A0A3Q0KQR5_SCHMA Loading...

Putative erythrocyte membrane protein

AlphaFold DB , UniProt , Accession A0A3Q0KQR5, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,698 aa.

>A0A3Q0KQR5_SCHMA|A0A3Q0KQR5
MSTERSLMEEHLRIYHRITENPSAKLIERFHTPTTTSDALGFSCVTPSTMSGGTLPLSLTNSNATTAQSSLALNLVNAIAALQHANKTQSQQATVSTASSSCTTCTVSTVSSTKNTIITPTAENLENSEQDTNLDMQVYQDGTVTVEAQTPTLGSPAFSISGSRRRKATTPGRICLSASKSTNSCSSSEEGDVSTCKINQSITNSTKNEAAITNSPPGAKRGFLSGVDEVDGQIKDDGVGSPMSKRICKNVDNTVTDTNMTKCVSFSNITPFCLPIGNSPADNKQVPLVTFSSPNVNGLNSLSIPSPFFGQLIPLSSLPENVICGLSTTIMNNPQTSTMSNTGDNSITTSTGHHTELQTTQNHPSAWVLTNPSGNLSCNLTQQAELTALQPTLFVPVPTLGDSSVTPTLKVPQSLDTSTTNPLANCAGILRYPDIIEALKCMAANGNLISAVNVPASSYSTNIQTQANNSSNYNDNIERLQSASQISSPNLSSTNNLAALVAHLTASNNSRTIPQSVATNIPNTTCGITSTDNNTADSLSFSTKSTSESSNISNFNALVSSAPVYTKVDHIDSDGTSLVSGLTSVNNIGTNEDINFPSNDQALDMSVRSVSIPSEHSQSFTQTSNITKSDTKNVNLFTGININDSTCKETSTLEQPTFNVVNNVAEVINAAIKGGLKQRLIQSIEVPVSSLFPNPAQCLTALANTISSLPTMNETVVSSDNQSDKRNQNINCQNESYTNTINIKKELMNSTMTNSLQNVEPITLTSGDNKLNDSMNKSAQNSISANALINLPPTSSHIVSLAQLQAIMAALANASSVSISLPVNSTASTSLSLAPACSATVSSLSSSNPSIQQLVNPSTPSISSSGTNVLINTSGSSLNVTGSVTTSEAGNTSLIPGLNNLTSVCGFTLTGPSSFVNNNITTYNPSMSANFGTINSNIKGITVPSGECISLTGILSGNVANLNINNNSNSAQLGHTVVGNPALINFISANKSPVQSSVTLSSTNATRLLTNLATSTTGTNLLSLPNNGTIGNNTNICGSTLLGATNIPSGAISLLDPHQALFAAAAAAAAQNIQKPGGVNNAINQIALANLKLSNTNGRHLGTTAPVIGLLDPRTGLQLRVADTSTTTSAIPTSNLTDCLNNNYSHSSDNEQMEKQINESNRMTTNETDLNQTNELETGSNYEDQIDEEWEPEQDETCSIQSNAQQLCLKRNKICDKTSGNSESPNKNDQSHDLILTNDLQSNLLLGSSNKRSSSSARISGGNSSNNRRGLSSSYNDSSNQQQLRPHRQNFTPTQNRILTEWYQLHQAKPYPSTDDTKELANISGLSYSQVKKWFANKRARSTSSGLPKPTPPLAPDSSTDPSSAAALVAAAVAAATSAVADVNNMMTSTSTSPLNVSSSSSSSSNCSTIISNINSNDTSLSIQPFLLKSKSVSFSTQPYTDLNFLKTENDKQAEFVSNLISSHLQMDEENIQLGLSLQPSNNNNNNNNNDIINNDNITNNSVQITKKDNQDSIQTTVDNLSNHYSSTSDDIRVNDNDSMTDMTTISCDPIYYSVSSPPTLHVHINNRLSSPTNHLNTLSSVSSSSSSSLSSSSSSDEEYHKDDKMDNNKTTLKEKKNKVKTKLPTYDNDSMLIISEETDDNNDHTSDNTTLNCSPLETIININMNCTNVSTTDVSTTDSSVYSSNSIKSESLTLEIS
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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
1M44.7Very low63.3Low204 Ų204126 Ų126100%1.00564%0.636SS**  0-40.90-70.1-167.9170.800117.3T3M1-T3 PolarHBondContact O-N 3.05Å
2S52Low63.6Low109 Ų109123.2 Ų123.276%0.76262%0.623SS**Hα-helixtrans-64.9-30.9-170.1-165.20000116.2S6S2-S6 PolarHBondContact O-N 2.89Å
3T64.4Low63.5Low113 Ų113124.2 Ų124.269%0.69362%0.615SS**Hα-helixtrans-69.4-41.3-176.838.10000113.8M1 S6 L7M1-T3 PolarHBondContact O-N 3.05Å; T3-S6 WeakPolarHBondContact O-CB 3.3Å; T3-S6 PolarHBondContact O-N 3.15Å; T3-L7 PolarHBondContact O-N 3.4Å
4E60Low63.2Low151 Ų151121 Ų12171%0.70660%0.6SS**Hα-helixtrans-72.2-38.2-175.4-169.2157.2-131.100112S6 L7 M8E4-S6 VanDerWaalsContact C-N 3.28Å; E4-S6 PolarHBondContact O-N 3.48Å; E4-L7 PolarHBondContact O-N 2.76Å; E4-M8 WeakPolarHBondContact O-CB 3.48Å; E4-M8 PolarHBondContact O-N 2.92Å
5R64.7Low61.9Low204 Ų204123.5 Ų123.577%0.7760%0.602SS**Hα-helixtrans-60.7-38.7171-161.7177.8-167.2167.26.6111.5E9R5-E9 WeakPolarHBondContact O-CB 3.23Å; R5-E9 PolarHBondContact O-N 2.92Å
6S69Low61.1Low63 Ų63123.9 Ų123.944%0.44160%0.601SS.*Hα-helixtrans-66.7-40.4175-170.60000112.5S2 T3 E4 E10S2-S6 PolarHBondContact O-N 2.89Å; T3-S6 WeakPolarHBondContact O-CB 3.3Å; T3-S6 PolarHBondContact O-N 3.15Å; E4-S6 VanDerWaalsContact C-N 3.28Å; E4-S6 PolarHBondContact O-N 3.48Å; S6-E10 VanDerWaalsContact O-CB 3.23Å; S6-E10 WeakPolarHBondContact O-CB 3.21Å; S6-E10 PolarHBondContact O-N 2.73Å
7L70Confident60.2Low101 Ų101128.6 Ų128.653%0.52961%0.611SS.*Hα-helixtrans-67.3-39.9175.8-99.6165.3000112.2T3 E4 E10 H11T3-L7 PolarHBondContact O-N 3.4Å; E4-L7 PolarHBondContact O-N 2.76Å; L7-E10 PolarHBondContact O-N 2.92Å; L7-H11 WeakPolarHBondContact O-CB 3.41Å; L7-H11 PolarHBondContact O-CD2 3.47Å; L7-H11 PolarHBondContact O-N 2.85Å
8M69.1Low59.4Low131 Ų131128.4 Ų128.465%0.64561%0.613SS**Hα-helixtrans-71.9-37177.9-161.6171-163.800111.7E4 H11 L12E4-M8 WeakPolarHBondContact O-CB 3.48Å; E4-M8 PolarHBondContact O-N 2.92Å; M8-H11 PolarHBondContact O-N 2.63Å; M8-L12 HydrophobicContact CG-CD1 4.23Å; M8-L12 WeakPolarHBondContact O-CB 3.25Å; M8-L12 WeakPolarHBondContact O-CD1 3.44Å; M8-L12 PolarHBondContact O-N 3.11Å
9E70.1Confident58.4Low105 Ų105126.9 Ų126.949%0.49161%0.613SS.*Hα-helixtrans-74.5-27174.3-163.9-174.9-124.600112.6R5 R13R5-E9 WeakPolarHBondContact O-CB 3.23Å; R5-E9 PolarHBondContact O-N 2.92Å; E9-R13 VanDerWaalsContact O-CB 3.26Å; E9-R13 WeakPolarHBondContact O-CB 3.46Å; E9-R13 VanDerWaalsContact O-CG 3.29Å; E9-R13 WeakPolarHBondContact O-CG 3.22Å; E9-R13 PolarHBondContact O-N 3.45Å; E9-R13 PolarHBondContact O-NE 3.4Å; E9-R13 VanDerWaalsContact O-NE 3.14Å; E9-R13 IonicContact OE2-CZ 2.65Å; E9-R13 IonicContact OE2-NH2 3.58Å; E9-R13 PolarHBondContact OE2-NH2 2.98Å
10E66.6Low57.3Low99 Ų99128.4 Ų128.446%0.46362%0.619SS.*Hα-helixtrans-70.3-44.7166.9-177165.2-154.600111.1S6 L7 R13 I14S6-E10 VanDerWaalsContact O-CB 3.23Å; S6-E10 WeakPolarHBondContact O-CB 3.21Å; S6-E10 PolarHBondContact O-N 2.73Å; L7-E10 PolarHBondContact O-N 2.92Å; E10-R13 CarbonylContact O-C 3.59Å; E10-R13 PolarHBondContact O-N 3.37Å; E10-I14 HydrophobicContact CG-CD1 4.07Å; E10-I14 VanDerWaalsContact O-CG1 3.27Å; E10-I14 WeakPolarHBondContact O-CG1 3.02Å; E10-I14 PolarHBondContact O-N 2.94Å
11H66.1Low56.3Low106 Ų106127.3 Ų127.349%0.49162%0.616SS.*Hα-helixtrans-60.7-43.5172.4-90.4-133.8000112.2L7 M8 I14 Y15L7-H11 WeakPolarHBondContact O-CB 3.41Å; L7-H11 PolarHBondContact O-CD2 3.47Å; L7-H11 PolarHBondContact O-N 2.85Å; M8-H11 PolarHBondContact O-N 2.63Å; H11-I14 PolarHBondContact O-N 2.87Å; H11-Y15 WeakPolarHBondContact O-CD2 3.32Å; H11-Y15 PolarHBondContact O-N 3.44Å
12L66.5Low55.9Low92 Ų92123.6 Ų123.648%0.48261%0.607SS.*Hα-helixtrans-65.9-38174.1-98.869.1000111.7M8 I14 Y15 H16M8-L12 HydrophobicContact CG-CD1 4.23Å; M8-L12 WeakPolarHBondContact O-CB 3.25Å; M8-L12 WeakPolarHBondContact O-CD1 3.44Å; M8-L12 PolarHBondContact O-N 3.11Å; L12-I14 VanDerWaalsContact C-N 3.3Å; L12-I14 PolarHBondContact O-N 3.3Å; L12-Y15 PolarHBondContact O-N 3.5Å; L12-H16 WeakPolarHBondContact O-CB 2.95Å; L12-H16 PolarHBondContact O-N 3.17Å
13R62.3Low54.8Low136 Ų136123.3 Ų123.351%0.51361%0.606SS.*Hα-helixtrans-64.1-33.8172-84.1178.4-92.4150.3-14.2112.6E9 E10 R17E9-R13 VanDerWaalsContact O-CB 3.26Å; E9-R13 WeakPolarHBondContact O-CB 3.46Å; E9-R13 VanDerWaalsContact O-CG 3.29Å; E9-R13 WeakPolarHBondContact O-CG 3.22Å; E9-R13 PolarHBondContact O-N 3.45Å; E9-R13 PolarHBondContact O-NE 3.4Å; E9-R13 VanDerWaalsContact O-NE 3.14Å; E9-R13 IonicContact OE2-CZ 2.65Å; E9-R13 IonicContact OE2-NH2 3.58Å; E9-R13 PolarHBondContact OE2-NH2 2.98Å; E10-R13 CarbonylContact O-C 3.59Å; E10-R13 PolarHBondContact O-N 3.37Å; R13-R17 WeakPolarHBondContact O-CB 3.09Å; R13-R17 PolarHBondContact O-N 2.85Å
14I59.1Low53.3Low80 Ų80121.4 Ų121.441%0.4160%0.601SS.*Hα-helixtrans-70.1-48.2173.7-70.6163.5000110.3E10 H11 L12 R17 I18E10-I14 HydrophobicContact CG-CD1 4.07Å; E10-I14 VanDerWaalsContact O-CG1 3.27Å; E10-I14 WeakPolarHBondContact O-CG1 3.02Å; E10-I14 PolarHBondContact O-N 2.94Å; H11-I14 PolarHBondContact O-N 2.87Å; L12-I14 VanDerWaalsContact C-N 3.3Å; L12-I14 PolarHBondContact O-N 3.3Å; I14-R17 PolarHBondContact O-N 2.96Å; I14-I18 HydrophobicContact CG2-CD1 3.7Å; I14-I18 WeakPolarHBondContact O-CB 3.48Å; I14-I18 WeakPolarHBondContact O-CD1 3.47Å; I14-I18 VanDerWaalsContact O-CG1 3.24Å; I14-I18 WeakPolarHBondContact O-CG1 3.48Å; I14-I18 PolarHBondContact O-N 3.28Å
15Y44Very low51.9Low159 Ų159124 Ų12462%0.62461%0.61SS**Hα-helixtrans-66.8-38.7178.9-90.3-84.1000113.3H11 L12 I18 T19H11-Y15 WeakPolarHBondContact O-CD2 3.32Å; H11-Y15 PolarHBondContact O-N 3.44Å; L12-Y15 PolarHBondContact O-N 3.5Å; Y15-I18 PolarHBondContact O-N 2.7Å; Y15-T19 PolarHBondContact O-N 2.91Å; Y15-T19 PolarHBondContact O-OG1 3.37Å
16H49.2Very low50.2Low129 Ų129121.8 Ų121.860%0.59761%0.613SS**Hα-helixtrans-66.9-40.6172-88.4-70.6000112.3L12 I18 T19 E20L12-H16 WeakPolarHBondContact O-CB 2.95Å; L12-H16 PolarHBondContact O-N 3.17Å; H16-I18 PolarHBondContact O-N 2.97Å; H16-T19 WeakPolarHBondContact CA-OG1 3.12Å; H16-T19 CarbonylContact O-C 3.28Å; H16-T19 PolarHBondContact O-N 3.17Å; H16-T19 PolarHBondContact O-OG1 3.34Å; H16-E20 PolarHBondContact O-N 3.31Å
17R46.1Very low48.5Very low205 Ų205125.9 Ų125.977%0.77463%0.628SS**Hα-helixtrans-66.1-20.2173.2-170.6176.8-67.5-162.2-0.5113.5R13 I14R13-R17 WeakPolarHBondContact O-CB 3.09Å; R13-R17 PolarHBondContact O-N 2.85Å; I14-R17 PolarHBondContact O-N 2.96Å
18I45.7Very low46.5Very low124 Ų124129.9 Ų129.964%0.63664%0.644SS**Hα-helixtrans-88.9-15173.8-70.9167.7000112.2I14 Y15 H16I14-I18 HydrophobicContact CG2-CD1 3.7Å; I14-I18 WeakPolarHBondContact O-CB 3.48Å; I14-I18 WeakPolarHBondContact O-CD1 3.47Å; I14-I18 VanDerWaalsContact O-CG1 3.24Å; I14-I18 WeakPolarHBondContact O-CG1 3.48Å; I14-I18 PolarHBondContact O-N 3.28Å; Y15-I18 PolarHBondContact O-N 2.7Å; H16-I18 PolarHBondContact O-N 2.97Å
19T40.1Very low44.6Very low101 Ų101134.1 Ų134.162%0.6265%0.653SS**Hα-helixtrans-103.8-6.7175.940.60000113.9Y15 H16 N21Y15-T19 PolarHBondContact O-N 2.91Å; Y15-T19 PolarHBondContact O-OG1 3.37Å; H16-T19 WeakPolarHBondContact CA-OG1 3.12Å; H16-T19 CarbonylContact O-C 3.28Å; H16-T19 PolarHBondContact O-N 3.17Å; H16-T19 PolarHBondContact O-OG1 3.34Å; T19-N21 PolarHBondContact O-N 2.84Å
20E36.1Very low42.6Very low155 Ų155138 Ų13872%0.72467%0.669SS**SBendtrans-70.294.8162.6-78.6-170.9172.500110.6H16 P22H16-E20 PolarHBondContact O-N 3.31Å; E20-P22 WeakPolarHBondContact O-CD 3.07Å
21N35.7Very low41.1Very low106 Ų106141.7 Ų141.757%0.56769%0.685SS**  trans-51.7116.3179.9178.511.9000113.4T19 S23T19-N21 PolarHBondContact O-N 2.84Å; N21-S23 VanDerWaalsContact C-N 3.26Å; N21-S23 PolarHBondContact O-N 3.12Å; N21-S23 VanDerWaalsContact OD1-CB 3.3Å; N21-S23 WeakPolarHBondContact OD1-CB 3.38Å; N21-S23 PolarHBondContact OD1-N 3.1Å
22P36.3Very low39.4Very low126 Ų126142.1 Ų142.182%0.81870%0.696SS**SBendtrans-75.9-9.7176.931.6-35.3000113.8E20 A24E20-P22 WeakPolarHBondContact O-CD 3.07Å; P22-A24 VanDerWaalsContact C-N 3.31Å; P22-A24 PolarHBondContact O-N 3.27Å
23S30.5Very low37.8Very low104 Ų104142.6 Ų142.673%0.72770%0.704SS**  trans-9231-173.4-53.30000114N21N21-S23 VanDerWaalsContact C-N 3.26Å; N21-S23 PolarHBondContact O-N 3.12Å; N21-S23 VanDerWaalsContact OD1-CB 3.3Å; N21-S23 WeakPolarHBondContact OD1-CB 3.38Å; N21-S23 PolarHBondContact OD1-N 3.1Å
24A31.2Very low36.1Very low72 Ų72142.2 Ų142.260%0.59572%0.717SS**SBendtrans-12736.5-174.200000113.8P22P22-A24 VanDerWaalsContact C-N 3.31Å; P22-A24 PolarHBondContact O-N 3.27Å
25K31.6Very low34.6Very low206 Ų206143.8 Ų143.890%0.89673%0.731SS**SBendtrans-161.233.6174.5-122.1153.7-166.1160.30117.6
26L29.5Very low34.1Very low157 Ų157142.9 Ų142.982%0.82274%0.742SS**SBendtrans-146.228.2178.7-120.1170.2000117
27I32.3Very low33.3Very low150 Ų150141.4 Ų141.477%0.76975%0.746SS**  trans-140.898.3154.4-83.3119.6000107.4
28E29.2Very low32.6Very low185 Ų185139.5 Ų139.586%0.86475%0.751SS**  trans-160.865.2154.6-163-179.1-117.200109.1
29R27.8Very low32.2Very low220 Ų220136.7 Ų136.783%0.8375%0.747SS**SBendtrans-168.5116.8164.5-107157.3-149.9-124.9-0.5109.9
30F29.7Very low31.8Very low187 Ų187140.1 Ų140.182%0.8276%0.76SS**  trans73.455.6164.4-47-63000119.2
31H33.8Very low31.7Very low175 Ų175135.6 Ų135.681%0.8176%0.755SS**  -106.9141.2122-74.2-83.3000107
32T30.2Very low31.8Very low116 Ų116139.6 Ų139.671%0.71277%0.768SS**  cis-156.6161.6-26.720000105.2
33P32.7Very low31.4Very low102 Ų102138.9 Ų138.966%0.66277%0.766SS**  trans-84155.4-166.734.5-36.2000114.1
34T27.6Very low31.4Very low128 Ų128139 Ų13979%0.78577%0.765SS**  trans62.8145.316156.10000117.3
35T28.3Very low31.7Very low113 Ų113141.8 Ų141.869%0.69378%0.775SS**  cis-167.4137.6-6.416.20000108.8
36T33.2Very low32Very low139 Ų139137.7 Ų137.785%0.85377%0.767SS**  trans-171.9128.6133.826.40000106.7
37S30.9Very low32.4Very low99 Ų99135.7 Ų135.769%0.69276%0.764SS**  cis90.383.943.9-61.90000113.3
38D32Very low32.4Very low164 Ų164133 Ų13388%0.87776%0.759SS**  -94.7115.2115.3-85.7-51.3000106.2
39A37.8Very low32.7Very low66 Ų66130 Ų13055%0.54575%0.752SS.*  79.291.275.900000110.3
40L32.3Very low33Very low173 Ų173127.6 Ų127.691%0.90675%0.753SS**  64.713075-62.1166.5000112
41G33.7Very low33.2Very low60 Ų60123.8 Ų123.862%0.61975%0.75SS**  cis-157.1-162.3-4.800000107.9
42F37.1Very low33.2Very low190 Ų190118.9 Ų118.983%0.83375%0.746SS**  cis-143.9160.17.2-81.2-106.4000106.6
43S27.4Very low33.3Very low111 Ų111116.7 Ų116.778%0.77675%0.747SS**  41.6138.976-136.90000114.1
44C31.3Very low33.2Very low105 Ų105118 Ų11871%0.70975%0.753SS**  cis-138.1-170.35.653.10000108.5
45V36.5Very low33.4Very low132 Ų132119.5 Ų119.580%0.876%0.755SS**  cis-148.4168.320.6-130.50000111.2
46T39.3Very low34.1Very low119 Ų119119.6 Ų119.673%0.7376%0.758SS**  trans-90.8177.8160.652.50000111.2
47P37Very low34Very low116 Ų116121.5 Ų121.575%0.75376%0.762SS**  -132.9163.6105.941.4-33.6000111.8
48S32Very low33.9Very low94 Ų94121.3 Ų121.366%0.65776%0.761SS**  cis-144134.622.8-48.50000113.9
49T36.6Very low33.8Very low120 Ų120121 Ų12174%0.73676%0.758SS**  trans52.3137.8131.263.30000121.8
50M34.6Very low33.6Very low171 Ų171123.1 Ų123.184%0.84276%0.764SS**  cis-165.8162.7-1.5-120.3173.378.600112.6
51S33.9Very low33.7Very low107 Ų107121.6 Ų121.675%0.74876%0.757SS**  trans18.4144.5152.4-139.10000121.7
52G32.3Very low33.7Very low71 Ų71123.6 Ų123.673%0.73276%0.762SS**  cis108.5126.53.900000113.9
53G32.1Very low33.5Very low71 Ų71121.9 Ų121.973%0.73276%0.761SS**  trans114.286.8160.800000119.9
54T32.5Very low33.8Very low128 Ų128120.6 Ų120.679%0.78576%0.758SS**  trans36.3123.3134.251.30000124.4
55L30.5Very low34Very low161 Ų161121.5 Ų121.584%0.84376%0.76SS**  trans75.5178.2136.8-54.5172.1000117.4
56P42.4Very low33.9Very low114 Ų114121.3 Ų121.374%0.7476%0.759SS**  -135.4172.6-98.138.1-17.4000116.1
57L32.8Very low33.6Very low180 Ų180120.2 Ų120.294%0.94276%0.762SS**  trans-163.4175.9156.2-111.6168000111.9
58S28.2Very low33.1Very low95 Ų95123.9 Ų123.966%0.66477%0.769SS**  trans-148.1176.6-162.5-170.40000113.9
59L29Very low33.1Very low156 Ų156124.7 Ų124.782%0.81778%0.775SS**  trans74.8141.5172.6-46.7169.8000114.3
60T33.5Very low32.8Very low112 Ų112123.7 Ų123.769%0.68777%0.773SS**  cis-155.5165.622.941.50000112.5
61N35.4Very low32.6Very low141 Ų141123.6 Ų123.675%0.75478%0.775SS**  trans63113.1154.4-67.5-2.3000117.8
62S32.8Very low32.4Very low102 Ų102123.3 Ų123.371%0.71378%0.779SS**  cis61.1138.116.3-35.10000114.2
63N33.8Very low32.4Very low153 Ų153128.1 Ų128.182%0.81879%0.787SS**  cis-73-165.1-0.5-62.1-58.9000111.5
64A33Very low32.3Very low85 Ų85131.2 Ų131.270%0.70279%0.787SS**  cis-160.3157.813.200000108.7
65T35.1Very low32.3Very low124 Ų124131.3 Ų131.376%0.76178%0.782SS**  cis-167.7143.3-8.713.40000105.8
66T35.5Very low32.5Very low127 Ų127129.4 Ų129.478%0.77978%0.777SS**  cis-147.6170.74.6-49.70000108.4
67A33.1Very low32.1Very low96 Ų96126.1 Ų126.179%0.79375%0.753SS**  trans58.883.3163.400000116.8
68Q26.6Very low32Very low193 Ų193120.8 Ų120.890%0.90274%0.735SS**  trans-81.7146.7155.1-65.3179.7-28.700110.5
69S31.5Very low32.3Very low112 Ų112124.6 Ų124.678%0.78375%0.746SS**  trans-165.1121.3136.136.60000113.6
70S31.3Very low32.7Very low99 Ų99121.8 Ų121.869%0.69275%0.745SS**  trans48.6118142.860.80000122.4
71L29Very low32.5Very low168 Ų168120.5 Ų120.588%0.8875%0.746SS**  trans82.7157.5137.2-61.5165.4000119.8
72A30.6Very low32.3Very low102 Ų102120.9 Ų120.984%0.84375%0.747SS**  trans57.364.7174.300000116.8
73L31.8Very low32.2Very low171 Ų171123.5 Ų123.590%0.89575%0.748SS**  trans-104.4123.7165.4-75177.5000112.7
74N30.5Very low32.2Very low137 Ų137125.1 Ų125.173%0.73375%0.75SS**  trans-111.2164.9159.2-163.4-20000106.9
75L31.4Very low32Very low130 Ų130125.1 Ų125.168%0.68175%0.75SS**  trans73.9155.7-164.8-65.772.2000112.9
76V35.2Very low32Very low121 Ų121125.8 Ų125.873%0.73375%0.749SS**  cis-134.6160.534176.50000113.5Q1074V76-Q1074 VanDerWaalsContact C-NE2 3.34Å; V76-Q1074 PolarHBondContact O-OE1 3.03Å
77N34.4Very low31.8Very low44 Ų44128 Ų12824%0.23575%0.748CS.*  trans-80.3155.2-171.6-165.623.7000116I1073 Q1074 K1075 P1076N77-I1073 HydrophobicContact CB-CG2 4.48Å; N77-I1073 WeakPolarHBondContact OD1-CG2 3.38Å; N77-I1073 PolarHBondContact OD1-O 3.11Å; N77-Q1074 HydrophobicContact CB-CB 3.62Å; N77-Q1074 VanDerWaalsContact CG-C 3.46Å; N77-Q1074 VanDerWaalsContact CG-CB 3.48Å; N77-Q1074 PolarHBondContact ND2-O 3.45Å; N77-Q1074 VanDerWaalsContact OD1-C 3.31Å; N77-Q1074 WeakPolarHBondContact OD1-CA 3.41Å; N77-Q1074 WeakPolarHBondContact OD1-CB 3.18Å; N77-Q1074 PolarHBondContact OD1-O 3.48Å; N77-K1075 VanDerWaalsContact CB-O 3.24Å; N77-K1075 WeakPolarHBondContact CB-O 3.4Å; N77-K1075 PolarHBondContact ND2-O 2.65Å; N77-K1075 VanDerWaalsContact ND2-O 3.1Å; N77-P1076 WeakPolarHBondContact ND2-CD 3.39Å
78A30.1Very low31.9Very low68 Ų68128.7 Ų128.756%0.56274%0.743SS**  trans64.8136.7149.800000120.9
79I34.7Very low32.2Very low176 Ų176127.1 Ų127.190%0.90374%0.735SS**  trans-156.9153133-103.9155.6000108.2
80A36.7Very low32Very low96 Ų96126.5 Ų126.579%0.79373%0.731SS**  trans-101.2175.8-167.300000114.2
81A29.9Very low32.1Very low86 Ų86130.2 Ų130.271%0.71174%0.737SS**  trans-79.2153.3177.900000113.2
82L31.7Very low32.3Very low148 Ų148130.9 Ų130.978%0.77574%0.736SS**  -164.9147.9110.7-125.380.1000113.8
83Q30.8Very low32.5Very low158 Ų158130 Ų13074%0.73873%0.729SS**  trans0129.5150.9-59.6163.34.400119.3
84H33.5Very low32.5Very low187 Ų187127.8 Ų127.887%0.86672%0.723SS**  -162.8150.5110.5-118.5-84.8000111.8
85A29.8Very low32.8Very low84 Ų84127.1 Ų127.169%0.69472%0.723SS**  trans-95.7126176.300000111.6
86N34Very low33Very low138 Ų138125.5 Ų125.574%0.73872%0.722SS**  trans-167.3135.6149.4-109-57.1000113
87K31.9Very low33Very low173 Ų173125.5 Ų125.575%0.75272%0.723SS**  trans29.9150.9133.6-68.1179-179.3176.50122.8
88T34.7Very low33.1Very low112 Ų112127.8 Ų127.869%0.68775%0.748SS**  trans67.2119.8148.643.40000116.9
89Q33Very low33.3Very low160 Ų160129.9 Ų129.975%0.74876%0.759SS**  54.397.683.2-73.4-178.9-43.100111.8
90S27.7Very low33.3Very low98 Ų98126.4 Ų126.469%0.68575%0.75SS**  70.4101.178.474.80000113.6
91Q33.5Very low33.2Very low178 Ų178126.7 Ų126.783%0.83275%0.746SS**  trans-175143.7170.6-105.4157.698.200105.5
92Q32.7Very low33.2Very low181 Ų181128.3 Ų128.385%0.84675%0.751SS**  cis-130.5173.54.5-54.9172.4-59.100108.1
93A33.5Very low33.2Very low85 Ų85126.9 Ų126.970%0.70275%0.749SS**  cis-148.7151.913.600000114.3
94T33.1Very low33.3Very low124 Ų124125 Ų12576%0.76175%0.748SS**  trans-16.8160.2144.455.50000118.4
95V36.5Very low33Very low122 Ų122121 Ų12174%0.73974%0.74SS**  cis-143-168.622.8-129.60000109.3T97V95-T97 HydrophobicContact CG1-CG2 4.38Å
96S36.4Very low33Very low96 Ų96123.3 Ų123.367%0.67175%0.745SS**  cis-155.8131.87.1-117.30000107.8
97T33.8Very low32.9Very low122 Ų122123.1 Ų123.175%0.74875%0.749SS**  75.693.368.3680000117.9V95V95-T97 HydrophobicContact CG1-CG2 4.38Å
98A36.8Very low32.8Very low92 Ų92119.8 Ų119.876%0.7675%0.748SS**  trans-179.3124.2149.500000108
99S33.9Very low32.8Very low112 Ų112121.3 Ų121.378%0.78376%0.757SS**  62.6130.164.370.30000114.7
100S35.7Very low32.8Very low103 Ų103119.9 Ų119.972%0.7276%0.759SS**  cis-173.4142.9145.10000114.1
101S34Very low33Very low101 Ų101120.7 Ų120.771%0.70676%0.764SS**  trans47.5136.5144.164.40000124.7
102C31.2Very low33.1Very low121 Ų121116.9 Ų116.982%0.81876%0.758SS**  trans77151.3148111.70000117.1
103T31.6Very low33.2Very low118 Ų118114.2 Ų114.272%0.72475%0.754SS**  cis-159.2171.2-21.4-38.20000109
104T32Very low33.1Very low117 Ų117119.3 Ų119.372%0.71876%0.76SS**  trans84.3108.5147.6-54.50000121.2
105C26.9Very low33.1Very low103 Ų103120.5 Ų120.570%0.69676%0.762SS**  trans47.1135.6137-57.60000124.7
106T29.5Very low33Very low133 Ų133120 Ų12082%0.81676%0.759SS**  trans63.5140.6147.955.90000117.7
107V31.9Very low32.9Very low135 Ų135123.1 Ų123.182%0.81877%0.766SS**  cis-147156.740.51650000111
108S29.8Very low33Very low103 Ų103124.7 Ų124.772%0.7277%0.769SS**  trans-70.1140.2175.9-43.80000114.5
109T35.5Very low32.9Very low143 Ų143126.3 Ų126.388%0.87777%0.769SS**  trans-130.2154151.547.80000109.7
110V32.6Very low33.2Very low131 Ų131126.3 Ų126.379%0.79477%0.767SS**  trans-128.8158.1-165.1177.60000110.3
111S32.4Very low33.2Very low114 Ų114128 Ų12880%0.79777%0.773SS**  trans85144.1176.187.70000115.1
112S35.9Very low32.8Very low99 Ų99127.9 Ų127.969%0.69278%0.778SS**  cis-149.6151.20.848.90000114.6
113T33.3Very low33Very low125 Ų125131.4 Ų131.477%0.76778%0.782SS**  trans58.8118.5149.947.50000123.5
114K32.4Very low33.1Very low192 Ų192133.9 Ų133.984%0.83579%0.791SS**  trans59.7111.6142.4-74.5-173.2172-177.60120.9
115N32.8Very low33.1Very low148 Ų148135.7 Ų135.779%0.79180%0.796SS**  -175.1159.6102.9-96.7-9.2000114.3
116T34.9Very low33.3Very low112 Ų112139 Ų13969%0.68780%0.801SS**  trans34.796.8153-44.70000118.4
117I34.2Very low33.3Very low161 Ų161139.7 Ų139.783%0.82680%0.799SS**  73.9130.886-65.1168.1000114.1
118I36.8Very low33.4Very low155 Ų155138.8 Ų138.880%0.79580%0.799SS**  trans-130.5162.3-162.9-74.4176.3000112.7
119T33.7Very low33.5Very low126 Ų126142.5 Ų142.577%0.77381%0.805SS**  trans-61.2167.8-178.640.60000117.6
120P40.8Very low33.5Very low112 Ų112143.3 Ų143.373%0.72780%0.799SS**  trans-102.8172.7-172.141.9-38.1000116.1
121T34.3Very low33.5Very low140 Ų140142.6 Ų142.686%0.85979%0.791SS**  trans65.7103.9154.1-45.40000120.5
122A27.3Very low33.5Very low97 Ų97142.6 Ų142.680%0.80279%0.786SS**  trans-161.5152.7135.400000109.5
123E33.8Very low33.2Very low196 Ų196144.5 Ų144.592%0.91679%0.788SS**  trans-94.1171.5172.4-71.5-169.4135.600112.4
124N34.8Very low33.3Very low169 Ų169145 Ų14590%0.90479%0.786SS**  trans-77.7171.4-159.2-72.1-63.8000116.4
125L32.3Very low33.1Very low156 Ų156142.2 Ų142.282%0.81778%0.78SS**  trans-110.3152.4171-164.174.3000111.1
126E30.8Very low33Very low171 Ų171142.7 Ų142.780%0.79978%0.779SS**  trans77.8157.5165.8-87.9171.1164.100120
127N29.6Very low32.7Very low148 Ų148146.1 Ų146.179%0.79179%0.787SS**  trans-143.4158.4-157.9-36-101000109.9
128S32.9Very low32.6Very low116 Ų116143.9 Ų143.981%0.81178%0.781SS**  trans170.5174.4138.6-81.50000113.6
129E32Very low32.2Very low182 Ų182146.6 Ų146.685%0.8578%0.783SS**  trans81.1160.5173.3-58.1-171.2174.800118.5
130Q35.5Very low32.1Very low160 Ų160147.2 Ų147.275%0.74878%0.777SS**  -167157.9-71.5-114.9175.2-110.800110.4
131D32.4Very low31.5Very low116 Ų116148.6 Ų148.662%0.6278%0.778SS**  trans60.7105.8148.2-66.9-38.8000124.1
132T33.9Very low31.4Very low114 Ų114145.9 Ų145.970%0.69978%0.778SS**  97.6140.1119.866.20000124.4
133N29.4Very low31.5Very low138 Ų138147.7 Ų147.774%0.73878%0.78SS**  trans61.8164.8153.7-74.2-70.7000119.9
134L33.9Very low31.2Very low136 Ų136143.9 Ų143.971%0.71277%0.769SS**  cis-167.4143.4-46.7-161.876000110.1
135D29.3Very low30.7Very low133 Ų133142 Ų14271%0.71176%0.764SS**  trans70.8153.6149-107.6-31000125.2
136M29.9Very low30.5Very low159 Ų159140 Ų14078%0.78376%0.758SS**  trans62.486.6148.1-68.5-75.9-83.800121.1
137Q29.2Very low30.4Very low183 Ų183140.2 Ų140.286%0.85576%0.759SS**  trans-47.3137.8149.4174.6175.413.600115
138V31.1Very low30.4Very low115 Ų115137.3 Ų137.370%0.69776%0.756SS**  trans-166.8124.9155.8127.40000112.3
139Y30.1Very low30.3Very low212 Ų212140.7 Ų140.783%0.83176%0.759SS**  trans65.8155.2156.6-72.1-139.3000116.7
140Q30.9Very low30.3Very low139 Ų139138.3 Ų138.365%0.6576%0.757SS**  cis-156170.4-7.7-118-71.870.200110.6
141D28Very low30.5Very low141 Ų141135.2 Ų135.275%0.75475%0.751SS**  trans4143.4164-71.4-40.2000122.4
142G32Very low30.7Very low83 Ų83133.4 Ų133.486%0.85674%0.744SS**  trans-17688.4169.100000117
143T29.3Very low30.6Very low135 Ų135132.3 Ų132.383%0.82873%0.733SS**  trans-83.1135.9-178.336.70000116.5
144V27.1Very low30.8Very low116 Ų116128.5 Ų128.570%0.70373%0.726SS**  50.4107.1124-175.30000119.9
145T25.2Very low30.7Very low129 Ų129127 Ų12779%0.79173%0.727SS**  trans69.5162.1148.160.40000122.8
146V28.6Very low31.6Very low115 Ų115126.6 Ų126.670%0.69773%0.732SS**  trans110.1126.9155.1-174.70000116.5
147E28.4Very low31.7Very low174 Ų174122.7 Ų122.781%0.81373%0.725SS**  trans57.4124.8163-75.3161.3-175.700119.3
148A28.5Very low31.9Very low88 Ų88123.1 Ų123.173%0.72772%0.724SS**  77.8143.473.300000112.5
149Q32.5Very low31.9Very low187 Ų187122.4 Ų122.487%0.87472%0.724SS**  cis-136.4167.725.4-65168.8-700114
150T30.6Very low32Very low131 Ų131119.8 Ų119.880%0.80472%0.723SS**  trans-67.7175.5164.937.30000111.2
151P40.9Very low32Very low95 Ų95119.1 Ų119.162%0.61773%0.734SS**  cis-160.2157.236.344.6-21.4000122.2
152T35.5Very low32.1Very low79 Ų79115.6 Ų115.649%0.48573%0.731SS.*  trans59.6144.9135.4630000122.3K567T152-K567 VanDerWaalsContact CB-CD 3.45Å; T152-K567 HydrophobicContact CG2-CD 3.97Å; T152-K567 VanDerWaalsContact OG1-CD 3.26Å; T152-K567 WeakPolarHBondContact OG1-CD 3.3Å; T152-K567 PolarHBondContact OG1-NZ 3.09Å
153L32.8Very low32.1Very low91 Ų91117.3 Ų117.348%0.47673%0.73SS.*  cis-169.2178.6-12.7-146.5110.7000110.6T566 K567L153-T566 WeakPolarHBondContact CD1-OG1 3.46Å; L153-T566 WeakPolarHBondContact CD2-O 3.2Å; L153-T566 VanDerWaalsContact CD2-OG1 3.31Å; L153-T566 WeakPolarHBondContact CD2-OG1 3.19Å; L153-K567 HydrophobicContact CB-CB 3.94Å
154G32.1Very low32.2Very low57 Ų57122.2 Ų122.259%0.58873%0.733SS**  trans166.9140.4163.600000112.5
155S33.7Very low32.6Very low104 Ų104127.6 Ų127.673%0.72774%0.741SS**  trans-148.9-155-169-57.30000114.9
156P47.1Very low33.1Very low125 Ų125132.6 Ų132.681%0.81275%0.745SS**  -138.1179.1-107.143.8-24.6000117.6
157A32.9Very low33.2Very low77 Ų77137.2 Ų137.264%0.63676%0.756SS**  trans-179163.7147.700000109.4
158F33.3Very low33.2Very low192 Ų192133.2 Ų133.284%0.84275%0.752SS**  cis-141.114811-83.2-83.5000108.9
159S30.8Very low33.7Very low100 Ų100135.2 Ų135.270%0.69976%0.756SS**  57.9140.284.7-44.20000115.6
160I31.4Very low34.2Very low158 Ų158132.7 Ų132.781%0.8175%0.753SS**  cis-164.9160.511.2-128165.1000113.6
161S31.3Very low34.5Very low125 Ų125132.1 Ų132.187%0.87475%0.752SS**  trans67.8155.1161.8-1620000122
162G29.6Very low34.2Very low67 Ų67131.3 Ų131.369%0.69176%0.76SS**  trans178.6-14.717000000127.5
163S32.4Very low34.1Very low119 Ų119138.9 Ų138.983%0.83278%0.78SS**  trans68.8101.1167.8-155.90000123.2
164R31.5Very low34.1Very low238 Ų238142.6 Ų142.690%0.89880%0.799SS**  43.3122.3126.8-175-176.4-70.7-131.3-1.8122.2
165R35.7Very low33.9Very low229 Ų229145.3 Ų145.386%0.86481%0.808SS**  trans-142.6106.6153.4-157.9178.2-169.5-157.52.9116.4
166R35Very low33.9Very low233 Ų233148 Ų14888%0.87981%0.813SS**  trans48.2131148.4-59.4-173.5179.8-171.6-1.2123.1
167K30.3Very low33.2Very low213 Ų213147.1 Ų147.193%0.92681%0.81SS**  trans-33.3151.2165.2-68.1-179.9169.9-175.20118
168A29.6Very low33.3Very low89 Ų89148 Ų14874%0.73682%0.817SS**  trans-148.1160.2136.300000111.8
169T39.3Very low33.3Very low130 Ų130144.2 Ų144.280%0.79881%0.814SS**  trans59119.4154.7-35.80000121.6
170T43.2Very low33.5Very low135 Ų135148.9 Ų148.983%0.82882%0.822SS**  trans-102.7139.7151.4-30.80000107.6
171P35.5Very low33.6Very low119 Ų119146 Ų14677%0.77382%0.816SS**  -147.8168.7104.839.3-24.5000114.1
172G35.4Very low33.6Very low77 Ų77145.7 Ų145.779%0.79481%0.809SS**  trans135.4102.6162.600000115.7
173R34.3Very low33.6Very low239 Ų239149.9 Ų149.990%0.90282%0.815SS**  trans-98.2143.9143.4-73-168.5-173.5-1576.2107.4
174I32Very low33.6Very low169 Ų169149.9 Ų149.987%0.86782%0.815SS**  -172.5151.3124.7-95.4153.7000107.7
175C28.6Very low33.5Very low114 Ų114144.8 Ų144.877%0.7782%0.815SS**  trans-83.1163.6-172.5-46.80000112.2
176L33.3Very low33.4Very low161 Ų161139 Ų13984%0.84381%0.809SS**  -172.4137.8118-99.3159.6000113.4
177S32.7Very low33.3Very low106 Ų106132.9 Ų132.974%0.74180%0.802SS**  trans22.2135.3153.853.60000123
178A33.5Very low33.4Very low96 Ų96128.1 Ų128.179%0.79380%0.796SS**  trans-65.3171.1157.600000111.7
179S35.1Very low33.5Very low112 Ų112133 Ų13378%0.78380%0.804SS**  cis-163.7179.731.457.60000113.9
180K34.8Very low33.1Very low197 Ų197135.2 Ų135.286%0.85781%0.805SS**  trans-4.5144.4166.3-67.2178.5177.5179.20118.8
181S31.6Very low32.7Very low97 Ų97131.3 Ų131.368%0.67879%0.792SS**  cis-164-147.8-4.844.20000108.6
182T32.2Very low32.5Very low119 Ų119132.9 Ų132.973%0.7379%0.793SS**  cis-162.3-169.215-23.50000111.2
183N29.8Very low32.3Very low155 Ų155135 Ų13583%0.82979%0.791SS**  trans-67.9162.6-172.3-55.6-6.4000117.2
184S32.9Very low32.3Very low119 Ų119128.9 Ų128.983%0.83278%0.784SS**  trans-105.6156.6168.7520000112.8
185C28.9Very low32.4Very low131 Ų131126.7 Ų126.789%0.88578%0.779SS**  trans-126170-173-60.20000113.3
186S33.4Very low32.4Very low108 Ų108125.9 Ų125.976%0.75577%0.774SS**  trans-148.6109.9160.952.80000107.2
187S33.5Very low32.3Very low104 Ų104127 Ų12773%0.72777%0.772SS**  94.4141.655.765.40000112.4
188S31.5Very low32.1Very low114 Ų114128 Ų12880%0.79777%0.768SS**  cis-170.5137.1-14.5-92.50000110
189E31.4Very low31.8Very low191 Ų191129.6 Ų129.689%0.89376%0.763SS**  trans-157149.5170.3-91170.8-99.200108.3
190E31.6Very low31.9Very low177 Ų177133.7 Ų133.783%0.82777%0.769SS**  cis-164.1164.7-29.8-130.3-59.378.700109.8
191G34.9Very low31.6Very low53 Ų53129.2 Ų129.255%0.54676%0.763SS.*  trans76.391.8139.400000120.6
192D30.4Very low31.6Very low151 Ų151131.6 Ų131.681%0.80777%0.767SS**  trans33.3119.8150.7-81.6-30.8000123.8
193V32.7Very low31.7Very low122 Ų122131.4 Ų131.474%0.73977%0.766SS**  37.4108.2126.9-170.70000119.5
194S33.2Very low31.9Very low110 Ų110130.4 Ų130.477%0.76976%0.76SS**  -170.5122.1126.233.80000117.1
195T34.3Very low31.8Very low123 Ų123129.3 Ų129.376%0.75575%0.753SS**  51.795.9118.1-46.30000121.4
196C28.5Very low32.2Very low98 Ų98129.4 Ų129.466%0.66275%0.749SS**  56.9131126-77.30000123.2
197K31.6Very low32.5Very low183 Ų183133.4 Ų133.480%0.79675%0.753SS**  trans75.4160.6130.1-71.4-180-179.6176.30119.5
198I29.2Very low32.2Very low128 Ų128135.9 Ų135.966%0.65676%0.758SS**  cis-166.9156.2-36.8-144.5172.3000108.6
199N26.6Very low32.3Very low130 Ų130139.9 Ų139.970%0.69576%0.764SS**  trans46.5126.2161.5-60.3-10.9000121.1
200Q36.8Very low32.4Very low197 Ų197134.8 Ų134.892%0.92176%0.755SS**  -149.6156.2117.5-118148.3106.500112.3
201S28.2Very low32.5Very low103 Ų103130.5 Ų130.572%0.7275%0.75SS**  trans-115.3-155-171.358.10000111.1
202I32.6Very low32.6Very low148 Ų148135.1 Ų135.176%0.75976%0.76SS**  trans85.4124178.2-55.9159.6000112.5
203T34.6Very low32.8Very low115 Ų115132.9 Ų132.971%0.70675%0.752SS**  cis-155.5-177.5-9.919.40000107.4
204N33.6Very low32.8Very low134 Ų134134.4 Ų134.472%0.71776%0.756SS**  cis-150.5144.58-116-17.2000106.3
205S31.2Very low32.7Very low96 Ų96134.4 Ų134.467%0.67176%0.756SS**  8590.163.5-58.50000116.9
206T36.2Very low33.1Very low133 Ų133134.3 Ų134.382%0.81676%0.758SS**  trans-178.7138.1132.542.40000108.2
207K39.7Very low33.8Very low191 Ų191135.6 Ų135.683%0.8377%0.765SS**  cis-154.2158.1-4.9-108.5-179.7-180-174.10108.7
208N27.7Very low33.8Very low157 Ų157130.4 Ų130.484%0.8476%0.763SS**  trans-101.9152.5169.4-69.5-20.3000111
209E32.5Very low34Very low197 Ų197129.6 Ų129.692%0.92178%0.776SS**  trans166.1142.7144.9-96.3164.7-178.700108.5
210A34.2Very low34.5Very low85 Ų85132.6 Ų132.670%0.70278%0.783SS**  cis-149.1173.8-3.100000111.3
211A34.1Very low34.3Very low87 Ų87134.9 Ų134.972%0.71978%0.783SS**  24.6143.2129.600000120.1
212I36.9Very low34.6Very low149 Ų149132.9 Ų132.976%0.76478%0.779SS**  cis-165.2145.828.7-132.6156.5000112.7
213T34.6Very low34.4Very low105 Ų105134.8 Ų134.864%0.64478%0.782SS**  trans51.7120.6156.860.90000125.5
214N31.6Very low34.3Very low153 Ų153136.7 Ų136.782%0.81879%0.787SS**  83.7124.4118.7-59.4-1000124.3
215S32.3Very low34.1Very low110 Ų110135.5 Ų135.577%0.76979%0.789SS**  trans-93.1-163.9153.9-28.50000110.4
216P41.9Very low34.1Very low122 Ų122134 Ų13479%0.79279%0.788SS**  -116.4-111.9-50.322.8-1.1000113.4
217P43.8Very low34.2Very low124 Ų124133.2 Ų133.281%0.80578%0.783SS**  -121.1160.9-105.936.4-21.3000117.7
218G30.4Very low34Very low74 Ų74130.8 Ų130.876%0.76378%0.78SS**  trans111.6-179139.500000119.4
219A34.9Very low34.3Very low112 Ų112131.3 Ų131.393%0.92678%0.777SS**  trans72.6156.317200000119.7
220K37.3Very low34.6Very low193 Ų193126.6 Ų126.684%0.83976%0.762SS**  trans-101150.6-165.5-64.1165.8177.51680112.4
221R31Very low34.7Very low245 Ų245129.3 Ų129.393%0.92576%0.764SS**  trans59128.7152.9-66.5175.2-175-165.61.2118.8
222G34.7Very low34.8Very low61 Ų61128.2 Ų128.263%0.62976%0.762SS**  141.9111.3114.800000119.1
223F30Very low34.8Very low187 Ų187128.6 Ų128.682%0.8276%0.76SS**  trans65.2126.4137.1-70.2-77.9000122.4
224L31.7Very low35Very low156 Ų156129.7 Ų129.782%0.81776%0.761SS**  trans70.7159.5139.7-62.2168.9000117.6
225S29.1Very low35.4Very low108 Ų108130.8 Ų130.876%0.75576%0.758SS**  cis179.6162.9-2354.50000107.4
226G32.3Very low35.8Very low64 Ų64131.8 Ų131.866%0.6676%0.755SS**  cis-129.5-115.2-17.400000106.3
227V36.6Very low35.6Very low118 Ų118133.2 Ų133.272%0.71576%0.756SS**  cis-164.6157.6-11-131.70000107.8
228D35.5Very low34.9Very low140 Ų140130.9 Ų130.975%0.74976%0.755SS**  trans62166.9151-55.9-22000118.4
229E34.4Very low35.3Very low167 Ų167134.2 Ų134.278%0.7876%0.76SS**  cis-162.4165.1-24.3-111.5-157.8135.800106.4
230V38.3Very low35.4Very low99 Ų99132.3 Ų132.360%0.675%0.751SS**  cis-162.2173.4-11640000108.1
231D36.4Very low35.4Very low141 Ų141128.3 Ų128.375%0.75475%0.748SS**  trans64.9157.7171.4-74.9-34.9000117.5
232G36.8Very low36Very low65 Ų65121.9 Ų121.967%0.6774%0.737SS**  cis162.3157.40.300000107.7
233Q38.1Very low36Very low157 Ų157127.5 Ų127.573%0.73475%0.749SS**  cis-155.8138.219.5-72.9-170.52.900109
234I37.2Very low36.1Very low128 Ų128123.9 Ų123.966%0.65675%0.747SS**  83134.1104.7-65.6176.6000116.3
235K40Very low36.1Very low176 Ų176126.8 Ų126.877%0.76575%0.754SS**  trans73.1149.8165.7-72.9166.2-174.2-179.50118
236D40.6Very low36.1Very low130 Ų130132.6 Ų132.670%0.69576%0.759SS**  cis-144.3170.2-4.3-117.1-30.8000113.4
237D38.1Very low36.1Very low152 Ų152136.8 Ų136.881%0.81377%0.765SS**  trans-30.5141.3-175.8-69.7-40.2000120.1
238G29.5Very low35.8Very low76 Ų76136.5 Ų136.578%0.78477%0.767SS**  trans-115.1131.1162.400000112.8
239V38.4Very low35.7Very low144 Ų144138.6 Ų138.687%0.87377%0.769SS**  trans-138.7133.6167.7-1780000105.2
240G37.8Very low35.5Very low72 Ų72137.5 Ų137.574%0.74277%0.768SS**  cis134.5-175.22600000105.9
241S37.6Very low35.4Very low109 Ų109137.8 Ų137.876%0.76277%0.77SS**  cis-175.1-176.7-9.6-144.20000104.6
242P43.4Very low35.3Very low109 Ų109137.4 Ų137.471%0.70877%0.768SS**  cis-112.9-169.6-18.415.611.1000109.5
243M33.3Very low35.1Very low179 Ų179140.8 Ų140.888%0.88277%0.771SS**  cis-150.3132.921.4-151.3162.9-156.700112.3
244S32.2Very low35Very low112 Ų112139.6 Ų139.678%0.78377%0.774SS**  trans-163.1134.3168.2-83.20000109.2
245K33Very low34.9Very low217 Ų217139.5 Ų139.594%0.94378%0.779SS**  trans174.1158.9150.5-96.3150.4-170.8178.60110.5
246R28.6Very low34.9Very low230 Ų230136.2 Ų136.287%0.86878%0.775SS**  trans-142.2159.7166.8-165-168.7-74.5-166.3-1.7106.5
247I32.1Very low34.6Very low152 Ų152136.5 Ų136.578%0.77978%0.776SS**  trans75.9125.4177.5-54.5156.6000111.6
248C29.8Very low34.6Very low112 Ų112134.3 Ų134.376%0.75777%0.768SS**  cis-162175.8-9.8-114.60000107.6
249K34Very low34.9Very low183 Ų183137 Ų13780%0.79677%0.765SS**  cis-152.5-1716-148-175.6177.6-1780108.9
250N31.3Very low34.9Very low144 Ų144138.1 Ų138.177%0.7776%0.762SS**  trans69.7146.8175.7-69.48.6000114.2
251V36Very low34.7Very low105 Ų105139.8 Ų139.864%0.63676%0.758SS**  cis-151.6160.4-7.9112.70000109.1
252D34.2Very low34.4Very low133 Ų133143.7 Ų143.771%0.71176%0.761SS**  trans60.7159.2173.5-70.6-32.2000117.8
253N31.9Very low33.7Very low137 Ų137143.7 Ų143.773%0.73376%0.763SS**  cis161.7107.4-35.6-105.7-38000105.6
254T36.7Very low33.6Very low131 Ų131141.5 Ų141.580%0.80476%0.759SS**  trans179.1124.2146.625.80000108.8
255V35.3Very low33.5Very low126 Ų126140.4 Ų140.476%0.76475%0.752SS**  65121.891174.20000111
256T39.1Very low33.4Very low108 Ų108138.9 Ų138.966%0.66375%0.745SS**  cis-153.2144.318.512.70000108.7
257D35.1Very low33.6Very low136 Ų136132.4 Ų132.473%0.72774%0.735SS**  58.5146.191.4-62.4-52.3000116.2
258T36.8Very low33.9Very low106 Ų106133.1 Ų133.165%0.6574%0.741SS**  cis-160.2166.44.64.70000112.8
259N37.3Very low34.2Very low133 Ų133135.5 Ų135.571%0.71174%0.744SS**  trans67.7148.6148.4-67.6-28.4000119.9
260M36.4Very low34.2Very low166 Ų166132.8 Ų132.882%0.81874%0.743SS**  cis-148170.8-3.9-123.8-61.4-176.200111
261T34.6Very low34.9Very low108 Ų108131.5 Ų131.566%0.66374%0.743SS**  trans-112.7146.8-170.6-460000112.3
262K31.4Very low34.7Very low190 Ų190136.2 Ų136.283%0.82676%0.755SS**  trans56.2123159.2-86.4169179.8177.10116.5
263C29.2Very low34.6Very low109 Ų109135.5 Ų135.574%0.73676%0.759SS**  173.3167.461.5-117.10000112
264V30Very low34.5Very low133 Ų133137.1 Ų137.181%0.80677%0.767SS**  trans70.1115.4164.5-139.20000120.8
265S29.7Very low34.7Very low89 Ų89136 Ų13662%0.62276%0.762SS**  trans91.6136.7139.4-102.80000125
266F31.7Very low34.5Very low185 Ų185138 Ų13881%0.81177%0.767SS**  trans69.1104.9152.1-59.8-55.3000123.3
267S33.8Very low34.2Very low94 Ų94135.7 Ų135.766%0.65776%0.764SS**  71.5104.6122-540000121.9
268N37.7Very low34.1Very low168 Ų168137 Ų13790%0.89877%0.771SS**  -164.3141.7111.3-98.3-33.2000110.1
269I36.1Very low33.8Very low162 Ų162137 Ų13783%0.83178%0.775SS**  trans-134.2152.9-160.2-72.4179.5000113.4
270T34.8Very low33.7Very low125 Ų125136.3 Ų136.377%0.76778%0.778SS**  trans-76.4162-178.445.90000114.6
271P46Very low33.7Very low118 Ų118132.6 Ų132.677%0.76677%0.774SS**  trans-91.7118-178.433.7-32.4000113.9
272F31Very low33.5Very low203 Ų203133.9 Ų133.989%0.8978%0.777SS**  trans-159.5134.9155-110.5-77.4000111.5
273C31.4Very low33.5Very low119 Ų119130.5 Ų130.580%0.80477%0.767SS**  trans29.6137.1164.6-64.10000124.3
274L30Very low33.8Very low171 Ų171133.5 Ų133.590%0.89577%0.768SS**  trans-75156.9170.1-61.1158.2000112.1
275P42.2Very low33.9Very low107 Ų107135.2 Ų135.270%0.69577%0.767SS**  -157.3155.286.239.6-19.7000119.3
276I30.9Very low33.8Very low169 Ų169137.2 Ų137.287%0.86778%0.775SS**  trans57.8139.3145.2-59.8164.1000119.3
277G31.9Very low34.1Very low58 Ų58133.8 Ų133.860%0.59877%0.772SS**  cis162.2179.3-3.400000113.7
278N33.1Very low33.9Very low163 Ų163136.4 Ų136.487%0.87278%0.777SS**  trans79.3131.8177.7-51.5-25.3000116.9
279S30.7Very low33.2Very low106 Ų106133.8 Ų133.874%0.74177%0.767SS**  cis117.3131.17.4-175.30000112.2
280P36Very low32.8Very low119 Ų119132.1 Ų132.177%0.77377%0.765SS**  -146.5162110.140.1-26.4000116
281A34.7Very low32.3Very low88 Ų88134.1 Ų134.173%0.72776%0.763SS**  trans67.5144158.800000118.3
282D31.8Very low31.7Very low136 Ų136134.5 Ų134.573%0.72777%0.769SS**  cis-149151.4-8.9-138.8-16.7000114.9
283N32Very low31.6Very low118 Ų118130 Ų13063%0.63176%0.763SS**  trans19.5139.3150.8-92.6-75.9000124
284K34.2Very low32Very low173 Ų173129.9 Ų129.975%0.75276%0.76SS**  trans76.7166.6142-68.7171.4-175.2174.30119.7
285Q33.3Very low32Very low169 Ų169128.9 Ų128.979%0.7976%0.756SS**  cis-172.8152.2-36.2-169.6165.66.400108.2
286V26Very low31.5Very low130 Ų130129 Ų12979%0.78875%0.754SS**  trans-84.1155.2174.1175.40000109.9
287P38.6Very low31.6Very low114 Ų114128.1 Ų128.174%0.7475%0.752SS**  cis-128.2-128.6-18.839.3-18.4000111.1
288L28.8Very low31.7Very low148 Ų148128.8 Ų128.878%0.77576%0.758SS**  trans82102.1164.6-137.371.2000114.5
289V24Very low31.6Very low113 Ų113128.1 Ų128.169%0.68575%0.754SS**  58105.566.2-175.50000113.2
290T27.1Very low31.6Very low127 Ų127130 Ų13078%0.77976%0.756SS**  trans-166.1135.7137.3-83.40000111.8
291F24.8Very low31.3Very low167 Ų167128.5 Ų128.573%0.73275%0.748SS**  trans-41150.3173.7-53.4-95.4000117.7
292S33Very low31Very low127 Ų127131.8 Ų131.889%0.88875%0.752SS**  -159.2115.8122.9-81.20000110.8
293S28.7Very low30.9Very low109 Ų109129.2 Ų129.276%0.76275%0.745SS**  trans-102154172.4-52.40000110.3
294P40.1Very low30.8Very low115 Ų115130.7 Ų130.775%0.74775%0.751SS**  -138.9165.7112.937.2-25000112
295N31.2Very low30.9Very low150 Ų150127.4 Ų127.480%0.80275%0.748SS**  cis-147.8159.94.7-133.70.3000112.8
296V31Very low30.6Very low110 Ų110124.6 Ų124.667%0.66775%0.747SS**  trans-49.9164.4169-73.60000115.9
297N33.5Very low31.3Very low151 Ų151123.2 Ų123.281%0.80774%0.741SS**  cis-13816110.6-76.7-67.9000108.8
298G32.9Very low30.9Very low71 Ų71126.5 Ų126.573%0.73274%0.744SS**  cis107.9149.447.500000109.8
299L31.4Very low30.8Very low150 Ų150129.5 Ų129.579%0.78575%0.751SS**  cis-163.8156.5-1.7-94.8171000109.9
300N30.9Very low31Very low145 Ų145127.6 Ų127.678%0.77575%0.754SS**  trans66.7157.3158-58.6-20.4000119.6
301S30.2Very low31.2Very low87 Ų87130.2 Ų130.261%0.60876%0.757SS**  cis-173.1157-25560000111.7
302L28.2Very low31.4Very low158 Ų158126 Ų12683%0.82774%0.742SS**  trans67.6154164.7-58.2150.7000116.5
303S28.6Very low31.6Very low82 Ų82124.7 Ų124.757%0.57372%0.724SS**  cis-165.2140.8-8-108.50000113.9
304I29.6Very low32Very low148 Ų148122 Ų12276%0.75970%0.704SS**  45.2137.9118-50.8171.4000119.5
305P37.4Very low31.6Very low104 Ų104124.8 Ų124.868%0.67571%0.712SS**  cis-151.5-167.1-31.745.3-23.8000116.9
306S26.7Very low31.7Very low111 Ų111122.5 Ų122.578%0.77671%0.708SS**  trans88.3149.4138.4-71.10000125.6
307P41Very low31.8Very low101 Ų101122.1 Ų122.166%0.65671%0.71SS**  trans-150-157.2-14335.9-7.7000118.6
308F29.2Very low31.7Very low183 Ų183122.4 Ų122.480%0.80371%0.71SS**  trans82.3143.9170.3-62.8-84.7000119
309F27.8Very low32Very low210 Ų210124.4 Ų124.492%0.92171%0.71SS**  cis103.8126.918-109.1-83.2000115.7
310G28.5Very low32Very low73 Ų73125.6 Ų125.675%0.75371%0.712SS**  trans161.5154.3166.600000118.2
311Q31.4Very low32.1Very low182 Ų182124.6 Ų124.685%0.8571%0.707SS**  trans-139.6-170.2-175.7-57.2-173.1-10.500110.9
312L28.8Very low32.4Very low78 Ų78127.4 Ų127.441%0.40872%0.72SS.*  cis-157.8-172.413.8-140.4175.8000109.1T1115 G1116 L1117L312-T1115 CarbonylContact O-C 3.55Å; L312-T1115 VanDerWaalsContact O-CA 3.3Å; L312-T1115 WeakPolarHBondContact O-CA 3.26Å; L312-T1115 VanDerWaalsContact O-CB 3.31Å; L312-T1115 WeakPolarHBondContact O-CB 3.29Å; L312-G1116 WeakPolarHBondContact O-CA 3.43Å; L312-G1116 PolarHBondContact O-N 3.26Å; L312-L1117 HydrophobicContact CB-CB 4.12Å; L312-L1117 HydrophobicContact CB-CD1 3.98Å; L312-L1117 HydrophobicContact CD1-CD1 4.12Å; L312-L1117 HydrophobicContact CD2-CD1 4.41Å; L312-L1117 HydrophobicContact CG-CD1 4.39Å; L312-L1117 PolarHBondContact O-N 3.19Å
313I36.3Very low32.6Very low101 Ų101126.3 Ų126.352%0.51871%0.713SS.*  trans-62.4172.3-170-63.4154.4000116T1115 G1116 L1117I313-T1115 HydrophobicContact CG1-CG2 4.23Å; I313-G1116 CarbonylContact O-C 2.86Å; I313-G1116 VanDerWaalsContact O-C 3.28Å; I313-G1116 PolarHBondContact O-N 3.35Å; I313-L1117 WeakPolarHBondContact O-CB 3.47Å; I313-L1117 WeakPolarHBondContact O-CG 3.35Å; I313-L1117 PolarHBondContact O-N 3.01Å; I313-L1117 VanDerWaalsContact O-N 3.1Å
314P37.5Very low32.6Very low53 Ų53128.5 Ų128.534%0.34473%0.727SS.*  trans-150.5-165.9130.944.8-22.5000114.1R1114 T1115P314-R1114 WeakPolarHBondContact CD-O 3.42Å; P314-T1115 VanDerWaalsContact CD-CA 3.47Å
315L31Very low32.6Very low173 Ų173124.8 Ų124.891%0.90673%0.726SS**  trans-116.9-175.4158.6-71.2167.7000109.6
316S33Very low32.4Very low102 Ų102128.3 Ų128.371%0.71374%0.738SS**  trans-87.5148.6-166.353.70000116.3
317S33.9Very low32.5Very low102 Ų102127.7 Ų127.771%0.71373%0.733SS**  trans54144.6137.563.90000121.4
318L32Very low31.9Very low156 Ų156129 Ų12982%0.81774%0.74SS**  cis-166.5-168.6-10.3-127.896000104.5
319P39.1Very low32.1Very low113 Ų113125.5 Ų125.573%0.73473%0.734SS**  cis-122.9-166.1-8.543.3-27.7000113.3
320E30.5Very low32.5Very low175 Ų175122 Ų12282%0.81872%0.723SS**  trans-113.9-175.7-172.6-65.4177.2104.200114.8
321N33.7Very low32.7Very low125 Ų125126.6 Ų126.667%0.66873%0.727SS**  trans97.9111.8165.2-62.3-37.3000119.3
322V35.3Very low32.6Very low145 Ų145125 Ų12588%0.87972%0.724SS**  -154.4139.3103.5150.30000108.2
323I32.4Very low32.6Very low136 Ų136128.8 Ų128.870%0.69775%0.745SS**  trans-104.5169.4-176.4-50.8171000109.8
324C30.1Very low32.9Very low127 Ų127129.1 Ų129.186%0.85875%0.754SS**  trans114.5131.9147.9-63.20000117.1
325G29.9Very low32.5Very low71 Ų71134.8 Ų134.873%0.73278%0.775SS**  trans134.769.9144.500000117.9
326L32.9Very low32.3Very low178 Ų178132.4 Ų132.493%0.93277%0.768SS**  -172.9152.4112.7-96.7165000110.4
327S28.8Very low32Very low97 Ų97132.1 Ų132.168%0.67877%0.766SS**  trans-137.3176.8-171.6-55.80000110.7
328T28.5Very low31.8Very low129 Ų129133.5 Ų133.579%0.79177%0.771SS**  trans68.1154.516243.50000115.5
329T33.2Very low31.5Very low110 Ų110133.9 Ų133.968%0.67577%0.77SS**  cis-159.2176.118.1-170000111.5
330I35.1Very low31.1Very low137 Ų137132 Ų13270%0.70376%0.759SS**  trans74.5132.5150.5-71.6158.5000116.3
331M32.3Very low31Very low168 Ų168130.3 Ų130.383%0.82876%0.756SS**  cis-154166.7-7-119.3173.8-171.600112.5
332N31.1Very low30.8Very low149 Ų149130.9 Ų130.980%0.79776%0.764SS**  trans-88.3150.6173.9-51.7-37000111.9
333N28.6Very low30.7Very low157 Ų157127 Ų12784%0.8475%0.753SS**  -176165.3101.7-1124000114
334P40.9Very low30.6Very low108 Ų108127.3 Ų127.370%0.70176%0.757SS**  trans-111.6-157.2-172.343.8-35.4000114.1
335Q30.2Very low30.8Very low172 Ų172127.5 Ų127.580%0.80475%0.749SS**  trans96.6106.6178.5-63.4-169.8-28.700114.3
336T27Very low30.8Very low124 Ų124128.1 Ų128.176%0.76174%0.742SS**  61.8128.476.467.50000112.4
337S25.6Very low30.8Very low96 Ų96126.5 Ų126.567%0.67173%0.733SS**  cis-174.3-167.841.950.20000111.2
338T30.5Very low30.9Very low130 Ų130127.1 Ų127.180%0.79873%0.733SS**  trans70.6152.2165.966.40000118.3
339M26.2Very low31.2Very low164 Ų164127 Ų12781%0.80873%0.733SS**  cis-164.5166.8-36.6-151166.176.800109.4
340S30Very low31.2Very low73 Ų73126.3 Ų126.351%0.5173%0.732SS.*  trans70.1127.7151.2-67.60000121.9
341N27.6Very low31.2Very low140 Ų140126.5 Ų126.575%0.74974%0.739SS**  61.6147.5123.1-54-3.2000119.7
342T30.6Very low31.2Very low137 Ų137122.2 Ų122.284%0.8474%0.739SS**  cis-167.1165.61.19.50000108.4
343G33.1Very low31.5Very low63 Ų63123 Ų12365%0.64974%0.737SS**  trans131.373.3157.300000119.7
344D31.2Very low31.8Very low144 Ų144122.7 Ų122.777%0.7773%0.731SS**  48.5147.4121.5-47.3-29000125.3
345N33.6Very low31.5Very low131 Ų131123 Ų12370%0.70173%0.73SS**  trans74.8128.6154.3-67.9-40.9000119.2
346S29Very low31.4Very low83 Ų83122.4 Ų122.458%0.5873%0.728SS**  cis91.1147.946.386.30000112.1
347I32.9Very low31.6Very low144 Ų144122.1 Ų122.174%0.73872%0.721SS**  cis-161.4156.911-138.6166.3000113
348T32.2Very low31.8Very low111 Ų111125.3 Ų125.368%0.68173%0.725SS**  trans62135.5156.9550000127.9
349T33.7Very low31.8Very low127 Ų127124.2 Ų124.278%0.77972%0.719SS**  trans63.4150.8137.953.90000123.8
350S32.9Very low31.9Very low95 Ų95122.1 Ų122.166%0.66472%0.715SS**  cis-170.4158.9-20.459.20000114.2
351T35.8Very low32Very low140 Ų140126.4 Ų126.486%0.85973%0.727SS**  trans52.1135.1147.851.40000124.4
352G33.5Very low32.2Very low79 Ų79126.4 Ų126.481%0.81473%0.727SS**  trans155.875.8149.200000123.8
353H35.9Very low32Very low166 Ų166128.4 Ų128.477%0.76973%0.727SS**  trans27.2122.7139.3-90.4-105.5000126.6
354H35.3Very low32.1Very low150 Ų150130.7 Ų130.769%0.69473%0.73SS**  89.2126.6116-96.1-121.6000128.6
355T34Very low32Very low113 Ų113129.2 Ų129.269%0.69373%0.731SS**  trans78.2133.5136.632.40000128.5
356E29.8Very low31.8Very low160 Ų160126.7 Ų126.775%0.74873%0.728SS**  trans103128.7131.3-83.9-164.3130.700127.8
357L30Very low31.7Very low119 Ų119133.9 Ų133.962%0.62374%0.743SS**  trans68.3125.3139.9-62173000127.4
358Q30.7Very low31.5Very low162 Ų162132.3 Ų132.376%0.75774%0.74SS**  trans64.3157.1131.3-68.9-178.5-0.700121.6
359T30.3Very low31.3Very low108 Ų108133.7 Ų133.766%0.66374%0.742SS**  cis-156.8147.51.77.70000114
360T27.8Very low31.2Very low120 Ų120132.8 Ų132.874%0.73674%0.736SS**  trans30.7128.7147.661.80000124.4
361Q32.3Very low31Very low162 Ų162135.5 Ų135.576%0.75774%0.743SS**  159.2121103.9-86.2-156.9-4.700114.4
362N31.2Very low31.3Very low140 Ų140133.4 Ų133.475%0.74973%0.732SS**  163.5152.1112.3-92.1-55.5000115.4
363H26.6Very low31.2Very low180 Ų180134.2 Ų134.283%0.83373%0.726SS**  trans-104.8-175.7176.5-70.7-83.9000108.9
364P36.2Very low31.1Very low110 Ų110129.7 Ų129.771%0.71472%0.724SS**  cis-150.1174.32046.3-25.5000120
365S28.5Very low30.7Very low114 Ų114127 Ų12780%0.79771%0.714SS**  trans21.8139.3132.7-50.20000119.9
366A28.6Very low30.6Very low77 Ų77126.7 Ų126.764%0.63671%0.708SS**  cis169.6151.112.800000110.9
367W27.5Very low30.7Very low235 Ų235123.5 Ų123.589%0.8970%0.704SS**  trans76.3129135.1-75.641000122.4
368V28.4Very low30.8Very low111 Ų111121.7 Ų121.767%0.67370%0.7SS**  trans79.9127135.5166.90000117.7
369L28.9Very low30.8Very low140 Ų140121.1 Ų121.173%0.73370%0.702SS**  cis-158.7169.1-6.8-114.8177000110.9
370T30.3Very low30.7Very low107 Ų107122.5 Ų122.566%0.65670%0.704SS**  trans56.4113.6157.147.30000119.1
371N29.6Very low30.8Very low152 Ų152121.9 Ų121.981%0.81370%0.701SS**  74.2148.376.6-80.4-16000115.1
372P42.6Very low30.6Very low96 Ų96120.5 Ų120.562%0.62369%0.694SS**  cis-138.4-170.6-19.736-16000114
373S31.5Very low30.6Very low97 Ų97121.7 Ų121.768%0.67870%0.695SS**  trans107.9108.9150.9-42.50000119.6
374G33.1Very low30.8Very low71 Ų71117.7 Ų117.773%0.73269%0.694SS**  97.760.9104.400000121.7
375N27.9Very low30.6Very low93 Ų93120 Ų12050%0.49770%0.695SS.*  trans-150.9141.2132.5-86.5-47.1000105.1
376L31.5Very low30.5Very low106 Ų106121.4 Ų121.456%0.55569%0.693SS**SBendcis-119.1161.729.5-85.3163.9000115.7D1112L376-D1112 HydrophobicContact CD1-CB 3.81Å; L376-D1112 WeakPolarHBondContact CD1-OD1 3.48Å; L376-D1112 HydrophobicContact CD2-CB 4.41Å; L376-D1112 VanDerWaalsContact CD2-CG 3.44Å; L376-D1112 WeakPolarHBondContact CD2-OD2 3.39Å; L376-D1112 HydrophobicContact CG-CB 3.72Å; L376-D1112 WeakPolarHBondContact CG-OD2 3.36Å
377S31.3Very low30.7Very low94 Ų94124.2 Ų124.266%0.65770%0.702SS**  trans73.8124.2155-56.30000118.7
378C31.2Very low30.9Very low80 Ų80117 Ų11754%0.54169%0.693SS.*  cis5794.94.9-22.90000114
379N31.5Very low31.1Very low151 Ų151120 Ų12081%0.80770%0.704SS**SBendcis48104.432.6-150.6-16.8000112.8
380L28.9Very low31.1Very low136 Ų136120.7 Ų120.771%0.71270%0.703SS**  trans59.660.4-177-9662.3000117.1
381T29.3Very low31.5Very low108 Ų108120.5 Ų120.566%0.66370%0.704SS**  -125.9129.312447.90000107.9
382Q27.8Very low31.6Very low133 Ų133119 Ų11962%0.62170%0.7SS**  cis53.9113.87-80-15568.900114.5
383Q30.8Very low30.9Very low164 Ų164121.1 Ų121.177%0.76671%0.706SS**  cis-150.2160.916.3-90.8161.7-51.100110.8
384A30.8Very low30.9Very low97 Ų97123.4 Ų123.480%0.80270%0.704SS**  trans62.6164.714600000117.2
385E31.8Very low30.7Very low158 Ų158126 Ų12674%0.73871%0.705SS**  cis-147.9161.22-143.7173.2-168.700106.5
386L28.3Very low31.3Very low144 Ų144126.9 Ų126.975%0.75472%0.716SS**SBendcis-130.3156.54.3-38.8104000107
387T31.4Very low31Very low136 Ų136127.8 Ų127.883%0.83473%0.725SS**SBendcis-150.3159.531.142.60000109.6
388A32.6Very low31.3Very low83 Ų83126.8 Ų126.869%0.68672%0.717SS**  cis-158.8157.3-2.200000112.3
389L31.8Very low31.5Very low174 Ų174127.1 Ų127.191%0.91172%0.716SS**  trans73.9157.4155.5-69.4166.7000120.6
390Q30.1Very low31.4Very low155 Ų155125.4 Ų125.472%0.72471%0.707SS**  trans-114.6-159.2-167.7-54.3176.3-1800109.5
391P37Very low31.7Very low103 Ų103121.3 Ų121.367%0.66970%0.697SS**  -122.2-172.1-65.829.7-11.4000111
392T33Very low31.5Very low120 Ų120121.9 Ų121.974%0.73670%0.696SS**  160.4158.4115.9-62.30000111.6
393L26.9Very low31.8Very low141 Ų141120.1 Ų120.174%0.73870%0.699SS**  trans-61.6149.8179.7-67.964.2000113
394F31.5Very low31.6Very low144 Ų144117.3 Ų117.363%0.63270%0.697SS**  -170.2149.3102.3-108.7-76.8000112.3D1361F394-D1361 HydrophobicContact CE2-CB 4.35Å; F394-D1361 HydrophobicContact CZ-CB 4.42Å
395V29.3Very low32Very low127 Ų127119.1 Ų119.177%0.7770%0.698SS**  trans-158141.4-174.8179.40000108.2
396P39.7Very low32.1Very low110 Ų110117.6 Ų117.671%0.71470%0.699SS**  cis-122.5-130.2-32.735.8-15000110.1
397V25.9Very low32.4Very low125 Ų125115 Ų11576%0.75869%0.691SS**  trans81.5135.8164.6173.60000116.9
398P37.5Very low32.2Very low73 Ų73112.3 Ų112.347%0.47468%0.675SS.*  cis-141.7-136.6-29.443-21.4000113.1I819P398-I819 HydrophobicContact CB-CD1 4.09Å; P398-I819 HydrophobicContact CG-CD1 3.62Å; P398-I819 HydrophobicContact CG-CG1 3.75Å; P398-I819 HydrophobicContact CG-CG2 4.26Å
399T35.3Very low32Very low87 Ų87113.5 Ų113.553%0.53467%0.669SS.*  trans74.5105.2-175.268.90000113.4I819 L821T399-I819 HydrophobicContact CG2-CG2 4.13Å; T399-L821 HydrophobicContact CG2-CD1 4.28Å
400L28.9Very low32.1Very low115 Ų115114.9 Ų114.960%0.60267%0.668SS**  cis71.8115.323.4-130.9171.9000112.4D402 I819 L821L400-D402 WeakPolarHBondContact CD2-OD2 3.37Å; L400-I819 HydrophobicContact CB-CG2 4.45Å; L400-I819 HydrophobicContact CD1-CG2 4.41Å; L400-L821 WeakPolarHBondContact O-CD1 3.47Å
401G36.3Very low32.3Very low50 Ų50112.1 Ų112.152%0.51566%0.661SS.*  trans173.258.9-166.600000113.5
402D25.6Very low32.1Very low121 Ų121112.8 Ų112.865%0.64767%0.665SS**  trans-79.2174.6-175.3-65.3-82.2000114.9L400L400-D402 WeakPolarHBondContact CD2-OD2 3.37Å
403S33.7Very low32.2Very low96 Ų96115.1 Ų115.167%0.67167%0.668SS**  trans123.6141.9152.7-54.90000115
404S27.1Very low32.2Very low104 Ų104113.3 Ų113.373%0.72767%0.667SS**  cis172.6103.4-44.847.80000108.8
405V37.8Very low32.2Very low136 Ų136114.1 Ų114.182%0.82468%0.677SS**  trans-154.7137-174.2171.80000109.8
406T35.4Very low31.9Very low125 Ų125114.5 Ų114.577%0.76768%0.675SS**  cis-155.2154.2-27.430.10000107.5
407P34.4Very low31.5Very low89 Ų89115.2 Ų115.258%0.57868%0.678SS**  trans-107.9161-165.322.1-3.5000117
408T27.6Very low31.5Very low80 Ų80113.9 Ų113.949%0.49167%0.674SS.*  trans97.3133.4152-16.50000122.5P455T408-P455 HydrophobicContact CG2-CB 3.58Å; T408-P455 HydrophobicContact CG2-CG 3.4Å; T408-P455 VanDerWaalsContact CG2-CG 3.4Å; T408-P455 WeakPolarHBondContact CG2-O 3.49Å
409L26.7Very low31.2Very low108 Ų108116.7 Ų116.757%0.56569%0.69SS**  trans68.199141.5-105.5166.5000122.5S457L409-S457 VanDerWaalsContact CD2-OG 3.27Å; L409-S457 WeakPolarHBondContact CD2-OG 3.42Å
410K34.2Very low31.2Very low203 Ų203118.7 Ų118.788%0.88370%0.702SS**  -163.8152.7115.9-121167.3-178.2168.90113.1
411V34.2Very low31.1Very low97 Ų97120.6 Ų120.659%0.58871%0.713SS**  trans-144.1130.6-176.5168.80000107.6
412P33.4Very low31.1Very low117 Ų117124.4 Ų124.476%0.7673%0.728SS**  -141175.196.941.3-25.7000112.2
413Q34.4Very low31.2Very low170 Ų170126.8 Ų126.879%0.79474%0.74SS**  cis-138.2135.218.1-67.3169.6-50.200109.2
414S28.1Very low31Very low102 Ų102126 Ų12671%0.71374%0.74SS**  25.4129.3104.563.60000116
415L31.1Very low31.3Very low161 Ų161128.3 Ų128.384%0.84374%0.744SS**  -162.2152.563.8-169.570000113.3
416D23.3Very low30.8Very low135 Ų135127.2 Ų127.272%0.72274%0.741SS**  trans-70.4160.9169.8-53.9-92.2000114.1
417T30.9Very low30.5Very low126 Ų126126.1 Ų126.177%0.77375%0.745SS**  171.6114.9112.432.60000116.2
418S26.3Very low30.4Very low97 Ų97125.4 Ų125.468%0.67875%0.753SS**  trans70.6145.8130.379.40000124
419T30.8Very low30.6Very low132 Ų132128.7 Ų128.781%0.8177%0.766SS**  trans70.4142.8163.276.30000116.7
420T35Very low30.7Very low128 Ų128130.5 Ų130.579%0.78578%0.776SS**  cis-134.81628.745.20000112.9
421N26.8Very low30.8Very low155 Ų155131.5 Ų131.583%0.82977%0.774SS**  trans-81.6159163.1-78.1-35.5000110.9
422P36.3Very low30.5Very low130 Ų130134.2 Ų134.284%0.84478%0.775SS**  -135.4174102.438.6-28.9000114.6
423L27.1Very low30.5Very low171 Ų171132.9 Ų132.990%0.89577%0.766SS**  trans-113.7163.4-165.4-16870.7000112.6
424A30.8Very low30.5Very low81 Ų81131 Ų13167%0.66976%0.761SS**  trans103152.1147.600000120.1
425N31.9Very low30.9Very low151 Ų151130.4 Ų130.481%0.80775%0.749SS**  trans71.6132.2173.1-68-24.4000119.5
426C27.4Very low31.2Very low113 Ų113128.3 Ų128.376%0.76474%0.738SS**  cis-166.8154.2-24.5-1290000111.8
427A30.2Very low31.8Very low103 Ų103129.4 Ų129.485%0.85174%0.739SS**  trans52.4133.1160.500000120.3
428G32.5Very low31.9Very low73 Ų73127 Ų12775%0.75373%0.732SS**  trans-173.8-14.3176.600000119.8
429I30.7Very low32.3Very low149 Ų149128.2 Ų128.276%0.76473%0.73SS**  trans39.395.7167.3-45.2177.6000117.2
430L30.2Very low32.4Very low146 Ų146129.1 Ų129.176%0.76472%0.723SS**  trans-127.8133.6138.4-78.4177000108.1L1009L430-L1009 HydrophobicContact CD1-CD1 3.71Å; L430-L1009 HydrophobicContact CD1-CG 4.5Å
431R35.6Very low32.2Very low225 Ų225128.8 Ų128.885%0.84972%0.724SS**  trans-94.3127.5-177.5-70.1-158.1-77.8-173.6-4.6110.7
432Y28Very low32.4Very low153 Ų153128.9 Ų128.960%0.672%0.722SS**  trans-55.3134.3153.4-88.4-123.3000107.9I435 I436Y432-I435 HydrophobicContact CD1-CB 4.12Å; Y432-I435 HydrophobicContact CD2-CD1 4.42Å; Y432-I435 HydrophobicContact CE1-CB 3.67Å; Y432-I435 HydrophobicContact CE1-CD1 4.41Å; Y432-I435 HydrophobicContact CE1-CG2 3.74Å; Y432-I435 HydrophobicContact CE2-CD1 3.85Å; Y432-I436 HydrophobicContact CD1-CD1 4.23Å; Y432-I436 HydrophobicContact CD1-CG1 4.26Å; Y432-I436 HydrophobicContact CE1-CG1 4.33Å
433P33.1Very low32Very low89 Ų89127.3 Ų127.358%0.57872%0.719SS**SBend-131.5-10.987.236.2-25.9000116.1I435 I436P433-I435 VanDerWaalsContact C-N 3.26Å; P433-I435 PolarHBondContact O-N 2.96Å; P433-I435 VanDerWaalsContact O-N 3.12Å; P433-I436 PolarHBondContact O-N 2.87Å
434D33.8Very low32.1Very low130 Ų130123.2 Ų123.270%0.69571%0.71SS**THydrogen-bonded Turntrans-72-12-164.8-55.6-29.2000115.5I436D434-I436 VanDerWaalsContact C-N 3.34Å
435I37Very low32.2Very low90 Ų90127.5 Ų127.546%0.46272%0.722SS.*THydrogen-bonded Turntrans-81.1-13.4-177.6-68171.3000112.5Y432 P433Y432-I435 HydrophobicContact CD1-CB 4.12Å; Y432-I435 HydrophobicContact CD2-CD1 4.42Å; Y432-I435 HydrophobicContact CE1-CB 3.67Å; Y432-I435 HydrophobicContact CE1-CD1 4.41Å; Y432-I435 HydrophobicContact CE1-CG2 3.74Å; Y432-I435 HydrophobicContact CE2-CD1 3.85Å; P433-I435 VanDerWaalsContact C-N 3.26Å; P433-I435 PolarHBondContact O-N 2.96Å; P433-I435 VanDerWaalsContact O-N 3.12Å
436I38.3Very low32Very low117 Ų117122.4 Ų122.460%0.671%0.705SS**THydrogen-bonded Turntrans-94.3-22.4-177.1-67.3178.9000113.2Y432 P433 D434Y432-I436 HydrophobicContact CD1-CD1 4.23Å; Y432-I436 HydrophobicContact CD1-CG1 4.26Å; Y432-I436 HydrophobicContact CE1-CG1 4.33Å; P433-I436 PolarHBondContact O-N 2.87Å; D434-I436 VanDerWaalsContact C-N 3.34Å
437E36.2Very low32.1Very low158 Ų158121.5 Ų121.574%0.73869%0.693SS**THydrogen-bonded Turntrans-85-32.2169.4-69.6-162.5127.700112.8L439 K440E437-L439 PolarHBondContact O-N 3.39Å; E437-L439 VanDerWaalsContact O-N 3.14Å; E437-K440 PolarHBondContact O-N 2.84Å
438A32Very low32Very low77 Ų77124 Ų12464%0.63669%0.691SS**THydrogen-bonded Turntrans-60.4-23.2174.400000113.8
439L35.2Very low31.8Very low122 Ų122128.1 Ų128.164%0.63969%0.694SS**THydrogen-bonded Turntrans-92.6-3174.8-80167.4000114.2E437E437-L439 PolarHBondContact O-N 3.39Å; E437-L439 VanDerWaalsContact O-N 3.14Å
440K32Very low31.6Very low151 Ų151126.3 Ų126.366%0.65770%0.695SS**THydrogen-bonded Turntrans-95.4-10.1-176.8-137.5172.8-175.7-179.10114.2E437E437-K440 PolarHBondContact O-N 2.84Å
441C30.9Very low31.6Very low120 Ų120123.6 Ų123.681%0.81169%0.693SS**SBendtrans-96.16.5176.4-650000114.4
442M31.3Very low31.3Very low158 Ų158119 Ų11978%0.77869%0.69SS**  trans-114.643.1-176.2-158.9160.561.600112.3
443A27.6Very low31.4Very low96 Ų96117.1 Ų117.179%0.79369%0.69SS**SBendtrans-130.726179.400000112.6
444A29.3Very low31.8Very low86 Ų86119.4 Ų119.471%0.71170%0.702SS**SBendtrans-149.258.1-176.800000112.6
445N32.5Very low31.6Very low170 Ų170115.4 Ų115.491%0.90968%0.683SS**  trans-169.1114.6153.7-95.4-35.1000108.7
446G28.2Very low31.2Very low44 Ų44115.4 Ų115.445%0.45470%0.697SS.*  trans-84.9156.7171.300000111.7H797G446-H797 WeakPolarHBondContact CA-NE2 3.43Å; G446-H797 PolarHBondContact O-CE1 3.02Å; G446-H797 PolarHBondContact O-NE2 3.04Å
447N29.1Very low30.9Very low94 Ų94112.2 Ų112.250%0.50369%0.685SS.*  trans59.5148.1177.4-75.432.3000116.1H797N447-H797 HydrophobicContact CB-CB 4.45Å; N447-H797 PolarHBondContact OD1-CD2 3.3Å
448L28.2Very low30.6Very low156 Ų156110.1 Ų110.182%0.81769%0.687SS**  cis-124.5121.313.9-67.4158.2000111.1
449I27.8Very low30.4Very low160 Ų160116 Ų11682%0.82169%0.694SS**  trans-139.9133.1165.9-70.6-172.4000110.5
450S27.3Very low30.2Very low111 Ų111115.7 Ų115.778%0.77670%0.703SS**  trans62.7110.6160.7-660000121.4
451A29.2Very low30.1Very low88 Ų88113.9 Ų113.973%0.72771%0.705SS**  -132.5156.298.800000107.6
452V29.2Very low30Very low129 Ų129114.1 Ų114.178%0.78270%0.698SS**SBendcis-131.2118.922.2174.20000112.5
453N31.6Very low29.9Very low113 Ų113113.3 Ų113.360%0.60470%0.695SS**  trans36.1103.3141-57.1-4.2000121P455N453-P455 HydrophobicContact CB-CG 4.15Å
454V40.5Very low30.2Very low138 Ų138116.8 Ų116.884%0.83670%0.695SS**  -54.1140.2121.2-177.50000108.3
455P31Very low30Very low46 Ų46119.5 Ų119.530%0.29970%0.703SS.*  trans-140.2131.1134.712.411.7000115.6T408 N453T408-P455 HydrophobicContact CG2-CB 3.58Å; T408-P455 HydrophobicContact CG2-CG 3.4Å; T408-P455 VanDerWaalsContact CG2-CG 3.4Å; T408-P455 WeakPolarHBondContact CG2-O 3.49Å; N453-P455 HydrophobicContact CB-CG 4.15Å
456A28.4Very low29.8Very low90 Ų90119.7 Ų119.774%0.74470%0.699SS**  trans-111.9128.5142.100000106.2
457S31.4Very low29.8Very low50 Ų50121.6 Ų121.635%0.3571%0.71SS.*  trans-75.7138.9-164.455.20000113.7L409L409-S457 VanDerWaalsContact CD2-OG 3.27Å; L409-S457 WeakPolarHBondContact CD2-OG 3.42Å
458S29.6Very low29.8Very low113 Ų113124.1 Ų124.179%0.7972%0.723SS**  trans-58.4149.2162.1460000112.3
459Y27.7Very low29.9Very low200 Ų200123.1 Ų123.178%0.78472%0.719SS**  trans-112.8116153.6-109.1-82.8000108.4
460S30.5Very low30Very low116 Ų116120.8 Ų120.881%0.81172%0.717SS**  trans-149.6121.2153.5-77.70000108.5
461T30.1Very low30.2Very low114 Ų114120.7 Ų120.770%0.69972%0.716SS**  trans-62.8158.2164.138.40000109.9
462N29.7Very low30.2Very low125 Ų125123.1 Ų123.167%0.66872%0.717SS**  cis-146.5135.56.5-119.7-15.5000111.6
463I28.1Very low30.3Very low141 Ų141127.4 Ų127.472%0.72372%0.72SS**  21.2121.8116.6-58.8175.4000115.7
464Q33.7Very low30.3Very low168 Ų168127.2 Ų127.279%0.78572%0.72SS**  -159.7110.9107.5-150.5152.7-3.900114.3
465T26.5Very low29.9Very low144 Ų144126.2 Ų126.288%0.88371%0.71SS**  trans-127.5120.8150.143.60000107.6
466Q28.8Very low29.8Very low174 Ų174130 Ų13081%0.81373%0.727SS**  trans-110.3140.4166.1-159.3166.416.100107.6
467A26.5Very low29.9Very low84 Ų84132.7 Ų132.769%0.69473%0.728SS**  trans-75.8159.5-16100000114
468N29.1Very low29.7Very low146 Ų146136.7 Ų136.778%0.78174%0.741SS**  -158138.6127.1-95.1-32.6000111.9
469N30.3Very low29.7Very low136 Ų136141.1 Ų141.173%0.72774%0.74SS**  trans64.2108.9152-59.7-13.2000121.1
470S30.4Very low29.6Very low110 Ų110139.1 Ų139.177%0.76974%0.742SS**  48.4140.912363.30000121.5
471S32.9Very low29.4Very low110 Ų110142.6 Ų142.677%0.76975%0.746SS**  cis-168.3165.21.9390000111.9
472N27.8Very low29Very low139 Ų139142.9 Ų142.974%0.74375%0.752SS**  trans-34.1142.8174.3-48.3-10000116.1
473Y32.2Very low29Very low218 Ų218141.9 Ų141.986%0.85576%0.761SS**  -159.9124.5105.5-117.3-94000110.9
474N31.9Very low28.9Very low110 Ų110141 Ų14159%0.58877%0.768SS**  trans10157.4137.9-62.959.4000120.9
475D32.2Very low28.7Very low117 Ų117141.9 Ų141.963%0.62677%0.772SS**  cis-171.6152-17.3-109.9-12.7000111.2
476N28.8Very low28.9Very low125 Ų125142.7 Ų142.767%0.66877%0.769SS**  trans41.6147.8134-59.8-40.6000125
477I30.3Very low29Very low146 Ų146139.9 Ų139.975%0.74977%0.768SS**  trans98.2124.6130.5-89.9166000121.3
478E27.3Very low29Very low135 Ų135141.4 Ų141.463%0.63177%0.774SS**  trans53.3121.3145.7-74.4-164.4-141.100124.4
479R28.6Very low29.7Very low206 Ų206140.1 Ų140.178%0.77777%0.774SS**  79.5153.6112.3-168.2176.3175.2169.90120.3
480L25.2Very low29.6Very low157 Ų157140.9 Ų140.982%0.82278%0.778SS**  trans-53.4128.8164.8-68.3142.8000112
481Q26.5Very low29.8Very low190 Ų190143.2 Ų143.289%0.88878%0.781SS**  -166.5148.5114.9-109.2170.4-8.600115.2
482S23.4Very low29.8Very low120 Ų120142.7 Ų142.784%0.83978%0.777SS**  trans-74.7140.5-179.7-34.40000112.8
483A28.3Very low30Very low104 Ų104141 Ų14186%0.8678%0.776SS**  trans-158.175.3159.700000113
484S26.3Very low30Very low122 Ų122136.1 Ų136.185%0.85377%0.769SS**  trans-122.397.4159.846.60000109.4
485Q30.6Very low30Very low187 Ų187137.7 Ų137.787%0.87478%0.778SS**  trans-119.9135.1170.4-73.6-169.9-2.600109.8
486I30.9Very low29.9Very low161 Ų161139 Ų13983%0.82679%0.785SS**  -176.3147.2125.1-95155.6000108.1
487S30.1Very low29.9Very low114 Ų114141.1 Ų141.180%0.79780%0.795SS**  trans72.883.4174.9-57.20000118.4
488S25.8Very low29.8Very low117 Ų117138.4 Ų138.482%0.81880%0.795SS**  trans-93.5169148.2-50.10000110.2
489P43.7Very low29.7Very low119 Ų119136.7 Ų136.777%0.77380%0.804SS**  -140.7147.1120.636.7-25000116
490N29.3Very low29.7Very low151 Ų151135 Ų13581%0.80781%0.809SS**  trans-5.5136.8154.9-55.7-35.5000117.7
491L33.9Very low29.9Very low160 Ų160133.9 Ų133.984%0.83881%0.808SS**  -161.1153.175.1-147.167.4000113.7
492S32.1Very low30.2Very low99 Ų99128.8 Ų128.869%0.69280%0.799SS**  trans33.7138.3151.856.70000122.2
493S33.2Very low30.4Very low103 Ų103131.5 Ų131.572%0.7280%0.798SS**  cis-176.6161.7-4.849.30000111.1
494T31.7Very low30.6Very low115 Ų115132.5 Ų132.571%0.70679%0.788SS**  trans4.3143.5149.254.30000119.8
495N32.8Very low30.8Very low144 Ų144132.5 Ų132.577%0.7778%0.783SS**  cis-161.1-178.323.7-124.9-15.1000114.2
496N29.4Very low30.6Very low145 Ų145127.4 Ų127.478%0.77577%0.773SS**  trans-74.7166.8-176.4-60.3-76.3000116.1
497L29.4Very low30.5Very low169 Ų169122.8 Ų122.889%0.88576%0.755SS**  trans88.5107.4148.3-133.280.1000120.5
498A27.5Very low30.6Very low89 Ų89122.5 Ų122.574%0.73674%0.744SS**  trans48.9122.3139.500000123
499A25.5Very low30.9Very low99 Ų99124.6 Ų124.682%0.81875%0.747SS**  trans38.6131.9142.400000120.2
500L27.1Very low30.4Very low171 Ų171124.8 Ų124.890%0.89575%0.75SS**  cis-151.2163.848-170.366.8000111.9
501V29.9Very low31.1Very low133 Ų133128.5 Ų128.581%0.80675%0.753SS**  trans-100.6129.4-171.3169.40000113.8
502A33Very low31.6Very low83 Ų83125.7 Ų125.769%0.68674%0.743SS**  trans46.8140.2150.600000122.1
503H28.4Very low32.1Very low176 Ų176128 Ų12882%0.81575%0.746SS**  trans-136.5148.5149-88.214.7000108.4
504L31.3Very low32.8Very low125 Ų125128.2 Ų128.265%0.65475%0.745SS**  cis-161.9-176.6-15.1-109.8172.8000105.1
505T30.4Very low32.5Very low123 Ų123131.6 Ų131.676%0.75575%0.752SS**  cis-156.3160.718.4-15.20000106.3
506A26.6Very low32.7Very low79 Ų79129.7 Ų129.765%0.65375%0.75SS**  cis-151.7173.112.500000110.1
507S29.1Very low32.8Very low65 Ų65129 Ų12946%0.45575%0.751SS.*  cis-155.7150.415.180.90000115
508N33Very low32.9Very low108 Ų108123.2 Ų123.258%0.57873%0.728SS**  trans69.877.3145.7-50.6-22.5000119.5
509N31.2Very low33Very low161 Ų161123.9 Ų123.986%0.86172%0.723SS**  41.5140.9116.3-59.16.2000121.7
510S32.7Very low33.3Very low122 Ų122125.3 Ų125.385%0.85372%0.717SS**  trans-73.9168.417548.80000115.1
511R45.2Very low33.6Very low230 Ų230122.8 Ų122.887%0.86870%0.703SS**  trans-130.4146.6176.8-116.1-171.2171.6-177.9-2.6107
512T44Very low33.5Very low101 Ų101122.2 Ų122.262%0.6270%0.702SS**  cis-144.1136.715.734.10000112.2
513I43.2Very low33.5Very low146 Ų146123.5 Ų123.575%0.74970%0.698SS**  56.8119.5127-57.9171.8000115.7
514P47.3Very low33.6Very low108 Ų108118.3 Ų118.370%0.70168%0.678SS**  -140.9-177.967.535.2-15.5000117.1S516P514-S516 PolarHBondContact O-N 3.38Å
515Q24.8Very low33.5Very low186 Ų186116 Ų11687%0.86967%0.669SS**  trans-17.1119.7135.5-170.5173.31.500112.3
516S37Very low33.5Very low104 Ų104113.9 Ų113.973%0.72766%0.659SS**  trans-76.9145.4-166.954.40000115.2P514P514-S516 PolarHBondContact O-N 3.38Å
517V31.8Very low33.8Very low130 Ų130113.5 Ų113.579%0.78866%0.662SS**  trans-147.3121.9150179.40000106.1V1380V517-V1380 HydrophobicContact CG1-CG1 4.22Å
518A30.8Very low33.9Very low48 Ų48117.6 Ų117.640%0.39768%0.678SS.*  cis-149.6154.5-5.600000112.2V1380A518-V1380 HydrophobicContact CB-CG1 3.78Å
519T30.9Very low33.8Very low103 Ų103118.6 Ų118.663%0.63269%0.688SS**  trans39.7138.7133.661.30000120.7
520N31.1Very low33.7Very low129 Ų129115.6 Ų115.669%0.6968%0.68SS**  cis-165.2171.78.8-116-4.6000108.1
521I32.8Very low33.8Very low118 Ų118115.9 Ų115.961%0.60568%0.676SS**SBendcis-149.5167.72.3-135.2166.4000105.4
522P29.5Very low33.1Very low121 Ų121111.1 Ų111.179%0.78667%0.668SS**SBendcis-111.2173.237.11.223.5000116.3
523N31.5Very low32.5Very low111 Ų111111.8 Ų111.859%0.59467%0.668SS**  trans-72162.2-173-86.1-19.2000115.9
524T31.3Very low32Very low67 Ų67109.9 Ų109.941%0.41166%0.659SS.*  cis-171.4-177.7-46.519.50000107.4T543 K544T524-T543 WeakPolarHBondContact O-CB 3.29Å; T524-T543 WeakPolarHBondContact OG1-CG2 3.3Å; T524-K544 VanDerWaalsContact O-CB 3.31Å; T524-K544 WeakPolarHBondContact O-CB 3.46Å; T524-K544 PolarHBondContact O-N 2.84Å
525T28.9Very low31.3Very low75 Ų75109.2 Ų109.246%0.4665%0.653SS.*  trans-111.5160.9-166-55.70000114T543 K544 S545T525-T543 VanDerWaalsContact O-CB 3.22Å; T525-T543 WeakPolarHBondContact O-CB 3.2Å; T525-T543 PolarHBondContact O-OG1 3.14Å; T525-K544 PolarHBondContact OG1-NZ 2.94Å; T525-S545 WeakPolarHBondContact CG2-OG 3.37Å
526C29.8Very low31.7Very low79 Ų79103.9 Ų103.953%0.53464%0.641SS.*  trans-77.6164179.1-149.90000113.2K544 S545C526-K544 WeakPolarHBondContact CB-O 3.42Å; C526-S545 VanDerWaalsContact CB-OG 3.25Å; C526-S545 WeakPolarHBondContact CB-OG 3.36Å; C526-S545 PolarHBondContact N-OG 3.45Å
527G33.8Very low31.4Very low71 Ų71106.2 Ų106.273%0.73265%0.645SS**  trans133.7113.6166.100000113.2
528I30.3Very low31.5Very low151 Ų151105.2 Ų105.277%0.77464%0.644SS**  trans-122.4125.9-178.1-57.7168.7000109.9
529T31.9Very low31.6Very low129 Ų129111.3 Ų111.379%0.79167%0.669SS**  trans-166.4113.7132.642.50000105.6
530S29.7Very low31.7Very low99 Ų99111.5 Ų111.569%0.69268%0.675SS**  62.912969.5-55.60000111.4
531T33.2Very low31.7Very low128 Ų128114.1 Ų114.179%0.78568%0.68SS**  cis-112.5172.211.149.30000110.9
532D31.2Very low31.5Very low129 Ų129112.6 Ų112.669%0.6968%0.68SS**  cis-167165.4-4.4-118.230000108
533N30.8Very low31.6Very low116 Ų116109.9 Ų109.962%0.6266%0.662SS**  cis-163.8-167.8-14.9-147.6-39.1000109
534N33.4Very low31.6Very low105 Ų105111.4 Ų111.456%0.56166%0.663SS**  trans65.685.2156.2-62.3-30.7000118.9
535T32.6Very low31.7Very low94 Ų94110.5 Ų110.558%0.57766%0.659SS**  45.6135.5118.960.40000120.4
536A33.2Very low31.7Very low74 Ų74113 Ų11361%0.61267%0.674SS**  cis-155.2168.62000000114.7
537D31.8Very low31.9Very low154 Ų154114.7 Ų114.782%0.82469%0.687SS**  trans44.2109.9153.6-55.1-19000119.7
538S32.6Very low31.7Very low109 Ų109119.5 Ų119.576%0.76269%0.691SS**  -175.7148.764.440.80000114.9
539L32.8Very low31.7Very low175 Ų175117 Ų11792%0.91669%0.686SS**  trans74.1117.3167.2-55.5177.4000119.9
540S33.5Very low31.7Very low108 Ų108114.7 Ų114.776%0.75568%0.676SS**  trans-95.6167.7-160.7-49.30000115.9
541F31.8Very low31.9Very low184 Ų184118.1 Ų118.181%0.80769%0.686SS**  cis-161.6-177.9-12.3-130.8-106000113.1
542S28.9Very low31.7Very low86 Ų86120 Ų12060%0.60169%0.69SS**  trans-72.6-166.4-172.6-55.40000119.8
543T29.8Very low31.7Very low64 Ų64118.6 Ų118.639%0.39369%0.69SS.*  -156.5179.9-62.8540000110.5T524 T525T524-T543 WeakPolarHBondContact O-CB 3.29Å; T524-T543 WeakPolarHBondContact OG1-CG2 3.3Å; T525-T543 VanDerWaalsContact O-CB 3.22Å; T525-T543 WeakPolarHBondContact O-CB 3.2Å; T525-T543 PolarHBondContact O-OG1 3.14Å
544K32.9Very low31.8Very low142 Ų142119.7 Ų119.762%0.61770%0.696SS**  trans-70.7-147.4-171.5-143.3169.263.6-153.70114.4T524 T525 C526T524-K544 VanDerWaalsContact O-CB 3.31Å; T524-K544 WeakPolarHBondContact O-CB 3.46Å; T524-K544 PolarHBondContact O-N 2.84Å; T525-K544 PolarHBondContact OG1-NZ 2.94Å; C526-K544 WeakPolarHBondContact CB-O 3.42Å
545S32.2Very low31.6Very low48 Ų48123.3 Ų123.334%0.33671%0.707SS.*  cis-160.9-167.44.644.20000109.6T525 C526T525-S545 WeakPolarHBondContact CG2-OG 3.37Å; C526-S545 VanDerWaalsContact CB-OG 3.25Å; C526-S545 WeakPolarHBondContact CB-OG 3.36Å; C526-S545 PolarHBondContact N-OG 3.45Å
546T30.5Very low31.4Very low127 Ų127125.2 Ų125.278%0.77971%0.714SS**  cis-158.6-167.824.2-30.20000111.5
547S33.2Very low31.2Very low115 Ų115125.8 Ų125.880%0.80472%0.719SS**  trans-161.9157-164.6560000116.2
548E28.6Very low31Very low173 Ų173125.8 Ų125.881%0.80872%0.718SS**  trans-128.5-155.1163.9-147.8-134.7-33.500109.1
549S30.7Very low30.9Very low97 Ų97126.3 Ų126.368%0.67872%0.716SS**  cis-162.7-173.66.872.90000109.3
550S31.7Very low30.8Very low82 Ų82122.7 Ų122.757%0.57371%0.705SS**  cis-171.6127.5-38.453.50000109.8
551N35Very low30.7Very low171 Ų171122.8 Ų122.891%0.91471%0.706SS**  trans-172.6148.9164.5-115.2-28.8000113.3
552I29Very low30.5Very low166 Ų166118.5 Ų118.585%0.85171%0.705SS**  trans-141.1156.4-170.6-74.8-179.8000113.7
553S31.5Very low30.9Very low101 Ų101120.2 Ų120.271%0.70671%0.714SS**  trans-107.5173.7-178.857.90000114.8
554N31.2Very low30.9Very low139 Ų139123.4 Ų123.474%0.74373%0.733SS**  trans-150159.1161.7-96-56.4000108.7
555F29.2Very low30.6Very low181 Ų181125.8 Ų125.879%0.79474%0.739SS**  cis-128.1175.322.8-75-95.8000111.4
556N29.6Very low30.4Very low134 Ų134127.2 Ų127.272%0.71775%0.746SS**  cis-153.716712.5-143.5-29.2000113.2
557A28.5Very low30.5Very low86 Ų86126.4 Ų126.471%0.71173%0.732SS**  trans71.6143.1162.600000119.8
558L28.5Very low30.3Very low153 Ų153125.5 Ų125.580%0.80172%0.721SS**  cis-170.1121.5-21.2-17667.6000111.1
559V29.6Very low30.4Very low121 Ų121124 Ų12473%0.73372%0.719SS**  trans64.3141.8156.8169.70000117.2
560S31.3Very low30.4Very low98 Ų98126.8 Ų126.869%0.68572%0.72SS**  cis-123.5155.17.2-62.60000110.2
561S30.5Very low30.5Very low111 Ų111129.6 Ų129.678%0.77673%0.728SS**  63.2129.255-370000114.1
562A28.8Very low30.5Very low94 Ų94127.5 Ų127.578%0.77772%0.717SS**  cis-161.7164.2-9.100000110.2
563P37.4Very low30.7Very low121 Ų121123.8 Ų123.879%0.78671%0.705SS**  trans-94.3-162.6179.238.4-35.4000113.8
564V28Very low30.8Very low131 Ų131126.7 Ų126.779%0.79471%0.713SS**  trans98127.1173.7178.80000114.4
565Y27.1Very low30.8Very low193 Ų193122.7 Ų122.776%0.75771%0.705SS**  cis-164.8-170-6.7-142-106.2000113.4
566T28.8Very low31Very low78 Ų78120.8 Ų120.848%0.47971%0.708SS.*  trans70.4156.8162.347.70000116.9L153L153-T566 WeakPolarHBondContact CD1-OG1 3.46Å; L153-T566 WeakPolarHBondContact CD2-O 3.2Å; L153-T566 VanDerWaalsContact CD2-OG1 3.31Å; L153-T566 WeakPolarHBondContact CD2-OG1 3.19Å
567K31.6Very low30.8Very low110 Ų110119.1 Ų119.148%0.47871%0.707SS.*  cis-164.5169.2-6.2-115.2-167.3134.3-153.10105.1T152 L153T152-K567 VanDerWaalsContact CB-CD 3.45Å; T152-K567 HydrophobicContact CG2-CD 3.97Å; T152-K567 VanDerWaalsContact OG1-CD 3.26Å; T152-K567 WeakPolarHBondContact OG1-CD 3.3Å; T152-K567 PolarHBondContact OG1-NZ 3.09Å; L153-K567 HydrophobicContact CB-CB 3.94Å
568V28.9Very low31.1Very low96 Ų96123 Ų12358%0.58272%0.715SS**  cis-172.5153.4-29.362.90000108.3
569D30.5Very low31.1Very low141 Ų141121.1 Ų121.175%0.75471%0.709SS**  trans165149.8146.1-91.2-16.4000108.5
570H31.9Very low31.1Very low155 Ų155120.8 Ų120.872%0.71871%0.712SS**  cis-166.7157.9-32.1-151.1-66.6000106.5
571I34.5Very low31Very low142 Ų142119.2 Ų119.273%0.72871%0.711SS**  trans71.1134.5168.8-55.1173.4000114.4
572D33.2Very low30.9Very low127 Ų127121.4 Ų121.468%0.67971%0.714SS**  cis-152.6155.1-16.8-113.1-30.7000107.6
573S34.1Very low31.4Very low88 Ų88123 Ų12362%0.61571%0.714SS**  49.6127.189.9-40.50000113.4
574D33.6Very low31.1Very low162 Ų162122 Ų12287%0.86671%0.71SS**  cis-143.8-178.817.1-79.8-55.6000110.2
575G32.1Very low31.3Very low55 Ų55121.2 Ų121.257%0.56771%0.705SS**  cis121.5129.94.500000112.7
576T32.1Very low31.7Very low140 Ų140118.3 Ų118.386%0.85970%0.702SS**  trans60.8127.617460.40000117.4
577S26.5Very low32Very low99 Ų99120.5 Ų120.569%0.69271%0.711SS**  cis83105.842.281.70000116.1
578L33.9Very low32.1Very low168 Ų168122.9 Ų122.988%0.8873%0.728SS**  trans-155.3117.5149.3-87.2175.2000105.8
579V28.6Very low32.3Very low114 Ų114121.4 Ų121.469%0.69173%0.732SS**  cis86.6111.949.4174.20000113.2
580S29.5Very low32.5Very low113 Ų113121 Ų12179%0.7974%0.735SS**  trans59.1150.2157.8-59.90000119.8
581G29.7Very low32.3Very low65 Ų65120.9 Ų120.967%0.6774%0.74SS**  cis123170.80.900000113.2
582L28.8Very low32.2Very low157 Ų157122.6 Ų122.682%0.82274%0.744SS**  trans69.8150-178.1-44.8171.4000112.5
583T37.8Very low32.1Very low127 Ų127123.8 Ų123.878%0.77975%0.751SS**  cis-137.1140.725.641.60000111.4
584S33.1Very low32.1Very low100 Ų100127 Ų12770%0.69976%0.76SS**  70.7139.765.1-77.40000114.7
585V30.7Very low32Very low115 Ų115125.8 Ų125.870%0.69775%0.753SS**  cis-167.6177-13.996.70000109.5
586N36.3Very low31.9Very low132 Ų132132.3 Ų132.371%0.70677%0.766SS**  trans104.3139170.3-62-55.1000116.2
587N35Very low32.2Very low125 Ų125130.9 Ų130.967%0.66876%0.759SS**  cis-163.3141.6-23.5-130.2-8.7000111.7
588I34.5Very low32.3Very low159 Ų159131.5 Ų131.582%0.81576%0.763SS**  trans52.3116.9152.9-60.1160000118.9
589G32.9Very low32.1Very low66 Ų66130.4 Ų130.468%0.6876%0.759SS**  trans166.459.4164.100000120.1
590T33.7Very low32.3Very low132 Ų132131.7 Ų131.781%0.8176%0.762SS**  trans41.4128155.454.20000122.6
591N28.4Very low32.4Very low153 Ų153135 Ų13582%0.81877%0.765SS**  trans86.9147.9156.2-646.1000120.6
592E32.9Very low32.6Very low177 Ų177135.8 Ų135.883%0.82777%0.765SS**  trans72.8113.6165.3-70.5173.8-164.800121.5
593D30.7Very low32.7Very low152 Ų152136.3 Ų136.381%0.81377%0.768SS**  trans69.2157.7139.3-726.8000126.4
594I34.4Very low32.2Very low156 Ų156137.1 Ų137.180%0.877%0.767SS**  trans97.197.1162.4-48.5-175.8000119.5
595N29.8Very low31.9Very low136 Ų136140.1 Ų140.173%0.72777%0.772SS**  trans38.1128.8139-70.7-19.1000124.8
596F29.9Very low31.9Very low192 Ų192139.4 Ų139.484%0.84277%0.772SS**  29.2152.8117.5-66.7-70.8000121.8
597P38.6Very low31.7Very low110 Ų110138.8 Ų138.871%0.71477%0.773SS**  cis-147.7176.830.444.4-25000119.6
598S29.5Very low31.4Very low112 Ų112143.5 Ų143.578%0.78378%0.781SS**  trans55125.2146.6-61.60000123.6
599N30.2Very low31.1Very low145 Ų145140.9 Ų140.978%0.77578%0.777SS**  trans-156.5-177.7134.2-152.447.4000112.4
600D32.8Very low30.9Very low141 Ų141143.9 Ų143.975%0.75478%0.782SS**  trans97.1147.9156.4-58.7-22.6000121.2
601Q31.8Very low30.8Very low183 Ų183142.1 Ų142.186%0.85578%0.775SS**  trans-156.6169.1-170.5-100.8-81.73.700108.5
602A32.1Very low30.9Very low81 Ų81141.4 Ų141.467%0.66977%0.77SS**  trans68.176.3169.400000119.2
603L30.7Very low31.1Very low169 Ų169139.3 Ų139.389%0.88577%0.771SS**  52.7127117.1-65174.4000123.2
604D28Very low30.9Very low144 Ų144136.4 Ų136.477%0.7776%0.763SS**  trans76.9101.6132.9-153.719.4000120.6
605M26.5Very low30.7Very low163 Ų163137.9 Ų137.980%0.80377%0.766SS**  176.5157.7101-90.8-170.575.500113.4
606S30.5Very low30.8Very low100 Ų100138 Ų13870%0.69976%0.762SS**  trans84.4100153.1-149.80000121.7
607V33.1Very low30.7Very low118 Ų118134 Ų13472%0.71576%0.758SS**  46.1115.4119.3-173.60000120.3
608R28.3Very low30.1Very low225 Ų225136.4 Ų136.485%0.84976%0.759SS**  trans77.5113.1149-77.2174.2-175-169.71.3121.3
609S27.3Very low30.1Very low103 Ų103136.5 Ų136.572%0.7276%0.76SS**  95.2129.1114.7-69.60000121.3
610V30.7Very low30.1Very low129 Ų129137.9 Ų137.978%0.78276%0.76SS**  trans78.5100145.6176.20000117.9
611S29.9Very low30.1Very low95 Ų95135.9 Ų135.966%0.66475%0.753SS**  trans64.4100.6134.8-55.50000120.9
612I31Very low30.2Very low139 Ų139134.7 Ų134.771%0.71375%0.747SS**  41.1112.4108.4-54.9163.8000116.5
613P37.1Very low30.3Very low133 Ų133136.6 Ų136.686%0.86475%0.751SS**  -89.1133.7125.832.8-28.3000109.9
614S26.3Very low30.4Very low90 Ų90132.8 Ų132.863%0.62974%0.738SS**  trans-137.9106.3179159.40000109.5
615E31.4Very low30.7Very low188 Ų188132.7 Ų132.788%0.87974%0.738SS**  trans-116113.5164.8-63.8-164.8158.400107.7
616H31.7Very low31Very low138 Ų138131.2 Ų131.264%0.63973%0.732SS**  56100.298.3-88.8-89.9000112.3
617S26.3Very low30.9Very low107 Ų107133.4 Ų133.475%0.74874%0.741SS**  cis67.5144.443-43.40000115.7
618Q26.7Very low30.8Very low161 Ų161136.7 Ų136.775%0.75275%0.746SS**  trans96.5118.2163-54.8-176.610.900119
619S30.6Very low30.9Very low115 Ų115130 Ų13080%0.80473%0.734SS**  trans-171.5126.6141-175.90000108.1
620F29.9Very low31Very low173 Ų173131.1 Ų131.176%0.75973%0.731SS**SBendcis-159.6141.4-11.5-148.2-127.4000107.4
621T33Very low31.3Very low100 Ų100131 Ų13161%0.61373%0.731SS**  cis-119.3-101.7-2.5-30.30000110.2
622Q32.3Very low31.4Very low158 Ų158134.3 Ų134.374%0.73873%0.734SS**  cis-154113.1-19.4-168.2175.3-50.600111.7
623T34.2Very low31.4Very low120 Ų120135 Ų13574%0.73674%0.739SS**  trans52.7137.3163.7580000119.8
624S33.8Very low31Very low90 Ų90135 Ų13563%0.62974%0.736SS**  cis-171.5141.2-9.1-99.80000110.4
625N33.1Very low31.3Very low141 Ų141137.6 Ų137.675%0.75474%0.743SS**  trans43.5154.2131.2-56.5-11.8000122.3
626I33Very low31.4Very low132 Ų132135 Ų13568%0.67774%0.735SS**  cis-167150.5-18.2-107.4161.8000105.7K628I626-K628 HydrophobicContact CG2-CB 4.4Å
627T28.5Very low31.3Very low146 Ų146136.7 Ų136.790%0.89674%0.74SS**  trans-81.6115.7167.826.40000112.7
628K31.7Very low31.6Very low187 Ų187137.6 Ų137.681%0.81374%0.742SS**  trans-167.4153.7167.6-99.7-179.3-178.2177.40107.5I626I626-K628 HydrophobicContact CG2-CB 4.4Å
629S30.2Very low31.6Very low86 Ų86133 Ų13360%0.60174%0.738SS**  cis178.6144.4-21.445.50000106.9
630D30.1Very low31.7Very low125 Ų125135.3 Ų135.367%0.66874%0.739SS**  trans53.8111.7159.9-63.6-62.9000120.6
631T35.9Very low31.5Very low127 Ų127133.7 Ų133.778%0.77974%0.738SS**  -175.7121.2107.324.30000108.3
632K32.5Very low31.5Very low165 Ų165135.2 Ų135.272%0.71774%0.741SS**  57.4120.776.7-65.8179.1-177.11720111.4
633N31.5Very low31.5Very low152 Ų152134 Ų13481%0.81374%0.74SS**  cis-147.916537.5-90.9-38.6000114.9
634V28.2Very low31.3Very low135 Ų135134.5 Ų134.582%0.81874%0.738SS**  trans-97.8131.4163.5173.20000109.4
635N33.2Very low31.2Very low143 Ų143134.5 Ų134.577%0.76574%0.738SS**  trans173.4150.1166-95.8-21.2000108.2
636L32.7Very low31Very low135 Ų135133.9 Ų133.971%0.70774%0.739SS**  cis-163.4136.2-11.3-172.172.8000109
637F30.4Very low30.7Very low173 Ų173133.1 Ų133.176%0.75975%0.745SS**  trans54.9123.6153.6-86.6-120.6000124.2
638T31.5Very low30.8Very low126 Ų126133.7 Ų133.777%0.77374%0.735SS**  trans52.5122.3132.163.50000123.5
639G27.8Very low30.6Very low65 Ų65131.4 Ų131.467%0.6773%0.727SS**  116.4161.599.400000119.2
640I31.8Very low30.5Very low162 Ų162133.2 Ų133.283%0.83173%0.734SS**  trans70.9116.8170.8-53.3166.9000113.2
641N26.4Very low30.5Very low140 Ų140132 Ų13275%0.74974%0.736SS**  cis104.2157.832.5-170.431.9000112.5
642I33.7Very low30.2Very low132 Ų132129.9 Ų129.968%0.67772%0.723SS**  trans91.997.1166.4-50.8-179.5000117.8
643N30.7Very low30Very low131 Ų131126.8 Ų126.870%0.70171%0.714SS**  47.1139.6123.3-73.444.3000126.2
644D31.5Very low30Very low132 Ų132124.1 Ų124.171%0.70670%0.696SS**  104.2129121.8-91.2-48.1000125.4
645S31.2Very low30Very low89 Ų89122.2 Ų122.262%0.62268%0.678SS**  trans74101.3139.470.90000122.6
646T29.6Very low30.3Very low128 Ų128119 Ų11979%0.78567%0.665SS**  50.7131.7125.458.90000124
647C25.7Very low30.2Very low117 Ų117118.1 Ų118.179%0.79167%0.666SS**  trans89.5116.6139.2-72.70000122.4
648K30.3Very low30.2Very low157 Ų157118.6 Ų118.668%0.68367%0.668SS**  trans69.3115140.4-84.5-179.9161.3-780121.9
649E27.4Very low30Very low139 Ų139118.8 Ų118.865%0.6566%0.664SS**  78130.1125-73.4160.4-174.700122.2
650T28.8Very low30.2Very low124 Ų124121.5 Ų121.576%0.76167%0.668SS**  trans53.693.3151.2500000117.9
651S29.1Very low30.1Very low101 Ų101119.4 Ų119.471%0.70666%0.662SS**  75.5121.482.270.30000115.2
652T30Very low30.5Very low82 Ų82119.2 Ų119.250%0.50366%0.661SS.*  trans178.8133.2161.617.30000110.4K1507T652-K1507 VanDerWaalsContact O-CE 3.23Å; T652-K1507 WeakPolarHBondContact O-CE 3.36Å; T652-K1507 PolarHBondContact O-NZ 3.05Å; T652-K1507 VanDerWaalsContact OG1-CE 3.3Å; T652-K1507 WeakPolarHBondContact OG1-CE 3.08Å; T652-K1507 PolarHBondContact OG1-NZ 2.96Å
653L29.1Very low30.4Very low100 Ų100119.4 Ų119.452%0.52466%0.664SS.*  -148.3152.6-56.971.9160.5000106.9I1505 T1506L653-I1505 HydrophobicContact CD2-CG2 3.62Å; L653-I1505 HydrophobicContact CG-CB 4.46Å; L653-I1505 HydrophobicContact CG-CG2 3.92Å; L653-I1505 CarbonylContact O-C 3.48Å; L653-T1506 PolarHBondContact O-N 2.95Å; L653-T1506 VanDerWaalsContact O-N 3.15Å; L653-T1506 PolarHBondContact O-OG1 2.61Å; L653-T1506 VanDerWaalsContact O-OG1 3.11Å
654E30.7Very low30.3Very low95 Ų95120.7 Ų120.744%0.44468%0.676SS.*  trans-135.5157.5-170.3-151.978.8131.500112.9Q1504 T1506E654-Q1504 CarbonylContact C-O 3.34Å; E654-Q1504 VanDerWaalsContact CA-O 3.22Å; E654-Q1504 WeakPolarHBondContact CA-O 3.14Å; E654-Q1504 VanDerWaalsContact CD-CG 3.47Å; E654-Q1504 HydrophobicContact CG-CB 4.48Å; E654-Q1504 HydrophobicContact CG-CG 3.94Å; E654-Q1504 WeakPolarHBondContact OE1-CG 3.2Å; E654-Q1504 PolarHBondContact OE1-NE2 2.77Å; E654-Q1504 WeakPolarHBondContact OE2-CB 3.49Å; E654-T1506 PolarHBondContact OE1-OG1 3.03Å; E654-T1506 WeakPolarHBondContact OE2-CB 3.18Å; E654-T1506 PolarHBondContact OE2-N 3.19Å; E654-T1506 PolarHBondContact OE2-OG1 3.23Å
655Q29.1Very low30.2Very low95 Ų95118.7 Ų118.744%0.44468%0.677SS.*  trans-141.8163.6175.3-74.6-165.819.900111.5S1502 Q1504 I1505Q655-S1502 PolarHBondContact OE1-O 3.48Å; Q655-Q1504 PolarHBondContact N-O 2.79Å; Q655-I1505 HydrophobicContact CG-CD1 4.15Å
656P39Very low30.1Very low75 Ų75121.7 Ų121.749%0.48768%0.682SS.*  cis-106-112.5-16.132.4-18.5000112.5V1503P656-V1503 HydrophobicContact CG-CG2 4.14Å
657T31.5Very low30.2Very low118 Ų118121.8 Ų121.872%0.72468%0.682SS**  cis-142.4152.611.1-47.90000111.5
658F29.8Very low30.4Very low183 Ų183124.1 Ų124.180%0.80369%0.685SS**  trans-76.7152.4173.8-86.2-117.2000112.3
659N26.7Very low30.3Very low130 Ų130123.5 Ų123.570%0.69569%0.689SS**  cis-167.9-162.2-17.6-143.7-7.3000109.1
660V33.1Very low30.6Very low122 Ų122119.7 Ų119.774%0.73968%0.681SS**  trans91.184.5161.7-165.60000116.8
661V29.5Very low30.9Very low118 Ų118117.7 Ų117.772%0.71568%0.677SS**  44111.6121.2-176.90000118.2
662N34.8Very low31.2Very low136 Ų136120.3 Ų120.373%0.72768%0.681SS**  -155.6127.3116-111.6-22.3000113.1
663N31.8Very low31.4Very low136 Ų136125.8 Ų125.873%0.72770%0.698SS**  trans55.373.5150.9-54.4-20.2000120
664V27.6Very low31.5Very low157 Ų157124.6 Ų124.695%0.95271%0.711SS**  trans-126.482.4139.6-176.30000109.9
665A29.5Very low31.4Very low90 Ų90123.8 Ų123.874%0.74473%0.728SS**  trans-148144.3156.400000105.3
666E29.8Very low31.4Very low152 Ų152126.7 Ų126.771%0.7175%0.745SS**  cis-122.612621.8-55.6171.39700113.7A670E666-A670 WeakPolarHBondContact OE1-CB 3.49Å
667V30.1Very low31.2Very low130 Ų130133.2 Ų133.279%0.78877%0.766SS**SBendtrans-137.7113.6142.5174.90000106.5
668I30.8Very low31.3Very low166 Ų166136 Ų13685%0.85177%0.771SS**SBendtrans60.172.9176.3-47.3159.9000114.1
669N28.3Very low31.4Very low145 Ų145137.7 Ų137.778%0.77577%0.772SS**  -174.867.5116.1-167.831.3000113.2
670A32.7Very low31.5Very low59 Ų59138.9 Ų138.949%0.48878%0.778SS.*  trans-126.529166.300000112E666 I672E666-A670 WeakPolarHBondContact OE1-CB 3.49Å; A670-I672 PolarHBondContact O-N 3.05Å
671A35.1Very low31.5Very low81 Ų81138.9 Ų138.967%0.66977%0.772SS**  trans-66.9131.615900000108
672I36.5Very low31.5Very low156 Ų156140.5 Ų140.580%0.877%0.772SS**SBendtrans79.8101.6-176.4-49.9173.5000114.1A670A670-I672 PolarHBondContact O-N 3.05Å
673K33.8Very low31.1Very low197 Ų197139 Ų13986%0.85777%0.772SS**SBendtrans65.2107.1174.5-61.1178.9179.1179.10115.4
674G31.4Very low31.1Very low76 Ų76140.8 Ų140.878%0.78478%0.78SS**SBendcis179.41740.300000111.8
675G29.1Very low31.1Very low78 Ų78141.8 Ų141.880%0.80477%0.774SS**  cis-135.1165.912.100000114.7
676L29.6Very low30.9Very low155 Ų155143.5 Ų143.581%0.81278%0.775SS**  trans-88.8127.9-165.1-70.276.1000113.7
677K34.4Very low30.9Very low213 Ų213141.8 Ų141.893%0.92678%0.777SS**  trans-118.9126.7130.6-66.1177.5-176.6174.10105
678Q32.8Very low30.6Very low175 Ų175141.5 Ų141.582%0.81878%0.775SS**SBendcis-159.9123.318.9173.4-179.92.500111
679R31.3Very low30.4Very low220 Ų220138.9 Ų138.983%0.8377%0.771SS**  trans-176.9133131.7-104.1174.2-155.9-1445112.6
680L30Very low30.3Very low155 Ų155136.8 Ų136.881%0.81277%0.768SS**  trans-80.6123.8152.8179.269.1000107.5
681I31.6Very low30.1Very low121 Ų121141.7 Ų141.762%0.62179%0.785SS**SBendtrans72.7143.2159.6-68.1169.3000119
682Q30.6Very low29.7Very low153 Ų153147.5 Ų147.572%0.71580%0.796SS**  trans-33.4147.1176.5-77103.7-18.100117.1
683S26.9Very low29.7Very low105 Ų105145 Ų14573%0.73479%0.79SS**  73.2103.652.9-51.90000114.4
684I31.3Very low29.5Very low172 Ų172141.8 Ų141.888%0.88278%0.782SS**  trans-162159.7143.3-102.9157.8000107.5
685E27.9Very low29.4Very low179 Ų179144.2 Ų144.284%0.83678%0.784SS**  trans-80162.9-164.7-66.5157.9106.900115.8
686V24.9Very low29.4Very low126 Ų126144.4 Ų144.476%0.76478%0.778SS**  trans-77.3129.6162.4167.30000107.5V688V686-V688 HydrophobicContact CG1-CG2 4.12Å
687P30.8Very low29.5Very low116 Ų116145.9 Ų145.975%0.75378%0.781SS**  -146.2127.39235.2-16.6000117.4
688V23.4Very low29.2Very low124 Ų124141.4 Ų141.475%0.75278%0.775SS**  26.6104124.5-169.20000117.5V686V686-V688 HydrophobicContact CG1-CG2 4.12Å
689S25.6Very low28.7Very low110 Ų110140.8 Ų140.877%0.76978%0.776SS**  -171.9142127.2-84.70000114.5
690S26.3Very low28.6Very low102 Ų102137 Ų13771%0.71378%0.778SS**  trans53119.4148.8590000123.2
691L29.2Very low28.6Very low161 Ų161134.3 Ų134.384%0.84378%0.778SS**  trans73.7110134.3-86.461.3000121.8
692F26.3Very low28.3Very low203 Ų203136.6 Ų136.689%0.8979%0.79SS**  11.3153.2116.4-73-68.6000121
693P35.7Very low28.1Very low103 Ų103132.9 Ų132.967%0.66979%0.786SS**  -133.3171.4-122.742.8-27.9000115.9
694N30.2Very low28.2Very low131 Ų131134.3 Ų134.370%0.70179%0.785SS**  trans179138.8137.7-104-65.5000111.5
695P29.6Very low28.4Very low126 Ų126133 Ų13382%0.81879%0.786SS**  trans-122102.2162.934.6-20.8000112.2
696A29.3Very low28.5Very low82 Ų82128.9 Ų128.968%0.67877%0.769SS**  trans-161.4124.9164.200000112
697Q30.7Very low28.9Very low187 Ų187127.2 Ų127.287%0.87476%0.762SS**  trans66.7138.1161.9-59.9177.5-1.400116.9
698C28.2Very low29Very low119 Ų119126 Ų12680%0.80476%0.757SS**  cis-150.7156.4-5-112.10000111.9
699L23.9Very low29.4Very low162 Ų162124.2 Ų124.285%0.84874%0.742SS**  trans-99.4177.5159.6-95.3169.9000109.7
700T29.4Very low30Very low140 Ų140123.9 Ų123.986%0.85974%0.738SS**  trans87.4123.8-179.2-40.70000112.8
701A29Very low30.2Very low99 Ų99124.2 Ų124.282%0.81874%0.735SS**  cis-154.8179.8-9.300000111
702L24.6Very low30.4Very low168 Ų168123.4 Ų123.488%0.8873%0.729SS**  trans-126.2167.8177.5-179.2140.8000110.3
703A27.7Very low30.8Very low75 Ų75118.7 Ų118.762%0.6271%0.713SS**  trans94.4135.5-177.200000113.9
704N29.1Very low30.6Very low135 Ų135120.1 Ų120.172%0.72271%0.711SS**  cis-147.1158.8-0.1-97.1-27.6000110.5
705T35.1Very low30.6Very low145 Ų145119.7 Ų119.789%0.8971%0.713SS**  -172.2162.8103.824.80000111.9
706I30.7Very low30.5Very low93 Ų93118.2 Ų118.248%0.47770%0.702SS.*  trans-124.2141.3-165.1-64169.8000112.1Q728 I730I706-Q728 HydrophobicContact CG2-CG 4.02Å; I706-I730 HydrophobicContact CD1-CD1 3.94Å; I706-I730 HydrophobicContact CD1-CG1 3.94Å
707S33Very low30.6Very low90 Ų90117.5 Ų117.563%0.62969%0.689SS**  trans-157.2159.9151.255.20000112.3
708S33.4Very low30.5Very low91 Ų91111.7 Ų111.764%0.63667%0.669SS**  trans62.1149176540000122.4N727 Q728S708-N727 WeakPolarHBondContact O-CB 3.35Å; S708-Q728 VanDerWaalsContact N-NE2 3.16Å; S708-Q728 PolarHBondContact O-NE2 2.91Å
709L31.1Very low30.6Very low86 Ų86108.6 Ų108.645%0.4565%0.648SS.*  trans-174.6161.7-161173.667.5000106T711 N727 Q728L709-T711 HydrophobicContact CD1-CG2 3.95Å; L709-N727 WeakPolarHBondContact CD1-O 3.13Å; L709-Q728 HydrophobicContact CB-CB 4.07Å; L709-Q728 HydrophobicContact CB-CG 4.23Å; L709-Q728 HydrophobicContact CD1-CB 3.96Å; L709-Q728 HydrophobicContact CD2-CB 4.11Å; L709-Q728 HydrophobicContact CG-CB 4.27Å
710P37.3Very low30.7Very low104 Ų104107 Ų10768%0.67564%0.641SS**  cis-99.6-168.516620.2000114.3
711T31.7Very low30.8Very low108 Ų108107.7 Ų107.766%0.66364%0.639SS**  cis77.3138.728.188.90000116.4L709L709-T711 HydrophobicContact CD1-CG2 3.95Å
712M33.4Very low30.6Very low145 Ų145112.3 Ų112.371%0.71464%0.644SS**  cis-148.1167.735.9-73.1-74.6-7900115.8
713N34.2Very low30.9Very low104 Ų104109.5 Ų109.556%0.55664%0.638SS**  trans-0.8148.4157.9-86.131000126.2
714E31.4Very low30.9Very low133 Ų133112.2 Ų112.262%0.62164%0.642SS**  trans80.4129.8135.5-72.8166.112800123.4
715T29.5Very low31.3Very low122 Ų122113.5 Ų113.575%0.74864%0.642SS**  trans-13.1144.5164.652.70000119.1
716V28.6Very low31.2Very low94 Ų94116.4 Ų116.457%0.5764%0.636SS**  cis-149.5152.540.5-145.40000115.4
717V30.8Very low31.1Very low68 Ų68115.8 Ų115.841%0.41263%0.634SS.*  trans70.6145.8161.6-153.90000119.8S1584V717-S1584 WeakPolarHBondContact CB-O 3.21Å; V717-S1584 WeakPolarHBondContact CG1-OG 3.25Å; V717-S1584 WeakPolarHBondContact CG2-O 3.3Å
718S27.6Very low30.9Very low65 Ų65115 Ų11546%0.45562%0.62SS.*  trans5.3128.5165.4-60.50000118.7V1582 S1583S718-V1582 CarbonylContact C-O 3.59Å; S718-V1582 CarbonylContact O-C 3.36Å; S718-V1582 WeakPolarHBondContact O-CA 3.37Å; S718-S1583 WeakPolarHBondContact O-CA 3.44Å; S718-S1583 PolarHBondContact O-N 3.12Å; S718-S1583 VanDerWaalsContact O-N 3.17Å
719S30.4Very low30.8Very low53 Ų53116.3 Ų116.337%0.37162%0.62SS.*  cis-168.2163.226.1-123.70000114.1V1582S719-V1582 PolarHBondContact N-O 2.97Å
720D27.1Very low30.8Very low129 Ų129118.1 Ų118.169%0.6963%0.629SS**  trans3591.7143.3-43.5-43.3000116.3
721N31.6Very low30.3Very low154 Ų154120 Ų12082%0.82463%0.633SS**  -170.8119.761.7-83.2-87.6000110.3S723N721-S723 PolarHBondContact O-N 3.17Å
722Q24.1Very low30.1Very low197 Ų197121 Ų12192%0.92164%0.643SS**  trans-78.1118.5168.9-85.1-178.2-38.800111.2
723S30.8Very low30Very low108 Ų108121.2 Ų121.276%0.75564%0.642SS**  trans-142.2121.3151.365.30000108.5N721N721-S723 PolarHBondContact O-N 3.17Å
724D29Very low29.9Very low132 Ų132121.9 Ų121.971%0.70665%0.646SS**  trans-67155.5-163.3-54-87.2000114.7
725K36Very low30Very low163 Ų163121 Ų12171%0.70964%0.642SS**  -175.6132122.4-98.5152.9-145.480.40115.1
726R32.7Very low30.2Very low205 Ų205119.9 Ų119.977%0.77464%0.639SS**  trans75.1150.7143.6-65.5171.5-177.2159.4-1.5117.4
727N30.5Very low30.5Very low80 Ų80122.7 Ų122.743%0.42864%0.64SS.*  cis-157171.5-3.8-123.8-3.6000113.5S708 L709S708-N727 WeakPolarHBondContact O-CB 3.35Å; L709-N727 WeakPolarHBondContact CD1-O 3.13Å
728Q28.8Very low30.6Very low74 Ų74124.3 Ų124.335%0.34665%0.65SS.*  trans70.4155.4177.2-59.4-179.645.200115.6I706 S708 L709I706-Q728 HydrophobicContact CG2-CG 4.02Å; S708-Q728 VanDerWaalsContact N-NE2 3.16Å; S708-Q728 PolarHBondContact O-NE2 2.91Å; L709-Q728 HydrophobicContact CB-CB 4.07Å; L709-Q728 HydrophobicContact CB-CG 4.23Å; L709-Q728 HydrophobicContact CD1-CB 3.96Å; L709-Q728 HydrophobicContact CD2-CB 4.11Å; L709-Q728 HydrophobicContact CG-CB 4.27Å
729N30.8Very low30.7Very low119 Ų119127.1 Ų127.164%0.63666%0.661SS**SBendcis-124.496.11.2-153.68.2000113.1
730I30.7Very low30.6Very low123 Ų123130.4 Ų130.463%0.63168%0.678SS**  trans61.579.8157.8-53.2167.2000116.4I706I706-I730 HydrophobicContact CD1-CD1 3.94Å; I706-I730 HydrophobicContact CD1-CG1 3.94Å
731N26.5Very low31Very low144 Ų144131.6 Ų131.677%0.7768%0.683SS**  70.878.3118.9-162.957.5000119.3
732C27.3Very low31Very low128 Ų128130.7 Ų130.787%0.86568%0.678SS**  -160.499.8123.8-108.50000111.5
733Q31.3Very low31.8Very low151 Ų151127.3 Ų127.371%0.70667%0.665SS**  trans-142.7150.4164.1-108.2-164.2-29.800106.6E735Q733-E735 PolarHBondContact NE2-OE2 2.89Å
734N32Very low32.1Very low117 Ų117130.5 Ų130.563%0.62667%0.666SS**  cis-116.21716-79.1-51.1000109.6
735E34.2Very low32.6Very low115 Ų115131.5 Ų131.554%0.53766%0.664SS.*  cis58.6163.241.2-42.4-172106.600111.2Q733 Y737Q733-E735 PolarHBondContact NE2-OE2 2.89Å; E735-Y737 HydrophobicContact CG-CE2 4.49Å; E735-Y737 WeakPolarHBondContact OE1-CE2 3.46Å
736S34Very low32.5Very low98 Ų98130.2 Ų130.269%0.68566%0.66SS**  cis-160.3152.49.3-161.50000108.5
737Y34Very low32.5Very low153 Ų153126 Ų12660%0.665%0.652SS**  cis-146.5150.2-18.2-118.1-158.6000105.2E735E735-Y737 HydrophobicContact CG-CE2 4.49Å; E735-Y737 WeakPolarHBondContact OE1-CE2 3.46Å
738T34Very low32.5Very low102 Ų102129.3 Ų129.363%0.62667%0.667SS**  53144.973.65.60000112.9
739N29.4Very low32.8Very low125 Ų125132.2 Ų132.267%0.66869%0.685SS**  -153.7130.457.1-137.8-22.4000116.1
740T28.3Very low32.8Very low121 Ų121131.8 Ų131.874%0.74269%0.691SS**  trans-169.3137.3134.7-70.80000107.5
741I35Very low32.7Very low154 Ų154131.7 Ų131.779%0.7970%0.697SS**  trans161.6148.3143.9-87.2158.5000109
742N32.2Very low33Very low136 Ų136133.1 Ų133.173%0.72770%0.701SS**  trans-124.9127170.5-117.7-21.9000109.8
743I39.3Very low33.3Very low126 Ų126132.2 Ų132.265%0.64669%0.692SS**  58.5129.8127.3-74.4179000118.2
744K38.9Very low33.3Very low175 Ų175131.3 Ų131.376%0.76169%0.691SS**  cis-167176.82.1-98.5171-162.5169.90106.5
745K39.6Very low33.3Very low153 Ų153130.3 Ų130.367%0.66569%0.694SS**  cis172.7172.1-26.8-169.7-156.4160.8-157.70106.1
746E33.2Very low33.1Very low136 Ų136133.1 Ų133.164%0.63671%0.712SS**  trans89.5133.1157-54.5-133.3168.100118
747L32.7Very low33.2Very low115 Ų115135.9 Ų135.960%0.60271%0.714SS**  cis-158.4137.7-5-156.956.6000116.3
748M31.3Very low33Very low150 Ų150135.7 Ų135.774%0.73972%0.723SS**  trans73.2143.1146.7-86.6168.9-175.600126.2
749N33.5Very low33.1Very low135 Ų135135.5 Ų135.572%0.72272%0.722SS**  trans73.286.2156.4-62.3-12.5000118.1
750S30.7Very low33.1Very low110 Ų110136.1 Ų136.177%0.76972%0.72SS**  83.8131.270.2-68.60000112.6
751T30Very low33.4Very low122 Ų122135.5 Ų135.575%0.74872%0.719SS**  cis-136.3144.925.2470000114.9
752M31.7Very low33.2Very low173 Ų173134.3 Ų134.385%0.85271%0.713SS**  trans46.6142.2145.4-64.3-174168.200121.1
753T33.6Very low33.1Very low110 Ų110133.7 Ų133.768%0.67571%0.714SS**  cis174.5146.5-23.533.50000104.8
754N32.9Very low32.7Very low131 Ų131135.8 Ų135.870%0.70173%0.725SS**  cis-155.7156.6-8.2-105.913.7000106
755S31.3Very low32.6Very low97 Ų97134.1 Ų134.168%0.67873%0.73SS**  cis77.510226.5-57.30000116.2
756L29.5Very low32.3Very low174 Ų174132.2 Ų132.291%0.91174%0.736SS**  -139.2111.7106.8-138.679.5000110.5
757Q35.3Very low32.3Very low156 Ų156128.6 Ų128.673%0.72974%0.735SS**  trans-94.7166.8166.4-155.788.25.200108.1V759Q757-V759 HydrophobicContact CG-CG2 3.98Å
758N30.5Very low32.4Very low148 Ų148129.8 Ų129.879%0.79174%0.742SS**  -169.9133.5117.8-94.44.3000110.1
759V35.7Very low32.6Very low99 Ų99128.2 Ų128.260%0.674%0.737SS**  cis89.3131.846.5164.80000109.9Q757Q757-V759 HydrophobicContact CG-CG2 3.98Å
760E30.2Very low32.7Very low137 Ų137130.2 Ų130.264%0.6474%0.739SS**  cis-146.3178.415.5-144.1152.3-13000111.8I762E760-I762 HydrophobicContact CG-CG1 3.99Å; E760-I762 WeakPolarHBondContact OE2-CD1 3.28Å; E760-I762 VanDerWaalsContact OE2-CG1 3.29Å; E760-I762 WeakPolarHBondContact OE2-CG1 3.03Å
761P34.8Very low32.9Very low109 Ų109131.7 Ų131.771%0.70874%0.738SS**  -144.2177.89038.4-20.8000115.7
762I31.2Very low33Very low129 Ų129131.6 Ų131.666%0.66273%0.732SS**  trans-116.3144.6-158.2-49.6165.4000112.3E760E760-I762 HydrophobicContact CG-CG1 3.99Å; E760-I762 WeakPolarHBondContact OE2-CD1 3.28Å; E760-I762 VanDerWaalsContact OE2-CG1 3.29Å; E760-I762 WeakPolarHBondContact OE2-CG1 3.03Å
763T28.7Very low33.2Very low123 Ų123129.6 Ų129.676%0.75573%0.725SS**  148.7122.8129.3-600000113.6
764L32.5Very low33.3Very low170 Ų170129.6 Ų129.689%0.8973%0.73SS**  trans-148132.2164-81.1177.8000111.3
765T35.7Very low33.2Very low140 Ų140132 Ų13286%0.85974%0.739SS**  trans-161.7158151.845.40000106.5
766S34.4Very low33.3Very low113 Ų113133.9 Ų133.979%0.7974%0.741SS**  cis-148.4156.26.6-1620000108.2
767G32.8Very low33.6Very low60 Ų60132.3 Ų132.362%0.61973%0.727SS**  cis171.5-176.6-2.800000111.4
768D35.3Very low33.2Very low139 Ų139130.2 Ų130.274%0.74373%0.73SS**  trans61.7138.6147.6-65.88.4000121.4
769N33.6Very low33.2Very low117 Ų117128.1 Ų128.163%0.62673%0.733SS**  cis-157.9154.5-5.3-123-48.8000112.7
770K35.9Very low33Very low178 Ų178130.5 Ų130.577%0.77474%0.737SS**  trans3.8151.5151.4-66.7-179.6172.7-172.70120.8
771L35.4Very low33.1Very low141 Ų141130.6 Ų130.674%0.73874%0.742SS**  cis-168.51762.2-118.9171.2000112.2
772N33.2Very low32.8Very low120 Ų120129.6 Ų129.664%0.64274%0.738SS**  trans87112.4151.7-107.766.2000122.3
773D34.6Very low32.6Very low130 Ų130130.6 Ų130.670%0.69574%0.743SS**  trans62104.1137.5-60.8-1.7000123.6
774S36.2Very low32.5Very low111 Ų111130 Ų13078%0.77674%0.744SS**  101.1128.3119.2-68.80000122
775M31.7Very low32.2Very low180 Ų180126.2 Ų126.289%0.88774%0.737SS**  trans68.382.5160.2-54.6-162.492.900119.7
776N32.9Very low31.8Very low137 Ų137127 Ų12773%0.73374%0.736SS**  trans17.5125.3134.5-65.7-19.8000119.3
777K34.9Very low31.5Very low142 Ų142126 Ų12662%0.61773%0.734SS**  62.4125.166.6-65176.1177.9175.40112.3Q780K777-Q780 HydrophobicContact CD-CG 4.47Å
778S28.2Very low31.1Very low112 Ų112130.6 Ų130.678%0.78374%0.744SS**SBendcis58.1101.612.966.10000117.4
779A30.4Very low30.7Very low103 Ų103130.4 Ų130.485%0.85174%0.742SS**  trans46.186.8153.400000119
780Q30.8Very low30.4Very low149 Ų149132 Ų13270%0.69675%0.75SS**  trans-89.6147.9157.3-92.6179.3-88.100109.6K777K777-Q780 HydrophobicContact CD-CG 4.47Å
781N31.1Very low30.1Very low140 Ų140131.5 Ų131.575%0.74976%0.755SS**  cis58.4116.220.2-91.33000116.3
782S28.7Very low30Very low87 Ų87130 Ų13061%0.60875%0.753SS**  cis178.51680.443.40000108.9
783I27.1Very low29.8Very low151 Ų151129.7 Ų129.777%0.77476%0.758SS**  trans78.7108.9158.1-62.9155.1000119
784S26.6Very low29.5Very low110 Ų110129.3 Ų129.377%0.76976%0.761SS**  50.9117.3129.6-50.30000125.6
785A27.3Very low29Very low90 Ų90129.3 Ų129.374%0.74476%0.761SS**  93.3131.3115.500000123.5
786N26.9Very low29Very low156 Ų156126.1 Ų126.183%0.83476%0.756SS**  trans67.3108.8153.5-68.2-3.2000122.1
787A27.7Very low28.9Very low92 Ų92123.9 Ų123.976%0.7674%0.741SS**  trans43.6136.8131.900000119.9
788L24.6Very low28.7Very low157 Ų157125.2 Ų125.282%0.82275%0.753SS**  cis-170175.745.9-168.270.7000110.3
789I26.1Very low29.1Very low136 Ų136124.3 Ų124.370%0.69774%0.743SS**  trans86.4126.3159.5-52.3-177000118.7
790N28.2Very low29.4Very low151 Ų151123.6 Ų123.681%0.80773%0.732SS**  trans45.4102.8156.2-59.4-7.9000122.6
791L29.2Very low29.5Very low166 Ų166122.8 Ų122.887%0.86973%0.732SS**  trans-55.4173.1139.3-84.571.3000112.7
792P33.2Very low29.8Very low109 Ų109120.1 Ų120.171%0.70873%0.729SS**  cis-122.1173.7-1.642.2-29.3000113.2
793P29.2Very low30.1Very low114 Ų114122.7 Ų122.774%0.7473%0.731SS**  -133.2156.191.138.3-29.9000115.1
794T28.7Very low30.4Very low122 Ų122120.8 Ų120.875%0.74872%0.722SS**  trans48.3101.2151.554.40000120.6
795S26.4Very low30.8Very low112 Ų112123.7 Ų123.778%0.78372%0.724SS**  50.192.2116.9179.90000119.4
796S30.1Very low31Very low112 Ų112123 Ų12378%0.78372%0.718SS**  -165.1146.4127.130.10000110.7
797H31.1Very low31.1Very low90 Ų90122.5 Ų122.542%0.41771%0.714SS.*  trans-80.2142.3176.6-94.4-135.9000111.7G446 N447G446-H797 WeakPolarHBondContact CA-NE2 3.43Å; G446-H797 PolarHBondContact O-CE1 3.02Å; G446-H797 PolarHBondContact O-NE2 3.04Å; N447-H797 HydrophobicContact CB-CB 4.45Å; N447-H797 PolarHBondContact OD1-CD2 3.3Å
798I32Very low31.3Very low171 Ų171126.3 Ų126.388%0.87772%0.718SS**  trans-117.6113.3148.3-59178000106
799V35.1Very low31.5Very low92 Ų92123.2 Ų123.256%0.55872%0.715SS**  trans-79.1146.6173.9175.20000108.9
800S37.4Very low31.6Very low89 Ų89121 Ų12162%0.62272%0.717SS**  trans-69.8149.7-167.356.60000114.1A802 Q803S800-A802 PolarHBondContact O-N 2.83Å; S800-Q803 PolarHBondContact O-N 3.25Å
801L33.7Very low31.6Very low132 Ų132121.8 Ų121.869%0.69172%0.72SS**G310 helixtrans-60.7-9.2-170.8-168.457.2000115.1Q803 L804L801-Q803 VanDerWaalsContact C-N 3.27Å; L801-Q803 PolarHBondContact O-N 3.01Å; L801-L804 HydrophobicContact CD1-CB 4.02Å; L801-L804 HydrophobicContact CD1-CD2 3.85Å; L801-L804 PolarHBondContact O-N 2.81Å
802A36.1Very low31.6Very low84 Ų84118.2 Ų118.269%0.69471%0.714SS**G310 helixtrans-70-15.8177.400000114.5S800S800-A802 PolarHBondContact O-N 2.83Å
803Q35.1Very low31.6Very low140 Ų140120.8 Ų120.865%0.65472%0.722SS**G310 helixtrans-102.11.6174.9-74-177.9-35.700114.1S800 L801S800-Q803 PolarHBondContact O-N 3.25Å; L801-Q803 VanDerWaalsContact C-N 3.27Å; L801-Q803 PolarHBondContact O-N 3.01Å
804L34.4Very low31.7Very low112 Ų112119.6 Ų119.659%0.58672%0.722SS**SBendtrans-91.3-12.6176.1-153.168000113.4L801 A806L801-L804 HydrophobicContact CD1-CB 4.02Å; L801-L804 HydrophobicContact CD1-CD2 3.85Å; L801-L804 PolarHBondContact O-N 2.81Å; L804-A806 VanDerWaalsContact C-N 3.32Å; L804-A806 PolarHBondContact O-N 2.84Å
805Q35.2Very low31.7Very low171 Ų171120 Ų12080%0.79973%0.73SS**SBendtrans-82.1-6.1178.7-154.270.612.500113.5
806A30.9Very low31.9Very low76 Ų76120.1 Ų120.163%0.62873%0.731SS**SBendtrans-112.4-3.1-172.100000115L804L804-A806 VanDerWaalsContact C-N 3.32Å; L804-A806 PolarHBondContact O-N 2.84Å
807I29.2Very low31.8Very low144 Ų144122 Ų12274%0.73874%0.737SS**SBendtrans-121.86.4-174.4-51.8-177.8000111.8
808M30.8Very low31.6Very low172 Ų172122.4 Ų122.485%0.84775%0.75SS**SBendtrans-111.814.9177.7-76.4-82.4-79.300113.6
809A29.3Very low31.4Very low93 Ų93119.2 Ų119.277%0.76973%0.734SS**SBendtrans-136.718.6-175.200000114.3
810A27.8Very low31.1Very low88 Ų88118 Ų11873%0.72773%0.73SS**SBendtrans-152.337.5-171.600000116.8
811L29.2Very low30.7Very low168 Ų168118.9 Ų118.988%0.8873%0.727SS**  trans-15577.1155.1-16756.4000113.1
812A27.9Very low30.8Very low91 Ų91116.4 Ų116.475%0.75272%0.718SS**SBendtrans-145.746.3172.500000112.6
813N35.1Very low30.4Very low163 Ų163117.3 Ų117.387%0.87272%0.715SS**SBendtrans-167.3155.3145.2-98.9-33.7000111.7
814A29.3Very low30.1Very low90 Ų90117 Ų11774%0.74472%0.718SS**  trans-78.6140.5-159.400000115.7
815S29.8Very low29.9Very low130 Ų130118 Ų11891%0.90973%0.734SS**  trans-160102142.4-80.90000108.4
816S30Very low29.5Very low114 Ų114115.9 Ų115.980%0.79773%0.733SS**  trans-107.1122.8-171.855.90000112.4
817V27.7Very low29.6Very low151 Ų151117 Ų11792%0.91574%0.742SS**  trans-124.5137.8155.1179.90000107.9
818S28.4Very low29.7Very low99 Ų99114.9 Ų114.969%0.69274%0.74SS**  trans-95.2144.4-16051.80000114.6
819I27.7Very low29.6Very low104 Ų104113.1 Ų113.153%0.53374%0.74SS.*  trans-113108.4153.5-62.7178.8000107P398 T399 L400P398-I819 HydrophobicContact CB-CD1 4.09Å; P398-I819 HydrophobicContact CG-CD1 3.62Å; P398-I819 HydrophobicContact CG-CG1 3.75Å; P398-I819 HydrophobicContact CG-CG2 4.26Å; T399-I819 HydrophobicContact CG2-CG2 4.13Å; L400-I819 HydrophobicContact CB-CG2 4.45Å; L400-I819 HydrophobicContact CD1-CG2 4.41Å
820S28.7Very low29.8Very low67 Ų67114 Ų11447%0.46974%0.74SS.*  trans-71.9170.6165.9-47.80000109.2
821L28.8Very low29.8Very low108 Ų108117.6 Ų117.657%0.56575%0.746SS**  cis-136.1-15917.9-65.384.5000110.7T399 L400T399-L821 HydrophobicContact CG2-CD1 4.28Å; L400-L821 WeakPolarHBondContact O-CD1 3.47Å
822P34.6Very low29.9Very low79 Ų79114.4 Ų114.451%0.51374%0.738SS.*  -107.5-164.5-83.628.5-7.9000111
823V29.5Very low29.9Very low103 Ų103118.2 Ų118.262%0.62475%0.745SS**  cis-154.8159.120.4-139.70000111.9
824N28.3Very low29.9Very low134 Ų134115.1 Ų115.172%0.71774%0.742SS**  trans50.4118.3151.1-74.5-5.5000121.6
825S30Very low30.6Very low132 Ų132117.1 Ų117.192%0.92375%0.747SS**  -146.4139.2124-81.30000110
826T27.2Very low30.5Very low128 Ų128115.2 Ų115.279%0.78574%0.739SS**  trans-112.1126.6-168.149.70000113.3
827A32.5Very low30.4Very low98 Ų98115.5 Ų115.581%0.8174%0.74SS**  trans-161154.2155.800000109.4
828S30.3Very low30.4Very low101 Ų101113.5 Ų113.571%0.70673%0.733SS**  cis174.6125.2-36.3-990000107.3
829T29.3Very low30.7Very low135 Ų135113 Ų11383%0.82873%0.734SS**  trans58.197.6151.758.20000121.9
830S32.9Very low31Very low110 Ų110114.1 Ų114.177%0.76975%0.746SS**  -154.4123.9123.8500000107.2
831L29.6Very low31.4Very low164 Ų164117 Ų11786%0.85976%0.76SS**  58.2119.367.3-59.6178.8000112.2
832S30Very low31.5Very low101 Ų101116.7 Ų116.771%0.70677%0.767SS**  cis-162.5153.3-1.157.30000113.3
833L29.2Very low31.4Very low172 Ų172117.3 Ų117.390%0.90177%0.774SS**  trans26.3126.3152.8-80.464.4000120.3
834A34.3Very low31.4Very low98 Ų98119.5 Ų119.581%0.8178%0.781SS**  trans-102.5157.4162.100000112.3
835P44.6Very low31.6Very low131 Ų131118.2 Ų118.285%0.85178%0.783SS**  trans-112.7154151.635.6-26000111.5
836A27.8Very low31.7Very low91 Ų91116.8 Ų116.875%0.75277%0.773SS**  trans-129.9-167.1-171.600000112.9
837C27.3Very low31.8Very low120 Ų120115.5 Ų115.581%0.81177%0.769SS**  trans95.8144.2165.7-59.50000117
838S28.4Very low31.7Very low109 Ų109117.7 Ų117.776%0.76277%0.767SS**  cis-173.2-175.6-11.2-105.90000111.9
839A33.7Very low32Very low88 Ų88118.7 Ų118.773%0.72777%0.771SS**  trans90.4138.8154.900000116.4
840T34.4Very low32.1Very low127 Ų127118 Ų11878%0.77977%0.772SS**  cis-161.9160.5-56.80000107.3
841V35.7Very low31.9Very low127 Ų127120.6 Ų120.677%0.7778%0.776SS**  cis-151169.512-101.10000105.4
842S32Very low31.8Very low102 Ų102121.1 Ų121.171%0.71377%0.773SS**  cis-176.3172.1-7.7-99.80000105.9
843S31.8Very low31.7Very low93 Ų93124.3 Ų124.365%0.6578%0.777SS**  cis-175.7173.7-26.361.50000105.5
844L30.6Very low31.7Very low149 Ų149123.2 Ų123.278%0.7877%0.771SS**  cis-130.7-1726.8-5882.4000109.9
845S31.4Very low31.5Very low106 Ų106123.9 Ų123.974%0.74177%0.765SS**  trans24.6136.5144.761.40000122.1
846S33.2Very low30.8Very low103 Ų103124.6 Ų124.672%0.7276%0.762SS**  cis-173.5143.9-8.245.50000112
847S29.2Very low31.3Very low100 Ų100125.1 Ų125.170%0.69976%0.758SS**  10.4142.4125.8-53.20000118.4
848N30.6Very low31.7Very low144 Ų144124.1 Ų124.177%0.7775%0.752SS**  cis-160.1161.817.2-99.6-20000110.8
849P36.8Very low32.1Very low122 Ų122125.3 Ų125.379%0.79276%0.755SS**  trans-130.7130.7140.136-24.9000112.8
850S30.1Very low32.5Very low122 Ų122126.5 Ų126.585%0.85376%0.755SS**  trans-162.9147.6168.8-800000111.2
851I28.4Very low32.5Very low164 Ų164125.3 Ų125.384%0.84175%0.752SS**  trans-103.1130.7178-67.4173.8000109.7
852Q28.3Very low32.4Very low174 Ų174126.9 Ų126.981%0.81376%0.755SS**  trans-162.2122147.7-113.2172.523.600113.1
853Q27.1Very low32.5Very low169 Ų169127 Ų12779%0.7976%0.756SS**  62.7145.3126.7-150.5167.1400122.4
854L29Very low32.5Very low148 Ų148128.4 Ų128.478%0.77577%0.765SS**  trans93.591.3151.7-151.270.4000121.2
855V31Very low32.6Very low113 Ų113127.4 Ų127.469%0.68577%0.77SS**  29.7134.1123.3-177.30000121.2
856N29.2Very low32.7Very low146 Ų146125.6 Ų125.678%0.78177%0.768SS**  trans77.9153.7158.5-84.5-7.7000120
857P40.1Very low32.8Very low101 Ų101127.1 Ų127.166%0.65677%0.774SS**  cis-140.4180-24.839.7-21.9000116
858S34.6Very low33Very low99 Ų99129.4 Ų129.469%0.69278%0.778SS**  trans71.599.4149.1-59.50000122.4
859T37.6Very low33.1Very low135 Ų135128.3 Ų128.383%0.82878%0.776SS**  45.8154121.759.20000123.2
860P41.4Very low32.7Very low112 Ų112129.5 Ų129.573%0.72778%0.775SS**  cis-132.6155.14.438.8-22.4000116.8
861S34.6Very low32.7Very low102 Ų102130.7 Ų130.771%0.71377%0.77SS**  154.3121.2117.257.60000114.6
862I34.2Very low32.7Very low161 Ų161129.1 Ų129.183%0.82676%0.764SS**  trans51.1109.8138.3-51.6172.3000116.7
863S33.1Very low32.9Very low105 Ų105125.7 Ų125.773%0.73476%0.755SS**  cis-155.5153.914.6-93.60000114.9
864S31.9Very low33.3Very low121 Ų121123.2 Ų123.285%0.84676%0.756SS**  trans57.9103.6156.751.50000120.9
865S32.8Very low33.4Very low128 Ų128118.9 Ų118.990%0.89575%0.748SS**  trans-98.3-166.4162.260.40000110.8
866G32.9Very low33.3Very low68 Ų68119.2 Ų119.270%0.70176%0.755SS**  cis-177.3-156.114.900000113.5
867T35.6Very low33.5Very low136 Ų136116.5 Ų116.583%0.83475%0.747SS**  trans-126.2147.1-154.952.30000118.2
868N33.7Very low33.2Very low148 Ų148118.7 Ų118.779%0.79175%0.753SS**  trans39.4118.5147.9-75.3-19.3000123.8
869V33.2Very low33.1Very low120 Ų120119.7 Ų119.773%0.72775%0.75SS**  58.8111125.7-176.10000118.2
870L29.1Very low33Very low148 Ų148118.5 Ų118.578%0.77574%0.743SS**  -177.9156.870.3-160.674.2000112.4
871I29.1Very low32.7Very low146 Ų146119.6 Ų119.675%0.74975%0.748SS**  trans61.2130.6167.3-27.6-176.5000120
872N28.1Very low32.6Very low132 Ų132117.9 Ų117.971%0.70675%0.745SS**  trans115.2139.5133.2-140.319000119.4
873T33.7Very low32.7Very low102 Ų102116.1 Ų116.163%0.62675%0.747SS**  trans46.1127.3153.943.50000121.9
874S33.7Very low32.7Very low117 Ų117116.5 Ų116.582%0.81875%0.745SS**  trans64.9148.616124.10000115.3
875G31.1Very low33Very low57 Ų57116.4 Ų116.459%0.58874%0.74SS**  cis91.21144100000107.2
876S29.7Very low33.1Very low119 Ų119116 Ų11683%0.83273%0.732SS**  55.8113.884.8-60.90000109.9
877S32.9Very low33.2Very low90 Ų90117.5 Ų117.563%0.62973%0.732SS**  cis167.9170.930.752.30000111
878L33.6Very low33.1Very low147 Ų147119.9 Ų119.977%0.7773%0.734SS**  trans68.2159.5151.1-65.2160.8000115.9
879N32.5Very low33.1Very low119 Ų119117.7 Ų117.764%0.63674%0.736SS**  cis-155.8162.94.1-139.7-9.3000115.3
880V36Very low33.2Very low111 Ų111115.5 Ų115.567%0.67374%0.737SS**  trans43.4132.5132.6146.60000119.3
881T35.2Very low33.1Very low135 Ų135116.2 Ų116.283%0.82874%0.742SS**  cis-160163.219.42.90000108.7
882G33.5Very low33.3Very low65 Ų65116.7 Ų116.767%0.6775%0.752SS**  cis163.4-178.3-000000111.6
883S34.9Very low33.7Very low124 Ų124115.7 Ų115.787%0.86776%0.755SS**  trans71.5139.8179-960000117.7
884V34.3Very low33.5Very low113 Ų113119.2 Ų119.269%0.68577%0.77SS**  cis-162.6147.5-11.692.70000112.2
885T37Very low33.4Very low119 Ų119121.3 Ų121.373%0.7377%0.77SS**  trans58.7145.6164.958.30000120.1
886T36.2Very low33.8Very low119 Ų119124.3 Ų124.373%0.7378%0.779SS**  cis-161.1147-5.711.30000111.2
887S33.9Very low33.9Very low101 Ų101122 Ų12271%0.70677%0.774SS**  trans60138.4154.8-57.50000120.1
888E33.2Very low33.7Very low186 Ų186125.5 Ų125.587%0.86979%0.785SS**  cis-148.6172.6-3.7-132.1167.3158.400112.8
889A34.9Very low33.5Very low102 Ų102125.2 Ų125.284%0.84378%0.784SS**  trans-68.8161.6-160.400000116.5
890G34.2Very low33.5Very low73 Ų73126 Ų12675%0.75379%0.788SS**  cis146.2114.9-8.100000114.4
891N27.6Very low33.3Very low163 Ų163127.6 Ų127.687%0.87279%0.792SS**  trans-100.2146.4163.2-79.7-22.5000109.7
892T32.3Very low33.2Very low156 Ų156126.7 Ų126.796%0.95779%0.787SS**  trans-170.1161155.24.30000111.6
893S36.5Very low33.2Very low112 Ų112128.9 Ų128.978%0.78379%0.792SS**  trans-140.7134.7-171.950.40000113.2
894L31.1Very low33.1Very low176 Ų176129.1 Ų129.192%0.92179%0.788SS**  trans-149.3172173.4-84.5-177.5000112.5
895I31.6Very low33.2Very low161 Ų161129.2 Ų129.283%0.82679%0.792SS**  trans-150.7156.1-156.1-80168.9000107.9
896P38.1Very low33.1Very low119 Ų119126.6 Ų126.677%0.77379%0.788SS**  cis-130.5172.97.740.4-25.2000117.3
897G31.7Very low33Very low71 Ų71129.5 Ų129.573%0.73279%0.791SS**  trans93140.7130.700000120.8
898L29.1Very low33.2Very low163 Ų163129.6 Ų129.685%0.85379%0.788SS**  trans59.9110.8172.9-60.8170.3000115.7
899N30.2Very low33.4Very low141 Ų141127.2 Ų127.275%0.75478%0.78SS**  68.2114.875.6-74.7-11.5000115.9
900N31.4Very low33.6Very low136 Ų136128.9 Ų128.973%0.72778%0.78SS**  trans79.4111.6156.9-73.3-17.7000122.3
901L32.1Very low33.7Very low144 Ų144128.5 Ų128.575%0.75478%0.777SS**  69148.5127.3-53.7171.6000117.9
902T33.8Very low34.1Very low116 Ų116126.6 Ų126.671%0.71277%0.773SS**  cis-161.6150.86-70000111.6
903S32.8Very low33.9Very low111 Ų111123.6 Ų123.678%0.77676%0.759SS**  trans62.3162.5156.8-93.20000117.3
904V33.8Very low33.9Very low129 Ų129123.7 Ų123.778%0.78276%0.759SS**  cis-147.6157.12.4-114.50000107.3
905C35.6Very low34.6Very low116 Ų116123.9 Ų123.978%0.78475%0.753SS**  cis-159.9153.5-8.6-162.30000110
906G35.1Very low34.4Very low63 Ų63122.1 Ų122.165%0.64975%0.749SS**  trans89.1143.5157.500000117.4
907F34.8Very low34Very low180 Ų180123.1 Ų123.179%0.78975%0.748SS**  cis-147.9117.9-9.7-130.8-104.6000109.4
908T36.3Very low33.8Very low104 Ų104125.8 Ų125.864%0.63875%0.746SS**  trans63.2151.7137.3610000121.3
909L38.1Very low33.7Very low135 Ų135124.2 Ų124.271%0.70774%0.738SS**  cis-157.9146.30.8-121.5159.5000109.1
910T40.1Very low33.6Very low137 Ų137123.6 Ų123.684%0.8473%0.733SS**  trans56.1145.3159.442.90000119.5
911G36.6Very low33.5Very low66 Ų66122.7 Ų122.768%0.6873%0.733SS**  cis-170.5152.9-2.900000110.1
912P35.1Very low33.2Very low122 Ų122120.8 Ų120.879%0.79273%0.727SS**  trans-103.1173.2-159.639.5-37000115.7
913S27.9Very low33Very low94 Ų94125.2 Ų125.266%0.65773%0.732SS**SBendtrans87140.115476.90000119.7F915S913-F915 PolarHBondContact O-N 2.58Å
914S35.9Very low32.8Very low113 Ų113125.3 Ų125.379%0.7972%0.724SS**SBendtrans62.50.6157.6-51.20000119.2
915F45.5Very low33.1Very low181 Ų181124.7 Ų124.779%0.79472%0.723SS**  trans-148.6168.9-174.2-69.2-92.5000112.3S913S913-F915 PolarHBondContact O-N 2.58Å
916V28.6Very low33Very low123 Ų123123.8 Ų123.875%0.74572%0.718SS**  trans77.3136.6160.4-1650000117.7
917N28.9Very low32.9Very low140 Ų140128.6 Ų128.675%0.74973%0.726SS**  trans58.8136.5161.7-75.56.6000120.2
918N27.4Very low32.7Very low128 Ų128124.6 Ų124.668%0.68472%0.72SS**  cis72.5110.39.6-15017.1000117.4
919N26.9Very low32.6Very low130 Ų130123.6 Ų123.670%0.69572%0.722SS**  trans79.4165.7144.6-127.1-8.2000121.1
920I29.7Very low32.2Very low128 Ų128123 Ų12366%0.65672%0.72SS**  trans72.3108.5156.6-72161000115.5
921T28.3Very low31.9Very low117 Ų117125.6 Ų125.672%0.71872%0.72SS**  57.6138.169.374.60000113
922T27.2Very low31.7Very low103 Ų103125.7 Ų125.763%0.63272%0.721SS**  169.4-177.873.5-42.60000107.5
923Y28.7Very low31.2Very low209 Ų209126.1 Ų126.182%0.8272%0.721SS**  trans129.4101.4151.6-75.6-75.5000111.6
924N28.9Very low31.5Very low114 Ų114129.4 Ų129.461%0.6173%0.73SS**  cis76.3125.844.8-162.418.2000112S926N924-S926 PolarHBondContact OD1-N 2.8Å
925P40.7Very low31.1Very low116 Ų116130.6 Ų130.675%0.75373%0.727SS**  -145.8127.5101.336.2-19.6000116.6
926S33.3Very low30.4Very low97 Ų97125.6 Ų125.668%0.67872%0.715SS**  trans-159.6114.9142-73.30000107N924N924-S926 PolarHBondContact OD1-N 2.8Å
927M32.8Very low30.3Very low164 Ų164126.6 Ų126.681%0.80872%0.716SS**  61.3129.965.7-62.5-65.3105.700113
928S30.6Very low30.6Very low96 Ų96127 Ų12767%0.67172%0.716SS**  cis-169.8147.8-13.5-168.20000110
929A32.9Very low31.1Very low83 Ų83129.7 Ų129.769%0.68672%0.722SS**  trans64173.5157.700000116.3
930N30.7Very low31.5Very low122 Ų122126.8 Ų126.865%0.65272%0.723SS**  cis-161.8150.1-21.7-130.9-13.7000110.3
931F33Very low31.7Very low191 Ų191127.9 Ų127.984%0.83873%0.729SS**  trans56.7171.9166.8-54.3-61.3000115.5
932G32.5Very low31.8Very low68 Ų68128 Ų12870%0.70173%0.729SS**  cis-159.3147.9-4.100000112.4
933T25.3Very low31.9Very low131 Ų131129.4 Ų129.480%0.80474%0.737SS**  trans-56.4179.8163.544.80000113.3
934I33.2Very low32.6Very low163 Ų163124.2 Ų124.284%0.83673%0.729SS**  trans96.4139.9166.3-56.4161.4000114.1
935N28.1Very low32.8Very low138 Ų138124.5 Ų124.574%0.73874%0.74SS**  cis-171174.1-32.9-158.4-2.9000107.7
936S31.3Very low32.3Very low77 Ų77122.1 Ų122.154%0.53874%0.736SS.*  trans57121.7147.6-65.40000120.8
937N25.9Very low32.2Very low144 Ų144126.3 Ų126.377%0.7775%0.746SS**  41130.4120.3-47.5-46000118.5
938I36.4Very low32.1Very low147 Ų147124.1 Ų124.175%0.75475%0.745SS**  -166.4146.386.7-97.8161.6000111.8
939K36.2Very low32.3Very low185 Ų185127.3 Ų127.380%0.80475%0.753SS**  trans13.5134.9155.7-49.9166.9-171.6175.40118.6
940G36.5Very low32Very low69 Ų69128.1 Ų128.171%0.71175%0.753SS**  cis130.7-174.9500000112
941I34.1Very low32.1Very low152 Ų152130.2 Ų130.278%0.77976%0.764SS**  trans64.897.2164.2-50.4175.9000114.3
942T30Very low32Very low118 Ų118127.4 Ų127.472%0.72476%0.762SS**  78.394.566.6-58.80000114.8
943V29.6Very low31.9Very low133 Ų133127.4 Ų127.481%0.80676%0.763SS**  trans65.1164.9135.5178.40000117.3
944P42.2Very low32.2Very low101 Ų101128.8 Ų128.866%0.65676%0.763SS**  cis-116.3-177.2-26.432.1-14.7000113.8
945S33Very low32.2Very low120 Ų120128 Ų12884%0.83976%0.76SS**  trans61.8156.5151.656.30000119.5
946G31.6Very low32.4Very low65 Ų65127.1 Ų127.167%0.6776%0.764SS**  cis170.1138.1-9.600000112.7
947E30.8Very low32.4Very low186 Ų186127.1 Ų127.187%0.86978%0.777SS**  trans65.3155.8165.1-50.5-167.6142.600120.2
948C31Very low32.7Very low118 Ų118127.8 Ų127.880%0.79778%0.78SS**  trans68141.6162.5-64.70000117.3
949I33.4Very low32.5Very low162 Ų162127.5 Ų127.583%0.83179%0.785SS**  cis-137.8155.10.4-53.5175000108.9
950S26.7Very low32.2Very low100 Ų100122.4 Ų122.470%0.69978%0.778SS**  trans-66.4145.8172.9176.20000114.8
951L32.5Very low31.9Very low167 Ų167125.4 Ų125.487%0.87478%0.777SS**  trans-165.1155.1130.1-104.2163.9000112.5
952T32.2Very low31.8Very low131 Ų131124.7 Ų124.780%0.80477%0.774SS**  trans-79.4145.6-160.849.10000117.3
953G30.5Very low31.9Very low69 Ų69124.4 Ų124.471%0.71177%0.769SS**  trans164.3139.5149.600000119.2
954I31.1Very low32.4Very low160 Ų160124.6 Ų124.682%0.82176%0.764SS**  trans79.5111.7148.3-58177.4000120.6
955L32.3Very low31.8Very low147 Ų147125.9 Ų125.977%0.7777%0.765SS**  trans25.1135.3142.4-69.3109.3000124.2
956S32.4Very low31.8Very low118 Ų118126 Ų12683%0.82576%0.756SS**  trans64.9142.3132.1-61.60000122
957G32.5Very low31.7Very low77 Ų77128.6 Ų128.679%0.79476%0.755SS**  trans161.9109.1157.100000115.4
958N30.9Very low32.1Very low159 Ų159124.8 Ų124.885%0.8575%0.748SS**  trans-74.6157.1158.5-69.2-14.8000109.6
959V32.1Very low31.9Very low140 Ų140126.3 Ų126.385%0.84875%0.749SS**  174.7159.5111.6153.20000109.8
960A29.8Very low31.7Very low79 Ų79124.2 Ų124.265%0.65375%0.749SS**  trans-62.7-174.8176.800000112.3
961N30.8Very low32Very low132 Ų132123.5 Ų123.571%0.70675%0.749SS**  178.3169.754.5-146.6-7.2000112
962L33.3Very low31.7Very low136 Ų136124.4 Ų124.471%0.71275%0.748SS**  trans69.5147.4149.8-75.4166.8000117.7
963N30.6Very low31.7Very low113 Ų113125.9 Ų125.960%0.60475%0.751SS**  cis-166.7179.7-5.4-170.614000110.2
964I40.9Very low32Very low137 Ų137125.8 Ų125.870%0.70375%0.749SS**  trans75.595.3161.8-50179.8000112.4
965N29.3Very low32.1Very low128 Ų128126.8 Ų126.868%0.68475%0.75SS**  61.4157.454.4-53.7-25.8000112.2
966N32.3Very low32.2Very low121 Ų121125.7 Ų125.765%0.64775%0.75SS**  cis-160.6165.715.3-146.81.3000111.3
967N31.1Very low32.3Very low121 Ų121126 Ų12665%0.64775%0.747SS**  trans65.6167.7159.9-52.1-29.6000115.2
968S37.9Very low32.5Very low105 Ų105129.2 Ų129.273%0.73475%0.75SS**  cis-136.4136.58.5-51.10000113.7
969N28.2Very low32.6Very low150 Ų150124.8 Ų124.880%0.80274%0.742SS**  trans-8.5126.5139.4-43.8-27.9000115.2
970S28.5Very low32.5Very low119 Ų119125.9 Ų125.983%0.83274%0.743SS**  trans-91.8117143.946.90000109.6
971A32.9Very low33Very low85 Ų85127.3 Ų127.370%0.70275%0.746SS**  trans43.699150.400000119.3
972Q26.4Very low33.1Very low185 Ų185125.8 Ų125.886%0.86475%0.751SS**SBendtrans-73.1149.3130.4-166.5173.81400108
973L31.8Very low33.1Very low163 Ų163126.9 Ų126.985%0.85376%0.757SS**SBendtrans81.1123.1-176.2-47.8173.9000115.7
974G37.1Very low33.2Very low66 Ų66128.2 Ų128.268%0.6876%0.763SS**SBendtrans116.395.1166.300000116
975H33.3Very low32.9Very low182 Ų182128.7 Ų128.784%0.84377%0.767SS**SBendtrans68.583.4161.8-54-79.1000120.2
976T34.6Very low32.8Very low124 Ų124131.8 Ų131.876%0.76178%0.775SS**  69.896.6121.9-43.10000121.9
977V34.2Very low32.8Very low125 Ų125133.6 Ų133.676%0.75878%0.782SS**  trans79.1112.8132.9175.10000121.8
978V35.9Very low32.8Very low144 Ų144133 Ų13387%0.87379%0.788SS**  trans57145142.4179.40000119.4
979G32.9Very low32.4Very low66 Ų66131.7 Ų131.768%0.6878%0.783SS**  cis156.9142-6.800000112.9
980N30.9Very low32.5Very low162 Ų162132 Ų13287%0.86679%0.785SS**  trans4.8157.9165.3-90-0.6000122.9
981P39.9Very low32.8Very low110 Ų110136.2 Ų136.271%0.71479%0.788SS**  cis-146.8-166-34.442.1-22.1000115
982A33.4Very low32.5Very low99 Ų99137.4 Ų137.482%0.81879%0.792SS**  trans85.5162.8151.900000121.5
983L33.2Very low33.1Very low159 Ų159133.8 Ų133.883%0.83278%0.784SS**  trans-114.6137-152.1-66.2162.3000115.2
984I33.3Very low33.1Very low142 Ų142131.6 Ų131.673%0.72878%0.777SS**  18.1129.8113.8-63.1168.6000115.7
985N32.9Very low32.8Very low146 Ų146137.3 Ų137.378%0.78179%0.786SS**  cis-161.2168.40.1-119.5-0.4000111.6
986F27.4Very low32.6Very low194 Ų194133.9 Ų133.985%0.85178%0.783SS**  trans-77.2166.9161.8-69-108.8000110
987I32.7Very low32.5Very low158 Ų158133 Ų13381%0.8178%0.782SS**  -165.2125.250.9-70.6172.8000105.7
988S30.8Very low32.4Very low110 Ų110132.8 Ų132.877%0.76978%0.78SS**  97.2110.971.4-153.40000117.1
989A30.8Very low32Very low76 Ų76132.7 Ų132.763%0.62878%0.78SS**  trans44.5123.1150.400000124.1
990N29.1Very low31.8Very low156 Ų156137 Ų13783%0.83479%0.787SS**  176.7162.395.8-103.2-63.2000117.8
991K34.4Very low31.6Very low209 Ų209135.1 Ų135.191%0.90979%0.786SS**  trans74.9157.6164.2-78-178.3176.9177.60120.8
992S27.2Very low31.3Very low110 Ų110135.4 Ų135.477%0.76979%0.791SS**  trans-147.4-176.6-168.2-147.30000107.2
993P39.6Very low31Very low109 Ų109137 Ų13771%0.70879%0.791SS**  cis-140.5-156.13.336.5-11.8000115.1
994V32.5Very low30.8Very low116 Ų116135.7 Ų135.770%0.70379%0.785SS**  trans108.5113.2156.5-1750000117.5
995Q29.8Very low30.4Very low186 Ų186133.8 Ų133.887%0.86979%0.79SS**  trans35.8132.4149.2-58.3175.113.500119.6
996S30.1Very low30.2Very low111 Ų111133.3 Ų133.378%0.77679%0.792SS**  cis-155.8159.419.457.40000109.6
997S32.5Very low30.3Very low105 Ų105135.2 Ų135.273%0.73479%0.794SS**  177.916168.547.50000112.6
998V31.3Very low30.1Very low120 Ų120135.9 Ų135.973%0.72780%0.798SS**  trans25.2105.8158-171.10000118.9L1000V998-L1000 HydrophobicContact CG1-CD2 4.18Å; V998-L1000 HydrophobicContact CG1-CG 4.06Å
999T26.5Very low30.1Very low142 Ų142137.5 Ų137.587%0.87180%0.797SS**PPolyproline II helixtrans-72.7127.7151.4510000110.5
1000L29.8Very low30.1Very low158 Ų158140.3 Ų140.383%0.82781%0.807SS**PPolyproline II helixtrans-103.2125.5161.5-76.3-179.8000110.6V998V998-L1000 HydrophobicContact CG1-CD2 4.18Å; V998-L1000 HydrophobicContact CG1-CG 4.06Å
1001S26.8Very low30.1Very low122 Ų122141 Ų14185%0.85381%0.811SS**PPolyproline II helixtrans-81.4127.4171.654.80000110.9
1002S33.3Very low29.9Very low116 Ų116139.6 Ų139.681%0.81181%0.812SS**  trans-131.510816550.70000111.9N1004S1002-N1004 PolarHBondContact O-N 3.08Å
1003T26.6Very low30.2Very low132 Ų132138.5 Ų138.581%0.8181%0.81SS**  trans-54.6117.3157.6-53.60000109
1004N28.5Very low29.9Very low132 Ų132140.1 Ų140.171%0.70682%0.818SS**  trans164.878.3147.6-84.7-20.1000111.2S1002S1002-N1004 PolarHBondContact O-N 3.08Å
1005A25.9Very low29.8Very low102 Ų102139.7 Ų139.784%0.84382%0.82SS**  trans-117.627.3-17900000114
1006T29.7Very low30Very low135 Ų135137.6 Ų137.683%0.82882%0.82SS**SBendtrans-144.156.7179.346.30000113.3
1007R28Very low30.1Very low234 Ų234138.6 Ų138.688%0.88382%0.822SS**  trans-162.753.9164.3-118.4175.6-158.4-781.3115.8
1008L28.7Very low30.1Very low173 Ų173136.6 Ų136.691%0.90682%0.818SS**SBendtrans-147.572.7164.9-100.7-178.9000111.6
1009L30.5Very low30.1Very low143 Ų143136.9 Ų136.975%0.74982%0.82SS**SBendtrans-167.948.7158.3-113.3-178.3000113.3L430L430-L1009 HydrophobicContact CD1-CD1 3.71Å; L430-L1009 HydrophobicContact CD1-CG 4.5Å
1010T31.3Very low30.4Very low136 Ų136136.6 Ų136.683%0.83481%0.813SS**  trans-154.186.9166.7-27.10000111.3
1011N29.8Very low30.3Very low169 Ų169137.4 Ų137.490%0.90482%0.817SS**  trans-177.564.3154-99.5-9.2000110.6
1012L29.8Very low30.3Very low180 Ų180140.2 Ų140.294%0.94282%0.822SS**  trans-153.481.9159.8-168.165.1000111.6
1013A33.6Very low30.1Very low87 Ų87139.2 Ų139.272%0.71982%0.815SS**  trans-152.7144.6157.700000108.8
1014T32.3Very low30.2Very low144 Ų144140.1 Ų140.188%0.88381%0.814SS**  trans59.788.5177.366.70000118.2
1015S30.6Very low30.3Very low106 Ų106139.6 Ų139.674%0.74182%0.818SS**  trans-152.9106130.4-172.70000110.2
1016T33.5Very low30.6Very low143 Ų143141.7 Ų141.788%0.87782%0.815SS**  trans-109.564.8177.847.40000111.4
1017T33.7Very low30.7Very low132 Ų132143.1 Ų143.181%0.8182%0.817SS**  trans-163140159.738.60000108.1
1018G32.1Very low30.9Very low63 Ų63135.3 Ų135.365%0.64981%0.809SS**  cis172.8118.3-9.900000110.2
1019T32Very low30.9Very low125 Ų125133 Ų13377%0.76780%0.803SS**  trans48.9115.2166.958.70000118.7
1020N31.7Very low31Very low136 Ų136134.3 Ų134.373%0.72781%0.809SS**  16489.5107.6-83.3-46.8000113.1
1021L27.4Very low31.1Very low175 Ų175131.3 Ų131.392%0.91681%0.805SS**SBendtrans-143.489152.3-80.4-176.4000108.6
1022L27.6Very low31.2Very low181 Ų181130.3 Ų130.395%0.94880%0.8SS**  trans158.389.2154.6-89.8165.1000109.3
1023S28.3Very low31.2Very low95 Ų95128.5 Ų128.566%0.66479%0.791SS**  trans-145149.8167.4600000110.1
1024L28.5Very low31.1Very low152 Ų152130.7 Ų130.780%0.79680%0.795SS**  trans74.681.8-177.8-72.367.5000117.3
1025P31.1Very low30.8Very low121 Ų121131.2 Ų131.279%0.78679%0.793SS**  -8994.9126.433.3-24000109.5
1026N32.8Very low30.9Very low146 Ų146134.2 Ų134.278%0.78180%0.799SS**  trans-172.6120.7154.1-108.5-29.2000113.9
1027N31Very low30.5Very low164 Ų164133.9 Ų133.988%0.87780%0.801SS**  trans59150.8140.5-151.48.5000120.5
1028G32.3Very low30.3Very low70 Ų70130.3 Ų130.372%0.72279%0.791SS**  trans123.366.7168.700000116.5
1029T28.9Very low30.2Very low126 Ų126132.3 Ų132.377%0.77380%0.795SS**  trans-77.3153.8165.5-29.10000111
1030I32.4Very low30.2Very low170 Ų170132.6 Ų132.687%0.87280%0.796SS**  trans76.1126.6166.4-50.7162.3000115.9
1031G33.2Very low30.4Very low73 Ų73133.1 Ų133.175%0.75380%0.798SS**  trans165.6107.916700000114.2
1032N32.9Very low30.6Very low148 Ų148132.4 Ų132.479%0.79179%0.794SS**  trans-75.5161.2-176.2-64.3-42.9000114.5
1033N28.7Very low31Very low142 Ų142127.2 Ų127.276%0.75979%0.785SS**  trans9.1143.5138.1-47.8-30.6000117.7
1034T31.2Very low31.1Very low132 Ų132126.8 Ų126.881%0.8179%0.787SS**  cis-167174.440-290000111.3
1035N27.4Very low31.3Very low156 Ų156125.8 Ų125.883%0.83479%0.788SS**  trans-54.3143.2171.1-68.6-58.6000114.4
1036I31.5Very low31.2Very low168 Ų168127.3 Ų127.386%0.86279%0.789SS**  trans-151.3138.9140-100.6152000107.9
1037C26.5Very low30.9Very low136 Ų136128.1 Ų128.192%0.91979%0.792SS**  trans-109.2130.9170178.20000108.3
1038G29.5Very low31.2Very low58 Ų58125.6 Ų125.660%0.59878%0.784SS**  trans-170.790.8-174.100000116
1039S28.5Very low31Very low105 Ų105128.4 Ų128.473%0.73479%0.793SS**  trans59.3146.8147.456.80000121.7
1040T32.1Very low31.1Very low130 Ų130125.7 Ų125.780%0.79879%0.79SS**  trans65.1145.9166.344.50000117.2
1041L35.5Very low31.2Very low148 Ų148121.7 Ų121.778%0.77578%0.782SS**  cis-137.5169.83.2-161.563.5000111.9
1042L31.8Very low31.1Very low159 Ų159125.3 Ų125.383%0.83278%0.783SS**  trans-57.9166.1-179.7-68.265.2000115.4
1043G36.1Very low30.8Very low72 Ų72123.1 Ų123.174%0.74278%0.779SS**  trans129.482.1164.400000112.2
1044A30.7Very low30.9Very low87 Ų87124 Ų12472%0.71978%0.783SS**  cis65124.83500000113.9
1045T32.9Very low30.6Very low131 Ų131125 Ų12580%0.80478%0.782SS**  trans65135.7-176.476.70000115.1
1046N29.3Very low31.1Very low152 Ų152123.4 Ų123.481%0.81377%0.774SS**  cis-129.5139.68.9-78.2-61.1000114.1
1047I26.3Very low31.1Very low164 Ų164120.7 Ų120.784%0.84177%0.767SS**  trans-140143.2149.2-47.6173.2000105.1
1048P38Very low31.4Very low110 Ų110121.3 Ų121.371%0.71476%0.756SS**  cis-117.3178.1-37.738.6-25.2000110.9
1049S28.3Very low31.7Very low129 Ų129126.3 Ų126.390%0.90276%0.764SS**  trans-170.9153.1151.7-86.80000111.4
1050G30.7Very low31.6Very low69 Ų69125.8 Ų125.871%0.71177%0.766SS**  trans105.688.6-169.700000110.1
1051A33.9Very low31.7Very low86 Ų86127.5 Ų127.571%0.71177%0.769SS**  58.38293.600000110
1052I31.1Very low31.6Very low150 Ų150129.2 Ų129.277%0.76977%0.771SS**  56132.958.8-40156.4000110.6
1053S26.5Very low31.5Very low102 Ų102125.5 Ų125.571%0.71376%0.763SS**SBendtrans-49.9144.3163.1-48.20000111.7L1055S1053-L1055 PolarHBondContact O-N 2.72Å
1054L30.3Very low31.3Very low160 Ų160126.8 Ų126.884%0.83877%0.767SS**  trans48.360.5136.2-158.673.7000116.3
1055L26.1Very low31.3Very low153 Ų153127.8 Ų127.880%0.80178%0.775SS**  trans-104.783.2137-81.287000107.5S1053S1053-L1055 PolarHBondContact O-N 2.72Å
1056D37.6Very low31.2Very low122 Ų122125.9 Ų125.965%0.65277%0.773SS**  trans-91.6118.6152.9177.68.9000107.5H1058D1056-H1058 PolarHBondContact OD1-N 3.2Å; D1056-H1058 VanDerWaalsContact OD1-N 3.16Å
1057P31Very low31.2Very low112 Ų112123.6 Ų123.673%0.72778%0.775SS**  trans-119.644.1177.240-26.5000112.8
1058H33.3Very low31.4Very low148 Ų148120.6 Ų120.669%0.68577%0.774SS**  trans-90.1102.2166.8-94.8-96.7000113.5D1056D1056-H1058 PolarHBondContact OD1-N 3.2Å; D1056-H1058 VanDerWaalsContact OD1-N 3.16Å
1059Q36.1Very low31Very low164 Ų164120 Ų12077%0.76678%0.779SS**  trans61.5105.2148.2-58.3168.221.300116.4
1060A27Very low31.1Very low93 Ų93117.4 Ų117.477%0.76977%0.765SS**  cis70.787.527.600000116
1061L34Very low31.2Very low166 Ų166122.3 Ų122.387%0.86977%0.769SS**  trans-171.8146159.5-123.466.7000105.8
1062F33.8Very low31.1Very low185 Ų185124 Ų12481%0.81177%0.767SS**  cis-159116.7-6.5-156.5-116.1000105.7
1063A28.3Very low31.2Very low81 Ų81121 Ų12167%0.66975%0.751SS**  81.4101.274.500000116.6
1064A31.7Very low31.5Very low99 Ų99120.5 Ų120.582%0.81874%0.738SS**  trans-162.7100.6155.100000107.9
1065A30.5Very low31.8Very low107 Ų107121.8 Ų121.888%0.88474%0.736SS**  76.6133.47400000113
1066A30.9Very low32.3Very low92 Ų92120 Ų12076%0.7673%0.734SS**  cis-137.6140.49.600000110.3
1067A29.9Very low31.9Very low104 Ų104117.7 Ų117.786%0.8674%0.739SS**  72.8146.875.900000114
1068A29.8Very low31.8Very low100 Ų100115.8 Ų115.883%0.82674%0.74SS**  cis-148.5-176.94.800000109.3
1069A31Very low31.6Very low99 Ų99114.7 Ų114.782%0.81874%0.743SS**  cis-153.2177.8-1.300000107
1070A30.6Very low31.2Very low74 Ų74113.4 Ų113.461%0.61274%0.742SS**  cis-151.9157.13.500000108.5
1071Q32Very low31.3Very low171 Ų171116.3 Ų116.380%0.79974%0.744SS**  51.8139.7105.5-57.4-177.725.200117
1072N32Very low31.1Very low122 Ų122112 Ų11265%0.65273%0.732SS**  cis-168.4155.9-3.9-117.1-20.3000112.7
1073I33.1Very low31Very low87 Ų87110 Ų11045%0.44673%0.729SS.*  trans66.6106137.2-68.1170.3000122.1N77N77-I1073 HydrophobicContact CB-CG2 4.48Å; N77-I1073 WeakPolarHBondContact OD1-CG2 3.38Å; N77-I1073 PolarHBondContact OD1-O 3.11Å
1074Q32.8Very low31.2Very low91 Ų91112.1 Ų112.143%0.42573%0.729SS.*  71.9167.4124-65.2174.9-116.700127.3V76 N77V76-Q1074 VanDerWaalsContact C-NE2 3.34Å; V76-Q1074 PolarHBondContact O-OE1 3.03Å; N77-Q1074 HydrophobicContact CB-CB 3.62Å; N77-Q1074 VanDerWaalsContact CG-C 3.46Å; N77-Q1074 VanDerWaalsContact CG-CB 3.48Å; N77-Q1074 PolarHBondContact ND2-O 3.45Å; N77-Q1074 VanDerWaalsContact OD1-C 3.31Å; N77-Q1074 WeakPolarHBondContact OD1-CA 3.41Å; N77-Q1074 WeakPolarHBondContact OD1-CB 3.18Å; N77-Q1074 PolarHBondContact OD1-O 3.48Å
1075K37.3Very low31.4Very low187 Ų187114.3 Ų114.381%0.81372%0.722SS**  trans-97.9155.6178.1-75.9179.9174.6177.30111.7N77N77-K1075 VanDerWaalsContact CB-O 3.24Å; N77-K1075 WeakPolarHBondContact CB-O 3.4Å; N77-K1075 PolarHBondContact ND2-O 2.65Å; N77-K1075 VanDerWaalsContact ND2-O 3.1Å
1076P35.4Very low31.5Very low117 Ų117115.3 Ų115.376%0.7671%0.711SS**  -157.8-178.677.144.1-23.7000118.3N77N77-P1076 WeakPolarHBondContact ND2-CD 3.39Å
1077G29.6Very low31.4Very low73 Ų73115.3 Ų115.375%0.75371%0.711SS**  trans88141.5164.200000115.8
1078G28.9Very low31.3Very low72 Ų72117.7 Ų117.774%0.74271%0.708SS**  cis82.7151.5-300000115
1079V28.7Very low31.6Very low124 Ų124117 Ų11775%0.75270%0.702SS**  cis-155.2131.110.2174.40000111.7
1080N29.1Very low31.5Very low137 Ų137118.7 Ų118.773%0.73370%0.698SS**  trans64.2163.3153.7-64.7-3.1000123.7
1081N28.7Very low31.5Very low155 Ų155122 Ų12283%0.82971%0.705SS**  trans83.2132.7152.6-69.2-15.3000118.9
1082A29.2Very low31.6Very low74 Ų74122.8 Ų122.861%0.61271%0.706SS**  cis-167-172.9-14.800000110.1
1083I31.8Very low31.5Very low145 Ų145123.5 Ų123.574%0.74471%0.709SS**  trans74.9126.5145.5-73160.5000117.8
1084N32.2Very low31.6Very low124 Ų124124.7 Ų124.766%0.66373%0.725SS**  trans74.7128.7151.5-75.9-9.8000123.2
1085Q35.1Very low31.5Very low145 Ų145126.4 Ų126.468%0.67874%0.737SS**  76.9149.4128.1-70.6178.462.200121.1
1086I34.4Very low31.3Very low129 Ų129122.7 Ų122.766%0.66273%0.73SS**  trans5399144.9-64.3165.4000114.4
1087A28.2Very low31.3Very low91 Ų91124.6 Ų124.675%0.75273%0.734SS**  cis56.1109.638.200000113.7
1088L28.1Very low31.5Very low154 Ų154124.7 Ų124.781%0.80673%0.734SS**  trans68.5151.6-165.7-83.463.1000113.7
1089A36.2Very low31.7Very low85 Ų85132.9 Ų132.970%0.70274%0.743SS**  cis-135.3145-0.700000109.8
1090N29.1Very low31.7Very low135 Ų135134.5 Ų134.572%0.72274%0.742SS**  61.4103.458.6-87.5-25.9000115
1091L29.2Very low31.8Very low145 Ų145135 Ų13576%0.75974%0.744SS**  159.9107.6116-87.1158000115.9L1093L1091-L1093 HydrophobicContact CD2-CB 4.22Å; L1091-L1093 HydrophobicContact CD2-CD2 3.95Å
1092K34.8Very low32Very low187 Ų187130.2 Ų130.281%0.81373%0.731SS**  trans-176.4107.4144-111.3178.2178.61790106.1
1093L29.3Very low32.1Very low137 Ų137132.9 Ų132.972%0.71774%0.74SS**  cis75.667.215.3-145.683.3000116.2L1091L1091-L1093 HydrophobicContact CD2-CB 4.22Å; L1091-L1093 HydrophobicContact CD2-CD2 3.95Å
1094S35.8Very low32Very low112 Ų112132.1 Ų132.178%0.78374%0.743SS**  -123.5123.9129-158.30000104.8
1095N31.3Very low31.9Very low126 Ų126130.8 Ų130.867%0.67475%0.749SS**  cis72.8133.932.7-154.813.6000113.8
1096T33.3Very low31.7Very low110 Ų110129.4 Ų129.468%0.67575%0.752SS**  trans53.3128-173.861.20000116.1
1097N34.8Very low31.5Very low156 Ų156129.6 Ų129.683%0.83476%0.759SS**  cis-124.4166.711.5-72.4-65.6000112.9
1098G32.9Very low31.7Very low75 Ų75133.1 Ų133.177%0.77376%0.764SS**  trans-65.3172.1-178.800000114.4
1099R33.5Very low31.8Very low244 Ų244128.9 Ų128.992%0.92176%0.758SS**  cis-157.1152.640.2-102.3-176.5-171.4-160.23.2108.9
1100H29.6Very low31.8Very low158 Ų158132.8 Ų132.873%0.73177%0.766SS**  cis60.598.633.1-152.1-96.6000113
1101L30.9Very low31.9Very low147 Ų147133.4 Ų133.477%0.7777%0.768SS**  cis-166.9164.53218062.8000109.8
1102G32.2Very low32.1Very low55 Ų55129.9 Ų129.957%0.56775%0.75SS**  trans136.390.3154.500000118.7
1103T31.2Very low32.4Very low130 Ų130124.3 Ų124.380%0.79873%0.733SS**  28.6131.1118.654.70000120.1
1104T30.3Very low32.4Very low130 Ų130125.6 Ų125.680%0.79873%0.728SS**  cis-153.5152.56.444.20000113.9
1105A30.2Very low32.6Very low95 Ų95124.5 Ų124.579%0.78572%0.717SS**  trans58.4102.714700000121.1
1106P30.1Very low32.7Very low116 Ų116120.6 Ų120.675%0.75371%0.706SS**  trans-117.2176.3153.738.1-26.9000113.1
1107V30.3Very low33Very low134 Ų134120.4 Ų120.481%0.81270%0.701SS**  trans65.6139.5174.6-127.40000113.2
1108I32.2Very low33.1Very low164 Ų164122 Ų12284%0.84170%0.704SS**  cis-141.7137.925.3-58.7159000111.8
1109G31.1Very low33.4Very low66 Ų66126 Ų12668%0.6871%0.706SS**  trans83.2148.2153.900000117
1110L35.5Very low33.3Very low166 Ų166126.3 Ų126.387%0.86971%0.707SS**  cis-143.5144.7-7.4-149.476000110.3
1111L31.7Very low33.5Very low148 Ų148124 Ų12478%0.77570%0.704SS**  trans-70.4151.3164.4-61.688.4000109.7
1112D32.4Very low33.5Very low72 Ų72121.7 Ų121.739%0.38571%0.706SS.*  -154.8140.1107.4-168.866.4000111.4L376L376-D1112 HydrophobicContact CD1-CB 3.81Å; L376-D1112 WeakPolarHBondContact CD1-OD1 3.48Å; L376-D1112 HydrophobicContact CD2-CB 4.41Å; L376-D1112 VanDerWaalsContact CD2-CG 3.44Å; L376-D1112 WeakPolarHBondContact CD2-OD2 3.39Å; L376-D1112 HydrophobicContact CG-CB 3.72Å; L376-D1112 WeakPolarHBondContact CG-OD2 3.36Å
1113P41.3Very low33.3Very low70 Ų70125.8 Ų125.846%0.45572%0.715SS.*  trans-105.4155177.538.3-30.2000113
1114R30Very low33.4Very low163 Ų163126.1 Ų126.162%0.61572%0.717SS**  trans-143.665.8140.5-113.2152.7-171173.82.8110.5P314P314-R1114 WeakPolarHBondContact CD-O 3.42Å
1115T40.4Very low33.3Very low89 Ų89124.2 Ų124.255%0.54671%0.709SS.*  trans-132.9110.2176.255.70000107.5L312 I313 P314L312-T1115 CarbonylContact O-C 3.55Å; L312-T1115 VanDerWaalsContact O-CA 3.3Å; L312-T1115 WeakPolarHBondContact O-CA 3.26Å; L312-T1115 VanDerWaalsContact O-CB 3.31Å; L312-T1115 WeakPolarHBondContact O-CB 3.29Å; I313-T1115 HydrophobicContact CG1-CG2 4.23Å; P314-T1115 VanDerWaalsContact CD-CA 3.47Å
1116G33.7Very low33.5Very low44 Ų44125.5 Ų125.545%0.45471%0.707SS.*  trans-162.480.5-172.700000112.6L312 I313 Q1118L312-G1116 WeakPolarHBondContact O-CA 3.43Å; L312-G1116 PolarHBondContact O-N 3.26Å; I313-G1116 CarbonylContact O-C 2.86Å; I313-G1116 VanDerWaalsContact O-C 3.28Å; I313-G1116 PolarHBondContact O-N 3.35Å; G1116-Q1118 PolarHBondContact O-N 2.8Å
1117L38Very low33.6Very low107 Ų107125.4 Ų125.456%0.5671%0.705SS**  trans-89.786.7173.2-114.7167.4000109.8L312 I313L312-L1117 HydrophobicContact CB-CB 4.12Å; L312-L1117 HydrophobicContact CB-CD1 3.98Å; L312-L1117 HydrophobicContact CD1-CD1 4.12Å; L312-L1117 HydrophobicContact CD2-CD1 4.41Å; L312-L1117 HydrophobicContact CG-CD1 4.39Å; L312-L1117 PolarHBondContact O-N 3.19Å; I313-L1117 WeakPolarHBondContact O-CB 3.47Å; I313-L1117 WeakPolarHBondContact O-CG 3.35Å; I313-L1117 PolarHBondContact O-N 3.01Å; I313-L1117 VanDerWaalsContact O-N 3.1Å
1118Q37.9Very low33.5Very low190 Ų190125.1 Ų125.189%0.88870%0.703SS**  trans-89.6108.7168.3-73.6-167.43.500110.6G1116G1116-Q1118 PolarHBondContact O-N 2.8Å
1119L38.5Very low33.4Very low157 Ų157123 Ų12382%0.82270%0.704SS**PPolyproline II helixtrans-69.8136.8157.1-72.2166.7000108.4V1121L1119-V1121 PolarHBondContact O-N 2.95Å
1120R32.3Very low33.3Very low251 Ų251123.7 Ų123.795%0.94770%0.703SS**PPolyproline II helixtrans-65.6131168.4-98.8-174.3175.3164.60.7109.6
1121V33.3Very low33Very low111 Ų111123.3 Ų123.367%0.67370%0.7SS**PPolyproline II helixtrans-63146.9170.81740000109.9L1119L1119-V1121 PolarHBondContact O-N 2.95Å
1122A31.6Very low33.7Very low98 Ų98121.2 Ų121.281%0.8170%0.695SS**  trans-109.3115.5154.900000106.9
1123D27.4Very low33.6Very low141 Ų141123.3 Ų123.375%0.75471%0.711SS**  trans-75.9137.3-170.5-58.4-76.9000112.9
1124T32.4Very low33.2Very low137 Ų137124 Ų12484%0.8472%0.717SS**  trans-179.2134.5147.216.90000109
1125S30Very low33.3Very low89 Ų89123.4 Ų123.462%0.62273%0.726SS**  cis-169.7171.3-17.849.80000109.4
1126T32.9Very low32.9Very low122 Ų122125.8 Ų125.875%0.74874%0.735SS**  trans65.6142.5156.355.50000118.5
1127T32.8Very low32.7Very low115 Ų115128.9 Ų128.971%0.70675%0.745SS**  cis-160.6141-4.88.20000112.6
1128T28.6Very low32.3Very low127 Ų127130.1 Ų130.178%0.77975%0.752SS**  trans28.9134.9144.457.50000123
1129S28.6Very low31.9Very low121 Ų121126.2 Ų126.285%0.84675%0.745SS**  trans-95.8142.513851.20000110.4
1130A29.2Very low31.5Very low80 Ų80126.2 Ų126.266%0.66175%0.745SS**  trans-100.7-167.9-17900000112.1
1131I30.8Very low31.4Very low158 Ų158120.3 Ų120.381%0.8173%0.732SS**  160.9147.1122.4-83.1156.4000109.6
1132P44.6Very low31.2Very low104 Ų104120.7 Ų120.768%0.67573%0.73SS**  cis-90.2-124.1-10.615.53.9000110.9
1133T31.5Very low31Very low116 Ų116122.1 Ų122.171%0.71272%0.724SS**  cis-170.6150-0.5-8.50000106.9
1134S32.3Very low31.1Very low85 Ų85125.5 Ų125.559%0.59473%0.728SS**  cis-173.7147.6-28.155.40000109.3
1135N31.5Very low30.9Very low149 Ų149123 Ų12380%0.79772%0.716SS**  trans68.2148.7167.4-58.8-5.7000116
1136L32.1Very low30.8Very low140 Ų140127 Ų12773%0.73373%0.725SS**  cis-151.7142.413.6-132.5154.4000112.1
1137T30.6Very low30.7Very low109 Ų109126.2 Ų126.267%0.66972%0.724SS**  trans72.7143.1154.723.80000124.7
1138D29.4Very low30.5Very low132 Ų132124.6 Ų124.671%0.70672%0.718SS**  trans85.374.1144.3-58.5-25.2000125.4
1139C28.4Very low30.8Very low108 Ų108125.4 Ų125.473%0.7372%0.717SS**  57.6134.4100.2-61.90000124.1
1140L31.2Very low30.9Very low158 Ų158126 Ų12683%0.82771%0.711SS**  trans8695146.9-67.1166.5000122.9
1141N31.1Very low31.1Very low127 Ų127129.1 Ų129.168%0.67971%0.712SS**  61118.6103.7-153.438000122.8
1142N28.9Very low31.2Very low118 Ų118128.1 Ų128.163%0.63170%0.703SS**  trans73.6116.2142.3-83.1-15.1000124.6
1143N27.6Very low30.6Very low129 Ų129130.1 Ų130.169%0.6971%0.706SS**  trans79.2160.4132.9-61.6-36.7000123
1144Y27.9Very low30.4Very low211 Ų211131.8 Ų131.883%0.82771%0.705SS**  trans79.289.7164.2-79.2-86000121.6
1145S27.9Very low30.5Very low85 Ų85136.6 Ų136.659%0.59472%0.716SS**  83.8125.4105.6-70.50000125.5
1146H29Very low30.3Very low173 Ų173137.2 Ų137.280%0.80171%0.714SS**  trans76.8133.1131.4-80.9-72.6000124.1
1147S30Very low30.2Very low105 Ų105136.9 Ų136.973%0.73471%0.711SS**  trans71.5155143.4-90.40000119.7
1148S29.6Very low30Very low82 Ų82137.6 Ų137.657%0.57371%0.711SS**  cis-166158.4-14.5-1250000112.1
1149D33.6Very low30Very low143 Ų143138.8 Ų138.877%0.76571%0.712SS**  trans62.5161.3150.6-38.6-21.6000118.4
1150N31.4Very low30Very low135 Ų135138 Ų13872%0.72271%0.708SS**  cis-149.6168.34.3-156.19.2000113.9
1151E33.2Very low29.7Very low145 Ų145137.7 Ų137.768%0.67871%0.707SS**  trans70.5146.6163.3-73.6-171.9-118.800118.1
1152Q33.7Very low29.7Very low136 Ų136142.2 Ų142.264%0.63672%0.715SS**  cis-139.5153.6-13.3-102-171.754.600107
1153M31.9Very low29.5Very low147 Ų147143.3 Ų143.372%0.72472%0.718SS**  cis78134.446.8-157.8178.869.400113.9
1154E26.8Very low29.4Very low150 Ų150142.5 Ų142.570%0.70172%0.718SS**  cis-169.7176.2-29-177.1164.5-151.500108.1
1155K34.2Very low29.7Very low187 Ų187138.4 Ų138.481%0.81372%0.715SS**  trans88.4113.5170.9-54.3175.8-176.9176.30114.8
1156Q26.8Very low29.4Very low161 Ų161140.4 Ų140.475%0.75272%0.719SS**  cis88.1143.621.9-153.4-163.468.900115
1157I31.5Very low29.4Very low133 Ų133140.1 Ų140.168%0.68272%0.718SS**  trans101.4105.7162.3-56.3-179000118.7
1158N27Very low29.6Very low124 Ų124141.1 Ų141.166%0.66372%0.72SS**  trans66.5131.9136.7-7324.4000127.7
1159E28.4Very low29.4Very low158 Ų158143.9 Ų143.974%0.73873%0.728SS**  82.4109.9123.9-70.6175.4126.300124.7
1160S28.1Very low29.5Very low92 Ų92145.2 Ų145.264%0.64373%0.734SS**  78.9122.4113.7-58.80000123.1
1161N25.9Very low29.1Very low151 Ų151145.5 Ų145.581%0.80774%0.736SS**  trans50.8104.5134.5-60.7-19.3000120.4
1162R29.5Very low29.1Very low221 Ų221147 Ų14783%0.83474%0.743SS**  -178.1152.8121.4-95.6174.890.9-128.71.1108.2
1163M25.6Very low28.9Very low142 Ų142145.8 Ų145.870%0.775%0.745SS**  cis129.3132.73.4176.9178.8-173.600107.9
1164T26.3Very low28.7Very low112 Ų112145.5 Ų145.569%0.68775%0.746SS**  trans61.5153.5172.747.80000116.7
1165T32.6Very low28.9Very low124 Ų124147.9 Ų147.976%0.76176%0.757SS**  cis-117.9162.6-2.152.10000110.1
1166N23Very low28.6Very low128 Ų128145.5 Ų145.568%0.68475%0.753SS**  cis70.9136.844.6-95.345.1000115.8
1167E28.7Very low28.8Very low167 Ų167146.9 Ų146.978%0.7876%0.759SS**  trans68.8151.5168.5-70.9150.2-117.200117.1
1168T34.2Very low28.7Very low126 Ų126146.2 Ų146.277%0.77376%0.762SS**  cis-143161.913-17.20000111.9
1169D25.9Very low29Very low140 Ų140144.3 Ų144.375%0.74977%0.771SS**  trans-63.5164.4165.1-56.1-95.2000113.8
1170L34.2Very low29Very low170 Ų170141.6 Ų141.689%0.8977%0.77SS**  -169.5132.7121-103.7168.8000112.5
1171N24.3Very low29.1Very low142 Ų142144.9 Ų144.976%0.75978%0.78SS**  trans-83.9153.8165.3-66.7-69000110.3
1172Q31.6Very low29.3Very low177 Ų177147.3 Ų147.383%0.82778%0.779SS**  -179.8133.8123.6-101.4168.75.400115.3
1173T31.4Very low29.3Very low110 Ų110144.8 Ų144.868%0.67578%0.777SS**  trans44.8120.7142.654.90000120.8
1174N26.5Very low29.7Very low140 Ų140144.8 Ų144.875%0.74978%0.78SS**  73.6107.865.6-70.4-0.9000115
1175E30.9Very low29.9Very low200 Ų200146.6 Ų146.694%0.93578%0.781SS**  trans-164.2128.5131-65.3-157.3149.900105.6
1176L29.4Very low30Very low138 Ų138148.3 Ų148.372%0.72378%0.783SS**  cis99.3743-140.4175.8000117.5T1178L1176-T1178 HydrophobicContact CD2-CG2 3.78Å
1177E30.9Very low30.3Very low189 Ų189147.2 Ų147.288%0.88378%0.777SS**  trans-122.4113.1146.5-65.5-174.713100106.8
1178T29.4Very low30.5Very low120 Ų120146.9 Ų146.974%0.73678%0.776SS**  56.496.870.764.40000116L1176L1176-T1178 HydrophobicContact CD2-CG2 3.78Å
1179G31.7Very low30.3Very low84 Ų84148.2 Ų148.287%0.86677%0.773SS**  trans-158107.1163.300000109.7
1180S29.6Very low30.7Very low101 Ų101151.4 Ų151.471%0.70678%0.775SS**  trans-97.6145-163.454.60000114.7
1181N30.6Very low30.6Very low161 Ų161150.1 Ų150.186%0.86177%0.765SS**  -164.6169.2122.5-105.8-60.8000112.7
1182Y28.2Very low31Very low201 Ų201147.7 Ų147.779%0.78876%0.757SS**  trans-104.1165.2-161.3-96.8-109.6000115.2
1183E30Very low30.9Very low169 Ų169148.7 Ų148.779%0.7976%0.761SS**  trans65.9144.9159.3-72.7160.8-162.200117.7
1184D33.7Very low30.6Very low142 Ų142151.6 Ų151.676%0.75977%0.767SS**  cis-138151.911.1-153.9-6000111.9
1185Q31.2Very low30.8Very low150 Ų150152.1 Ų152.170%0.70177%0.77SS**  trans-139117.7-175.6177-178.7-12.400110.4D1187Q1185-D1187 PolarHBondContact NE2-OD1 3.42Å
1186I35.3Very low30.8Very low159 Ų159150.6 Ų150.682%0.81576%0.763SS**  trans-134.6123.5165.3-58.5-177.9000109.1
1187D28.3Very low30.8Very low105 Ų105150.6 Ų150.656%0.56177%0.769SS**  trans-87.2159.5-169.5-35-81.2000112.6Q1185Q1185-D1187 PolarHBondContact NE2-OD1 3.42Å
1188E33Very low30.9Very low160 Ų160146.2 Ų146.275%0.74876%0.758SS**  trans-148.157.6137.4-132.5-166.4167.200110.2W1190E1188-W1190 PolarHBondContact O-N 2.94Å; E1188-W1190 PolarHBondContact OE1-NE1 3.42Å
1189E31.4Very low30.8Very low154 Ų154146.1 Ų146.172%0.7276%0.762SS**  trans-71.886.3174.5-175.8164.5-137.800110.6E1191E1189-E1191 VanDerWaalsContact C-N 3.27Å; E1189-E1191 HydrophobicContact CG-CG 4.38Å; E1189-E1191 PolarHBondContact O-N 3.16Å
1190W32.7Very low30.8Very low208 Ų208149.5 Ų149.579%0.78876%0.759SS**  trans-77.277.3171.3-83.494.4000111.3E1188E1188-W1190 PolarHBondContact O-N 2.94Å; E1188-W1190 PolarHBondContact OE1-NE1 3.42Å
1191E31.9Very low30.9Very low143 Ų143152.6 Ų152.667%0.66876%0.762SS**  trans-52.5144.9167.2-96-77.796.600111.6E1189E1189-E1191 VanDerWaalsContact C-N 3.27Å; E1189-E1191 HydrophobicContact CG-CG 4.38Å; E1189-E1191 PolarHBondContact O-N 3.16Å
1192P32.5Very low30.9Very low91 Ų91149.3 Ų149.359%0.59175%0.752SS**  trans-89.6109.8-176.933.7-30.4000112Q1194P1192-Q1194 PolarHBondContact O-N 3.22Å
1193E29.8Very low31Very low197 Ų197147.5 Ų147.592%0.92176%0.756SS**  trans-55.6107.7169.9-72.2-174.3150.200111.5
1194Q26.6Very low31Very low172 Ų172143.1 Ų143.180%0.80475%0.749SS**  trans-134.266.8172-77.2-112.3-82.400109.6P1192P1192-Q1194 PolarHBondContact O-N 3.22Å
1195D29.6Very low30.9Very low151 Ų151143.5 Ų143.581%0.80775%0.746SS**  trans-165.6158.5150.6-97.2-34.3000107.8
1196E31.7Very low30.8Very low168 Ų168145.3 Ų145.379%0.78575%0.754SS**  cis-118.5155.912.1-56.1-172.9158.200113.9
1197T29.5Very low30.6Very low137 Ų137142.5 Ų142.584%0.8474%0.74SS**  trans-101.1115.4149.754.60000110.3
1198C32Very low30.8Very low97 Ų97143.6 Ų143.666%0.65575%0.754SS**  trans-137.1137.1168.3-155.80000111.7
1199S26.8Very low30.6Very low119 Ų119143.6 Ų143.683%0.83276%0.759SS**  trans-14971.1-174.3-67.80000112.5
1200I33.5Very low30.8Very low154 Ų154143 Ų14379%0.7975%0.754SS**  trans-145.2135.7170.6-56.7-179.2000106.1
1201Q30.4Very low30.8Very low166 Ų166143.8 Ų143.878%0.77676%0.757SS**  cis175.7155.8-17.1175172.2-60.600104
1202S31.3Very low30.9Very low93 Ų93143.3 Ų143.365%0.6576%0.759SS**  trans64.3120.9165.450.40000120.3
1203N29.3Very low31Very low163 Ų163147 Ų14787%0.87277%0.765SS**  trans36.6129.6131.3-66.4-24.8000119.3
1204A30.4Very low31.1Very low77 Ų77143.8 Ų143.864%0.63675%0.753SS**  cis-167173.228.100000113.2
1205Q31.8Very low31.3Very low149 Ų149140.6 Ų140.670%0.69675%0.749SS**  trans69.5124.8164.1-64.9165.374.500114.8
1206Q29Very low31.5Very low189 Ų189139.3 Ų139.388%0.88374%0.742SS**  cis46.793.215.8-88.5-158.234.200113.9
1207L31.5Very low31.6Very low100 Ų100138.9 Ų138.952%0.52474%0.737SS.*  trans-172.9102.4138.5-103.6164.5000113.5L1209 K1210L1207-L1209 WeakPolarHBondContact CD2-O 3.37Å; L1207-K1210 HydrophobicContact CD1-CD 3.84Å; L1207-K1210 HydrophobicContact CD1-CG 4.26Å; L1207-K1210 HydrophobicContact CD2-CB 4.07Å; L1207-K1210 HydrophobicContact CD2-CG 4.17Å
1208C31.4Very low31.9Very low127 Ų127138.7 Ų138.786%0.85874%0.737SS**SBendtrans-140.2116.1137.2-166.30000104
1209L30.7Very low32Very low160 Ų160139.2 Ų139.284%0.83874%0.741SS**SBendcis-106.3147.833.2-54.578.5000114.5L1207L1207-L1209 WeakPolarHBondContact CD2-O 3.37Å
1210K34Very low32.4Very low142 Ų142136.9 Ų136.962%0.61774%0.736SS**  trans-145.9116.2169.9-147.9-171.3-158.6164.80114.2L1207L1207-K1210 HydrophobicContact CD1-CD 3.84Å; L1207-K1210 HydrophobicContact CD1-CG 4.26Å; L1207-K1210 HydrophobicContact CD2-CB 4.07Å; L1207-K1210 HydrophobicContact CD2-CG 4.17Å
1211R33.6Very low32.3Very low224 Ų224136.8 Ų136.885%0.84574%0.737SS**  trans-176.6110.3150-103.9165175.788.6-4.7106.7
1212N33.2Very low32.3Very low133 Ų133133.1 Ų133.171%0.71173%0.73SS**  84.6139.786.8-83.1-8.9000112
1213K34.2Very low32.4Very low168 Ų168137.2 Ų137.273%0.7374%0.739SS**  cis-163.3156.122.4-128.9171.8171.5-169.80111.7
1214I32.3Very low32.6Very low131 Ų131134.4 Ų134.467%0.67273%0.732SS**  trans71.4119.1145.7-73.3161.5000120.7
1215C31.9Very low33.2Very low104 Ų104136.3 Ų136.370%0.70374%0.737SS**  trans45157.1130.7-47.90000122
1216D33.7Very low33.1Very low125 Ų125135.1 Ų135.167%0.66874%0.736SS**  cis-152.1-170.621.8-140.8-26.3000115.7
1217K33.5Very low33.5Very low158 Ų158133.9 Ų133.969%0.68773%0.728SS**  trans-60176.6-169.7-62.1155.7-15579.80119.2
1218T36.5Very low33.4Very low134 Ų134135.9 Ų135.982%0.82274%0.739SS**  trans95.4156.5152.8710000119.1
1219S33.3Very low33.5Very low108 Ų108135.4 Ų135.476%0.75573%0.728SS**  -172.9132.7-56.5500000112.5
1220G34.7Very low33.8Very low70 Ų70135.3 Ų135.372%0.72272%0.723SS**  trans69.7-179.916700000116.2
1221N31.8Very low33.7Very low151 Ų151132.7 Ų132.781%0.80772%0.723SS**  cis-166.9134.9-23.6-125.837.4000110.2
1222S31.2Very low33.7Very low90 Ų90129.4 Ų129.463%0.62972%0.717SS**  trans48.5169.914867.40000120.7
1223E32.2Very low33.7Very low179 Ų179129.2 Ų129.284%0.83672%0.716SS**  cis-150.2179.512-144.8135.2149.400113
1224S34.8Very low33.6Very low103 Ų103127.9 Ų127.972%0.7272%0.716SS**  trans-131.3162.8-174.4-44.40000113.5
1225P41.7Very low33.7Very low117 Ų117128.3 Ų128.376%0.7672%0.718SS**  trans-134.1140.9137.521.2-1.2000113
1226N30.5Very low33.5Very low125 Ų125130.3 Ų130.367%0.66872%0.721SS**  71.1137.857.3-72.2-48.2000113
1227K36.1Very low33.8Very low163 Ų163130.7 Ų130.771%0.70973%0.728SS**  cis-169.9163.412.5-118.2167.6-169.3172.40113.9
1228N31.1Very low33.7Very low141 Ų141129 Ų12975%0.75473%0.726SS**  trans66.5163.9146.1-71.218.1000122.4
1229D32.3Very low33.6Very low117 Ų117128.6 Ų128.663%0.62672%0.719SS**  cis-176.9161.9-38.1-160.57.2000111
1230Q37Very low33.8Very low158 Ų158129.2 Ų129.274%0.73871%0.713SS**  trans65.1155.6160.2-74.4161.357.100119.4
1231S32.6Very low34Very low88 Ų88134 Ų13462%0.61572%0.717SS**  cis-172173.2-13.851.10000112.9
1232H33.1Very low34.3Very low155 Ų155131.2 Ų131.272%0.71871%0.709SS**  trans75.5116.5161.5-72.4-73.5000123
1233D33.3Very low34.6Very low129 Ų129133.6 Ų133.669%0.6972%0.715SS**  59.3152.2117.2-58.2-8.7000122.9
1234L32.9Very low34.8Very low139 Ų139131.5 Ų131.573%0.72871%0.709SS**  cis-167.6176.5-8.7-114.4172.9000112
1235I33Very low34.8Very low141 Ų141133.8 Ų133.872%0.72371%0.712SS**  trans69.3122.4161.4-68.3151.5000116.2
1236L29Very low34.5Very low146 Ų146135.7 Ų135.776%0.76472%0.715SS**  86.997.750.4-89.7172000116.9
1237T39.6Very low34.7Very low132 Ų132132.9 Ų132.981%0.8172%0.715SS**  trans177.5135139.8340000107.9
1238N31.8Very low34.8Very low122 Ų122130.4 Ų130.465%0.65272%0.718SS**  57.1135.668.2-7061.3000112.5
1239D34.3Very low35.1Very low126 Ų126128.7 Ų128.767%0.67472%0.718SS**  cis-167.4171.71.1-96.2-25.3000107.6
1240L38Very low35.3Very low122 Ų122129.2 Ų129.264%0.63972%0.72SS**  cis-165.1170.4-0.5-117.2166.8000109.5
1241Q38.6Very low35.5Very low170 Ų170130.8 Ų130.879%0.79473%0.725SS**  trans66.2150.5155.3-75.6148.93.800119.5
1242S36.6Very low35.5Very low92 Ų92137.7 Ų137.764%0.64374%0.738SS**  cis-164.8158.4-9.756.80000115
1243N37.3Very low35.5Very low140 Ų140135.7 Ų135.775%0.74974%0.741SS**  trans68.9131.3142.5-71.3-24.7000125.6
1244L36.4Very low35.6Very low136 Ų136135.2 Ų135.271%0.71275%0.748SS**  trans65.2115.7145.6-87.155.4000119.4
1245L36.3Very low35.6Very low150 Ų150134 Ų13479%0.78575%0.751SS**  75.1138.186.2-93.566.1000113.5
1246L35.6Very low35.9Very low158 Ų158132.7 Ų132.783%0.82775%0.754SS**  cis-153.9138.223.3-176.266.4000114.4
1247G33.8Very low36.2Very low65 Ų65130.1 Ų130.167%0.6775%0.754SS**  trans94.2142.8145.100000118.6
1248S38.2Very low35.9Very low111 Ų111135.9 Ų135.978%0.77676%0.761SS**  cis-159.5139.9-7-85.60000112.1
1249S38.3Very low35.9Very low106 Ų106137.6 Ų137.674%0.74177%0.768SS**  trans33.5144.8140.4-68.60000122.5
1250N36.7Very low36.1Very low127 Ų127137.6 Ų137.668%0.67978%0.778SS**  cis-177.2156.8-13.9-120.9-70.7000105.5
1251K39.2Very low35.8Very low192 Ų192135.2 Ų135.284%0.83578%0.783SS**  cis-129.9171.513.4-57.1166.2-174.6165.30108.1
1252R34.2Very low35.5Very low233 Ų233130.4 Ų130.488%0.87978%0.779SS**  cis87.5104.525.6-110.1-174.5-172.7-1560.9117.3
1253S31.8Very low35.4Very low112 Ų112134.2 Ų134.278%0.78379%0.793SS**  trans-95.7-178.2169.5-47.60000112.5
1254S36.6Very low35.6Very low120 Ų120132.2 Ų132.284%0.83979%0.79SS**  trans125.2152.3139.6-62.80000117.1
1255S33.3Very low35.7Very low113 Ų113130.3 Ų130.379%0.7979%0.787SS**  trans-120.2179.1-168.6-50.50000112.9
1256S38.1Very low36Very low114 Ų114131.6 Ų131.680%0.79780%0.795SS**  trans83.890.4157.8-55.60000119.8
1257A34.9Very low36Very low91 Ų91130.6 Ų130.675%0.75279%0.791SS**  39.5133.7123.800000122.7
1258R33.3Very low36.3Very low253 Ų253137.5 Ų137.596%0.95580%0.796SS**  trans-151.8165.7137.2-117.3170.9-114.4-148.6-1.8110.9
1259I33.3Very low36.4Very low158 Ų158142 Ų14281%0.8180%0.797SS**  trans-137.9153.2-158.7-50.5170.5000110.5
1260S36.6Very low36.3Very low126 Ų126140.5 Ų140.588%0.88180%0.798SS**  trans72.8149.8173.2-153.40000114.7
1261G32.1Very low36.5Very low73 Ų73142.4 Ų142.475%0.75381%0.807SS**  cis-170.1-177.4-2.900000107.8
1262G32Very low36.5Very low69 Ų69139 Ų13971%0.71181%0.807SS**  cis178.5-166.12.700000109.2
1263N34.5Very low36.8Very low172 Ų172133.3 Ų133.392%0.9280%0.803SS**  trans86.5140.8-176.4-61.1-8.3000117.1
1264S41.5Very low37.1Very low98 Ų98132.4 Ų132.469%0.68580%0.797SS**  177.6142.5-62.5175.50000109.4
1265S40.2Very low37.3Very low95 Ų95136.2 Ų136.266%0.66479%0.794SS**  trans49.3114.4151.359.10000119.9
1266N42.4Very low37.8Very low177 Ų177138.5 Ų138.595%0.94780%0.797SS**  -126.5138.6125.3-117.1-35.5000108.9
1267N34.3Very low37.5Very low137 Ų137139.3 Ų139.373%0.73379%0.793SS**  trans-137.8133.9-161.3-174.90.1000109.7
1268R41.2Very low37.6Very low210 Ų210140.7 Ų140.779%0.79280%0.797SS**  trans174.5112.8153-98.5160.1-143.7-137.39.1112.7
1269R39.8Very low38Very low207 Ų207133.4 Ų133.478%0.78179%0.785SS**  56.7153.9130-74.3178.1-102.4-137.7-3.2119.7L1271R1269-L1271 HydrophobicContact CG-CD1 4.44Å
1270G35.6Very low38.3Very low74 Ų74132 Ų13276%0.76378%0.779SS**  cis-113.4176.91300000116.8
1271L41.4Very low38.8Very low166 Ų166133.2 Ų133.287%0.86977%0.771SS**  trans-124.3140.6177.8-64.478.4000109.4R1269R1269-L1271 HydrophobicContact CG-CD1 4.44Å
1272S39.8Very low39.6Very low120 Ų120137.7 Ų137.784%0.83977%0.772SS**  trans178.7137.7143.4-167.50000108
1273S40.3Very low40.4Very low114 Ų114141.9 Ų141.980%0.79777%0.773SS**  cis-131.7172.1-0-167.70000110.8
1274S38.5Very low41Very low93 Ų93141.6 Ų141.665%0.6577%0.771SS**  trans-106.9-173.5-176.7-164.60000113
1275Y41.2Very low41.6Very low201 Ų201147.9 Ų147.979%0.78878%0.779SS**  trans80.696.8172.6-53.2-73.9000115
1276N42.3Very low42.2Very low160 Ų160149 Ų14986%0.85679%0.785SS**  cis-152.8132.849.4-76.5-39.2000113.2
1277D32.7Very low43.1Very low131 Ų131148.7 Ų148.770%0.70178%0.777SS**  trans-111.9120.5162173.821.7000108.7
1278S37.2Very low44.8Very low120 Ų120152.9 Ų152.984%0.83978%0.783SS**  trans-174.162.5166.1-83.40000112
1279S41.9Very low46.5Very low100 Ų100151.1 Ų151.170%0.69978%0.784SS**  trans-178.185153.641.80000111.7Q1281S1279-Q1281 PolarHBondContact O-N 3.24Å
1280N39.2Very low48.8Very low130 Ų130148 Ų14870%0.69578%0.782SS**  trans-77.649.9174.1-126.2-55.6000112.3Q1282N1280-Q1282 VanDerWaalsContact C-N 3.32Å; N1280-Q1282 PolarHBondContact O-N 3.4Å
1281Q45.9Very low51.6Low151 Ų151147.4 Ų147.471%0.70676%0.759SS**  trans-87.873.1168-68.9-16324.200109.7S1279 Q1283S1279-Q1281 PolarHBondContact O-N 3.24Å; Q1281-Q1283 PolarHBondContact O-N 3.29Å
1282Q49.8Very low54.1Low166 Ų166142.5 Ų142.578%0.77674%0.736SS**  trans-64.689.5156.2-68.3-170.88.600107.5N1280 L1284N1280-Q1282 VanDerWaalsContact C-N 3.32Å; N1280-Q1282 PolarHBondContact O-N 3.4Å; Q1282-L1284 PolarHBondContact O-N 3.27Å
1283Q48.8Very low56.7Low157 Ų157142.3 Ų142.373%0.73473%0.732SS**  trans-60.1101.2178.9-74.6-172.5-9.500109.3Q1281 R1285Q1281-Q1283 PolarHBondContact O-N 3.29Å; Q1283-R1285 VanDerWaalsContact C-N 3.27Å; Q1283-R1285 PolarHBondContact O-N 3.39Å
1284L46.1Very low59.4Low166 Ų166140.9 Ų140.987%0.86972%0.718SS**  trans-57.493.9166.1-70.9166.7000107.2Q1282 P1286Q1282-L1284 PolarHBondContact O-N 3.27Å; L1284-P1286 WeakPolarHBondContact O-CD 3.48Å
1285R55.6Low62.2Low230 Ų230137.9 Ų137.987%0.86869%0.694SS**PPolyproline II helixtrans-47.5119.8179.6-80.7-174.9171-175-2.4107.9Q1283 H1287Q1283-R1285 VanDerWaalsContact C-N 3.27Å; Q1283-R1285 PolarHBondContact O-N 3.39Å; R1285-H1287 PolarHBondContact O-N 2.83Å
1286P51.8Low64.8Low120 Ų120131 Ų13178%0.77967%0.671SS**PPolyproline II helixtrans-47.9119.5-173.7-32.636.2000110.4L1284 R1288L1284-P1286 WeakPolarHBondContact O-CD 3.48Å; P1286-R1288 PolarHBondContact O-N 2.87Å
1287H61.3Low67.5Low169 Ų169129.8 Ų129.878%0.78265%0.654SS**PPolyproline II helixtrans-55.5116.5-171.5178.885.1000108.3R1285 Q1289R1285-H1287 PolarHBondContact O-N 2.83Å; H1287-Q1289 VanDerWaalsContact C-N 3.29Å; H1287-Q1289 PolarHBondContact O-N 3.2Å
1288R69.5Low70.5Confident225 Ų225124.5 Ų124.585%0.84963%0.626SS**  trans-65.592.3-175.7-91.5-174.5169-116.74.6109.2P1286 N1290P1286-R1288 PolarHBondContact O-N 2.87Å; R1288-N1290 PolarHBondContact O-N 3Å; R1288-N1290 VanDerWaalsContact O-N 3.15Å
1289Q76.8Confident73.4Confident174 Ų174118.8 Ų118.881%0.81359%0.586SS**PPolyproline II helixtrans-58.5118177.2-161.9175.42700108.3H1287H1287-Q1289 VanDerWaalsContact C-N 3.29Å; H1287-Q1289 PolarHBondContact O-N 3.2Å
1290N89.3Confident76.1Confident141 Ų141115.5 Ų115.575%0.75456%0.561SS**PPolyproline II helixtrans-70.2137175.9-67.5-64.4000108.8R1288R1288-N1290 PolarHBondContact O-N 3Å; R1288-N1290 VanDerWaalsContact O-N 3.15Å
1291F93.4Very high78.8Confident61 Ų61113.4 Ų113.427%0.26855%0.548SS..PPolyproline II helixtrans-57.9140.8172.6-55.4-61.9000110Q1295 N1296 L1326 Q1330 W1334F1291-Q1295 HydrophobicContact CB-CB 4.08Å; F1291-N1296 PolarHBondContact O-ND2 3.29Å; F1291-L1326 HydrophobicContact CD1-CD1 3.56Å; F1291-L1326 HydrophobicContact CD1-CD2 3.62Å; F1291-L1326 HydrophobicContact CD1-CG 4.27Å; F1291-L1326 HydrophobicContact CE1-CD1 3.8Å; F1291-L1326 HydrophobicContact CE1-CD2 3.82Å; F1291-L1326 HydrophobicContact CE1-CG 4.45Å; F1291-L1326 HydrophobicContact CG-CD1 4.27Å; F1291-Q1330 HydrophobicContact CE1-CB 4.22Å; F1291-Q1330 HydrophobicContact CE1-CG 4.43Å; F1291-Q1330 HydrophobicContact CZ-CB 4.39Å; F1291-W1334 AromaticContact CD2-CD1 3.64Å; F1291-W1334 HydrophobicContact CE2-CB 4.46Å; F1291-W1334 AromaticContact CE2-CD1 3.62Å; F1291-W1334 HydrophobicContact CE2-CG 4.45Å
1292T94.6Very high81.3Confident64 Ų64107.7 Ų107.739%0.39352%0.52SS..PPolyproline II helixtrans-61160.2-179.862.60000111.5T1294 Q1295 N1296T1292-T1294 PolarHBondContact O-N 3.15Å; T1292-Q1295 PolarHBondContact O-N 2.9Å; T1292-Q1295 WeakPolarHBondContact OG1-CB 3.34Å; T1292-Q1295 VanDerWaalsContact OG1-CD 3.24Å; T1292-Q1295 VanDerWaalsContact OG1-CG 3.28Å; T1292-Q1295 WeakPolarHBondContact OG1-CG 3.44Å; T1292-Q1295 PolarHBondContact OG1-N 3.4Å; T1292-Q1295 VanDerWaalsContact OG1-N 3.16Å; T1292-Q1295 PolarHBondContact OG1-OE1 2.77Å; T1292-N1296 PolarHBondContact O-N 2.75Å; T1292-N1296 PolarHBondContact O-ND2 2.92Å
1293P95.3Very high83.5Confident115 Ų115100.7 Ų100.775%0.74749%0.486SS*.Hα-helixtrans-55-40173.5-27.136.2000112.4N1296 R1297P1293-N1296 PolarHBondContact O-N 3.29Å; P1293-R1297 WeakPolarHBondContact O-CB 3.17Å; P1293-R1297 PolarHBondContact O-N 3.13Å
1294T96.2Very high85.7Confident84 Ų8498.8 Ų98.852%0.51548%0.477SS..Hα-helixtrans-62.8-47.4176.6-46.30000112.1T1292 R1297 I1298T1292-T1294 PolarHBondContact O-N 3.15Å; T1294-R1297 WeakPolarHBondContact O-CB 3.47Å; T1294-R1297 PolarHBondContact O-N 2.75Å; T1294-I1298 HydrophobicContact CG2-CD1 4.06Å; T1294-I1298 WeakPolarHBondContact O-CD1 3.46Å; T1294-I1298 WeakPolarHBondContact O-CG1 3.37Å; T1294-I1298 PolarHBondContact O-N 2.99Å
1295Q97.4Very high88.1Confident31 Ų3197.5 Ų97.515%0.14547%0.47CS..Hα-helixtrans-59.3-47.3175.1-80.8160.4-15.600112.1F1291 T1292 R1297 I1298 L1299 S1324 L1326F1291-Q1295 HydrophobicContact CB-CB 4.08Å; T1292-Q1295 PolarHBondContact O-N 2.9Å; T1292-Q1295 WeakPolarHBondContact OG1-CB 3.34Å; T1292-Q1295 VanDerWaalsContact OG1-CD 3.24Å; T1292-Q1295 VanDerWaalsContact OG1-CG 3.28Å; T1292-Q1295 WeakPolarHBondContact OG1-CG 3.44Å; T1292-Q1295 PolarHBondContact OG1-N 3.4Å; T1292-Q1295 VanDerWaalsContact OG1-N 3.16Å; T1292-Q1295 PolarHBondContact OG1-OE1 2.77Å; Q1295-R1297 VanDerWaalsContact C-N 3.3Å; Q1295-R1297 PolarHBondContact O-N 2.87Å; Q1295-I1298 PolarHBondContact O-N 3.37Å; Q1295-L1299 WeakPolarHBondContact O-CG 3.33Å; Q1295-L1299 PolarHBondContact O-N 3.41Å; Q1295-L1299 VanDerWaalsContact O-N 3.11Å; Q1295-S1324 WeakPolarHBondContact CG-O 3.48Å; Q1295-S1324 PolarHBondContact NE2-O 2.96Å; Q1295-L1326 HydrophobicContact CB-CD1 4.1Å; Q1295-L1326 HydrophobicContact CG-CD1 3.97Å; Q1295-L1326 HydrophobicContact CG-CD2 4.34Å; Q1295-L1326 HydrophobicContact CG-CG 3.97Å; Q1295-L1326 VanDerWaalsContact NE2-CD2 3.32Å
1296N96.7Very high90Very high55 Ų5590 Ų9029%0.29445%0.445SS..Hα-helixtrans-66.4-30.8177.7-80.3-57.4000112.9F1291 T1292 P1293 T1300 W1334F1291-N1296 PolarHBondContact O-ND2 3.29Å; T1292-N1296 PolarHBondContact O-N 2.75Å; T1292-N1296 PolarHBondContact O-ND2 2.92Å; P1293-N1296 PolarHBondContact O-N 3.29Å; N1296-T1300 WeakPolarHBondContact O-CB 3.26Å; N1296-T1300 PolarHBondContact O-N 3.02Å; N1296-T1300 PolarHBondContact O-OG1 3.49Å; N1296-W1334 PolarHBondContact OD1-NE1 3.38Å; N1296-W1334 VanDerWaalsContact OD1-NE1 3.16Å
1297R97.2Very high91.9Very high135 Ų13590.8 Ų90.851%0.50944%0.438SS..Hα-helixtrans-62.9-60.9171.5-177.2-178.563.881.8-6.2110P1293 T1294 Q1295 L1299 T1300 E1301P1293-R1297 WeakPolarHBondContact O-CB 3.17Å; P1293-R1297 PolarHBondContact O-N 3.13Å; T1294-R1297 WeakPolarHBondContact O-CB 3.47Å; T1294-R1297 PolarHBondContact O-N 2.75Å; Q1295-R1297 VanDerWaalsContact C-N 3.3Å; Q1295-R1297 PolarHBondContact O-N 2.87Å; R1297-L1299 VanDerWaalsContact C-N 3.28Å; R1297-L1299 PolarHBondContact O-N 3.17Å; R1297-T1300 CarbonylContact O-C 2.98Å; R1297-T1300 PolarHBondContact O-N 3.17Å; R1297-E1301 WeakPolarHBondContact CG-OE2 3.25Å; R1297-E1301 IonicContact CZ-OE2 2.7Å; R1297-E1301 IonicContact NH1-OE1 2.82Å; R1297-E1301 IonicContact NH1-OE2 3.72Å; R1297-E1301 PolarHBondContact NH1-OE2 3.35Å; R1297-E1301 VanDerWaalsContact O-CB 3.25Å; R1297-E1301 WeakPolarHBondContact O-CB 3.2Å; R1297-E1301 PolarHBondContact O-N 3.37Å
1298I97.4Very high93.2Very high21 Ų2188 Ų8811%0.10845%0.445CS..Hα-helixtrans-49.3-49.5-177.9-66.7155.3000111.3T1294 Q1295 W1302 L1320 I1323T1294-I1298 HydrophobicContact CG2-CD1 4.06Å; T1294-I1298 WeakPolarHBondContact O-CD1 3.46Å; T1294-I1298 WeakPolarHBondContact O-CG1 3.37Å; T1294-I1298 PolarHBondContact O-N 2.99Å; Q1295-I1298 PolarHBondContact O-N 3.37Å; I1298-W1302 PolarHBondContact O-N 2.79Å; I1298-W1302 VanDerWaalsContact O-N 3.17Å; I1298-L1320 HydrophobicContact CG2-CD2 3.96Å; I1298-I1323 HydrophobicContact CD1-CG2 4.01Å; I1298-I1323 WeakPolarHBondContact CD1-O 3.41Å; I1298-I1323 HydrophobicContact CG1-CG2 4.24Å; I1298-I1323 HydrophobicContact CG2-CB 4.4Å; I1298-I1323 HydrophobicContact CG2-CG2 3.87Å
1299L98.1Very high94.2Very high0 Ų084.7 Ų84.70%044%0.436CS..Hα-helixtrans-70.4-33.6-179.5-62.4178.3000113.2Q1295 R1297 Y1303 L1320 L1326 V1331 W1334 F1335Q1295-L1299 WeakPolarHBondContact O-CG 3.33Å; Q1295-L1299 PolarHBondContact O-N 3.41Å; Q1295-L1299 VanDerWaalsContact O-N 3.11Å; R1297-L1299 VanDerWaalsContact C-N 3.28Å; R1297-L1299 PolarHBondContact O-N 3.17Å; L1299-Y1303 VanDerWaalsContact O-CB 3.26Å; L1299-Y1303 WeakPolarHBondContact O-CB 3.09Å; L1299-Y1303 PolarHBondContact O-N 3.43Å; L1299-Y1303 VanDerWaalsContact O-N 3.13Å; L1299-L1320 HydrophobicContact CD2-CB 4.04Å; L1299-L1320 HydrophobicContact CD2-CD1 4.48Å; L1299-L1320 HydrophobicContact CD2-CD2 4.48Å; L1299-L1326 HydrophobicContact CD1-CD1 3.94Å; L1299-V1331 HydrophobicContact CD2-CG1 3.91Å; L1299-V1331 HydrophobicContact CD2-CG2 4.3Å; L1299-W1334 HydrophobicContact CB-CD2 3.83Å; L1299-W1334 HydrophobicContact CB-CE3 3.82Å; L1299-W1334 HydrophobicContact CB-CH2 3.68Å; L1299-W1334 HydrophobicContact CB-CZ2 3.65Å; L1299-W1334 HydrophobicContact CB-CZ3 3.75Å; L1299-W1334 HydrophobicContact CD1-CB 4.1Å; L1299-W1334 HydrophobicContact CD1-CD2 3.74Å; L1299-W1334 HydrophobicContact CD1-CE3 4.28Å; L1299-W1334 HydrophobicContact CD1-CG 3.62Å; L1299-W1334 HydrophobicContact CG-CD2 4.39Å; L1299-W1334 WeakPolarHBondContact O-CH2 3.49Å; L1299-W1334 WeakPolarHBondContact O-CZ3 3.3Å; L1299-F1335 HydrophobicContact CD2-CE2 3.95Å
1300T96.7Very high95Very high30 Ų3077.2 Ų77.218%0.18440%0.403CS..Hα-helixtrans-76.2-35.4177.4-63.20000112.7N1296 R1297 Y1303 Q1304 W1334 K1338N1296-T1300 WeakPolarHBondContact O-CB 3.26Å; N1296-T1300 PolarHBondContact O-N 3.02Å; N1296-T1300 PolarHBondContact O-OG1 3.49Å; R1297-T1300 CarbonylContact O-C 2.98Å; R1297-T1300 PolarHBondContact O-N 3.17Å; T1300-Y1303 WeakPolarHBondContact O-CB 3.43Å; T1300-Y1303 PolarHBondContact O-N 2.78Å; T1300-Q1304 HydrophobicContact CG2-CG 4.23Å; T1300-Q1304 WeakPolarHBondContact O-CB 3.49Å; T1300-Q1304 VanDerWaalsContact O-CG 3.27Å; T1300-Q1304 WeakPolarHBondContact O-CG 3.47Å; T1300-Q1304 PolarHBondContact O-N 2.92Å; T1300-W1334 WeakPolarHBondContact OG1-CZ2 3.31Å; T1300-K1338 VanDerWaalsContact CG2-NZ 3.32Å; T1300-K1338 PolarHBondContact OG1-NZ 2.94Å
1301E97.2Very high95.4Very high87 Ų8777.3 Ų77.341%0.40739%0.394SS..Hα-helixtrans-64.3-51.8177.4-169.7171.513900110.1R1297 Y1303 Q1304 L1305R1297-E1301 WeakPolarHBondContact CG-OE2 3.25Å; R1297-E1301 IonicContact CZ-OE2 2.7Å; R1297-E1301 IonicContact NH1-OE1 2.82Å; R1297-E1301 IonicContact NH1-OE2 3.72Å; R1297-E1301 PolarHBondContact NH1-OE2 3.35Å; R1297-E1301 VanDerWaalsContact O-CB 3.25Å; R1297-E1301 WeakPolarHBondContact O-CB 3.2Å; R1297-E1301 PolarHBondContact O-N 3.37Å; E1301-Y1303 VanDerWaalsContact C-N 3.31Å; E1301-Y1303 PolarHBondContact O-N 2.79Å; E1301-Q1304 PolarHBondContact O-N 3.01Å; E1301-Q1304 VanDerWaalsContact O-N 3.17Å; E1301-L1305 WeakPolarHBondContact O-CG 3.43Å; E1301-L1305 PolarHBondContact O-N 2.96Å
1302W97.3Very high95.5Very high31 Ų3175.5 Ų75.512%0.11739%0.388CS..Hα-helixtrans-58-43171.5-170.3105000111.5I1298 Q1304 L1305 H1306 P1312 D1316 L1320 F1335I1298-W1302 PolarHBondContact O-N 2.79Å; I1298-W1302 VanDerWaalsContact O-N 3.17Å; W1302-Q1304 VanDerWaalsContact C-N 3.33Å; W1302-Q1304 PolarHBondContact O-N 3.11Å; W1302-L1305 PolarHBondContact O-N 3.17Å; W1302-H1306 AromaticContact CD1-CE1 3.77Å; W1302-H1306 AromaticContact CD1-ND1 3.88Å; W1302-H1306 HydrophobicContact CD2-CB 4.39Å; W1302-H1306 AromaticContact CD2-CE1 3.85Å; W1302-H1306 AromaticContact CD2-CG 3.93Å; W1302-H1306 AromaticContact CD2-ND1 3.28Å; W1302-H1306 VanDerWaalsContact CD2-ND1 3.28Å; W1302-H1306 AromaticContact CE2-CE1 3.41Å; W1302-H1306 VanDerWaalsContact CE2-CE1 3.41Å; W1302-H1306 AromaticContact CE2-CG 3.76Å; W1302-H1306 AromaticContact CE2-ND1 3.25Å; W1302-H1306 VanDerWaalsContact CE2-ND1 3.25Å; W1302-H1306 AromaticContact CE2-NE2 4Å; W1302-H1306 HydrophobicContact CE3-CB 3.88Å; W1302-H1306 AromaticContact CE3-CG 3.93Å; W1302-H1306 AromaticContact CE3-ND1 3.67Å; W1302-H1306 AromaticContact CG-ND1 3.69Å; W1302-H1306 HydrophobicContact CH2-CB 3.61Å; W1302-H1306 AromaticContact CH2-CD2 3.98Å; W1302-H1306 AromaticContact CH2-CG 3.54Å; W1302-H1306 AromaticContact CH2-ND1 3.91Å; W1302-H1306 HydrophobicContact CZ2-CB 4.18Å; W1302-H1306 AromaticContact CZ2-CD2 3.77Å; W1302-H1306 AromaticContact CZ2-CE1 3.77Å; W1302-H1306 AromaticContact CZ2-CG 3.58Å; W1302-H1306 AromaticContact CZ2-ND1 3.59Å; W1302-H1306 AromaticContact CZ2-NE2 3.91Å; W1302-H1306 HydrophobicContact CZ3-CB 3.46Å; W1302-H1306 VanDerWaalsContact CZ3-CB 3.46Å; W1302-H1306 AromaticContact CZ3-CG 3.75Å; W1302-H1306 AromaticContact CZ3-ND1 3.97Å; W1302-H1306 AromaticContact NE1-CE1 3.4Å; W1302-H1306 PolarHBondContact NE1-CE1 3.47Å; W1302-H1306 AromaticContact NE1-ND1 3.66Å; W1302-H1306 WeakPolarHBondContact O-CB 3.48Å; W1302-H1306 PolarHBondContact O-N 3.13Å; W1302-H1306 PolarHBondContact O-ND1 2.87Å; W1302-P1312 HydrophobicContact CH2-CB 3.56Å; W1302-P1312 HydrophobicContact CH2-CG 4.26Å; W1302-P1312 HydrophobicContact CZ2-CB 3.73Å; W1302-P1312 HydrophobicContact CZ3-CB 4.03Å; W1302-P1312 HydrophobicContact CZ3-CG 4.32Å; W1302-D1316 HydrophobicContact CZ2-CB 4.01Å; W1302-L1320 HydrophobicContact CB-CD1 4.15Å; W1302-L1320 HydrophobicContact CB-CD2 3.84Å; W1302-L1320 HydrophobicContact CD2-CD1 3.8Å; W1302-L1320 HydrophobicContact CE3-CD1 4.41Å; W1302-L1320 HydrophobicContact CG-CD1 3.65Å; W1302-L1320 HydrophobicContact CG-CD2 3.94Å; W1302-L1320 HydrophobicContact CG-CG 4.31Å; W1302-F1335 HydrophobicContact CD2-CE1 4.44Å; W1302-F1335 HydrophobicContact CD2-CZ 4.11Å; W1302-F1335 AromaticContact CE3-CE1 3.37Å; W1302-F1335 HydrophobicContact CE3-CE1 3.37Å; W1302-F1335 AromaticContact CE3-CZ 3.44Å; W1302-F1335 HydrophobicContact CE3-CZ 3.44Å; W1302-F1335 VanDerWaalsContact CE3-CZ 3.44Å; W1302-F1335 HydrophobicContact CZ3-CD1 4.41Å; W1302-F1335 AromaticContact CZ3-CE1 3.58Å; W1302-F1335 HydrophobicContact CZ3-CE1 3.58Å; W1302-F1335 AromaticContact CZ3-CZ 3.99Å; W1302-F1335 HydrophobicContact CZ3-CZ 3.99Å
1303Y96.9Very high95.6Very high18 Ų1875.1 Ų75.17%0.07139%0.388CS..Hα-helixtrans-62-38.1178-169.2-80.7000112.9L1299 T1300 E1301 H1306 Q1307 P1310 W1334 F1335 K1338 R1339 S1342L1299-Y1303 VanDerWaalsContact O-CB 3.26Å; L1299-Y1303 WeakPolarHBondContact O-CB 3.09Å; L1299-Y1303 PolarHBondContact O-N 3.43Å; L1299-Y1303 VanDerWaalsContact O-N 3.13Å; T1300-Y1303 WeakPolarHBondContact O-CB 3.43Å; T1300-Y1303 PolarHBondContact O-N 2.78Å; E1301-Y1303 VanDerWaalsContact C-N 3.31Å; E1301-Y1303 PolarHBondContact O-N 2.79Å; Y1303-H1306 CarbonylContact O-C 3.6Å; Y1303-H1306 PolarHBondContact O-N 2.88Å; Y1303-Q1307 WeakPolarHBondContact O-CG 3.35Å; Y1303-Q1307 PolarHBondContact O-N 2.92Å; Y1303-P1310 HydrophobicContact CD2-CB 4.23Å; Y1303-P1310 HydrophobicContact CE1-CB 4.45Å; Y1303-P1310 HydrophobicContact CE2-CB 3.52Å; Y1303-W1334 HydrophobicContact CD2-CZ3 4.12Å; Y1303-W1334 HydrophobicContact CG-CZ3 4.45Å; Y1303-F1335 AromaticContact CD2-CD1 3.78Å; Y1303-F1335 HydrophobicContact CD2-CD1 3.78Å; Y1303-F1335 AromaticContact CD2-CE1 3.71Å; Y1303-F1335 HydrophobicContact CD2-CE1 3.71Å; Y1303-F1335 HydrophobicContact CE2-CD1 4.35Å; Y1303-F1335 HydrophobicContact CG-CE1 4.46Å; Y1303-K1338 HydrophobicContact CD1-CG 4.06Å; Y1303-K1338 HydrophobicContact CD2-CB 4.13Å; Y1303-K1338 HydrophobicContact CD2-CG 3.42Å; Y1303-K1338 VanDerWaalsContact CD2-CG 3.42Å; Y1303-K1338 HydrophobicContact CE1-CG 4.13Å; Y1303-K1338 HydrophobicContact CE2-CB 4.01Å; Y1303-K1338 HydrophobicContact CE2-CG 3.48Å; Y1303-K1338 VanDerWaalsContact CE2-CG 3.48Å; Y1303-K1338 HydrophobicContact CG-CG 3.75Å; Y1303-R1339 HydrophobicContact CE2-CG 3.95Å; Y1303-S1342 PolarHBondContact OH-OG 3.16Å
1304Q95.4Very high95.6Very high117 Ų11773.2 Ų73.255%0.54737%0.374SS..Hα-helixtrans-70.5-39.5179.3-80.2169.9-32.700111.8T1300 E1301 W1302 H1306 Q1307T1300-Q1304 HydrophobicContact CG2-CG 4.23Å; T1300-Q1304 WeakPolarHBondContact O-CB 3.49Å; T1300-Q1304 VanDerWaalsContact O-CG 3.27Å; T1300-Q1304 WeakPolarHBondContact O-CG 3.47Å; T1300-Q1304 PolarHBondContact O-N 2.92Å; E1301-Q1304 PolarHBondContact O-N 3.01Å; E1301-Q1304 VanDerWaalsContact O-N 3.17Å; W1302-Q1304 VanDerWaalsContact C-N 3.33Å; W1302-Q1304 PolarHBondContact O-N 3.11Å; Q1304-H1306 VanDerWaalsContact C-N 3.33Å; Q1304-Q1307 WeakPolarHBondContact O-CG 3.37Å; Q1304-Q1307 PolarHBondContact O-NE2 2.75Å
1305L95.7Very high95.7Very high139 Ų13973.8 Ų73.873%0.72838%0.375SS*.Hα-helixtrans-65-36.8173.1-66169.8000111.8E1301 W1302E1301-L1305 WeakPolarHBondContact O-CG 3.43Å; E1301-L1305 PolarHBondContact O-N 2.96Å; W1302-L1305 PolarHBondContact O-N 3.17Å
1306H95.3Very high95.7Very high72 Ų7274.5 Ų74.533%0.33338%0.379SS..THydrogen-bonded Turntrans-100.928.3-175.9-6287.9000114.3W1302 Y1303 Q1304 A1308 K1309 P1310W1302-H1306 AromaticContact CD1-CE1 3.77Å; W1302-H1306 AromaticContact CD1-ND1 3.88Å; W1302-H1306 HydrophobicContact CD2-CB 4.39Å; W1302-H1306 AromaticContact CD2-CE1 3.85Å; W1302-H1306 AromaticContact CD2-CG 3.93Å; W1302-H1306 AromaticContact CD2-ND1 3.28Å; W1302-H1306 VanDerWaalsContact CD2-ND1 3.28Å; W1302-H1306 AromaticContact CE2-CE1 3.41Å; W1302-H1306 VanDerWaalsContact CE2-CE1 3.41Å; W1302-H1306 AromaticContact CE2-CG 3.76Å; W1302-H1306 AromaticContact CE2-ND1 3.25Å; W1302-H1306 VanDerWaalsContact CE2-ND1 3.25Å; W1302-H1306 AromaticContact CE2-NE2 4Å; W1302-H1306 HydrophobicContact CE3-CB 3.88Å; W1302-H1306 AromaticContact CE3-CG 3.93Å; W1302-H1306 AromaticContact CE3-ND1 3.67Å; W1302-H1306 AromaticContact CG-ND1 3.69Å; W1302-H1306 HydrophobicContact CH2-CB 3.61Å; W1302-H1306 AromaticContact CH2-CD2 3.98Å; W1302-H1306 AromaticContact CH2-CG 3.54Å; W1302-H1306 AromaticContact CH2-ND1 3.91Å; W1302-H1306 HydrophobicContact CZ2-CB 4.18Å; W1302-H1306 AromaticContact CZ2-CD2 3.77Å; W1302-H1306 AromaticContact CZ2-CE1 3.77Å; W1302-H1306 AromaticContact CZ2-CG 3.58Å; W1302-H1306 AromaticContact CZ2-ND1 3.59Å; W1302-H1306 AromaticContact CZ2-NE2 3.91Å; W1302-H1306 HydrophobicContact CZ3-CB 3.46Å; W1302-H1306 VanDerWaalsContact CZ3-CB 3.46Å; W1302-H1306 AromaticContact CZ3-CG 3.75Å; W1302-H1306 AromaticContact CZ3-ND1 3.97Å; W1302-H1306 AromaticContact NE1-CE1 3.4Å; W1302-H1306 PolarHBondContact NE1-CE1 3.47Å; W1302-H1306 AromaticContact NE1-ND1 3.66Å; W1302-H1306 WeakPolarHBondContact O-CB 3.48Å; W1302-H1306 PolarHBondContact O-N 3.13Å; W1302-H1306 PolarHBondContact O-ND1 2.87Å; Y1303-H1306 CarbonylContact O-C 3.6Å; Y1303-H1306 PolarHBondContact O-N 2.88Å; Q1304-H1306 VanDerWaalsContact C-N 3.33Å; H1306-A1308 PolarHBondContact O-N 3.14Å; H1306-A1308 VanDerWaalsContact O-N 3.12Å; H1306-K1309 CarbonylContact O-C 3.51Å; H1306-K1309 PolarHBondContact O-N 2.79Å; H1306-P1310 WeakPolarHBondContact O-CA 3.44Å; H1306-P1310 VanDerWaalsContact O-N 3.09Å
1307Q92.2Very high95.7Very high138 Ų13872.1 Ų72.165%0.64537%0.367SS*.THydrogen-bonded Turntrans-55.8-31.8-177.4-83.6175.48800114.6Y1303 Q1304Y1303-Q1307 WeakPolarHBondContact O-CG 3.35Å; Y1303-Q1307 PolarHBondContact O-N 2.92Å; Q1304-Q1307 WeakPolarHBondContact O-CG 3.37Å; Q1304-Q1307 PolarHBondContact O-NE2 2.75Å
1308A88.8Confident95.7Very high111 Ų11171.1 Ų71.192%0.91737%0.366SS*.THydrogen-bonded Turntrans-72.2-27.1176.700000113.5H1306H1306-A1308 PolarHBondContact O-N 3.14Å; H1306-A1308 VanDerWaalsContact O-N 3.12Å
1309K90.8Very high95.7Very high154 Ų15475.6 Ų75.667%0.6739%0.387SS*.SBendtrans-140.975177.3-170.4-175.4176.1-174.60109.3H1306 Y1311H1306-K1309 CarbonylContact O-C 3.51Å; H1306-K1309 PolarHBondContact O-N 2.79Å; K1309-Y1311 PolarHBondContact O-N 2.85Å
1310P93.4Very high95.7Very high18 Ų1876 Ų7612%0.11739%0.389CS..  trans-77.337.5-17331.9-36.2000112.9Y1303 H1306 R1339Y1303-P1310 HydrophobicContact CD2-CB 4.23Å; Y1303-P1310 HydrophobicContact CE1-CB 4.45Å; Y1303-P1310 HydrophobicContact CE2-CB 3.52Å; H1306-P1310 WeakPolarHBondContact O-CA 3.44Å; H1306-P1310 VanDerWaalsContact O-N 3.09Å; P1310-R1339 HydrophobicContact CB-CG 4.05Å; P1310-R1339 HydrophobicContact CG-CG 4.07Å; P1310-R1339 WeakPolarHBondContact O-CD 3.29Å; P1310-R1339 PolarHBondContact O-NH1 3.41Å
1311Y96.4Very high95.8Very high143 Ų14375.2 Ų75.256%0.56139%0.385SS*.  trans-124.488.1-176.2-65.6-95.6000107.4K1309K1309-Y1311 PolarHBondContact O-N 2.85Å
1312P95.8Very high95.8Very high22 Ų2277.6 Ų77.614%0.14340%0.401CS..  trans-58142.9174.324.8-34.3000110.1W1302 D1316 F1335W1302-P1312 HydrophobicContact CH2-CB 3.56Å; W1302-P1312 HydrophobicContact CH2-CG 4.26Å; W1302-P1312 HydrophobicContact CZ2-CB 3.73Å; W1302-P1312 HydrophobicContact CZ3-CB 4.03Å; W1302-P1312 HydrophobicContact CZ3-CG 4.32Å; P1312-D1316 HydrophobicContact CB-CB 3.57Å; P1312-F1335 HydrophobicContact CG-CB 4.42Å; P1312-F1335 HydrophobicContact CG-CD1 3.99Å; P1312-F1335 HydrophobicContact CG-CD2 3.78Å; P1312-F1335 HydrophobicContact CG-CE1 4.2Å; P1312-F1335 HydrophobicContact CG-CE2 3.99Å; P1312-F1335 HydrophobicContact CG-CG 3.78Å; P1312-F1335 HydrophobicContact CG-CZ 4.21Å
1313S96.7Very high95.8Very high57 Ų5780.7 Ų80.740%0.39942%0.418SS..  trans-65.7173.6169.869.60000111.2D1315 D1316 T1317S1313-D1315 PolarHBondContact O-N 2.82Å; S1313-D1315 PolarHBondContact OG-N 2.95Å; S1313-D1316 WeakPolarHBondContact CB-OD2 3.26Å; S1313-D1316 PolarHBondContact N-OD2 2.81Å; S1313-D1316 PolarHBondContact OG-N 3.43Å; S1313-D1316 VanDerWaalsContact OG-N 3.08Å; S1313-D1316 PolarHBondContact OG-OD2 2.8Å; S1313-T1317 VanDerWaalsContact O-CB 3.29Å; S1313-T1317 WeakPolarHBondContact O-CB 3.36Å; S1313-T1317 PolarHBondContact O-N 3.15Å; S1313-T1317 PolarHBondContact O-OG1 3.01Å
1314T96.8Very high95.8Very high74 Ų7480.2 Ų80.245%0.45442%0.418SS..Hα-helixtrans-54-41.1170.7-61.40000111.2T1317 K1318 Y1328T1314-T1317 PolarHBondContact O-N 3.32Å; T1314-K1318 WeakPolarHBondContact O-CG 3.28Å; T1314-K1318 PolarHBondContact O-N 2.94Å; T1314-K1318 VanDerWaalsContact O-N 3.1Å; T1314-Y1328 WeakPolarHBondContact O-CE2 3.39Å
1315D97Very high95.9Very high97 Ų9777.6 Ų77.652%0.51942%0.422SS..Hα-helixtrans-83.4-36.9-175.6-59.1-44.8000112.6S1313 T1317 K1318 E1319S1313-D1315 PolarHBondContact O-N 2.82Å; S1313-D1315 PolarHBondContact OG-N 2.95Å; D1315-T1317 PolarHBondContact O-N 3.15Å; D1315-K1318 WeakPolarHBondContact O-CB 3.43Å; D1315-K1318 PolarHBondContact O-N 3.03Å; D1315-K1318 VanDerWaalsContact O-N 3.12Å; D1315-K1318 WeakPolarHBondContact OD1-CD 3.23Å; D1315-K1318 WeakPolarHBondContact OD1-CE 3.42Å; D1315-K1318 IonicContact OD1-NZ 3.81Å; D1315-K1318 PolarHBondContact OD1-NZ 3.25Å; D1315-E1319 PolarHBondContact O-N 3.12Å
1316D97.1Very high95.9Very high45 Ų4571.9 Ų71.924%0.24139%0.392CS..Hα-helixtrans-54.7-41.1166.4-63.6-64.6000110.9W1302 P1312 S1313 E1319 L1320W1302-D1316 HydrophobicContact CZ2-CB 4.01Å; P1312-D1316 HydrophobicContact CB-CB 3.57Å; S1313-D1316 WeakPolarHBondContact CB-OD2 3.26Å; S1313-D1316 PolarHBondContact N-OD2 2.81Å; S1313-D1316 PolarHBondContact OG-N 3.43Å; S1313-D1316 VanDerWaalsContact OG-N 3.08Å; S1313-D1316 PolarHBondContact OG-OD2 2.8Å; D1316-E1319 PolarHBondContact O-N 3.45Å; D1316-L1320 VanDerWaalsContact O-CB 3.3Å; D1316-L1320 WeakPolarHBondContact O-CB 3.39Å; D1316-L1320 WeakPolarHBondContact O-CG 3.49Å; D1316-L1320 PolarHBondContact O-N 2.86Å
1317T97.2Very high96Very high6 Ų671 Ų714%0.03739%0.394CS..Hα-helixtrans-71.5-31.3-178.7-54.60000111.6S1313 T1314 D1315 A1321 Y1328 V1331 K1332S1313-T1317 VanDerWaalsContact O-CB 3.29Å; S1313-T1317 WeakPolarHBondContact O-CB 3.36Å; S1313-T1317 PolarHBondContact O-N 3.15Å; S1313-T1317 PolarHBondContact O-OG1 3.01Å; T1314-T1317 PolarHBondContact O-N 3.32Å; D1315-T1317 PolarHBondContact O-N 3.15Å; T1317-A1321 WeakPolarHBondContact O-CB 3.27Å; T1317-A1321 PolarHBondContact O-N 3.1Å; T1317-A1321 VanDerWaalsContact O-N 3.09Å; T1317-Y1328 VanDerWaalsContact CB-CE2 3.46Å; T1317-Y1328 HydrophobicContact CG2-CD2 3.5Å; T1317-Y1328 HydrophobicContact CG2-CE2 3.4Å; T1317-Y1328 HydrophobicContact CG2-CG 4.17Å; T1317-V1331 HydrophobicContact CG2-CB 4.15Å; T1317-V1331 HydrophobicContact CG2-CG1 3.9Å; T1317-K1332 HydrophobicContact CG2-CB 4.34Å
1318K97.8Very high96.3Very high114 Ų11468.4 Ų68.450%0.49638%0.379SS..Hα-helixtrans-70.4-43.8170-69.7168.5-168.21600111.7T1314 D1315 A1321 N1322 Y1328T1314-K1318 WeakPolarHBondContact O-CG 3.28Å; T1314-K1318 PolarHBondContact O-N 2.94Å; T1314-K1318 VanDerWaalsContact O-N 3.1Å; D1315-K1318 WeakPolarHBondContact O-CB 3.43Å; D1315-K1318 PolarHBondContact O-N 3.03Å; D1315-K1318 VanDerWaalsContact O-N 3.12Å; D1315-K1318 WeakPolarHBondContact OD1-CD 3.23Å; D1315-K1318 WeakPolarHBondContact OD1-CE 3.42Å; D1315-K1318 IonicContact OD1-NZ 3.81Å; D1315-K1318 PolarHBondContact OD1-NZ 3.25Å; K1318-A1321 WeakPolarHBondContact O-CB 3.45Å; K1318-A1321 PolarHBondContact O-N 3.23Å; K1318-N1322 PolarHBondContact O-N 2.81Å; K1318-Y1328 HydrophobicContact CG-CD2 4.04Å; K1318-Y1328 HydrophobicContact CG-CE2 4.06Å
1319E97.7Very high96.6Very high115 Ų11565.9 Ų65.954%0.53736%0.355SS..Hα-helixtrans-63.7-48179.3-168.8-173.7164.900110.7D1315 D1316 A1321 N1322 I1323D1315-E1319 PolarHBondContact O-N 3.12Å; D1316-E1319 PolarHBondContact O-N 3.45Å; E1319-A1321 VanDerWaalsContact C-N 3.3Å; E1319-A1321 PolarHBondContact O-N 3.39Å; E1319-N1322 WeakPolarHBondContact O-CB 3.14Å; E1319-N1322 PolarHBondContact O-N 3.46Å; E1319-N1322 VanDerWaalsContact O-N 3.14Å; E1319-I1323 HydrophobicContact CG-CD1 3.72Å; E1319-I1323 HydrophobicContact CG-CG1 4.31Å; E1319-I1323 WeakPolarHBondContact O-CG1 3.36Å; E1319-I1323 PolarHBondContact O-N 2.84Å
1320L98Very high96.9Very high9 Ų962.3 Ų62.35%0.04734%0.34CS..Hα-helixtrans-64.6-32.8175.9-68.8170.4000112.7I1298 L1299 W1302 D1316 S1324 V1331 F1335I1298-L1320 HydrophobicContact CG2-CD2 3.96Å; L1299-L1320 HydrophobicContact CD2-CB 4.04Å; L1299-L1320 HydrophobicContact CD2-CD1 4.48Å; L1299-L1320 HydrophobicContact CD2-CD2 4.48Å; W1302-L1320 HydrophobicContact CB-CD1 4.15Å; W1302-L1320 HydrophobicContact CB-CD2 3.84Å; W1302-L1320 HydrophobicContact CD2-CD1 3.8Å; W1302-L1320 HydrophobicContact CE3-CD1 4.41Å; W1302-L1320 HydrophobicContact CG-CD1 3.65Å; W1302-L1320 HydrophobicContact CG-CD2 3.94Å; W1302-L1320 HydrophobicContact CG-CG 4.31Å; D1316-L1320 VanDerWaalsContact O-CB 3.3Å; D1316-L1320 WeakPolarHBondContact O-CB 3.39Å; D1316-L1320 WeakPolarHBondContact O-CG 3.49Å; D1316-L1320 PolarHBondContact O-N 2.86Å; L1320-S1324 WeakPolarHBondContact O-CB 3.27Å; L1320-S1324 PolarHBondContact O-N 3.23Å; L1320-S1324 PolarHBondContact O-OG 2.84Å; L1320-V1331 HydrophobicContact CB-CG1 4.05Å; L1320-F1335 HydrophobicContact CD1-CE2 3.62Å; L1320-F1335 HydrophobicContact CD1-CZ 3.69Å
1321A97.9Very high97.2Very high12 Ų1261.4 Ų61.410%0.09934%0.335CS..Hα-helixtrans-61.8-47.4170.800000111.2T1317 K1318 E1319 G1325 L1326 V1331T1317-A1321 WeakPolarHBondContact O-CB 3.27Å; T1317-A1321 PolarHBondContact O-N 3.1Å; T1317-A1321 VanDerWaalsContact O-N 3.09Å; K1318-A1321 WeakPolarHBondContact O-CB 3.45Å; K1318-A1321 PolarHBondContact O-N 3.23Å; E1319-A1321 VanDerWaalsContact C-N 3.3Å; E1319-A1321 PolarHBondContact O-N 3.39Å; A1321-G1325 WeakPolarHBondContact O-CA 3.31Å; A1321-G1325 PolarHBondContact O-N 3.33Å; A1321-L1326 CarbonylContact C-O 3.6Å; A1321-L1326 VanDerWaalsContact CA-O 3.3Å; A1321-L1326 WeakPolarHBondContact CA-O 3.25Å; A1321-L1326 WeakPolarHBondContact CB-O 3.35Å; A1321-L1326 PolarHBondContact O-N 3.35Å; A1321-V1331 HydrophobicContact CB-CG2 4.07Å
1322N97.5Very high97.2Very high138 Ų13860.9 Ų60.974%0.73834%0.335SS*.Hα-helixtrans-62-56176.9-170.119.3000112.1K1318 E1319 S1324 G1325K1318-N1322 PolarHBondContact O-N 2.81Å; E1319-N1322 WeakPolarHBondContact O-CB 3.14Å; E1319-N1322 PolarHBondContact O-N 3.46Å; E1319-N1322 VanDerWaalsContact O-N 3.14Å; N1322-S1324 VanDerWaalsContact C-N 3.29Å; N1322-S1324 PolarHBondContact O-N 3.32Å; N1322-G1325 PolarHBondContact O-N 2.91Å; N1322-G1325 VanDerWaalsContact O-N 3.17Å
1323I97.3Very high97.3Very high95 Ų9566.2 Ų66.249%0.48736%0.356SS..Hα-helixtrans-62.6-34.2-176.9-62.6173.9000111.9I1298 E1319I1298-I1323 HydrophobicContact CD1-CG2 4.01Å; I1298-I1323 WeakPolarHBondContact CD1-O 3.41Å; I1298-I1323 HydrophobicContact CG1-CG2 4.24Å; I1298-I1323 HydrophobicContact CG2-CB 4.4Å; I1298-I1323 HydrophobicContact CG2-CG2 3.87Å; E1319-I1323 HydrophobicContact CG-CD1 3.72Å; E1319-I1323 HydrophobicContact CG-CG1 4.31Å; E1319-I1323 WeakPolarHBondContact O-CG1 3.36Å; E1319-I1323 PolarHBondContact O-N 2.84Å
1324S96.7Very high97.3Very high8 Ų864.6 Ų64.66%0.05634%0.341CS..Hα-helixtrans-89.4-11.3178.973.50000114.4Q1295 L1320 N1322 L1326Q1295-S1324 WeakPolarHBondContact CG-O 3.48Å; Q1295-S1324 PolarHBondContact NE2-O 2.96Å; L1320-S1324 WeakPolarHBondContact O-CB 3.27Å; L1320-S1324 PolarHBondContact O-N 3.23Å; L1320-S1324 PolarHBondContact O-OG 2.84Å; N1322-S1324 VanDerWaalsContact C-N 3.29Å; N1322-S1324 PolarHBondContact O-N 3.32Å; S1324-L1326 VanDerWaalsContact C-N 3.3Å; S1324-L1326 WeakPolarHBondContact OG-CB 3.24Å
1325G96.9Very high97.3Very high62 Ų6261.1 Ų61.164%0.63932%0.32SS*.THydrogen-bonded Turntrans61.239-172.600000112.5A1321 N1322A1321-G1325 WeakPolarHBondContact O-CA 3.31Å; A1321-G1325 PolarHBondContact O-N 3.33Å; N1322-G1325 PolarHBondContact O-N 2.91Å; N1322-G1325 VanDerWaalsContact O-N 3.17Å
1326L97Very high97.3Very high19 Ų1958.8 Ų58.810%0.09931%0.314CS..  trans-120154.7177.2-67.2176.9000110.1F1291 Q1295 L1299 A1321 S1324 Q1330 V1331F1291-L1326 HydrophobicContact CD1-CD1 3.56Å; F1291-L1326 HydrophobicContact CD1-CD2 3.62Å; F1291-L1326 HydrophobicContact CD1-CG 4.27Å; F1291-L1326 HydrophobicContact CE1-CD1 3.8Å; F1291-L1326 HydrophobicContact CE1-CD2 3.82Å; F1291-L1326 HydrophobicContact CE1-CG 4.45Å; F1291-L1326 HydrophobicContact CG-CD1 4.27Å; Q1295-L1326 HydrophobicContact CB-CD1 4.1Å; Q1295-L1326 HydrophobicContact CG-CD1 3.97Å; Q1295-L1326 HydrophobicContact CG-CD2 4.34Å; Q1295-L1326 HydrophobicContact CG-CG 3.97Å; Q1295-L1326 VanDerWaalsContact NE2-CD2 3.32Å; L1299-L1326 HydrophobicContact CD1-CD1 3.94Å; A1321-L1326 CarbonylContact C-O 3.6Å; A1321-L1326 VanDerWaalsContact CA-O 3.3Å; A1321-L1326 WeakPolarHBondContact CA-O 3.25Å; A1321-L1326 WeakPolarHBondContact CB-O 3.35Å; A1321-L1326 PolarHBondContact O-N 3.35Å; S1324-L1326 VanDerWaalsContact C-N 3.3Å; S1324-L1326 WeakPolarHBondContact OG-CB 3.24Å; L1326-Q1330 HydrophobicContact CB-CB 4.3Å; L1326-V1331 HydrophobicContact CB-CG2 3.98Å
1327S97.4Very high97.2Very high53 Ų5360.9 Ų60.937%0.37133%0.325SS..  trans-69.3149.5175.780.70000111.5S1329 Q1330 V1331S1327-S1329 PolarHBondContact O-N 2.9Å; S1327-S1329 VanDerWaalsContact O-N 3.12Å; S1327-S1329 PolarHBondContact OG-OG 2.82Å; S1327-Q1330 WeakPolarHBondContact O-CA 3.46Å; S1327-Q1330 WeakPolarHBondContact O-CB 3.12Å; S1327-Q1330 PolarHBondContact O-N 2.95Å; S1327-Q1330 WeakPolarHBondContact OG-CG 3.44Å; S1327-Q1330 PolarHBondContact OG-N 3.41Å; S1327-Q1330 VanDerWaalsContact OG-N 3.17Å; S1327-V1331 PolarHBondContact O-N 3.13Å
1328Y97.5Very high97.2Very high84 Ų8463.3 Ų63.333%0.32934%0.335SS..Hα-helixtrans-48.6-40.1174.1-178.7-97.6000112.6T1314 T1317 K1318 V1331 K1332T1314-Y1328 WeakPolarHBondContact O-CE2 3.39Å; T1317-Y1328 VanDerWaalsContact CB-CE2 3.46Å; T1317-Y1328 HydrophobicContact CG2-CD2 3.5Å; T1317-Y1328 HydrophobicContact CG2-CE2 3.4Å; T1317-Y1328 HydrophobicContact CG2-CG 4.17Å; K1318-Y1328 HydrophobicContact CG-CD2 4.04Å; K1318-Y1328 HydrophobicContact CG-CE2 4.06Å; Y1328-V1331 PolarHBondContact O-N 3.14Å; Y1328-K1332 HydrophobicContact CE1-CD 4.37Å; Y1328-K1332 WeakPolarHBondContact O-CB 3.35Å; Y1328-K1332 PolarHBondContact O-N 3.4Å
1329S96.7Very high97.1Very high59 Ų5960.3 Ų60.341%0.41332%0.321SS..Hα-helixtrans-74-30.5177.973.80000113.4S1327 K1333S1327-S1329 PolarHBondContact O-N 2.9Å; S1327-S1329 VanDerWaalsContact O-N 3.12Å; S1327-S1329 PolarHBondContact OG-OG 2.82Å; S1329-K1333 VanDerWaalsContact O-CB 3.25Å; S1329-K1333 WeakPolarHBondContact O-CB 3.37Å; S1329-K1333 VanDerWaalsContact O-CD 3.3Å; S1329-K1333 WeakPolarHBondContact O-CD 3.4Å; S1329-K1333 WeakPolarHBondContact O-CG 3.26Å; S1329-K1333 PolarHBondContact O-N 3.32Å
1330Q97Very high96.8Very high78 Ų7857.9 Ų57.936%0.36432%0.32SS..Hα-helixtrans-66.2-44.7169.7-75.6168.7-23.200111.3F1291 L1326 S1327 K1333 W1334F1291-Q1330 HydrophobicContact CE1-CB 4.22Å; F1291-Q1330 HydrophobicContact CE1-CG 4.43Å; F1291-Q1330 HydrophobicContact CZ-CB 4.39Å; L1326-Q1330 HydrophobicContact CB-CB 4.3Å; S1327-Q1330 WeakPolarHBondContact O-CA 3.46Å; S1327-Q1330 WeakPolarHBondContact O-CB 3.12Å; S1327-Q1330 PolarHBondContact O-N 2.95Å; S1327-Q1330 WeakPolarHBondContact OG-CG 3.44Å; S1327-Q1330 PolarHBondContact OG-N 3.41Å; S1327-Q1330 VanDerWaalsContact OG-N 3.17Å; Q1330-K1333 PolarHBondContact O-N 3.23Å; Q1330-W1334 WeakPolarHBondContact O-CB 3.46Å; Q1330-W1334 PolarHBondContact O-N 3.26Å
1331V98Very high96.6Very high0 Ų066.4 Ų66.40%035%0.352CS..Hα-helixtrans-63-50.8177.21780000110.9L1299 T1317 L1320 A1321 L1326 S1327 Y1328 K1333 W1334 F1335L1299-V1331 HydrophobicContact CD2-CG1 3.91Å; L1299-V1331 HydrophobicContact CD2-CG2 4.3Å; T1317-V1331 HydrophobicContact CG2-CB 4.15Å; T1317-V1331 HydrophobicContact CG2-CG1 3.9Å; L1320-V1331 HydrophobicContact CB-CG1 4.05Å; A1321-V1331 HydrophobicContact CB-CG2 4.07Å; L1326-V1331 HydrophobicContact CB-CG2 3.98Å; S1327-V1331 PolarHBondContact O-N 3.13Å; Y1328-V1331 PolarHBondContact O-N 3.14Å; V1331-K1333 VanDerWaalsContact C-N 3.27Å; V1331-K1333 PolarHBondContact O-N 3.06Å; V1331-W1334 WeakPolarHBondContact O-CB 3.47Å; V1331-W1334 PolarHBondContact O-N 3.13Å; V1331-F1335 HydrophobicContact CG1-CD2 3.77Å; V1331-F1335 HydrophobicContact CG1-CE2 3.75Å; V1331-F1335 WeakPolarHBondContact O-CD2 3.41Å; V1331-F1335 PolarHBondContact O-N 3.12Å
1332K97.2Very high96.1Very high131 Ų13168 Ų6857%0.5736%0.362SS*.Hα-helixtrans-56.3-40.1176.3-167.9171.7-178.9177.50112T1317 Y1328 A1336T1317-K1332 HydrophobicContact CG2-CB 4.34Å; Y1328-K1332 HydrophobicContact CE1-CD 4.37Å; Y1328-K1332 WeakPolarHBondContact O-CB 3.35Å; Y1328-K1332 PolarHBondContact O-N 3.4Å; K1332-A1336 PolarHBondContact O-N 2.81Å
1333K97Very high94.9Very high135 Ų13566.7 Ų66.759%0.58736%0.359SS*.Hα-helixtrans-68.9-38.2173.6-74.1166.9-174.9168.10112.6S1329 Q1330 V1331 N1337S1329-K1333 VanDerWaalsContact O-CB 3.25Å; S1329-K1333 WeakPolarHBondContact O-CB 3.37Å; S1329-K1333 VanDerWaalsContact O-CD 3.3Å; S1329-K1333 WeakPolarHBondContact O-CD 3.4Å; S1329-K1333 WeakPolarHBondContact O-CG 3.26Å; S1329-K1333 PolarHBondContact O-N 3.32Å; Q1330-K1333 PolarHBondContact O-N 3.23Å; V1331-K1333 VanDerWaalsContact C-N 3.27Å; V1331-K1333 PolarHBondContact O-N 3.06Å; K1333-N1337 PolarHBondContact O-N 3.49Å; K1333-N1337 VanDerWaalsContact O-N 3.11Å; K1333-N1337 PolarHBondContact O-ND2 3.25Å
1334W97.2Very high93.1Very high22 Ų2267 Ų678%0.08337%0.37CS..Hα-helixtrans-61.6-47.9175.2-174.2105.4000110.7F1291 N1296 L1299 T1300 Y1303 Q1330 V1331 A1336 N1337 K1338F1291-W1334 AromaticContact CD2-CD1 3.64Å; F1291-W1334 HydrophobicContact CE2-CB 4.46Å; F1291-W1334 AromaticContact CE2-CD1 3.62Å; F1291-W1334 HydrophobicContact CE2-CG 4.45Å; N1296-W1334 PolarHBondContact OD1-NE1 3.38Å; N1296-W1334 VanDerWaalsContact OD1-NE1 3.16Å; L1299-W1334 HydrophobicContact CB-CD2 3.83Å; L1299-W1334 HydrophobicContact CB-CE3 3.82Å; L1299-W1334 HydrophobicContact CB-CH2 3.68Å; L1299-W1334 HydrophobicContact CB-CZ2 3.65Å; L1299-W1334 HydrophobicContact CB-CZ3 3.75Å; L1299-W1334 HydrophobicContact CD1-CB 4.1Å; L1299-W1334 HydrophobicContact CD1-CD2 3.74Å; L1299-W1334 HydrophobicContact CD1-CE3 4.28Å; L1299-W1334 HydrophobicContact CD1-CG 3.62Å; L1299-W1334 HydrophobicContact CG-CD2 4.39Å; L1299-W1334 WeakPolarHBondContact O-CH2 3.49Å; L1299-W1334 WeakPolarHBondContact O-CZ3 3.3Å; T1300-W1334 WeakPolarHBondContact OG1-CZ2 3.31Å; Y1303-W1334 HydrophobicContact CD2-CZ3 4.12Å; Y1303-W1334 HydrophobicContact CG-CZ3 4.45Å; Q1330-W1334 WeakPolarHBondContact O-CB 3.46Å; Q1330-W1334 PolarHBondContact O-N 3.26Å; V1331-W1334 WeakPolarHBondContact O-CB 3.47Å; V1331-W1334 PolarHBondContact O-N 3.13Å; W1334-A1336 PolarHBondContact O-N 2.97Å; W1334-N1337 CarbonylContact O-C 2.85Å; W1334-N1337 PolarHBondContact O-N 3.32Å; W1334-N1337 VanDerWaalsContact O-N 3.17Å; W1334-K1338 HydrophobicContact CD2-CB 4.36Å; W1334-K1338 HydrophobicContact CE3-CB 3.86Å; W1334-K1338 HydrophobicContact CE3-CG 4.3Å; W1334-K1338 HydrophobicContact CH2-CB 4Å; W1334-K1338 HydrophobicContact CH2-CD 3.42Å; W1334-K1338 VanDerWaalsContact CH2-CD 3.42Å; W1334-K1338 HydrophobicContact CH2-CG 3.55Å; W1334-K1338 HydrophobicContact CZ2-CD 3.75Å; W1334-K1338 HydrophobicContact CZ2-CG 4.25Å; W1334-K1338 HydrophobicContact CZ3-CB 3.66Å; W1334-K1338 HydrophobicContact CZ3-CD 4.01Å; W1334-K1338 HydrophobicContact CZ3-CG 3.59Å; W1334-K1338 WeakPolarHBondContact O-CB 3.3Å; W1334-K1338 PolarHBondContact O-N 2.98Å
1335F97.5Very high91.1Very high2 Ų271 Ų711%0.00940%0.398CS..Hα-helixtrans-62.4-41.1179.2-86.8-79.8000113.3L1299 W1302 Y1303 P1312 L1320 V1331 N1337 K1338 R1339L1299-F1335 HydrophobicContact CD2-CE2 3.95Å; W1302-F1335 HydrophobicContact CD2-CE1 4.44Å; W1302-F1335 HydrophobicContact CD2-CZ 4.11Å; W1302-F1335 AromaticContact CE3-CE1 3.37Å; W1302-F1335 HydrophobicContact CE3-CE1 3.37Å; W1302-F1335 AromaticContact CE3-CZ 3.44Å; W1302-F1335 HydrophobicContact CE3-CZ 3.44Å; W1302-F1335 VanDerWaalsContact CE3-CZ 3.44Å; W1302-F1335 HydrophobicContact CZ3-CD1 4.41Å; W1302-F1335 AromaticContact CZ3-CE1 3.58Å; W1302-F1335 HydrophobicContact CZ3-CE1 3.58Å; W1302-F1335 AromaticContact CZ3-CZ 3.99Å; W1302-F1335 HydrophobicContact CZ3-CZ 3.99Å; Y1303-F1335 AromaticContact CD2-CD1 3.78Å; Y1303-F1335 HydrophobicContact CD2-CD1 3.78Å; Y1303-F1335 AromaticContact CD2-CE1 3.71Å; Y1303-F1335 HydrophobicContact CD2-CE1 3.71Å; Y1303-F1335 HydrophobicContact CE2-CD1 4.35Å; Y1303-F1335 HydrophobicContact CG-CE1 4.46Å; P1312-F1335 HydrophobicContact CG-CB 4.42Å; P1312-F1335 HydrophobicContact CG-CD1 3.99Å; P1312-F1335 HydrophobicContact CG-CD2 3.78Å; P1312-F1335 HydrophobicContact CG-CE1 4.2Å; P1312-F1335 HydrophobicContact CG-CE2 3.99Å; P1312-F1335 HydrophobicContact CG-CG 3.78Å; P1312-F1335 HydrophobicContact CG-CZ 4.21Å; L1320-F1335 HydrophobicContact CD1-CE2 3.62Å; L1320-F1335 HydrophobicContact CD1-CZ 3.69Å; V1331-F1335 HydrophobicContact CG1-CD2 3.77Å; V1331-F1335 HydrophobicContact CG1-CE2 3.75Å; V1331-F1335 WeakPolarHBondContact O-CD2 3.41Å; V1331-F1335 PolarHBondContact O-N 3.12Å; F1335-N1337 PolarHBondContact O-N 3.33Å; F1335-K1338 PolarHBondContact O-N 2.98Å; F1335-R1339 WeakPolarHBondContact O-CB 3.34Å; F1335-R1339 WeakPolarHBondContact O-CG 3.31Å; F1335-R1339 PolarHBondContact O-N 3.26Å
1336A96.3Very high88.6Confident47 Ų4771.7 Ų71.739%0.38841%0.405SS..Hα-helixtrans-59.5-45.7173.400000112K1332 W1334 A1340K1332-A1336 PolarHBondContact O-N 2.81Å; W1334-A1336 PolarHBondContact O-N 2.97Å; A1336-A1340 WeakPolarHBondContact O-CB 3.25Å; A1336-A1340 PolarHBondContact O-N 3.26Å; A1336-A1340 VanDerWaalsContact O-N 3.13Å
1337N96Very high86.2Confident89 Ų8977.8 Ų77.848%0.47644%0.437SS..Hα-helixtrans-68.1-36.8177.4-79.4-77.8000113.1K1333 W1334 F1335 R1341K1333-N1337 PolarHBondContact O-N 3.49Å; K1333-N1337 VanDerWaalsContact O-N 3.11Å; K1333-N1337 PolarHBondContact O-ND2 3.25Å; W1334-N1337 CarbonylContact O-C 2.85Å; W1334-N1337 PolarHBondContact O-N 3.32Å; W1334-N1337 VanDerWaalsContact O-N 3.17Å; F1335-N1337 PolarHBondContact O-N 3.33Å; N1337-R1341 WeakPolarHBondContact O-CD 3.47Å; N1337-R1341 VanDerWaalsContact O-CG 3.28Å; N1337-R1341 WeakPolarHBondContact O-CG 3.35Å; N1337-R1341 PolarHBondContact O-N 3.02Å; N1337-R1341 VanDerWaalsContact O-N 3.15Å
1338K95.9Very high83.5Confident57 Ų5780.2 Ų80.225%0.24845%0.452CS..Hα-helixtrans-66.7-46.9177.8-174.277.5169.2-156.70110.6T1300 Y1303 W1334 F1335 R1341 S1342T1300-K1338 VanDerWaalsContact CG2-NZ 3.32Å; T1300-K1338 PolarHBondContact OG1-NZ 2.94Å; Y1303-K1338 HydrophobicContact CD1-CG 4.06Å; Y1303-K1338 HydrophobicContact CD2-CB 4.13Å; Y1303-K1338 HydrophobicContact CD2-CG 3.42Å; Y1303-K1338 VanDerWaalsContact CD2-CG 3.42Å; Y1303-K1338 HydrophobicContact CE1-CG 4.13Å; Y1303-K1338 HydrophobicContact CE2-CB 4.01Å; Y1303-K1338 HydrophobicContact CE2-CG 3.48Å; Y1303-K1338 VanDerWaalsContact CE2-CG 3.48Å; Y1303-K1338 HydrophobicContact CG-CG 3.75Å; W1334-K1338 HydrophobicContact CD2-CB 4.36Å; W1334-K1338 HydrophobicContact CE3-CB 3.86Å; W1334-K1338 HydrophobicContact CE3-CG 4.3Å; W1334-K1338 HydrophobicContact CH2-CB 4Å; W1334-K1338 HydrophobicContact CH2-CD 3.42Å; W1334-K1338 VanDerWaalsContact CH2-CD 3.42Å; W1334-K1338 HydrophobicContact CH2-CG 3.55Å; W1334-K1338 HydrophobicContact CZ2-CD 3.75Å; W1334-K1338 HydrophobicContact CZ2-CG 4.25Å; W1334-K1338 HydrophobicContact CZ3-CB 3.66Å; W1334-K1338 HydrophobicContact CZ3-CD 4.01Å; W1334-K1338 HydrophobicContact CZ3-CG 3.59Å; W1334-K1338 WeakPolarHBondContact O-CB 3.3Å; W1334-K1338 PolarHBondContact O-N 2.98Å; F1335-K1338 PolarHBondContact O-N 2.98Å; K1338-R1341 PolarHBondContact O-N 3.07Å; K1338-S1342 PolarHBondContact O-N 3.33Å; K1338-S1342 PolarHBondContact O-OG 3.39Å
1339R95.6Very high81.1Confident52 Ų5285.4 Ų85.420%0.19648%0.476CS..Hα-helixtrans-54.4-56.8173.1-76.8-166.9-61.9-90.32.7111Y1303 P1310 F1335 R1341 S1342 T1343Y1303-R1339 HydrophobicContact CE2-CG 3.95Å; P1310-R1339 HydrophobicContact CB-CG 4.05Å; P1310-R1339 HydrophobicContact CG-CG 4.07Å; P1310-R1339 WeakPolarHBondContact O-CD 3.29Å; P1310-R1339 PolarHBondContact O-NH1 3.41Å; F1335-R1339 WeakPolarHBondContact O-CB 3.34Å; F1335-R1339 WeakPolarHBondContact O-CG 3.31Å; F1335-R1339 PolarHBondContact O-N 3.26Å; R1339-R1341 PolarHBondContact O-N 3.01Å; R1339-R1341 VanDerWaalsContact O-N 3.15Å; R1339-S1342 PolarHBondContact O-N 3.3Å; R1339-S1342 PolarHBondContact O-OG 3.26Å; R1339-T1343 PolarHBondContact O-N 2.73Å; R1339-T1343 PolarHBondContact O-OG1 2.89Å; R1339-T1343 VanDerWaalsContact O-OG1 3.1Å
1340A93.4Very high78.4Confident64 Ų6488 Ų8853%0.52949%0.491SS..Hα-helixtrans-56.5-33.2-177.800000113.9A1336 T1343A1336-A1340 WeakPolarHBondContact O-CB 3.25Å; A1336-A1340 PolarHBondContact O-N 3.26Å; A1336-A1340 VanDerWaalsContact O-N 3.13Å; A1340-T1343 PolarHBondContact O-OG1 3.41Å; A1340-T1343 VanDerWaalsContact O-OG1 3.13Å
1341R92.6Very high75.9Confident187 Ų18789 Ų8971%0.70650%0.503SS*.Hα-helixtrans-75.2-44.1174.2-70.8167.5-177.1-96.9-1.9112.2N1337 K1338 R1339 S1344 S1345N1337-R1341 WeakPolarHBondContact O-CD 3.47Å; N1337-R1341 VanDerWaalsContact O-CG 3.28Å; N1337-R1341 WeakPolarHBondContact O-CG 3.35Å; N1337-R1341 PolarHBondContact O-N 3.02Å; N1337-R1341 VanDerWaalsContact O-N 3.15Å; K1338-R1341 PolarHBondContact O-N 3.07Å; R1339-R1341 PolarHBondContact O-N 3.01Å; R1339-R1341 VanDerWaalsContact O-N 3.15Å; R1341-S1344 PolarHBondContact O-N 3Å; R1341-S1345 PolarHBondContact O-OG 3.36Å
1342S87.2Confident73.4Confident46 Ų4694 Ų9432%0.32254%0.535SS..Hα-helixtrans-67.4-35.5-18068.70000113.2Y1303 K1338 R1339 S1344 S1345Y1303-S1342 PolarHBondContact OH-OG 3.16Å; K1338-S1342 PolarHBondContact O-N 3.33Å; K1338-S1342 PolarHBondContact O-OG 3.39Å; R1339-S1342 PolarHBondContact O-N 3.3Å; R1339-S1342 PolarHBondContact O-OG 3.26Å; S1342-S1344 PolarHBondContact O-N 2.89Å; S1342-S1344 VanDerWaalsContact O-N 3.13Å; S1342-S1345 VanDerWaalsContact O-CB 3.25Å; S1342-S1345 WeakPolarHBondContact O-CB 3.18Å; S1342-S1345 PolarHBondContact O-N 3.39Å; S1342-S1345 PolarHBondContact O-OG 3.1Å
1343T72.7Confident70.7Confident110 Ų11093.7 Ų93.768%0.67555%0.547SS*.THydrogen-bonded Turntrans-67.2-11.8176.349.50000113.6R1339 A1340R1339-T1343 PolarHBondContact O-N 2.73Å; R1339-T1343 PolarHBondContact O-OG1 2.89Å; R1339-T1343 VanDerWaalsContact O-OG1 3.1Å; A1340-T1343 PolarHBondContact O-OG1 3.41Å; A1340-T1343 VanDerWaalsContact O-OG1 3.13Å
1344S59.9Low67.9Low103 Ų10393.7 Ų93.772%0.7255%0.552SS**THydrogen-bonded Turntrans-91.8-3.3172.5-158.70000112.8R1341 S1342 G1346R1341-S1344 PolarHBondContact O-N 3Å; S1342-S1344 PolarHBondContact O-N 2.89Å; S1342-S1344 VanDerWaalsContact O-N 3.13Å; S1344-G1346 VanDerWaalsContact C-N 3.32Å; S1344-G1346 PolarHBondContact O-N 3Å
1345S53.6Low65.4Low91 Ų9195.2 Ų95.264%0.63657%0.57SS**SBendtrans-86.865.4-172.1-59.10000112.6R1341 S1342 L1347R1341-S1345 PolarHBondContact O-OG 3.36Å; S1342-S1345 VanDerWaalsContact O-CB 3.25Å; S1342-S1345 WeakPolarHBondContact O-CB 3.18Å; S1342-S1345 PolarHBondContact O-N 3.39Å; S1342-S1345 PolarHBondContact O-OG 3.1Å; S1345-L1347 PolarHBondContact O-N 3.09Å
1346G44.9Very low62.8Low76 Ų76101.4 Ų101.478%0.78461%0.61SS**SBendtrans74.3-24.5158.400000118.2S1344S1344-G1346 VanDerWaalsContact C-N 3.32Å; S1344-G1346 PolarHBondContact O-N 3Å
1347L46.4Very low60Low148 Ų148105.3 Ų105.378%0.77563%0.625SS**SBendtrans-72.9124.8173.6-156.972.8000109S1345 K1349S1345-L1347 PolarHBondContact O-N 3.09Å; L1347-K1349 PolarHBondContact O-N 2.97Å
1348P40.3Very low57.5Low104 Ų104105.8 Ų105.868%0.67563%0.634SS**  trans-58.7133.3174.925-33.1000108.6P1350P1348-P1350 VanDerWaalsContact O-N 3.09Å
1349K47.6Very low54.9Low193 Ų193107.6 Ų107.684%0.83966%0.655SS**  trans-45.6120.5172.3-179.5-177.8-176.9-177.40107.3L1347 T1351L1347-K1349 PolarHBondContact O-N 2.97Å; K1349-T1351 PolarHBondContact O-N 2.99Å
1350P40.2Very low52.7Low112 Ų112109 Ų10973%0.72767%0.669SS**  trans-56.6120.4-177.422.7-32.6000107.3P1348P1348-P1350 VanDerWaalsContact O-N 3.09Å
1351T44.2Very low50.5Low100 Ų100108.7 Ų108.761%0.61366%0.658SS**  trans-51.7134.7173.7-37.70000106.6K1349 L1354K1349-T1351 PolarHBondContact O-N 2.99Å; T1351-L1354 HydrophobicContact CG2-CD1 3.65Å
1352P44.8Very low48.9Very low105 Ų105105 Ų10568%0.68266%0.659SS**SBendtrans-45.8130.4168.3-2634.6000107.5L1354P1352-L1354 PolarHBondContact O-N 2.9Å
1353P41.8Very low47.1Very low125 Ų125106.8 Ų106.881%0.81267%0.671SS**PPolyproline II helixtrans-51.6118.3-165.320.6-33.2000108.2A1355P1353-A1355 PolarHBondContact O-N 3.38Å; P1353-A1355 VanDerWaalsContact O-N 3.09Å
1354L38.4Very low46Very low135 Ų135104.2 Ų104.271%0.70766%0.658SS**PPolyproline II helixtrans-56.6124.3-174.3-84.672.6000107.1T1351 P1352T1351-L1354 HydrophobicContact CG2-CD1 3.65Å; P1352-L1354 PolarHBondContact O-N 2.9Å
1355A43.2Very low45.8Very low54 Ų54101.1 Ų101.145%0.44664%0.638SS.*PPolyproline II helixtrans-52134.8161.500000106.9P1353 D1357P1353-A1355 PolarHBondContact O-N 3.38Å; P1353-A1355 VanDerWaalsContact O-N 3.09Å; A1355-D1357 WeakPolarHBondContact CB-OD1 3.22Å; A1355-D1357 PolarHBondContact O-N 2.98Å
1356P43Very low45.9Very low132 Ų13299.7 Ų99.786%0.85763%0.632SS**THydrogen-bonded Turntrans-71.116.5-164.329.9-36.7000114.5
1357D37.9Very low46.7Very low129 Ų12998.6 Ų98.669%0.6962%0.616SS**THydrogen-bonded Turntrans-161.129-156.655.4-8.7000115.1A1355A1355-D1357 WeakPolarHBondContact CB-OD1 3.22Å; A1355-D1357 PolarHBondContact O-N 2.98Å
1358S43.9Very low47.6Very low98 Ų9897 Ų9769%0.68561%0.607SS**  trans-134.761.3177.883.70000116.9
1359S40.9Very low49.1Very low96 Ų9696.6 Ų96.667%0.67160%0.603SS**  trans-128.732.8161.965.30000113.9D1361S1359-D1361 PolarHBondContact O-N 3.39Å; S1359-D1361 VanDerWaalsContact O-N 3.12Å
1360T49.1Very low50Low82 Ų8290.2 Ų90.250%0.50359%0.586SS.*  trans-68.6105.9158.8-470000108.1A1365 L1368T1360-A1365 HydrophobicContact CG2-CB 3.88Å; T1360-L1368 HydrophobicContact CG2-CD1 4.26Å
1361D46.9Very low51.1Low56 Ų5687.5 Ų87.530%0.29957%0.573SS.*  trans-48.2138.6173.513862.2000110.4F394 S1359 S1363 S1364 A1365F394-D1361 HydrophobicContact CE2-CB 4.35Å; F394-D1361 HydrophobicContact CZ-CB 4.42Å; S1359-D1361 PolarHBondContact O-N 3.39Å; S1359-D1361 VanDerWaalsContact O-N 3.12Å; D1361-S1363 PolarHBondContact O-N 2.8Å; D1361-S1363 VanDerWaalsContact O-N 3.09Å; D1361-S1363 PolarHBondContact OD1-N 3.36Å; D1361-S1363 VanDerWaalsContact OD1-N 3.09Å; D1361-S1363 WeakPolarHBondContact OD2-CB 3.18Å; D1361-S1364 CarbonylContact O-C 3.44Å; D1361-S1364 WeakPolarHBondContact O-CA 3.32Å; D1361-S1364 WeakPolarHBondContact O-CB 3.2Å; D1361-S1364 PolarHBondContact O-N 3.3Å; D1361-S1364 WeakPolarHBondContact OD2-CB 3.33Å; D1361-S1364 PolarHBondContact OD2-N 2.94Å; D1361-S1364 PolarHBondContact OD2-OG 3.39Å; D1361-A1365 PolarHBondContact O-N 3.47Å
1362P59Low52.1Low110 Ų11085.7 Ų85.771%0.71457%0.569SS**Hα-helixtrans-57.2-27.1-17621.9-34.3000113.9A1366P1362-A1366 VanDerWaalsContact O-CB 3.28Å; P1362-A1366 WeakPolarHBondContact O-CB 3.42Å; P1362-A1366 PolarHBondContact O-N 2.88Å
1363S49.2Very low53.2Low84 Ų8484.8 Ų84.859%0.58756%0.561SS**Hα-helixtrans-69-46.3170.7-169.10000111.2D1361 A1365 A1366 A1367D1361-S1363 PolarHBondContact O-N 2.8Å; D1361-S1363 VanDerWaalsContact O-N 3.09Å; D1361-S1363 PolarHBondContact OD1-N 3.36Å; D1361-S1363 VanDerWaalsContact OD1-N 3.09Å; D1361-S1363 WeakPolarHBondContact OD2-CB 3.18Å; S1363-A1365 VanDerWaalsContact C-N 3.33Å; S1363-A1365 PolarHBondContact O-N 3.45Å; S1363-A1366 PolarHBondContact O-N 3.09Å; S1363-A1367 VanDerWaalsContact O-CB 3.26Å; S1363-A1367 WeakPolarHBondContact O-CB 3.28Å; S1363-A1367 PolarHBondContact O-N 3.28Å
1364S50.1Low54.1Low56 Ų5681.1 Ų81.139%0.39254%0.541SS..Hα-helixtrans-65.4-30.2173.9-58.30000113.7D1361 L1368D1361-S1364 CarbonylContact O-C 3.44Å; D1361-S1364 WeakPolarHBondContact O-CA 3.32Å; D1361-S1364 WeakPolarHBondContact O-CB 3.2Å; D1361-S1364 PolarHBondContact O-N 3.3Å; D1361-S1364 WeakPolarHBondContact OD2-CB 3.33Å; D1361-S1364 PolarHBondContact OD2-N 2.94Å; D1361-S1364 PolarHBondContact OD2-OG 3.39Å; S1364-L1368 WeakPolarHBondContact O-CB 3.49Å; S1364-L1368 PolarHBondContact O-N 3.36Å
1365A55.8Low54.9Low37 Ų3777.3 Ų77.331%0.30653%0.529SS..Hα-helixtrans-74.6-42.6174.400000110.9T1360 D1361 S1363 A1367 L1368 V1369T1360-A1365 HydrophobicContact CG2-CB 3.88Å; D1361-A1365 PolarHBondContact O-N 3.47Å; S1363-A1365 VanDerWaalsContact C-N 3.33Å; S1363-A1365 PolarHBondContact O-N 3.45Å; A1365-A1367 VanDerWaalsContact C-N 3.29Å; A1365-A1367 PolarHBondContact O-N 2.76Å; A1365-L1368 PolarHBondContact O-N 3.12Å; A1365-V1369 WeakPolarHBondContact O-CB 3.46Å; A1365-V1369 WeakPolarHBondContact O-CG2 3.29Å; A1365-V1369 PolarHBondContact O-N 3.26Å
1366A55.7Low55.5Low61 Ų6177.5 Ų77.550%0.50453%0.53SS..Hα-helixtrans-62.6-36.1169.600000111.7P1362 S1363 A1370P1362-A1366 VanDerWaalsContact O-CB 3.28Å; P1362-A1366 WeakPolarHBondContact O-CB 3.42Å; P1362-A1366 PolarHBondContact O-N 2.88Å; S1363-A1366 PolarHBondContact O-N 3.09Å; A1366-A1370 WeakPolarHBondContact O-CB 3.19Å; A1366-A1370 PolarHBondContact O-N 2.84Å
1367A62.3Low56Low54 Ų5475.6 Ų75.645%0.44652%0.516SS..Hα-helixtrans-72.8-36.8175.900000112.8S1363 A1365 A1371S1363-A1367 VanDerWaalsContact O-CB 3.26Å; S1363-A1367 WeakPolarHBondContact O-CB 3.28Å; S1363-A1367 PolarHBondContact O-N 3.28Å; A1365-A1367 VanDerWaalsContact C-N 3.29Å; A1365-A1367 PolarHBondContact O-N 2.76Å; A1367-A1371 WeakPolarHBondContact O-CB 3.27Å; A1367-A1371 PolarHBondContact O-N 3.5Å
1368L64.7Low56.4Low113 Ų11373.1 Ų73.159%0.59251%0.509SS*.Hα-helixtrans-69.5-38.5172-95.2165.1000111.8T1360 S1364 A1365 A1372T1360-L1368 HydrophobicContact CG2-CD1 4.26Å; S1364-L1368 WeakPolarHBondContact O-CB 3.49Å; S1364-L1368 PolarHBondContact O-N 3.36Å; A1365-L1368 PolarHBondContact O-N 3.12Å; L1368-A1372 WeakPolarHBondContact O-CB 3.17Å; L1368-A1372 PolarHBondContact O-N 2.81Å
1369V72.4Confident56.6Low96 Ų9672.1 Ų72.158%0.58251%0.507SS*.Hα-helixtrans-67.8-42.8172.3171.30000110.6A1365 A1372 V1373A1365-V1369 WeakPolarHBondContact O-CB 3.46Å; A1365-V1369 WeakPolarHBondContact O-CG2 3.29Å; A1365-V1369 PolarHBondContact O-N 3.26Å; V1369-A1372 PolarHBondContact O-N 3.25Å; V1369-V1373 HydrophobicContact CG1-CG2 4.37Å; V1369-V1373 VanDerWaalsContact O-CB 3.27Å; V1369-V1373 WeakPolarHBondContact O-CB 3.09Å; V1369-V1373 WeakPolarHBondContact O-CG2 3.36Å; V1369-V1373 PolarHBondContact O-N 2.79Å
1370A65.6Low57Low60 Ų6069.9 Ų69.950%0.49649%0.489SS..Hα-helixtrans-66.9-36.6176.200000112.5A1366 A1374A1366-A1370 WeakPolarHBondContact O-CB 3.19Å; A1366-A1370 PolarHBondContact O-N 2.84Å; A1370-A1374 WeakPolarHBondContact O-CB 3.42Å; A1370-A1374 PolarHBondContact O-N 2.79Å
1371A63.3Low56.7Low55 Ų5569.2 Ų69.246%0.45549%0.492SS..Hα-helixtrans-74.2-35.217500000112.1A1367 A1375A1367-A1371 WeakPolarHBondContact O-CB 3.27Å; A1367-A1371 PolarHBondContact O-N 3.5Å; A1371-A1375 WeakPolarHBondContact O-CB 3.11Å; A1371-A1375 PolarHBondContact O-N 2.79Å
1372A65.6Low56.6Low62 Ų6273.6 Ų73.651%0.51252%0.515SS..Hα-helixtrans-71-35.7172.500000111.8L1368 V1369 A1376L1368-A1372 WeakPolarHBondContact O-CB 3.17Å; L1368-A1372 PolarHBondContact O-N 2.81Å; V1369-A1372 PolarHBondContact O-N 3.25Å; A1372-A1376 WeakPolarHBondContact O-CB 3.26Å; A1372-A1376 PolarHBondContact O-N 2.87Å
1373V67.8Low56Low86 Ų8674.1 Ų74.152%0.52152%0.516SS..Hα-helixtrans-68-44.9170.7167.10000110.4V1369 A1375 A1376 T1377V1369-V1373 HydrophobicContact CG1-CG2 4.37Å; V1369-V1373 VanDerWaalsContact O-CB 3.27Å; V1369-V1373 WeakPolarHBondContact O-CB 3.09Å; V1369-V1373 WeakPolarHBondContact O-CG2 3.36Å; V1369-V1373 PolarHBondContact O-N 2.79Å; V1373-A1375 PolarHBondContact O-N 3.41Å; V1373-A1376 PolarHBondContact O-N 2.77Å; V1373-T1377 PolarHBondContact O-N 2.78Å; V1373-T1377 PolarHBondContact O-OG1 3.27Å; V1373-T1377 VanDerWaalsContact O-OG1 3.09Å
1374A60.9Low55.6Low47 Ų4776.1 Ų76.139%0.38852%0.52SS..Hα-helixtrans-60.1-45.5174.500000111.3A1370 T1377 S1378A1370-A1374 WeakPolarHBondContact O-CB 3.42Å; A1370-A1374 PolarHBondContact O-N 2.79Å; A1374-T1377 WeakPolarHBondContact CA-OG1 3.34Å; A1374-T1377 CarbonylContact O-C 3.56Å; A1374-T1377 PolarHBondContact O-N 2.81Å; A1374-T1377 PolarHBondContact O-OG1 3.09Å; A1374-S1378 WeakPolarHBondContact O-CB 3.47Å; A1374-S1378 PolarHBondContact O-N 2.93Å; A1374-S1378 PolarHBondContact O-OG 3.09Å
1375A55.7Low55Low56 Ų5680.3 Ų80.346%0.46354%0.538SS..Hα-helixtrans-66.2-36.5175.800000112.6A1371 V1373 S1378 A1379A1371-A1375 WeakPolarHBondContact O-CB 3.11Å; A1371-A1375 PolarHBondContact O-N 2.79Å; V1373-A1375 PolarHBondContact O-N 3.41Å; A1375-S1378 PolarHBondContact O-N 2.79Å; A1375-A1379 VanDerWaalsContact O-CB 3.29Å; A1375-A1379 WeakPolarHBondContact O-CB 3.35Å; A1375-A1379 PolarHBondContact O-N 2.76Å
1376A54.9Low54.1Low57 Ų5787.2 Ų87.247%0.47157%0.566SS.*Hα-helixtrans-66.2-38.9172.600000111.6A1372 V1373 A1379 V1380A1372-A1376 WeakPolarHBondContact O-CB 3.26Å; A1372-A1376 PolarHBondContact O-N 2.87Å; V1373-A1376 PolarHBondContact O-N 2.77Å; A1376-A1379 PolarHBondContact O-N 2.82Å; A1376-V1380 WeakPolarHBondContact O-CG2 3.42Å; A1376-V1380 PolarHBondContact O-N 3.07Å
1377T55.1Low53Low92 Ų9292.7 Ų92.756%0.56458%0.584SS**Hα-helixtrans-70.5-29.1171.852.90000113V1373 A1374 A1381V1373-T1377 PolarHBondContact O-N 2.78Å; V1373-T1377 PolarHBondContact O-OG1 3.27Å; V1373-T1377 VanDerWaalsContact O-OG1 3.09Å; A1374-T1377 WeakPolarHBondContact CA-OG1 3.34Å; A1374-T1377 CarbonylContact O-C 3.56Å; A1374-T1377 PolarHBondContact O-N 2.81Å; A1374-T1377 PolarHBondContact O-OG1 3.09Å; T1377-A1381 PolarHBondContact O-N 2.81Å
1378S45.7Very low51.6Low78 Ų7896.3 Ų96.355%0.54560%0.6SS.*Hα-helixtrans-75-36.6172.7-60.40000112.6A1374 A1375 V1380 A1381A1374-S1378 WeakPolarHBondContact O-CB 3.47Å; A1374-S1378 PolarHBondContact O-N 2.93Å; A1374-S1378 PolarHBondContact O-OG 3.09Å; A1375-S1378 PolarHBondContact O-N 2.79Å; S1378-V1380 PolarHBondContact O-N 3.34Å; S1378-A1381 WeakPolarHBondContact O-CB 3.38Å; S1378-A1381 PolarHBondContact O-N 3Å; S1378-A1381 VanDerWaalsContact O-N 3.07Å
1379A46.8Very low50Low76 Ų7696.2 Ų96.263%0.62861%0.609SS**Hα-helixtrans-69.5-15.9177.100000113.4A1375 A1376A1375-A1379 VanDerWaalsContact O-CB 3.29Å; A1375-A1379 WeakPolarHBondContact O-CB 3.35Å; A1375-A1379 PolarHBondContact O-N 2.76Å; A1376-A1379 PolarHBondContact O-N 2.82Å
1380V49.8Very low48.2Very low50 Ų5098.2 Ų98.230%0.30362%0.622SS.*THydrogen-bonded Turntrans-97.8-11.1171.61800000112.1V517 A518 A1376 S1378V517-V1380 HydrophobicContact CG1-CG1 4.22Å; A518-V1380 HydrophobicContact CB-CG1 3.78Å; A1376-V1380 WeakPolarHBondContact O-CG2 3.42Å; A1376-V1380 PolarHBondContact O-N 3.07Å; S1378-V1380 PolarHBondContact O-N 3.34Å
1381A43.8Very low46.8Very low67 Ų67100.5 Ų100.555%0.55463%0.634SS**G310 helixtrans-73.9-23.917900000113.7T1377 S1378T1377-A1381 PolarHBondContact O-N 2.81Å; S1378-A1381 WeakPolarHBondContact O-CB 3.38Å; S1378-A1381 PolarHBondContact O-N 3Å; S1378-A1381 VanDerWaalsContact O-N 3.07Å
1382D44.1Very low45.4Very low149 Ų149104 Ų10480%0.79765%0.65SS**G310 helixtrans-94.99.9-168.2-129.63.3000114.7
1383V46.3Very low43.7Very low120 Ų120105.8 Ų105.873%0.72766%0.659SS**G310 helixtrans-120.67.1-176.7-165.10000113.1
1384N41.8Very low42.5Very low126 Ų126105.9 Ų105.967%0.67466%0.661SS**SBendtrans-126.422.1178.2-84.5-52.1000114.5
1385N37.3Very low41.2Very low145 Ų145112.2 Ų112.278%0.77569%0.688SS**SBendtrans-115.239.6-179.8-163.228.7000114
1386M35.9Very low40Very low181 Ų181115.6 Ų115.689%0.89270%0.698SS**SBendtrans-137.212.9172.6-85.9-143.671.700115.6
1387M33.4Very low39.2Very low177 Ų177119.9 Ų119.987%0.87272%0.718SS**SBendtrans-158.4129.8168-92.4-178.5169.400108.2
1388T33.3Very low38Very low129 Ų129120.2 Ų120.279%0.79172%0.724SS**  cis-150.6146.1-8.344.30000109.3
1389S30Very low37.2Very low112 Ų112121.8 Ų121.878%0.78374%0.735SS**  trans-119.5131.1170.4-72.80000111.9
1390T35.1Very low36.5Very low137 Ų137123 Ų12384%0.8474%0.739SS**  trans93.1104.517269.10000118.6
1391S35.1Very low35.5Very low109 Ų109125.8 Ų125.876%0.76276%0.761SS**  -179.7145.397.844.60000114.1
1392T34.4Very low35Very low128 Ų128127.5 Ų127.579%0.78577%0.768SS**  trans-84.4156.2-161.150.30000117.8
1393S31.4Very low34.4Very low100 Ų100126.2 Ų126.270%0.69977%0.771SS**  trans106.8124140.4-580000120
1394P42.2Very low33.9Very low87 Ų87125.6 Ų125.657%0.56577%0.772SS**  trans-109.9166.8174.840.6-33.8000114.9
1395L33.2Very low33.6Very low181 Ų181124 Ų12495%0.94877%0.771SS**  trans-153.9170.6163-112.3176.2000113
1396N31.4Very low33.3Very low127 Ų127124 Ų12468%0.67977%0.77SS**  trans-116.7141.8-159.916346.2000114.5
1397V36.6Very low33.1Very low147 Ų147121.9 Ų121.989%0.89177%0.772SS**  trans-159.9157.7147.2-100.10000111.7
1398S30.1Very low33Very low98 Ų98118 Ų11869%0.68576%0.763SS**  trans-110.1159.4-171.4-35.10000113.9
1399S30.3Very low32.8Very low111 Ų111118.1 Ų118.178%0.77676%0.763SS**  159.4142125.8-69.60000116.8
1400S30.2Very low32.9Very low102 Ų102119 Ų11971%0.71376%0.758SS**  trans56.2105.1138.567.40000124.3
1401S29.2Very low32.9Very low109 Ų109119.6 Ų119.676%0.76275%0.754SS**  73.1150.9115.170.50000125.8
1402S33.8Very low32.8Very low102 Ų102118 Ų11871%0.71374%0.743SS**  trans75.298.9145.853.10000122.4
1403S32.4Very low32.7Very low122 Ų122118.8 Ų118.885%0.85374%0.742SS**  20.8146.6124.7-45.90000123.6
1404S34.5Very low33Very low108 Ų108120.2 Ų120.276%0.75574%0.741SS**  trans114.2107.7134.7-156.10000119.7
1405S35.2Very low32.6Very low92 Ų92122.8 Ų122.864%0.64375%0.75SS**  68.5111.8129.9-50.20000123.2
1406N32.6Very low32.6Very low144 Ų144118.4 Ų118.477%0.7773%0.734SS**  52.9122.2118.4-52-14.7000121.7
1407C30.8Very low32.8Very low137 Ų137119.1 Ų119.193%0.92674%0.738SS**  trans-146.7153.3131.7-960000109.6
1408S31.1Very low32.7Very low97 Ų97119 Ų11968%0.67873%0.733SS**  trans-147.9150.7-159.6-460000113.9
1409T29.7Very low32.9Very low130 Ų130121.6 Ų121.680%0.79874%0.744SS**  trans67.7170.1157.4-190000113.1
1410I32.1Very low32.9Very low132 Ų132121.2 Ų121.268%0.67774%0.742SS**  cis-140.3158.72.5-29165.7000106.9
1411I34.3Very low32.8Very low149 Ų149124.5 Ų124.576%0.76475%0.751SS**  167.6147.994-72-67.1000105.7
1412S33.1Very low32.8Very low74 Ų74124.4 Ų124.452%0.51775%0.75SS.*  cis-173.8170.4-36.7-79.80000108.5
1413N32.1Very low32.7Very low145 Ų145126.3 Ų126.378%0.77575%0.751SS**  trans76.8142.8154.6-70.35.8000120.2
1414I37.5Very low32.6Very low131 Ų131128.6 Ų128.667%0.67275%0.748SS**  cis-166.8168.7-20.8-130.5169.1000110.7
1415N35Very low32.8Very low140 Ų140128 Ų12875%0.74974%0.741SS**  trans70.8148.8174-67.9-15.6000118.4
1416S33Very low32.6Very low89 Ų89133.2 Ų133.262%0.62275%0.753SS**  cis-169.2171.2-23-96.10000110.7
1417N36.4Very low32.6Very low143 Ų143132.9 Ų132.977%0.76575%0.75SS**  trans78.1117.5178.4-48.53.2000113.3
1418D32.5Very low32.6Very low144 Ų144132.7 Ų132.777%0.7774%0.74SS**  cis87.696.143-67.6-42.7000114.7
1419T34.6Very low32.5Very low152 Ų152136.2 Ų136.293%0.93374%0.743SS**  175.8159.6107.530.10000111.1
1420S31Very low32.8Very low103 Ų103133.8 Ų133.872%0.7273%0.731SS**  trans-127.5153.2-170.558.80000114.3
1421L27.4Very low32.9Very low172 Ų172136.1 Ų136.190%0.90174%0.736SS**  trans36.4112.6148.3-68.5166.3000119.5
1422S29.5Very low32.5Very low107 Ų107134.6 Ų134.675%0.74874%0.739SS**  trans-155.1120.1149.2-157.40000114.6
1423I31.3Very low32.6Very low142 Ų142136.6 Ų136.673%0.72875%0.748SS**  trans59.4105.2134.3-64.3179.1000120.6
1424Q30.5Very low32.1Very low169 Ų169133.8 Ų133.879%0.7974%0.739SS**  trans69.3176.1135.1-53.6-73.2-1.200118.2
1425P38.9Very low31.4Very low96 Ų96136.7 Ų136.762%0.62375%0.747SS**  -136164.7-77.839.3-23.8000114.6
1426F31.4Very low30.9Very low201 Ų201134.8 Ų134.888%0.88275%0.745SS**  trans-154.7150.4148.8-110-76.1000114.8
1427L31.7Very low30.7Very low137 Ų137136.3 Ų136.372%0.71775%0.751SS**  trans-54.5170.9-177.1-46.1171.5000115.2
1428L31.1Very low30.2Very low134 Ų134137.5 Ų137.570%0.70275%0.752SS**  cis-158.21650.8-154.771.5000109.7
1429K30Very low30.3Very low171 Ų171134.5 Ų134.574%0.74374%0.74SS**  trans-139.7144.6150.1-153.3170.3-171.8175.60110.5
1430S35.3Very low30Very low78 Ų78137.4 Ų137.455%0.54574%0.735SS.*  trans-141171-173.973.10000109.5
1431K34.4Very low29.8Very low181 Ų181137.5 Ų137.579%0.78773%0.732SS**  cis-151.7145.23.2-158.9161.6-179.9172.40110.2V1433K1431-V1433 HydrophobicContact CD-CG2 4.31Å; K1431-V1433 VanDerWaalsContact CE-CG2 3.47Å; K1431-V1433 HydrophobicContact CG-CG2 4.06Å
1432S25.8Very low30Very low118 Ų118136.1 Ų136.183%0.82573%0.725SS**  trans-129.1142.4153.353.70000107.5
1433V34.3Very low29.9Very low116 Ų116137.4 Ų137.470%0.70372%0.723SS**  trans-147.4134.7175.8167.50000109.3K1431K1431-V1433 HydrophobicContact CD-CG2 4.31Å; K1431-V1433 VanDerWaalsContact CE-CG2 3.47Å; K1431-V1433 HydrophobicContact CG-CG2 4.06Å
1434S21.8Very low29.8Very low86 Ų86136 Ų13660%0.60172%0.717SS**  trans-136.7150.2137.2-158.60000109
1435F23.9Very low29.8Very low192 Ų192135.8 Ų135.884%0.84271%0.714SS**  trans69134.3164.7-58.4-61.7000122.7
1436S24.7Very low29.3Very low100 Ų100137.5 Ų137.570%0.69972%0.717SS**  trans87.2136.8142.1-1180000121.8
1437T28Very low29.3Very low120 Ų120135.8 Ų135.874%0.73671%0.709SS**  trans39.3150.4140.854.40000120.6
1438Q24.9Very low29.5Very low168 Ų168135 Ų13579%0.78571%0.71SS**  cis-157.6-168.5-6.5-103-82.516.900104.9
1439P36.2Very low29.5Very low81 Ų81136.3 Ų136.353%0.52671%0.713SS.*  trans-112174.2-152.425.5-1.5000114.2
1440Y28.4Very low29.5Very low214 Ų214133.2 Ų133.284%0.83970%0.704SS**  179.1169.1106.8-103.4-75.5000112.4
1441T26.5Very low29.1Very low105 Ų105137.4 Ų137.464%0.64472%0.721SS**  trans-99.4145.3-175.5490000112.7
1442D31.1Very low29Very low143 Ų143136.3 Ų136.377%0.76572%0.716SS**  -163132.1118.9-88.5-25.1000106.8
1443L27.7Very low29.3Very low133 Ų133137.9 Ų137.970%0.69671%0.71SS**  66.6134.856.8-60.6-178.3000111.9
1444N28.7Very low28.8Very low112 Ų112136.8 Ų136.860%0.59971%0.713SS**  cis-158.5-175.417.4-144.9-33.8000112.9
1445F30.1Very low29Very low166 Ų166140.8 Ų140.873%0.72872%0.722SS**  trans79.4146.8153.1-63.1-23.7000119.9
1446L30.2Very low29.3Very low132 Ų132140.2 Ų140.269%0.69172%0.72SS**  cis-163.4164.9-9.2-109.9-156.8000107.6
1447K30.7Very low29.5Very low164 Ų164140.9 Ų140.971%0.71372%0.72SS**  cis-158.3178.8-8.6-168.3156.1179.2175.30108.8
1448T35.7Very low29.4Very low120 Ų120141.2 Ų141.274%0.73673%0.726SS**  trans87.8132.3154.14.40000114.1
1449E32.3Very low29.4Very low162 Ų162139.7 Ų139.776%0.75772%0.724SS**SBendcis-159.8148.719.4-176.5173-172.800107.9
1450N29.9Very low29Very low106 Ų106142.8 Ų142.857%0.56774%0.735SS**  cis-137.9141.6-2.1-114.2-40.2000106.9
1451D26.1Very low29.1Very low167 Ų167138.7 Ų138.789%0.89373%0.726SS**  trans-127.5113.7157.2-125.5-25.8000108.9
1452K32.9Very low29.4Very low157 Ų157139.7 Ų139.768%0.68374%0.738SS**  trans-122.5130.2169-73179.3-175.6175.20104.2
1453Q30.9Very low29.4Very low152 Ų152136.9 Ų136.971%0.7173%0.729SS**  cis-153149.915.2-109.8156-68.300110
1454A24.8Very low29.7Very low92 Ų92137.8 Ų137.876%0.7673%0.73SS**SBendtrans-88.4155.6136.600000107.9
1455E26Very low29.8Very low170 Ų170137.3 Ų137.379%0.79473%0.726SS**SBendtrans53.591.5176.3-57.3-170.2128.800116.3
1456F29.1Very low29.9Very low180 Ų180136 Ų13679%0.78972%0.723SS**  -173.6137.4111.3-117.7-122.3000111
1457V28.7Very low29.9Very low115 Ų115136.1 Ų136.170%0.69772%0.721SS**  trans53.1100.6156.5-1750000117.5N1459V1457-N1459 VanDerWaalsContact CG1-O 3.26Å; V1457-N1459 WeakPolarHBondContact CG1-O 3.27Å
1458S26.4Very low30Very low126 Ų126134.6 Ų134.688%0.88172%0.721SS**  trans-137.647.5144.9-156.10000112
1459N25.7Very low29.9Very low136 Ų136136.6 Ų136.673%0.72772%0.722SS**  trans-121136.1148.2-82.7-27.5000103.6V1457V1457-N1459 VanDerWaalsContact CG1-O 3.26Å; V1457-N1459 WeakPolarHBondContact CG1-O 3.27Å
1460L27.7Very low30Very low147 Ų147136.1 Ų136.177%0.7772%0.72SS**  cis-140157.915.8-139.166.5000104.6
1461I31Very low30.2Very low127 Ų127136.6 Ų136.665%0.65172%0.722SS**  -153.5126.654.2-73.8176.9000109.9S1463I1461-S1463 WeakPolarHBondContact CG2-OG 3.36Å
1462S31.6Very low30.3Very low126 Ų126135.5 Ų135.588%0.88172%0.715SS**  trans-100.1121.8137.7-72.20000107.7
1463S31.8Very low30.2Very low84 Ų84135 Ų13559%0.58772%0.715SS**  trans-158.3137.5168.367.20000106.1I1461I1461-S1463 WeakPolarHBondContact CG2-OG 3.36Å
1464H33.5Very low30Very low152 Ų152135.2 Ų135.270%0.70472%0.72SS**  cis-166.7151.76.1-119.40000104.2
1465L31.3Very low30.3Very low102 Ų102134.1 Ų134.153%0.53472%0.718SS.*  cis-155.3-174.516.7-97.7154.7000107.7
1466Q31.5Very low30.6Very low139 Ų139134.4 Ų134.465%0.6572%0.724SS**  cis-153.8156.212.7-153.4108.224.100110.4
1467M30.4Very low30.7Very low135 Ų135130.5 Ų130.567%0.66572%0.719SS**  trans66.5134.7163.4-51.8-33.8-100.300117
1468D32.6Very low30.7Very low131 Ų131131.9 Ų131.970%0.70172%0.722SS**  cis-134.2159.35.1-82.4-49.1000114.2
1469E33.7Very low30.9Very low162 Ų162134.2 Ų134.276%0.75772%0.719SS**  trans-38.5160165.3-62.7166.6171.800116.3
1470E35.6Very low31.6Very low152 Ų152132.6 Ų132.671%0.7172%0.716SS**  cis-162.9161.1-3-123.8-166-174.400111.6
1471N33.9Very low31.7Very low117 Ų117131 Ų13163%0.62672%0.717SS**  trans48.5131.3145.6-72.2-34.4000122.2
1472I28.1Very low31.9Very low143 Ų143131.4 Ų131.473%0.73372%0.72SS**  cis65.7120.326.4-59.6178.8000112
1473Q29.7Very low32Very low148 Ų148131.6 Ų131.669%0.69271%0.711SS**  cis-155174.720.4-163.551-2000113.3
1474L27.9Very low32Very low155 Ų155134.6 Ų134.681%0.81272%0.721SS**  trans-18.9157.9161.7-55.6165.4000119.6
1475G30.7Very low32Very low69 Ų69134.3 Ų134.371%0.71173%0.725SS**  trans-147.5146.916000000114.1
1476L32.7Very low32.1Very low176 Ų176135.8 Ų135.892%0.92173%0.733SS**  trans159.1131.1160.1-90.4170000107.1
1477S29.4Very low32Very low98 Ų98135.5 Ų135.569%0.68574%0.736SS**  cis-167.5161.3-10-169.70000109.5
1478L28.7Very low32.1Very low144 Ų144135.7 Ų135.775%0.75474%0.739SS**  trans163.4115.6141.4-88.3160.1000116.3
1479Q31.6Very low32.2Very low175 Ų175137 Ų13782%0.81875%0.746SS**  trans72.3157.4142.6-73.7-169.8-86.600124.1
1480P39.8Very low32.2Very low103 Ų103136.6 Ų136.667%0.66975%0.749SS**  trans-142.3-179-140.845-26.5000120
1481S30.8Very low32Very low113 Ų113136.4 Ų136.479%0.7975%0.754SS**  trans128.6132.8136.9-159.90000120.8
1482N34.2Very low31.9Very low136 Ų136137.8 Ų137.873%0.72776%0.759SS**  trans100.4127.8142.7-142.74.6000124.8
1483N34.5Very low31.9Very low129 Ų129136.9 Ų136.969%0.6976%0.755SS**  trans77.182.9150.5-89-24000126.5
1484N31.7Very low31.8Very low148 Ų148136.1 Ų136.179%0.79176%0.756SS**  55.4149.2124.7-73.6-10.2000128.1
1485N33.4Very low32.5Very low146 Ų146135.6 Ų135.678%0.78175%0.754SS**  trans69.9126.6177.7-70.26.4000115.9
1486N32.7Very low32.1Very low133 Ų133138.9 Ų138.971%0.71176%0.755SS**SBendcis-145.71506-89.8-11.2000108.6
1487N30.3Very low32Very low133 Ų133136.7 Ų136.771%0.71174%0.744SS**SBendcis-131.2148.47.7-86.4-25.2000111.5
1488N32.8Very low31.9Very low138 Ų138138.4 Ų138.474%0.73874%0.744SS**SBendtrans62.176.5156.3-60.97.7000118.7
1489N35.1Very low31.9Very low158 Ų158136.8 Ų136.885%0.84574%0.74SS**  trans69.872.7135.7-54.34.1000117.8
1490N32.6Very low31.7Very low154 Ų154134.2 Ų134.282%0.82473%0.732SS**  trans-79.2154.9153-57.9-56.1000110.8
1491D32.4Very low31.2Very low149 Ų149136.3 Ų136.380%0.79774%0.738SS**  trans166.3146.9149-94.3-6.4000109.1
1492I31.5Very low31.2Very low145 Ų145133.7 Ų133.774%0.74472%0.72SS**  cis-154.7179.3-9.5-135.6166.7000110.8
1493I28.2Very low31Very low125 Ų125131 Ų13164%0.64171%0.707SS**  trans-78.2167.5177-57.3155.2000110.8
1494N27Very low31Very low132 Ų132130 Ų13071%0.70670%0.699SS**  trans69.7118.5171.6-63.9-22.2000117.9
1495N41.7Very low30.8Very low144 Ų144127.6 Ų127.677%0.7769%0.685SS**  trans160.4103.5132.3-85.6-9.8000105.9
1496D24.1Very low30.9Very low138 Ų138123.9 Ų123.974%0.73867%0.668SS**  cis48.3127.543-86.5-14.7000113
1497N29.5Very low30.9Very low130 Ų130124.1 Ų124.170%0.69566%0.662SS**  trans102.299.9179-55.3-53.1000114.8
1498I27Very low31.1Very low134 Ų134125.8 Ų125.869%0.68766%0.663SS**  88.9100.774.3-80.1175.7000109.3
1499T28.7Very low31.1Very low109 Ų109124 Ų12467%0.66965%0.654SS**  83.1144.889-460000112.5
1500N27.6Very low31.2Very low121 Ų121123 Ų12365%0.64765%0.648SS**  trans82.4125172.4-51.3-60.6000116.7
1501N29.9Very low31.3Very low147 Ų147123.9 Ų123.979%0.78665%0.648SS**  trans72.2149.2144.6-57.5-9.2000116.9
1502S30.6Very low31.5Very low59 Ų59123.8 Ų123.841%0.41365%0.647SS.*  cis-163.1152.1-8-112.60000109.5Q655Q655-S1502 PolarHBondContact OE1-O 3.48Å
1503V30.1Very low31.8Very low78 Ų78121.5 Ų121.547%0.47364%0.644SS.*  45.4117.791.4-1680000112P656P656-V1503 HydrophobicContact CG-CG2 4.14Å
1504Q33.4Very low32.1Very low110 Ų110122.3 Ų122.351%0.51465%0.648SS.*  cis-128.6-57.3-3.6-116.9170.9-88.500110E654 Q655E654-Q1504 CarbonylContact C-O 3.34Å; E654-Q1504 VanDerWaalsContact CA-O 3.22Å; E654-Q1504 WeakPolarHBondContact CA-O 3.14Å; E654-Q1504 VanDerWaalsContact CD-CG 3.47Å; E654-Q1504 HydrophobicContact CG-CB 4.48Å; E654-Q1504 HydrophobicContact CG-CG 3.94Å; E654-Q1504 WeakPolarHBondContact OE1-CG 3.2Å; E654-Q1504 PolarHBondContact OE1-NE2 2.77Å; E654-Q1504 WeakPolarHBondContact OE2-CB 3.49Å; Q655-Q1504 PolarHBondContact N-O 2.79Å
1505I29.3Very low32.4Very low96 Ų96123.6 Ų123.649%0.49265%0.65SS.*  trans100.5-17.6173.3-53.9167.8000115.7L653 Q655 K1507L653-I1505 HydrophobicContact CD2-CG2 3.62Å; L653-I1505 HydrophobicContact CG-CB 4.46Å; L653-I1505 HydrophobicContact CG-CG2 3.92Å; L653-I1505 CarbonylContact O-C 3.48Å; Q655-I1505 HydrophobicContact CG-CD1 4.15Å; I1505-K1507 PolarHBondContact O-N 3.16Å
1506T33.7Very low31.9Very low69 Ų69122.1 Ų122.142%0.42365%0.646SS.*  trans-66.8100.7176.9-58.60000114.1L653 E654L653-T1506 PolarHBondContact O-N 2.95Å; L653-T1506 VanDerWaalsContact O-N 3.15Å; L653-T1506 PolarHBondContact O-OG1 2.61Å; L653-T1506 VanDerWaalsContact O-OG1 3.11Å; E654-T1506 PolarHBondContact OE1-OG1 3.03Å; E654-T1506 WeakPolarHBondContact OE2-CB 3.18Å; E654-T1506 PolarHBondContact OE2-N 3.19Å; E654-T1506 PolarHBondContact OE2-OG1 3.23Å
1507K33.4Very low32.2Very low137 Ų137121.6 Ų121.660%0.59665%0.648SS**  trans47.2120.8145.5-56.7170.5-178.6167.70118.7T652 I1505T652-K1507 VanDerWaalsContact O-CE 3.23Å; T652-K1507 WeakPolarHBondContact O-CE 3.36Å; T652-K1507 PolarHBondContact O-NZ 3.05Å; T652-K1507 VanDerWaalsContact OG1-CE 3.3Å; T652-K1507 WeakPolarHBondContact OG1-CE 3.08Å; T652-K1507 PolarHBondContact OG1-NZ 2.96Å; I1505-K1507 PolarHBondContact O-N 3.16Å
1508K34Very low32.4Very low169 Ų169121.2 Ų121.274%0.73565%0.65SS**  -175.3148.897.4-101.7-171.8154-75.50115.5
1509D34.2Very low32.6Very low101 Ų101121.1 Ų121.154%0.5465%0.651SS.*  trans39.6126.3145.9-41.1-15.4000120
1510N35.7Very low32.6Very low135 Ų135122.2 Ų122.272%0.72265%0.653SS**  -161.1146.959.8-92.1-67.4000116.2
1511Q36.4Very low32.7Very low174 Ų174124 Ų12481%0.81366%0.661SS**  trans15132.4142.9-56.6-175.6-46.200121
1512D36.3Very low32.8Very low147 Ų147121.8 Ų121.879%0.78666%0.657SS**  -158.215696.9-138.8-37.9000112.5
1513S36.5Very low32.7Very low96 Ų96125.3 Ų125.367%0.67167%0.672SS**  trans32.1148.3159-63.50000122.9
1514I35.7Very low32.8Very low143 Ų143127.4 Ų127.473%0.73368%0.676SS**  cis167.6148.1-24.6-103.7164.7000107.2
1515Q33.4Very low32.8Very low159 Ų159132.5 Ų132.574%0.74369%0.692SS**  trans77.693.4164.2-131.580.514.900122.2
1516T30.7Very low33Very low112 Ų112131.8 Ų131.869%0.68770%0.695SS**  trans49.9135.5134.563.50000125.4
1517T30.8Very low33Very low128 Ų128133.3 Ų133.379%0.78571%0.709SS**  trans78.7134145.824.40000122
1518V33.9Very low32.9Very low121 Ų121132.8 Ų132.873%0.73372%0.717SS**  trans73.8116.9155.5177.30000117.9
1519D30.4Very low32.9Very low133 Ų133129.4 Ų129.471%0.71172%0.715SS**  trans52.6134.2146.6-66.88.3000124.4
1520N28.4Very low32.9Very low132 Ų132131 Ų13171%0.70672%0.724SS**  trans72130.5137.4-81.4-53.7000122
1521L29.3Very low32.7Very low157 Ų157132.2 Ų132.282%0.82273%0.73SS**  20.9140.1111.1-163.577.6000118.8
1522S32.6Very low32.6Very low101 Ų101131.1 Ų131.171%0.70673%0.728SS**  trans98.8137.4158.6-159.60000116.8
1523N29.4Very low32.6Very low134 Ų134135.5 Ų135.572%0.71773%0.734SS**  trans170.5138.1152.7-91.6-22.7000107.8
1524H31.9Very low32.7Very low121 Ų121136.6 Ų136.656%0.5674%0.736SS**  cis-127.4165.7-11.1-90-73.6000107.2S1526H1524-S1526 PolarHBondContact ND1-OG 2.97Å
1525Y33.5Very low32.7Very low218 Ų218135.8 Ų135.886%0.85573%0.734SS**  cis-148.2145.942.2-78.1-96.2000108.7
1526S33.7Very low32.7Very low80 Ų80134.6 Ų134.656%0.55973%0.732SS**  cis68.2118.339.5-50.80000113.5H1524H1524-S1526 PolarHBondContact ND1-OG 2.97Å
1527S32.2Very low32.9Very low101 Ų101135.9 Ų135.971%0.70674%0.735SS**  cis-170.8155.6-5.743.40000109
1528T32Very low32.9Very low126 Ų126137 Ų13777%0.77374%0.736SS**  trans42115.5149.5560000120.1
1529S34Very low32.7Very low98 Ų98135.9 Ų135.969%0.68573%0.734SS**  161.8149.489.6-111.30000115.8
1530D34.4Very low32.6Very low136 Ų136136.9 Ų136.973%0.72774%0.736SS**  trans63.689.2141.3-48.30.6000121.9
1531D31.2Very low32.7Very low159 Ų159135.9 Ų135.985%0.8574%0.735SS**  62.2162.6124.8-78.4-25.7000125.8
1532I34.7Very low32.6Very low152 Ų152135.4 Ų135.478%0.77973%0.733SS**  trans77.686.2166.2-38.7-175.3000118.3
1533R35.9Very low32.5Very low238 Ų238137.5 Ų137.590%0.89873%0.733SS**  trans164.8140.4133.7-93.4163.9-176.2-167.31.8110.9
1534V39.1Very low32.6Very low119 Ų119136.4 Ų136.472%0.72173%0.732SS**  cis-162.6154.4-12.592.60000109.8
1535N34.4Very low32.8Very low127 Ų127135.6 Ų135.668%0.67974%0.735SS**  trans68.383.8166.9-67.227.8000120.3
1536D34.1Very low33Very low134 Ų134132.3 Ų132.372%0.71773%0.731SS**  66.4136.2107.6-52.5-5.5000124.3
1537N34Very low33.2Very low139 Ų139133 Ų13374%0.74374%0.736SS**  trans75.2120.9158.7-53.6-22.1000117.6
1538D31.7Very low33.4Very low150 Ų150131.9 Ų131.980%0.80273%0.727SS**  73.7135.157.4-75.7-30.3000114
1539S29.9Very low33.6Very low98 Ų98128.9 Ų128.969%0.68571%0.707SS**  cis-162.5179.7-9.664.20000111.5
1540M27.9Very low34.2Very low155 Ų155127.1 Ų127.176%0.76469%0.693SS**  trans19.5131.5139.8-160174.7168.700121.2
1541T30.4Very low34.3Very low110 Ų110126.2 Ų126.268%0.67569%0.686SS**  trans64.8146.8155.844.40000121.6
1542D28.4Very low34.4Very low148 Ų148125.7 Ų125.779%0.79167%0.674SS**  trans69.1148.4154.2-86.5-42.8000122.7
1543M29.4Very low34.4Very low144 Ų144125.4 Ų125.471%0.70966%0.664SS**  trans44.9113144.3-64.5-74.3-88.500121.4
1544T32.5Very low34.3Very low112 Ų112118.4 Ų118.469%0.68765%0.652SS**  trans65.414413363.70000119.5
1545T36.1Very low34Very low103 Ų103119.4 Ų119.463%0.63266%0.658SS**  cis-171.1154.20.315.70000109.9
1546I36.3Very low33.8Very low149 Ų149118.9 Ų118.976%0.76466%0.664SS**  trans63.2131.7143.7-66.3165.2000117.3
1547S38.9Very low33.6Very low96 Ų96118.2 Ų118.267%0.67167%0.67SS**  cis-179.4168.6-2.3-98.60000108.4
1548C35.4Very low34.1Very low76 Ų76117 Ų11751%0.51467%0.67SS.*  cis-162.2157.5-4.8-121.70000113.3
1549D36.2Very low34.8Very low64 Ų64115.1 Ų115.134%0.34267%0.665SS.*  trans41.2158.4131.7-89.2-7.3000125.8K1619D1549-K1619 VanDerWaalsContact O-CA 3.25Å; D1549-K1619 WeakPolarHBondContact O-CA 3.47Å; D1549-K1619 PolarHBondContact O-N 3.02Å
1550P46.8Very low35Very low61 Ų61116.5 Ų116.540%0.39667%0.67SS.*  cis-123.1-165.8-3.327.2-2.8000111.2K1619P1550-K1619 WeakPolarHBondContact O-CE 3.46Å
1551I37.6Very low35.3Very low116 Ų116117.1 Ų117.160%0.59568%0.675SS**  cis-149.1120.920.1-55.3158.4000110.2K1621I1551-K1621 WeakPolarHBondContact O-CE 3.24Å; I1551-K1621 PolarHBondContact O-NZ 3.3Å
1552Y33.7Very low35.4Very low149 Ų149119.7 Ų119.758%0.58468%0.679SS**  trans45.2-179.7147.7-83.3-127.8000121.5K1621 K1623Y1552-K1621 PolarHBondContact O-NZ 3.1Å; Y1552-K1623 PolarHBondContact OH-NZ 3.29Å
1553Y33.8Very low35.7Very low145 Ų145117.4 Ų117.457%0.56967%0.67SS**  -177.9161-58.4-117.3-133.4000106.5K1623Y1553-K1623 HydrophobicContact CE1-CD 4.46Å; Y1553-K1623 HydrophobicContact CE2-CD 4.08Å; Y1553-K1623 WeakPolarHBondContact OH-CD 3.43Å
1554S33.6Very low35.7Very low92 Ų92118 Ų11864%0.64367%0.671SS**  cis-169.9-178.7-24.5-93.70000109.3
1555V32.1Very low35.8Very low140 Ų140118.5 Ų118.585%0.84867%0.669SS**  trans-124143.4-172.9-173.80000111.9
1556S31Very low35.7Very low116 Ų116119.8 Ų119.881%0.81167%0.672SS**  trans166.5142.8145.7-80.30000115.5
1557S31Very low35.4Very low120 Ų120117.8 Ų117.884%0.83966%0.662SS**  trans171.3164.3161.6-83.70000108.4
1558P42.8Very low35.1Very low114 Ų114123.5 Ų123.574%0.7467%0.669SS**  cis-140.5-158.22439.2-15000113.9
1559P47.8Very low34.8Very low109 Ų109127 Ų12771%0.70868%0.682SS**  -136.5173.7-59.738.3-21.8000116.4
1560T32.9Very low34.4Very low128 Ų128129 Ų12979%0.78570%0.7SS**  trans87.9107.9150-16.40000120.4
1561L34.9Very low33.7Very low168 Ų168129.8 Ų129.888%0.8871%0.708SS**  -151163.3129.4-118.1175.2000111.1
1562H32.9Very low33.8Very low164 Ų164129 Ų12976%0.75971%0.71SS**  trans-68.4161.8179-99.9-141.1000113.5
1563V33.9Very low33.7Very low99 Ų99128 Ų12860%0.672%0.72SS**  cis-164.2152.1-21.481.90000110.3
1564H30Very low33.7Very low157 Ų157128.4 Ų128.473%0.72773%0.732SS**  trans55.4130.9157.6-76.8141.4000123.9
1565I34.6Very low33.8Very low123 Ų123131.7 Ų131.763%0.63174%0.737SS**  84105128-70.7171.1000119.3
1566N32.8Very low33.8Very low130 Ų130132 Ų13270%0.69573%0.733SS**  trans71.2156.5135.1-64.813.8000118.9
1567N30.9Very low34Very low106 Ų106132.8 Ų132.857%0.56773%0.728SS**  cis-155.2157.1-7.7-120.9-4.2000109.9
1568R31.9Very low34Very low217 Ų217132.5 Ų132.582%0.81972%0.721SS**  trans-167.847.1145.3-108.3162-156-103.75.2116.6
1569L29.1Very low33.5Very low150 Ų150134.3 Ų134.379%0.78572%0.724SS**SBend-120.7124.6120.5-76.8168.8000105.1
1570S29.4Very low32.7Very low104 Ų104135 Ų13573%0.72773%0.731SS**  cis-134164.83.9-63.10000111.7
1571S32.1Very low32.6Very low78 Ų78133.1 Ų133.155%0.54572%0.723SS.*  trans-123.6165.1174.1550000110
1572P38.5Very low32.5Very low100 Ų100129.7 Ų129.765%0.64971%0.709SS**  cis-133.5167.3-39.437.3-23.2000112N1574P1572-N1574 PolarHBondContact O-N 3.3Å
1573T31.2Very low32.4Very low129 Ų129126.1 Ų126.179%0.79170%0.703SS**  trans-76.2107.5165.19.60000110.7
1574N34.5Very low32.3Very low152 Ų152124.3 Ų124.381%0.81369%0.694SS**  trans-97.9124.9158.4-81-20.1000108.5P1572P1572-N1574 PolarHBondContact O-N 3.3Å
1575H35Very low32.4Very low161 Ų161120.3 Ų120.375%0.74568%0.684SS**  trans-89.8147.8179.8-105.4-99.5000111.9
1576L33.8Very low32.2Very low148 Ų148119.5 Ų119.578%0.77569%0.69SS**  trans67.4123.9169.7-56.4152.9000113.3
1577N33.4Very low32.2Very low131 Ų131118.2 Ų118.270%0.70169%0.69SS**  cis-143.7152.719.2-102.5-29.4000113.4
1578T32.6Very low32.4Very low114 Ų114118 Ų11870%0.69970%0.698SS**  trans7.7131.8145.957.60000118.4
1579L30.7Very low32.4Very low152 Ų152112.9 Ų112.980%0.79670%0.695SS**  cis-147.5153.36.8-57.887.7000110.1
1580S31.5Very low32.6Very low123 Ų123113.3 Ų113.386%0.8670%0.697SS**  trans60.5155.6176.476.70000113.3
1581S32.2Very low32.8Very low89 Ų89113.4 Ų113.462%0.62270%0.698SS**  cis-161.6179.325.352.50000108.8
1582V31.2Very low33Very low97 Ų97114.5 Ų114.559%0.58871%0.706SS**SBendtrans-136.278.1150.1-111.40000110.1S718 S719S718-V1582 CarbonylContact C-O 3.59Å; S718-V1582 CarbonylContact O-C 3.36Å; S718-V1582 WeakPolarHBondContact O-CA 3.37Å; S719-V1582 PolarHBondContact N-O 2.97Å
1583S31Very low33.3Very low89 Ų89115.1 Ų115.162%0.62271%0.712SS**  trans-142.5150.4143.8-63.50000105.4S718S718-S1583 WeakPolarHBondContact O-CA 3.44Å; S718-S1583 PolarHBondContact O-N 3.12Å; S718-S1583 VanDerWaalsContact O-N 3.17Å
1584S32.7Very low33.7Very low60 Ų60114.2 Ų114.242%0.4271%0.711SS.*  trans-145.6171.4-158.2160.70000113.6V717V717-S1584 WeakPolarHBondContact CB-O 3.21Å; V717-S1584 WeakPolarHBondContact CG1-OG 3.25Å; V717-S1584 WeakPolarHBondContact CG2-O 3.3Å
1585S31.6Very low33.8Very low74 Ų74112 Ų11252%0.51771%0.707SS.*  trans65.5153-157.285.80000112.3
1586S30.4Very low33.7Very low106 Ų106108.8 Ų108.874%0.74170%0.703SS**  cis-139.5169.311.1-73.20000113.2
1587S33.6Very low33.6Very low102 Ų102108.3 Ų108.371%0.71370%0.701SS**  trans-34.9144166.354.10000118.9
1588S33.7Very low33.8Very low103 Ų103110.9 Ų110.972%0.7271%0.709SS**  trans29.8125.4141.462.50000121.3
1589S33Very low33.9Very low108 Ų108113.9 Ų113.976%0.75572%0.715SS**  trans-61.3138.7156.733.70000111.9
1590L33.4Very low34.1Very low159 Ų159116.8 Ų116.883%0.83272%0.717SS**  cis76.5144.245.9-64.7169000113.1
1591S32.7Very low34.6Very low107 Ų107117.1 Ų117.175%0.74871%0.705SS**  cis-163-175.8-14.262.50000107.9
1592S36.9Very low35Very low101 Ų101119.9 Ų119.971%0.70671%0.706SS**  cis-149.3175.8464.40000109.8
1593S45.5Very low35.4Very low113 Ų113121.6 Ų121.679%0.7971%0.711SS**  172.7156.696.742.90000108.2
1594S38.6Very low35.8Very low109 Ų109123 Ų12376%0.76271%0.712SS**  cis-154.1157.86.849.40000108.2
1595S35.9Very low36.1Very low105 Ų105126.9 Ų126.973%0.73472%0.721SS**  cis-169.1179.5-10.349.40000108
1596S33.3Very low36.4Very low94 Ų94131.2 Ų131.266%0.65774%0.735SS**  trans76.5103.8167.2-75.20000119.3
1597D32.8Very low36.6Very low139 Ų139132.7 Ų132.774%0.74374%0.735SS**  74.1118.1116.2-45.3-35.4000121.5
1598E36.4Very low36.7Very low184 Ų184133.9 Ų133.986%0.8673%0.733SS**  trans73.2120148.8-61.4-170.2161.400123.3
1599E35.8Very low36.8Very low178 Ų178136.2 Ų136.283%0.83274%0.738SS**  trans74.2139.4133.3-154.1157.9-134.600122.9
1600Y33.8Very low36.9Very low212 Ų212139.6 Ų139.683%0.83174%0.739SS**  trans-54.3131.1-176.6-70.3-107.6000116.3
1601H41.7Very low37Very low130 Ų130138.3 Ų138.360%0.60274%0.738SS**  169.4142.7109.9-106.8-32.3000116.3
1602K41.3Very low37.2Very low148 Ų148138.4 Ų138.464%0.64373%0.734SS**  trans66.2159.2137.9-78.4179.3173.6174.90124.7
1603D40Very low37.1Very low132 Ų132140.6 Ų140.671%0.70674%0.737SS**  trans-37.3161.7166.5-42.1-84.3000115.6
1604D38.9Very low36.6Very low119 Ų119142.6 Ų142.664%0.63673%0.732SS**  cis-170.1162.745.6-166.89.9000113.8
1605K39.1Very low36.4Very low142 Ų142142.6 Ų142.662%0.61772%0.72SS**  trans40.5134.5155.9-89.3169-150.368.40125.5
1606M36.8Very low36.5Very low164 Ų164145.7 Ų145.781%0.80872%0.72SS**  trans65.8148.5137.4-68.7170.2171.500118.3
1607D35.9Very low36.7Very low138 Ų138150.4 Ų150.474%0.73873%0.728SS**  cis-157.6-175.540.2-143.9-28.3000115.5
1608N34.4Very low37Very low126 Ų126149.9 Ų149.967%0.67473%0.726SS**  trans-63.2152.7-167.6-78.2-88.9000119.7
1609N35.7Very low37.1Very low153 Ų153147.1 Ų147.182%0.81871%0.711SS**  164.3140.5123.6-85.5-51.2000111.5
1610K36.3Very low37.3Very low178 Ų178143 Ų14377%0.77470%0.698SS**  cis121.393.2-3.5-175.2-167.3174.2-1790114.5
1611T35Very low37.6Very low132 Ų132137.4 Ų137.481%0.8168%0.678SS**  trans174147.6152.933.90000109.2
1612T36.3Very low37.5Very low109 Ų109137 Ų13767%0.66968%0.684SS**  cis-165136.2-427.90000111.4
1613L34.8Very low37.5Very low147 Ų147133.8 Ų133.877%0.7767%0.67SS**  trans54.1150.4142.7-73.876.7000121
1614K36.2Very low37.3Very low156 Ų156134.5 Ų134.568%0.67867%0.673SS**  cis-161.2142.3-3.3-124.4-175-172.4-123.80114
1615E34.7Very low37.4Very low109 Ų109133.4 Ų133.451%0.50967%0.673SS.*  trans45.2120.4137.7-69-176.5114.500124
1616K37.7Very low37.2Very low170 Ų170132.2 Ų132.274%0.73968%0.677SS**  75.2143.2100.5-66.4171.7-170.4164.80115.1
1617K38.1Very low37.1Very low192 Ų192134.3 Ų134.384%0.83568%0.678SS**  cis-156-176.122.2-111.2-178.5175.1179.70108.2
1618N37.9Very low37Very low129 Ų129133.6 Ų133.669%0.6967%0.674SS**  cis-178.8130.2-48.3-103.845.3000111.3
1619K39.2Very low37Very low126 Ų126133.4 Ų133.455%0.54867%0.673SS.*  trans67.7142.5148.2-94.7-179177.7-176.80119.6D1549 P1550D1549-K1619 VanDerWaalsContact O-CA 3.25Å; D1549-K1619 WeakPolarHBondContact O-CA 3.47Å; D1549-K1619 PolarHBondContact O-N 3.02Å; P1550-K1619 WeakPolarHBondContact O-CE 3.46Å
1620V39.3Very low36.9Very low92 Ų92132.2 Ų132.256%0.55867%0.667SS**  cis-148.8150.118.8-175.50000111.7
1621K40.5Very low36.9Very low94 Ų94128 Ų12841%0.40966%0.659SS.*  trans19.5141.9157.4-55.5167.9176-177.80120.4I1551 Y1552I1551-K1621 WeakPolarHBondContact O-CE 3.24Å; I1551-K1621 PolarHBondContact O-NZ 3.3Å; Y1552-K1621 PolarHBondContact O-NZ 3.1Å
1622T38.8Very low36.7Very low120 Ų120129.6 Ų129.674%0.73666%0.66SS**  cis-15715248.2-51.10000114
1623K42.2Very low36.5Very low82 Ų82130.3 Ų130.336%0.35766%0.659SS.*  trans-56159.5172.8-83.1-174.2175-175.40116.3Y1552 Y1553Y1552-K1623 PolarHBondContact OH-NZ 3.29Å; Y1553-K1623 HydrophobicContact CE1-CD 4.46Å; Y1553-K1623 HydrophobicContact CE2-CD 4.08Å; Y1553-K1623 WeakPolarHBondContact OH-CD 3.43Å
1624L35.9Very low36.3Very low147 Ų147130 Ų13077%0.7766%0.656SS**  cis-161.6148-18.4-165.969.5000110.6
1625P41.7Very low36.2Very low96 Ų96128.9 Ų128.962%0.62366%0.656SS**  trans-93.5-176.4174.3-1.123.4000113.9
1626T34Very low36Very low116 Ų116128.3 Ų128.371%0.71267%0.665SS**  cis175.5121-28.4-870000110
1627Y34.3Very low35.7Very low208 Ų208128.1 Ų128.182%0.81667%0.666SS**  trans54.3-173.9158.8-74.4-114.3000117.2
1628D34Very low35.5Very low124 Ų124126.9 Ų126.966%0.66366%0.663SS**  cis-159179.22-138-26.1000115.3
1629N34Very low35.3Very low122 Ų122125.5 Ų125.565%0.65266%0.66SS**  trans74151.7153.2-67.16.1000119.7
1630D33.7Very low35.1Very low128 Ų128126 Ų12668%0.68467%0.669SS**  cis-168.7165-10.9-108.1-40.8000105.8
1631S36.2Very low34.9Very low89 Ų89127.6 Ų127.662%0.62267%0.674SS**  cis166.5157.4-17.5-95.60000106.5
1632M31.8Very low34.6Very low166 Ų166128.7 Ų128.782%0.81869%0.685SS**  trans67.3152.4167.2-60.1-83.598.800118.3
1633L31.3Very low34.4Very low123 Ų123130 Ų13064%0.64469%0.687SS**  cis-170.2162.8-33.7-135.2-167.3000108.7
1634I31.4Very low34Very low140 Ų140133 Ų13372%0.71871%0.707SS**  trans69.5146164.4-58.9172.3000115.5
1635I32.9Very low33.9Very low133 Ų133133.4 Ų133.468%0.68270%0.704SS**  cis175.4145-40.2-99.6160.3000105.8
1636S31.3Very low33.7Very low98 Ų98134.1 Ų134.169%0.68571%0.707SS**  trans65.1160.7175.7-70.90000115.7
1637E31.9Very low33.7Very low165 Ų165133.1 Ų133.177%0.77171%0.705SS**  cis-144-173.58.9-147.8129.7-116.800113
1638E33.1Very low33.6Very low166 Ų166130.4 Ų130.478%0.77670%0.704SS**  trans-44.5166.8167.9-63.6-177.8138.900115.5
1639T34.5Very low33.7Very low100 Ų100131.4 Ų131.461%0.61371%0.71SS**  cis-164.6169.88.7-0.80000110.2
1640D34.2Very low33.8Very low138 Ų138130.3 Ų130.374%0.73871%0.708SS**  trans60.1166.3148.3-57.2-17.9000118.5
1641D34.3Very low34Very low125 Ų125131.2 Ų131.267%0.66872%0.718SS**  cis-152.5151.7-27.6-131-11.5000110.5
1642N34.1Very low34Very low117 Ų117132.9 Ų132.963%0.62672%0.719SS**  trans47.4150.9148.1-65.7-50.8000124.7
1643N36.1Very low33.9Very low146 Ų146132.4 Ų132.478%0.78172%0.72SS**  trans73.3121.6169.7-41.9-66.2000115.8
1644D32.8Very low34Very low146 Ų146131.5 Ų131.578%0.78172%0.723SS**  cis95.1137.940.1-83.6-36.1000116
1645H35.1Very low34.1Very low155 Ų155129.4 Ų129.472%0.71872%0.721SS**  trans71.183.1155.5-81.8-64.3000123.2
1646T35.7Very low34.3Very low112 Ų112127.5 Ų127.569%0.68772%0.717SS**  61.1122.5114.154.60000124.1
1647S34.9Very low34.4Very low95 Ų95128.6 Ų128.666%0.66471%0.714SS**  81.4116.8128.664.20000124.2
1648D32Very low34.4Very low150 Ų150128.3 Ų128.380%0.80271%0.713SS**  71.3122.4128.7-57-7.3000123.9
1649N36Very low34.3Very low146 Ų146126.5 Ų126.578%0.78171%0.714SS**  trans-175149.1147.1-113.7-99.5000110.2
1650T37.3Very low34.1Very low99 Ų99128.8 Ų128.861%0.60772%0.721SS**  cis-162.4141.3-29.822.60000108.7
1651T36.9Very low34.1Very low146 Ų146129.2 Ų129.290%0.89672%0.721SS**  trans-154.3139.2151.5-50000111.9
1652L36.2Very low34.1Very low124 Ų124129.7 Ų129.765%0.64972%0.724SS**  trans-84.8156.6176.5-59158.3000109.2S1655L1652-S1655 VanDerWaalsContact CD2-N 3.26Å
1653N29.9Very low34.2Very low156 Ų156130.9 Ų130.983%0.83473%0.729SS**SBendcis-89.3148.613.8-66.4-29.2000114
1654C33.7Very low34.2Very low104 Ų104130.7 Ų130.770%0.70373%0.728SS**SBendcis-143.6114.9-4-112.80000111.3
1655S33.4Very low34.4Very low97 Ų97132.5 Ų132.568%0.67873%0.734SS**  trans72.3144.5155-54.40000118.6L1652L1652-S1655 VanDerWaalsContact CD2-N 3.26Å
1656P36.7Very low34.4Very low92 Ų92132.3 Ų132.360%0.59774%0.738SS**  trans-138.3-168.5-143.841.6-20.8000114.9
1657L32.7Very low34.2Very low121 Ų121131.7 Ų131.763%0.63474%0.737SS**  trans75.7134.4157.1-98.261.8000119.4
1658E32.9Very low34.2Very low159 Ų159133 Ų13374%0.74374%0.742SS**  trans62.888.1136.5-68.3166.4175.100119.8
1659T31.1Very low34.3Very low128 Ų128132.8 Ų132.879%0.78574%0.74SS**  14.6139.1116.9-22.40000119.4
1660I30Very low34.2Very low149 Ų149131.7 Ų131.776%0.76474%0.739SS**  trans88.6126.8163.4-52.6-174.7000116
1661I35Very low34Very low146 Ų146131.6 Ų131.675%0.74974%0.742SS**  trans85.9103.4174.1-65.6148.9000118.1
1662N34Very low33.8Very low136 Ų136130.8 Ų130.873%0.72774%0.737SS**  trans66.9116.9140.5-71.6-6.7000124.8
1663I35.9Very low33.8Very low142 Ų142131 Ų13173%0.72874%0.743SS**  96.2128.8126.3-67.9168.8000120.8
1664N35.1Very low33.8Very low141 Ų141130.3 Ų130.375%0.75474%0.74SS**  trans58.199162.9-77.1-8.7000120.5
1665M37.4Very low33.9Very low184 Ų184131.4 Ų131.491%0.90674%0.743SS**  89149.573-83.3-64.8-176.100115.2
1666N35Very low33.9Very low151 Ų151132 Ų13281%0.80775%0.747SS**  trans-123.6-175.1-159.8-159.4-2.3000112.4
1667C32Very low33.9Very low99 Ų99132.8 Ų132.867%0.66975%0.751SS**  trans-79.7161.5-159.4-590000118.4
1668T35.5Very low34.1Very low124 Ų124132.7 Ų132.776%0.76176%0.755SS**  trans71.8116.2144.5410000122.3
1669N33.4Very low34.2Very low145 Ų145132.7 Ų132.778%0.77576%0.76SS**  trans74.4108.7133.8-73.2-6.4000122.7
1670V33.8Very low34.3Very low123 Ų123131.9 Ų131.975%0.74576%0.76SS**  94.6118.2123.6172.40000119
1671S33.9Very low34.5Very low97 Ų97130.2 Ų130.268%0.67876%0.761SS**  trans86115.6164.2-53.70000119.2
1672T33.4Very low34.5Very low129 Ų129129.3 Ų129.379%0.79176%0.762SS**  trans40.3130.1134.461.30000119.3
1673T34.3Very low34.5Very low127 Ų127132.8 Ų132.878%0.77977%0.767SS**  cis-157157.740.5-49.50000111.8
1674D31.1Very low34.3Very low143 Ų143130.6 Ų130.677%0.76576%0.764SS**  trans-69.3167.7178-48.1-97.4000115.3
1675V36.3Very low34.3Very low127 Ų127129.2 Ų129.277%0.7777%0.765SS**  171.3116.7105.1158.80000112.1
1676S32.7Very low34Very low108 Ų108128.1 Ų128.176%0.75576%0.763SS**  trans63.3158.315879.20000119.2
1677T37Very low33.8Very low110 Ų110125.9 Ų125.968%0.67576%0.759SS**  cis-136.1150.111.349.20000113
1678T36.3Very low33.9Very low119 Ų119127.5 Ų127.573%0.7376%0.76SS**  trans52.6135.6147.353.70000120.2
1679D35.2Very low33.8Very low159 Ų159130.5 Ų130.585%0.8576%0.762SS**  cis-140.2164.821-102.3-39.4000114.3
1680S32.5Very low33.9Very low111 Ų111128.3 Ų128.378%0.77676%0.758SS**  trans-123.2125.2-17659.90000113.5
1681S34.4Very low34Very low113 Ų113131.3 Ų131.379%0.7976%0.764SS**  trans-162.8123155.268.50000109.2
1682V36.4Very low34Very low127 Ų127131.6 Ų131.677%0.7777%0.766SS**  96.4113.579163.10000113.4
1683Y33.9Very low34.1Very low210 Ų210133 Ų13382%0.82477%0.768SS**  trans62.7119.3152-83.6-121.6000121.8
1684S31.7Very low34.2Very low96 Ų96133.9 Ų133.967%0.67177%0.773SS**  43121.2120.1-46.10000118.6
1685S34.8Very low34.3Very low112 Ų112135.1 Ų135.178%0.78378%0.779SS**  -175.3143.673.1-68.30000114.4
1686N31.4Very low34.4Very low161 Ų161137.2 Ų137.286%0.86178%0.781SS**  trans13.6123.9137.4-82.6-14.3000121
1687S29.9Very low34.8Very low103 Ų103138.7 Ų138.772%0.7278%0.778SS**  102.1153.1119.8-156.60000121
1688I34.2Very low34.6Very low133 Ų133143 Ų14368%0.68281%0.813SS**  trans79.8111.8157.2-80.1154000118.9
1689K34Very low34.5Very low188 Ų188144.2 Ų144.282%0.81782%0.817SS**  trans68.1148.4151.5-69.8171.6-164.8173.20117.9
1690S34.3Very low34.5Very low98 Ų98143.4 Ų143.469%0.68582%0.815SS**  cis-165.7170.1-12.142.20000111.6
1691E35.4Very low34.6Very low186 Ų186145.2 Ų145.287%0.86982%0.817SS**  trans85.5136.2162.4-50.3-165.8146.300119.8
1692S35.8Very low34.6Very low104 Ų104147.1 Ų147.173%0.72782%0.819SS**  trans6189.2155-160.60000122.1
1693L34.9Very low34.5Very low158 Ų158148.3 Ų148.383%0.82782%0.822SS**  45.8105.8124.9-65.9162.8000119.8
1694T35.3Very low34.5Very low145 Ų145144.2 Ų144.289%0.8982%0.822SS**  -169.6166.9129.2100000112.7
1695L33.4Very low34.7Very low170 Ų170147.6 Ų147.689%0.8983%0.833SS**  trans88.284174.6-60.1172.5000118.4
1696E38.1Very low34.7Very low171 Ų171150.4 Ų150.480%0.79984%0.837SS**  trans-82.5153.2138.9-73.2-170.8134.700109.5
1697I41.5Very low35Very low138 Ų138149.5 Ų149.571%0.70883%0.834SS**  cis-147.5131.2-14.5-98.8153.3000106.6
1698S33.2Very low35.5Very low200 Ų200153.7 Ų153.7100%1.39985%0.845SS**  trans-169.60155.3-77.90000109.8

Retrieved 1,698 of 1,698 residues in 641.8 ms (Link to these results)