Very low30.8Very low78 Ų78131.6 Ų131.680%0.80480%0.797SS**  trans-106.5146.6-172.200000115.2
778Q29.1Very low30.6Very low199 Ų199137 Ų13793%0.9380%0.802SS**  trans-150.4171.6147.4-113.9176-5.700109.5
779V32.6Very low30.7Very low137 Ų137135.7 Ų135.783%0.8379%0.793SS**  trans-134.7136.1-155.1176.30000112.9V781V779-V781 HydrophobicContact CG1-CG2 4.22Å
780S25.6Very low30.5Very low111 Ų111139.7 Ų139.778%0.77680%0.8SS**  trans-178.8131.4148.8-166.50000107.6
781V29Very low30.9Very low118 Ų118144.1 Ų144.172%0.71581%0.806SS**  cis100.7104.829.6177.40000114.4V779V779-V781 HydrophobicContact CG1-CG2 4.22Å
782R28.6Very low31.7Very low212 Ų212140.5 Ų140.580%0.880%0.798SS**  trans60128.4153.2-177.4177.6-96.5-175-6.8120.7H784R782-H784 PolarHBondContact NE-NE2 3.45Å
783G26.6Very low31.8Very low76 Ų76139 Ų13978%0.78480%0.798SS**  trans-139.2155.3152.100000110.2
784H30.2Very low31.7Very low165 Ų165137.6 Ų137.676%0.76479%0.789SS**  trans-120.3158.7-175.1-94.6-102.4000112.5R782R782-H784 PolarHBondContact NE-NE2 3.45Å
785G26.2Very low31.3Very low66 Ų66142.2 Ų142.268%0.6879%0.792SS**  trans146107.4171.600000109.6
786A31.5Very low31.1Very low86 Ų86142.4 Ų142.471%0.71179%0.793SS**  68.8127.45300000112.2
787D29.2Very low30.9Very low145 Ų145139.9 Ų139.978%0.77578%0.783SS**  cis-155.8170.3-9-90.2-37.5000108.2
788F29.4Very low30.5Very low215 Ų215145.1 Ų145.194%0.94379%0.787SS**  174.7158.6128.1-100.3-69.6000112
789S33Very low30.4Very low97 Ų97142.4 Ų142.468%0.67878%0.784SS**  trans-118.7141.8-162.954.50000113.9
790E30Very low30.6Very low185 Ų185147.5 Ų147.586%0.86479%0.788SS**  trans-175153.7130-106.8177.2164.500113.5
791F34.3Very low30.7Very low205 Ų205147.7 Ų147.790%0.89979%0.785SS**  trans-165.1164.6175-87.8-63.3000107.2
792P50.1Low30.9Very low105 Ų105149.3 Ų149.368%0.68279%0.785SS**  cis-131.7171.3-5.540.2-25.5000114.9
793L27.5Very low31.1Very low163 Ų163145.7 Ų145.785%0.85378%0.78SS**  trans-160.3107.7136.6-138.371.1000115.9
794V27.6Very low31.4Very low106 Ų106148.8 Ų148.864%0.64278%0.779SS**  trans29.5117132.6-169.70000121.3
795R28Very low31.5Very low232 Ų232146.3 Ų146.388%0.87578%0.78SS**  trans67.6163.6151.6-69.1174.8-171177.72.4117.5
796V29Very low31.9Very low125 Ų125148.5 Ų148.576%0.75879%0.785SS**  cis-141.1174.6-3.5980000111.5
797T31.1Very low33.1Very low112 Ų112149.4 Ų149.469%0.68778%0.784SS**  trans-66.2147.9178.7460000116
798E31.2Very low33.1Very low187 Ų187149.2 Ų149.287%0.87478%0.783SS**  trans4.5125.5151.7-56.6-179.7134.700119.2
799T26.9Very low33.1Very low143 Ų143144.4 Ų144.488%0.87777%0.771SS**  trans-136.8158.8153.241.60000111.9
800R37.9Very low33Very low243 Ų243144.6 Ų144.692%0.91777%0.772SS**  trans-90.2143.5-168.3176.3-178.6178.2175.8-1.1112
801V27Very low33Very low116 Ų116141.6 Ų141.670%0.70377%0.766SS**  trans-140.3144.3-176.7165.90000109.3
802Q33.8Very low32.9Very low152 Ų152136.8 Ų136.871%0.7176%0.759SS**  cis-157.6175.2-23.7-101.9172.7-3.400105.5
803L32.6Very low32Very low136 Ų136140.2 Ų140.271%0.71277%0.765SS**  148.9144.297.5-75.3174.7000104
804N32.2Very low32.1Very low140 Ų140137.6 Ų137.675%0.74976%0.76SS**  cis-148.5177-2.7-86.7-30.5000106.3
805S32.1Very low32Very low114 Ų114142.7 Ų142.780%0.79778%0.775SS**  cis-153.6152.714.843.80000111.6
806S35.1Very low32.3Very low111 Ų111138.8 Ų138.878%0.77681%0.807SS**  trans-79.4-176.2168.9-28.50000112.4
807P58.1Low32.5Very low106 Ų106139.5 Ų139.569%0.68881%0.809SS**  cis-126.2-142.8-8.841.6-22.3000110.2
808D27.9Very low32.6Very low141 Ų141140.9 Ų140.975%0.75482%0.815SS**  cis-164.3164.6-4.9-113.1-24.4000105.2
809V30.3Very low32.6Very low114 Ų114138.4 Ų138.469%0.69181%0.812SS**  cis-165.8160.6-17.170.10000108.4
810S31.1Very low33Very low101 Ų101138.1 Ų138.171%0.70681%0.808SS**  trans65.3153.2166.373.80000118.6
811T29.7Very low32.7Very low121 Ų121131.6 Ų131.674%0.74280%0.801SS**  cis-167.7150.9-33.731.20000107.1
812S31.4Very low33Very low105 Ų105132.6 Ų132.673%0.73481%0.808SS**  trans64.4156.6167.477.30000115.8
813E30.6Very low33Very low177 Ų177131.2 Ų131.283%0.82782%0.815SS**  cis-162.8177.2-21.9-117.2178.1134.800109.2
814S30.4Very low33Very low107 Ų107130.8 Ų130.875%0.74882%0.823SS**  trans74.7132.5155.774.10000121.1
815F26.5Very low33.1Very low214 Ų214130.1 Ų130.194%0.93983%0.829SS**  trans30.6133.3135.2-70.6-92.5000121.7
816G33.8Very low33.2Very low150 Ų150131.5 Ų131.5100%1.54683%0.832SS**  trans-175.50169.700000112.1

Retrieved 816 of 816 residues in 668.4 ms (Link to these results)